REMARK ID 96494 DOMAINID 91535 MODEL 1 2021-07-17_00000178_2_11 MODEL 1 REMARK Rerank model03.pdb to model01.pdb score: 231.756 tmscore: 0.92909 6wbjA_201 prob: 99.85 ident: 25.69 ATOM 1 N GLN A 1 -9.371 1.651 -4.219 1.00 0.440 N ATOM 2 CA GLN A 1 -9.147 1.476 -5.655 1.00 0.410 C ATOM 3 C GLN A 1 -7.679 1.712 -6.049 1.00 0.390 C ATOM 4 O GLN A 1 -7.223 1.213 -7.074 1.00 0.820 O ATOM 5 CB GLN A 1 -10.058 2.416 -6.464 1.00 0.590 C ATOM 6 CG GLN A 1 -11.563 2.184 -6.249 1.00 0.590 C ATOM 7 CD GLN A 1 -12.018 0.788 -6.603 1.00 0.590 C ATOM 8 OE1 GLN A 1 -11.920 0.344 -7.750 1.00 0.590 O ATOM 9 NE2 GLN A 1 -12.488 0.086 -5.596 1.00 0.590 N ATOM 10 1H GLN A 1 -10.296 1.305 -3.954 1.00 0.530 H ATOM 11 2H GLN A 1 -8.671 1.117 -3.721 1.00 0.530 H ATOM 12 3H GLN A 1 -9.300 2.619 -3.947 1.00 0.530 H ATOM 13 HA GLN A 1 -9.395 0.447 -5.914 1.00 0.490 H ATOM 14 1HB GLN A 1 -9.846 3.452 -6.192 1.00 0.700 H ATOM 15 2HB GLN A 1 -9.846 2.305 -7.527 1.00 0.700 H ATOM 16 1HG GLN A 1 -11.809 2.349 -5.215 1.00 0.700 H ATOM 17 2HG GLN A 1 -12.118 2.890 -6.869 1.00 0.700 H ATOM 18 1HE2 GLN A 1 -12.820 -0.883 -5.713 1.00 0.700 H ATOM 19 2HE2 GLN A 1 -12.522 0.499 -4.661 1.00 0.700 H ATOM 20 N GLU A 2 -6.934 2.461 -5.234 1.00 0.360 N ATOM 21 CA GLU A 2 -5.534 2.756 -5.528 1.00 0.280 C ATOM 22 C GLU A 2 -4.583 1.621 -5.080 1.00 0.200 C ATOM 23 O GLU A 2 -4.579 1.298 -3.887 1.00 0.240 O ATOM 24 CB GLU A 2 -5.141 4.053 -4.814 1.00 0.420 C ATOM 25 CG GLU A 2 -3.727 4.528 -5.080 1.00 0.420 C ATOM 26 CD GLU A 2 -3.384 5.777 -4.339 1.00 0.420 C ATOM 27 OE1 GLU A 2 -4.210 6.258 -3.603 1.00 0.420 O ATOM 28 OE2 GLU A 2 -2.289 6.250 -4.503 1.00 0.420 O ATOM 29 H GLU A 2 -7.330 2.865 -4.401 1.00 0.430 H ATOM 30 HA GLU A 2 -5.467 2.948 -6.590 1.00 0.340 H ATOM 31 1HB GLU A 2 -5.818 4.851 -5.121 1.00 0.510 H ATOM 32 2HB GLU A 2 -5.257 3.929 -3.745 1.00 0.510 H ATOM 33 1HG GLU A 2 -3.035 3.760 -4.782 1.00 0.510 H ATOM 34 2HG GLU A 2 -3.604 4.698 -6.147 1.00 0.510 H ATOM 35 N PRO A 3 -3.719 1.064 -5.982 1.00 0.160 N ATOM 36 CA PRO A 3 -2.759 -0.025 -5.744 1.00 0.180 C ATOM 37 C PRO A 3 -1.900 0.179 -4.505 1.00 0.170 C ATOM 38 O PRO A 3 -1.533 -0.784 -3.828 1.00 0.200 O ATOM 39 CB PRO A 3 -1.902 0.013 -7.014 1.00 0.270 C ATOM 40 CG PRO A 3 -2.840 0.504 -8.082 1.00 0.270 C ATOM 41 CD PRO A 3 -3.717 1.531 -7.399 1.00 0.270 C ATOM 42 HA PRO A 3 -3.311 -0.975 -5.675 1.00 0.220 H ATOM 43 1HB PRO A 3 -1.034 0.673 -6.868 1.00 0.320 H ATOM 44 2HB PRO A 3 -1.507 -0.991 -7.228 1.00 0.320 H ATOM 45 1HG PRO A 3 -2.269 0.926 -8.925 1.00 0.320 H ATOM 46 2HG PRO A 3 -3.422 -0.339 -8.488 1.00 0.320 H ATOM 47 1HD PRO A 3 -3.297 2.544 -7.494 1.00 0.320 H ATOM 48 2HD PRO A 3 -4.720 1.434 -7.855 1.00 0.320 H ATOM 49 N TYR A 4 -1.577 1.431 -4.184 1.00 0.160 N ATOM 50 CA TYR A 4 -0.793 1.736 -2.997 1.00 0.170 C ATOM 51 C TYR A 4 -1.274 0.952 -1.777 1.00 0.160 C ATOM 52 O TYR A 4 -0.470 0.520 -0.951 1.00 0.250 O ATOM 53 CB TYR A 4 -0.818 3.227 -2.655 1.00 0.230 C ATOM 54 CG TYR A 4 0.022 3.524 -1.415 1.00 0.230 C ATOM 55 CD1 TYR A 4 1.387 3.719 -1.521 1.00 0.230 C ATOM 56 CD2 TYR A 4 -0.569 3.550 -0.174 1.00 0.230 C ATOM 57 CE1 TYR A 4 2.136 3.932 -0.379 1.00 0.230 C ATOM 58 CE2 TYR A 4 0.177 3.755 0.961 1.00 0.230 C ATOM 59 CZ TYR A 4 1.536 3.932 0.859 1.00 0.230 C ATOM 60 OH TYR A 4 2.311 4.114 1.993 1.00 0.230 O ATOM 61 H TYR A 4 -1.836 2.207 -4.781 1.00 0.190 H ATOM 62 HA TYR A 4 0.238 1.442 -3.188 1.00 0.200 H ATOM 63 1HB TYR A 4 -0.437 3.815 -3.489 1.00 0.280 H ATOM 64 2HB TYR A 4 -1.844 3.547 -2.463 1.00 0.280 H ATOM 65 HD1 TYR A 4 1.870 3.702 -2.498 1.00 0.280 H ATOM 66 HD2 TYR A 4 -1.620 3.390 -0.097 1.00 0.280 H ATOM 67 HE1 TYR A 4 3.204 4.089 -0.446 1.00 0.280 H ATOM 68 HE2 TYR A 4 -0.306 3.757 1.937 1.00 0.280 H ATOM 69 HH TYR A 4 3.254 3.887 1.791 1.00 0.280 H ATOM 70 N PHE A 5 -2.599 0.815 -1.624 1.00 0.140 N ATOM 71 CA PHE A 5 -3.177 0.214 -0.439 1.00 0.160 C ATOM 72 C PHE A 5 -3.490 -1.276 -0.578 1.00 0.180 C ATOM 73 O PHE A 5 -4.142 -1.846 0.301 1.00 0.370 O ATOM 74 CB PHE A 5 -4.466 0.956 -0.097 1.00 0.220 C ATOM 75 CG PHE A 5 -4.241 2.396 0.244 1.00 0.220 C ATOM 76 CD1 PHE A 5 -4.418 3.371 -0.728 1.00 0.220 C ATOM 77 CD2 PHE A 5 -3.847 2.788 1.515 1.00 0.220 C ATOM 78 CE1 PHE A 5 -4.205 4.701 -0.446 1.00 0.220 C ATOM 79 CE2 PHE A 5 -3.632 4.123 1.800 1.00 0.220 C ATOM 80 CZ PHE A 5 -3.811 5.080 0.820 1.00 0.220 C ATOM 81 H PHE A 5 -3.244 1.139 -2.354 1.00 0.170 H ATOM 82 HA PHE A 5 -2.467 0.338 0.380 1.00 0.190 H ATOM 83 1HB PHE A 5 -5.142 0.908 -0.954 1.00 0.260 H ATOM 84 2HB PHE A 5 -4.960 0.475 0.745 1.00 0.260 H ATOM 85 HD1 PHE A 5 -4.721 3.071 -1.729 1.00 0.260 H ATOM 86 HD2 PHE A 5 -3.706 2.034 2.286 1.00 0.260 H ATOM 87 HE1 PHE A 5 -4.343 5.453 -1.233 1.00 0.260 H ATOM 88 HE2 PHE A 5 -3.315 4.420 2.786 1.00 0.260 H ATOM 89 HZ PHE A 5 -3.639 6.132 1.043 1.00 0.260 H ATOM 90 N THR A 6 -3.042 -1.923 -1.665 1.00 0.180 N ATOM 91 CA THR A 6 -3.266 -3.354 -1.830 1.00 0.220 C ATOM 92 C THR A 6 -1.878 -3.923 -1.780 1.00 0.180 C ATOM 93 O THR A 6 -1.625 -5.046 -1.308 1.00 0.170 O ATOM 94 CB THR A 6 -3.904 -3.699 -3.189 1.00 0.290 C ATOM 95 OG1 THR A 6 -3.006 -3.353 -4.246 1.00 0.290 O ATOM 96 CG2 THR A 6 -5.178 -2.901 -3.361 1.00 0.290 C ATOM 97 H THR A 6 -2.490 -1.444 -2.381 1.00 0.220 H ATOM 98 HA THR A 6 -3.858 -3.756 -1.007 1.00 0.260 H ATOM 99 HB THR A 6 -4.114 -4.751 -3.237 1.00 0.350 H ATOM 100 HG1 THR A 6 -3.349 -3.689 -5.080 1.00 0.350 H ATOM 101 1HG2 THR A 6 -5.629 -3.138 -4.322 1.00 0.350 H ATOM 102 2HG2 THR A 6 -5.869 -3.152 -2.559 1.00 0.350 H ATOM 103 3HG2 THR A 6 -4.951 -1.832 -3.324 1.00 0.350 H ATOM 104 N TRP A 7 -0.957 -3.033 -2.114 1.00 0.200 N ATOM 105 CA TRP A 7 0.442 -3.351 -2.185 1.00 0.190 C ATOM 106 C TRP A 7 1.001 -4.053 -0.961 1.00 0.170 C ATOM 107 O TRP A 7 1.723 -5.036 -1.118 1.00 0.190 O ATOM 108 CB TRP A 7 1.287 -2.126 -2.499 1.00 0.270 C ATOM 109 CG TRP A 7 2.657 -2.495 -2.611 1.00 0.270 C ATOM 110 CD1 TRP A 7 3.672 -2.248 -1.750 1.00 0.270 C ATOM 111 CD2 TRP A 7 3.203 -3.258 -3.679 1.00 0.270 C ATOM 112 NE1 TRP A 7 4.815 -2.788 -2.221 1.00 0.270 N ATOM 113 CE2 TRP A 7 4.541 -3.423 -3.409 1.00 0.270 C ATOM 114 CE3 TRP A 7 2.659 -3.814 -4.837 1.00 0.270 C ATOM 115 CZ2 TRP A 7 5.351 -4.123 -4.241 1.00 0.270 C ATOM 116 CZ3 TRP A 7 3.468 -4.517 -5.664 1.00 0.270 C ATOM 117 CH2 TRP A 7 4.765 -4.674 -5.381 1.00 0.270 C ATOM 118 H TRP A 7 -1.289 -2.139 -2.506 1.00 0.240 H ATOM 119 HA TRP A 7 0.570 -4.027 -3.014 1.00 0.230 H ATOM 120 1HB TRP A 7 0.963 -1.693 -3.444 1.00 0.320 H ATOM 121 2HB TRP A 7 1.198 -1.360 -1.753 1.00 0.320 H ATOM 122 HD1 TRP A 7 3.582 -1.702 -0.826 1.00 0.320 H ATOM 123 HE1 TRP A 7 5.713 -2.738 -1.751 1.00 0.320 H ATOM 124 HE3 TRP A 7 1.605 -3.695 -5.076 1.00 0.320 H ATOM 125 HZ2 TRP A 7 6.397 -4.254 -4.021 1.00 0.320 H ATOM 126 HZ3 TRP A 7 3.038 -4.955 -6.564 1.00 0.320 H ATOM 127 HH2 TRP A 7 5.341 -5.245 -6.068 1.00 0.320 H ATOM 128 N PRO A 8 0.741 -3.621 0.292 1.00 0.150 N ATOM 129 CA PRO A 8 1.319 -4.242 1.458 1.00 0.160 C ATOM 130 C PRO A 8 1.123 -5.770 1.475 1.00 0.180 C ATOM 131 O PRO A 8 2.018 -6.494 1.932 1.00 0.210 O ATOM 132 CB PRO A 8 0.537 -3.559 2.589 1.00 0.240 C ATOM 133 CG PRO A 8 0.139 -2.222 2.028 1.00 0.240 C ATOM 134 CD PRO A 8 -0.191 -2.503 0.615 1.00 0.240 C ATOM 135 HA PRO A 8 2.384 -3.988 1.491 1.00 0.190 H ATOM 136 1HB PRO A 8 -0.315 -4.184 2.909 1.00 0.290 H ATOM 137 2HB PRO A 8 1.189 -3.414 3.451 1.00 0.290 H ATOM 138 1HG PRO A 8 -0.721 -1.814 2.585 1.00 0.290 H ATOM 139 2HG PRO A 8 0.925 -1.504 2.112 1.00 0.290 H ATOM 140 1HD PRO A 8 -1.231 -2.823 0.583 1.00 0.290 H ATOM 141 2HD PRO A 8 -0.012 -1.623 0.029 1.00 0.290 H ATOM 142 N LEU A 9 -0.037 -6.263 0.966 1.00 0.170 N ATOM 143 CA LEU A 9 -0.321 -7.703 0.935 1.00 0.200 C ATOM 144 C LEU A 9 0.432 -8.417 -0.157 1.00 0.210 C ATOM 145 O LEU A 9 0.794 -9.587 -0.037 1.00 0.260 O ATOM 146 CB LEU A 9 -1.824 -7.981 0.760 1.00 0.270 C ATOM 147 CG LEU A 9 -2.680 -8.185 2.053 1.00 0.270 C ATOM 148 CD1 LEU A 9 -2.228 -9.476 2.780 1.00 0.270 C ATOM 149 CD2 LEU A 9 -2.562 -6.948 2.966 1.00 0.270 C ATOM 150 H LEU A 9 -0.747 -5.654 0.554 1.00 0.200 H ATOM 151 HA LEU A 9 0.018 -8.118 1.874 1.00 0.240 H ATOM 152 1HB LEU A 9 -2.255 -7.144 0.214 1.00 0.320 H ATOM 153 2HB LEU A 9 -1.939 -8.876 0.142 1.00 0.320 H ATOM 154 HG LEU A 9 -3.712 -8.321 1.768 1.00 0.320 H ATOM 155 1HD1 LEU A 9 -2.842 -9.634 3.664 1.00 0.320 H ATOM 156 2HD1 LEU A 9 -2.335 -10.331 2.110 1.00 0.320 H ATOM 157 3HD1 LEU A 9 -1.201 -9.400 3.091 1.00 0.320 H ATOM 158 1HD2 LEU A 9 -3.178 -7.094 3.855 1.00 0.320 H ATOM 159 2HD2 LEU A 9 -1.524 -6.803 3.274 1.00 0.320 H ATOM 160 3HD2 LEU A 9 -2.905 -6.060 2.430 1.00 0.320 H ATOM 161 N ILE A 10 0.572 -7.735 -1.277 1.00 0.170 N ATOM 162 CA ILE A 10 1.216 -8.286 -2.458 1.00 0.150 C ATOM 163 C ILE A 10 2.700 -8.495 -2.142 1.00 0.120 C ATOM 164 O ILE A 10 3.278 -9.586 -2.313 1.00 0.170 O ATOM 165 CB ILE A 10 1.006 -7.280 -3.614 1.00 0.220 C ATOM 166 CG1 ILE A 10 -0.526 -7.231 -3.931 1.00 0.220 C ATOM 167 CG2 ILE A 10 1.811 -7.651 -4.840 1.00 0.220 C ATOM 168 CD1 ILE A 10 -0.970 -6.089 -4.818 1.00 0.220 C ATOM 169 H ILE A 10 0.205 -6.774 -1.294 1.00 0.200 H ATOM 170 HA ILE A 10 0.766 -9.237 -2.715 1.00 0.180 H ATOM 171 HB ILE A 10 1.310 -6.295 -3.283 1.00 0.260 H ATOM 172 1HG1 ILE A 10 -0.807 -8.165 -4.393 1.00 0.260 H ATOM 173 2HG1 ILE A 10 -1.073 -7.141 -2.994 1.00 0.260 H ATOM 174 1HG2 ILE A 10 1.649 -6.930 -5.628 1.00 0.260 H ATOM 175 2HG2 ILE A 10 2.873 -7.677 -4.604 1.00 0.260 H ATOM 176 3HG2 ILE A 10 1.481 -8.610 -5.172 1.00 0.260 H ATOM 177 1HD1 ILE A 10 -2.044 -6.147 -4.951 1.00 0.260 H ATOM 178 2HD1 ILE A 10 -0.735 -5.149 -4.360 1.00 0.260 H ATOM 179 3HD1 ILE A 10 -0.487 -6.147 -5.784 1.00 0.260 H ATOM 180 N ALA A 11 3.280 -7.425 -1.618 1.00 0.090 N ATOM 181 CA ALA A 11 4.664 -7.339 -1.200 1.00 0.120 C ATOM 182 C ALA A 11 5.018 -8.321 -0.079 1.00 0.130 C ATOM 183 O ALA A 11 6.109 -8.900 -0.062 1.00 0.160 O ATOM 184 CB ALA A 11 4.927 -5.938 -0.761 1.00 0.160 C ATOM 185 H ALA A 11 2.705 -6.581 -1.523 1.00 0.110 H ATOM 186 HA ALA A 11 5.289 -7.563 -2.058 1.00 0.140 H ATOM 187 1HB ALA A 11 5.970 -5.816 -0.491 1.00 0.190 H ATOM 188 2HB ALA A 11 4.690 -5.309 -1.559 1.00 0.190 H ATOM 189 3HB ALA A 11 4.289 -5.696 0.085 1.00 0.190 H ATOM 190 N ALA A 12 4.075 -8.579 0.826 1.00 0.150 N ATOM 191 CA ALA A 12 4.306 -9.444 1.974 1.00 0.160 C ATOM 192 C ALA A 12 4.825 -10.827 1.616 1.00 0.150 C ATOM 193 O ALA A 12 5.585 -11.405 2.387 1.00 0.170 O ATOM 194 CB ALA A 12 3.019 -9.635 2.744 1.00 0.220 C ATOM 195 H ALA A 12 3.212 -8.038 0.807 1.00 0.180 H ATOM 196 HA ALA A 12 5.034 -8.950 2.617 1.00 0.190 H ATOM 197 1HB ALA A 12 3.215 -10.243 3.634 1.00 0.260 H ATOM 198 2HB ALA A 12 2.634 -8.694 3.030 1.00 0.260 H ATOM 199 3HB ALA A 12 2.290 -10.134 2.110 1.00 0.260 H ATOM 200 N ASP A 13 4.427 -11.398 0.474 1.00 0.120 N ATOM 201 CA ASP A 13 4.882 -12.753 0.182 1.00 0.100 C ATOM 202 C ASP A 13 5.924 -12.793 -0.926 1.00 0.100 C ATOM 203 O ASP A 13 6.188 -13.857 -1.486 1.00 0.090 O ATOM 204 CB ASP A 13 3.687 -13.640 -0.173 1.00 0.150 C ATOM 205 CG ASP A 13 3.926 -15.176 -0.055 1.00 0.150 C ATOM 206 OD1 ASP A 13 4.685 -15.600 0.773 1.00 0.150 O ATOM 207 OD2 ASP A 13 3.267 -15.916 -0.769 1.00 0.150 O ATOM 208 H ASP A 13 3.848 -10.915 -0.223 1.00 0.140 H ATOM 209 HA ASP A 13 5.339 -13.166 1.081 1.00 0.120 H ATOM 210 1HB ASP A 13 2.879 -13.385 0.485 1.00 0.180 H ATOM 211 2HB ASP A 13 3.351 -13.405 -1.176 1.00 0.180 H ATOM 212 N GLY A 14 6.560 -11.656 -1.228 1.00 0.110 N ATOM 213 CA GLY A 14 7.589 -11.650 -2.256 1.00 0.110 C ATOM 214 C GLY A 14 7.314 -10.784 -3.482 1.00 0.090 C ATOM 215 O GLY A 14 8.160 -10.727 -4.375 1.00 0.110 O ATOM 216 H GLY A 14 6.353 -10.772 -0.746 1.00 0.130 H ATOM 217 1HA GLY A 14 8.521 -11.316 -1.800 1.00 0.130 H ATOM 218 2HA GLY A 14 7.770 -12.671 -2.585 1.00 0.130 H ATOM 219 N GLY A 15 6.161 -10.114 -3.580 1.00 0.070 N ATOM 220 CA GLY A 15 5.970 -9.255 -4.739 1.00 0.070 C ATOM 221 C GLY A 15 6.887 -8.042 -4.614 1.00 0.080 C ATOM 222 O GLY A 15 7.277 -7.664 -3.506 1.00 0.080 O ATOM 223 H GLY A 15 5.401 -10.166 -2.895 1.00 0.080 H ATOM 224 1HA GLY A 15 6.190 -9.798 -5.659 1.00 0.080 H ATOM 225 2HA GLY A 15 4.934 -8.930 -4.782 1.00 0.080 H ATOM 226 N TYR A 16 7.219 -7.432 -5.742 1.00 0.140 N ATOM 227 CA TYR A 16 8.060 -6.230 -5.750 1.00 0.200 C ATOM 228 C TYR A 16 7.742 -5.375 -6.960 1.00 0.210 C ATOM 229 O TYR A 16 7.131 -5.855 -7.908 1.00 0.180 O ATOM 230 CB TYR A 16 9.558 -6.588 -5.662 1.00 0.260 C ATOM 231 CG TYR A 16 10.136 -7.448 -6.791 1.00 0.260 C ATOM 232 CD1 TYR A 16 10.715 -6.879 -7.921 1.00 0.260 C ATOM 233 CD2 TYR A 16 10.097 -8.826 -6.668 1.00 0.260 C ATOM 234 CE1 TYR A 16 11.250 -7.697 -8.928 1.00 0.260 C ATOM 235 CE2 TYR A 16 10.621 -9.629 -7.653 1.00 0.260 C ATOM 236 CZ TYR A 16 11.198 -9.079 -8.782 1.00 0.260 C ATOM 237 OH TYR A 16 11.715 -9.932 -9.751 1.00 0.260 O ATOM 238 H TYR A 16 6.861 -7.828 -6.616 1.00 0.170 H ATOM 239 HA TYR A 16 7.830 -5.650 -4.865 1.00 0.240 H ATOM 240 1HB TYR A 16 10.138 -5.664 -5.625 1.00 0.310 H ATOM 241 2HB TYR A 16 9.737 -7.111 -4.722 1.00 0.310 H ATOM 242 HD1 TYR A 16 10.743 -5.808 -8.015 1.00 0.310 H ATOM 243 HD2 TYR A 16 9.648 -9.278 -5.784 1.00 0.310 H ATOM 244 HE1 TYR A 16 11.702 -7.259 -9.819 1.00 0.310 H ATOM 245 HE2 TYR A 16 10.582 -10.709 -7.541 1.00 0.310 H ATOM 246 HH TYR A 16 12.048 -9.425 -10.542 1.00 0.310 H ATOM 247 N ALA A 17 8.102 -4.092 -6.933 1.00 0.240 N ATOM 248 CA ALA A 17 7.837 -3.308 -8.129 1.00 0.230 C ATOM 249 C ALA A 17 8.928 -3.571 -9.140 1.00 0.210 C ATOM 250 O ALA A 17 8.671 -4.170 -10.181 1.00 0.180 O ATOM 251 CB ALA A 17 7.741 -1.830 -7.801 1.00 0.330 C ATOM 252 H ALA A 17 8.570 -3.697 -6.130 1.00 0.290 H ATOM 253 HA ALA A 17 6.889 -3.633 -8.559 1.00 0.280 H ATOM 254 1HB ALA A 17 7.532 -1.275 -8.716 1.00 0.390 H ATOM 255 2HB ALA A 17 6.937 -1.674 -7.090 1.00 0.390 H ATOM 256 3HB ALA A 17 8.675 -1.480 -7.374 1.00 0.390 H ATOM 257 N PHE A 18 10.163 -3.181 -8.812 1.00 0.240 N ATOM 258 CA PHE A 18 11.268 -3.442 -9.717 1.00 0.240 C ATOM 259 C PHE A 18 12.470 -3.902 -8.926 1.00 0.270 C ATOM 260 O PHE A 18 12.715 -3.423 -7.816 1.00 0.300 O ATOM 261 CB PHE A 18 11.614 -2.213 -10.548 1.00 0.340 C ATOM 262 CG PHE A 18 10.471 -1.741 -11.346 1.00 0.340 C ATOM 263 CD1 PHE A 18 9.719 -0.666 -10.913 1.00 0.340 C ATOM 264 CD2 PHE A 18 10.104 -2.384 -12.501 1.00 0.340 C ATOM 265 CE1 PHE A 18 8.636 -0.238 -11.638 1.00 0.340 C ATOM 266 CE2 PHE A 18 9.026 -1.959 -13.227 1.00 0.340 C ATOM 267 CZ PHE A 18 8.292 -0.886 -12.800 1.00 0.340 C ATOM 268 H PHE A 18 10.336 -2.706 -7.942 1.00 0.290 H ATOM 269 HA PHE A 18 10.980 -4.239 -10.391 1.00 0.290 H ATOM 270 1HB PHE A 18 11.930 -1.412 -9.910 1.00 0.400 H ATOM 271 2HB PHE A 18 12.439 -2.454 -11.230 1.00 0.400 H ATOM 272 HD1 PHE A 18 9.995 -0.159 -9.988 1.00 0.400 H ATOM 273 HD2 PHE A 18 10.685 -3.249 -12.845 1.00 0.400 H ATOM 274 HE1 PHE A 18 8.050 0.613 -11.292 1.00 0.400 H ATOM 275 HE2 PHE A 18 8.760 -2.480 -14.148 1.00 0.400 H ATOM 276 HZ PHE A 18 7.436 -0.553 -13.379 1.00 0.400 H ATOM 277 N LYS A 19 13.219 -4.832 -9.485 1.00 0.270 N ATOM 278 CA LYS A 19 14.425 -5.300 -8.808 1.00 0.280 C ATOM 279 C LYS A 19 15.410 -4.155 -8.592 1.00 0.320 C ATOM 280 O LYS A 19 15.714 -3.404 -9.520 1.00 0.440 O ATOM 281 CB LYS A 19 15.084 -6.435 -9.578 1.00 0.390 C ATOM 282 CG LYS A 19 16.320 -7.021 -8.896 1.00 0.390 C ATOM 283 CD LYS A 19 16.880 -8.234 -9.644 1.00 0.390 C ATOM 284 CE LYS A 19 17.541 -7.833 -10.978 1.00 0.390 C ATOM 285 NZ LYS A 19 18.213 -8.979 -11.630 1.00 0.390 N ATOM 286 H LYS A 19 12.925 -5.210 -10.397 1.00 0.320 H ATOM 287 HA LYS A 19 14.138 -5.680 -7.827 1.00 0.340 H ATOM 288 1HB LYS A 19 14.365 -7.243 -9.715 1.00 0.470 H ATOM 289 2HB LYS A 19 15.360 -6.081 -10.554 1.00 0.470 H ATOM 290 1HG LYS A 19 17.093 -6.262 -8.858 1.00 0.470 H ATOM 291 2HG LYS A 19 16.075 -7.314 -7.878 1.00 0.470 H ATOM 292 1HD LYS A 19 17.635 -8.723 -9.023 1.00 0.470 H ATOM 293 2HD LYS A 19 16.079 -8.946 -9.845 1.00 0.470 H ATOM 294 1HE LYS A 19 16.791 -7.450 -11.664 1.00 0.470 H ATOM 295 2HE LYS A 19 18.273 -7.053 -10.792 1.00 0.470 H ATOM 296 1HZ LYS A 19 18.637 -8.664 -12.493 1.00 0.470 H ATOM 297 2HZ LYS A 19 18.933 -9.346 -11.015 1.00 0.470 H ATOM 298 3HZ LYS A 19 17.541 -9.711 -11.830 1.00 0.470 H ATOM 299 N TYR A 20 15.943 -4.027 -7.382 1.00 0.270 N ATOM 300 CA TYR A 20 16.869 -2.931 -7.123 1.00 0.300 C ATOM 301 C TYR A 20 18.264 -3.462 -6.838 1.00 0.480 C ATOM 302 O TYR A 20 18.447 -4.318 -5.967 1.00 0.690 O ATOM 303 CB TYR A 20 16.327 -2.090 -5.965 1.00 0.410 C ATOM 304 CG TYR A 20 17.076 -0.810 -5.661 1.00 0.410 C ATOM 305 CD1 TYR A 20 17.023 0.184 -6.572 1.00 0.410 C ATOM 306 CD2 TYR A 20 17.743 -0.606 -4.474 1.00 0.410 C ATOM 307 CE1 TYR A 20 17.618 1.380 -6.362 1.00 0.410 C ATOM 308 CE2 TYR A 20 18.357 0.623 -4.246 1.00 0.410 C ATOM 309 CZ TYR A 20 18.290 1.611 -5.207 1.00 0.410 C ATOM 310 OH TYR A 20 18.896 2.845 -5.009 1.00 0.410 O ATOM 311 H TYR A 20 15.685 -4.666 -6.642 1.00 0.320 H ATOM 312 HA TYR A 20 16.941 -2.305 -8.009 1.00 0.360 H ATOM 313 1HB TYR A 20 15.296 -1.836 -6.174 1.00 0.490 H ATOM 314 2HB TYR A 20 16.324 -2.695 -5.063 1.00 0.490 H ATOM 315 HD1 TYR A 20 16.499 0.015 -7.484 1.00 0.490 H ATOM 316 HD2 TYR A 20 17.782 -1.394 -3.721 1.00 0.490 H ATOM 317 HE1 TYR A 20 17.556 2.158 -7.121 1.00 0.490 H ATOM 318 HE2 TYR A 20 18.889 0.806 -3.312 1.00 0.490 H ATOM 319 HH TYR A 20 19.072 3.281 -5.888 1.00 0.490 H ATOM 320 N GLU A 21 19.237 -2.984 -7.616 1.00 0.470 N ATOM 321 CA GLU A 21 20.626 -3.406 -7.476 1.00 0.700 C ATOM 322 C GLU A 21 21.602 -2.258 -7.647 1.00 0.690 C ATOM 323 O GLU A 21 21.491 -1.445 -8.567 1.00 1.410 O ATOM 324 CB GLU A 21 21.001 -4.495 -8.499 1.00 0.890 C ATOM 325 CG GLU A 21 20.312 -5.846 -8.325 1.00 0.890 C ATOM 326 CD GLU A 21 20.758 -6.878 -9.354 1.00 0.890 C ATOM 327 OE1 GLU A 21 21.434 -6.509 -10.282 1.00 0.890 O ATOM 328 OE2 GLU A 21 20.428 -8.040 -9.200 1.00 0.890 O ATOM 329 H GLU A 21 18.996 -2.262 -8.303 1.00 0.560 H ATOM 330 HA GLU A 21 20.760 -3.814 -6.475 1.00 0.840 H ATOM 331 1HB GLU A 21 20.765 -4.136 -9.500 1.00 1.070 H ATOM 332 2HB GLU A 21 22.078 -4.665 -8.462 1.00 1.070 H ATOM 333 1HG GLU A 21 20.515 -6.223 -7.324 1.00 1.070 H ATOM 334 2HG GLU A 21 19.249 -5.699 -8.414 1.00 1.070 H ATOM 335 N ASN A 22 22.590 -2.212 -6.765 1.00 0.800 N ATOM 336 CA ASN A 22 23.694 -1.263 -6.828 1.00 1.050 C ATOM 337 C ASN A 22 23.252 0.191 -6.968 1.00 0.740 C ATOM 338 O ASN A 22 23.883 0.972 -7.669 1.00 1.200 O ATOM 339 CB ASN A 22 24.621 -1.645 -7.963 1.00 1.370 C ATOM 340 CG ASN A 22 25.218 -3.002 -7.757 1.00 1.370 C ATOM 341 OD1 ASN A 22 25.576 -3.381 -6.632 1.00 1.370 O ATOM 342 ND2 ASN A 22 25.326 -3.755 -8.820 1.00 1.370 N ATOM 343 H ASN A 22 22.598 -2.903 -6.026 1.00 0.960 H ATOM 344 HA ASN A 22 24.252 -1.334 -5.893 1.00 1.260 H ATOM 345 1HB ASN A 22 24.080 -1.631 -8.909 1.00 1.640 H ATOM 346 2HB ASN A 22 25.428 -0.916 -8.037 1.00 1.640 H ATOM 347 1HD2 ASN A 22 25.712 -4.675 -8.747 1.00 1.640 H ATOM 348 2HD2 ASN A 22 25.018 -3.412 -9.709 1.00 1.640 H ATOM 349 N GLY A 23 22.190 0.567 -6.286 1.00 0.690 N ATOM 350 CA GLY A 23 21.705 1.938 -6.335 1.00 0.600 C ATOM 351 C GLY A 23 20.679 2.256 -7.440 1.00 0.610 C ATOM 352 O GLY A 23 20.052 3.323 -7.387 1.00 0.900 O ATOM 353 H GLY A 23 21.725 -0.116 -5.706 1.00 0.830 H ATOM 354 1HA GLY A 23 21.278 2.183 -5.365 1.00 0.720 H ATOM 355 2HA GLY A 23 22.560 2.600 -6.457 1.00 0.720 H ATOM 356 N LYS A 24 20.435 1.335 -8.382 1.00 0.470 N ATOM 357 CA LYS A 24 19.500 1.586 -9.488 1.00 0.460 C ATOM 358 C LYS A 24 18.388 0.539 -9.625 1.00 0.340 C ATOM 359 O LYS A 24 18.540 -0.619 -9.225 1.00 0.410 O ATOM 360 CB LYS A 24 20.272 1.640 -10.810 1.00 0.650 C ATOM 361 CG LYS A 24 21.385 2.712 -10.897 1.00 0.650 C ATOM 362 CD LYS A 24 20.837 4.142 -10.914 1.00 0.650 C ATOM 363 CE LYS A 24 21.958 5.159 -11.102 1.00 0.650 C ATOM 364 NZ LYS A 24 21.453 6.566 -11.065 1.00 0.650 N ATOM 365 H LYS A 24 20.947 0.447 -8.366 1.00 0.560 H ATOM 366 HA LYS A 24 19.012 2.542 -9.315 1.00 0.550 H ATOM 367 1HB LYS A 24 20.743 0.670 -10.977 1.00 0.780 H ATOM 368 2HB LYS A 24 19.573 1.805 -11.631 1.00 0.780 H ATOM 369 1HG LYS A 24 22.057 2.600 -10.043 1.00 0.780 H ATOM 370 2HG LYS A 24 21.964 2.546 -11.802 1.00 0.780 H ATOM 371 1HD LYS A 24 20.112 4.251 -11.720 1.00 0.780 H ATOM 372 2HD LYS A 24 20.343 4.357 -9.967 1.00 0.780 H ATOM 373 1HE LYS A 24 22.692 5.026 -10.307 1.00 0.780 H ATOM 374 2HE LYS A 24 22.442 4.984 -12.063 1.00 0.780 H ATOM 375 1HZ LYS A 24 22.226 7.206 -11.191 1.00 0.780 H ATOM 376 2HZ LYS A 24 20.779 6.705 -11.806 1.00 0.780 H ATOM 377 3HZ LYS A 24 21.013 6.743 -10.172 1.00 0.780 H ATOM 378 N TYR A 25 17.255 0.942 -10.211 1.00 0.310 N ATOM 379 CA TYR A 25 16.192 -0.028 -10.470 1.00 0.370 C ATOM 380 C TYR A 25 16.321 -0.629 -11.851 1.00 0.380 C ATOM 381 O TYR A 25 16.512 0.080 -12.844 1.00 0.430 O ATOM 382 CB TYR A 25 14.802 0.593 -10.342 1.00 0.490 C ATOM 383 CG TYR A 25 14.407 0.919 -8.952 1.00 0.490 C ATOM 384 CD1 TYR A 25 14.616 2.186 -8.444 1.00 0.490 C ATOM 385 CD2 TYR A 25 13.836 -0.063 -8.163 1.00 0.490 C ATOM 386 CE1 TYR A 25 14.251 2.471 -7.145 1.00 0.490 C ATOM 387 CE2 TYR A 25 13.468 0.219 -6.873 1.00 0.490 C ATOM 388 CZ TYR A 25 13.675 1.479 -6.359 1.00 0.490 C ATOM 389 OH TYR A 25 13.311 1.760 -5.062 1.00 0.490 O ATOM 390 H TYR A 25 17.148 1.904 -10.504 1.00 0.370 H ATOM 391 HA TYR A 25 16.271 -0.844 -9.755 1.00 0.440 H ATOM 392 1HB TYR A 25 14.750 1.502 -10.938 1.00 0.590 H ATOM 393 2HB TYR A 25 14.071 -0.105 -10.745 1.00 0.590 H ATOM 394 HD1 TYR A 25 15.068 2.957 -9.065 1.00 0.590 H ATOM 395 HD2 TYR A 25 13.685 -1.063 -8.559 1.00 0.590 H ATOM 396 HE1 TYR A 25 14.416 3.467 -6.739 1.00 0.590 H ATOM 397 HE2 TYR A 25 13.021 -0.561 -6.254 1.00 0.590 H ATOM 398 HH TYR A 25 13.541 2.669 -4.855 1.00 0.590 H ATOM 399 N ASP A 26 16.171 -1.939 -11.905 1.00 0.380 N ATOM 400 CA ASP A 26 16.185 -2.699 -13.133 1.00 0.380 C ATOM 401 C ASP A 26 14.743 -2.713 -13.606 1.00 0.380 C ATOM 402 O ASP A 26 14.004 -3.649 -13.319 1.00 0.440 O ATOM 403 CB ASP A 26 16.708 -4.119 -12.864 1.00 0.530 C ATOM 404 CG ASP A 26 16.967 -4.975 -14.122 1.00 0.530 C ATOM 405 OD1 ASP A 26 16.763 -4.498 -15.224 1.00 0.530 O ATOM 406 OD2 ASP A 26 17.380 -6.107 -13.966 1.00 0.530 O ATOM 407 H ASP A 26 16.038 -2.441 -11.026 1.00 0.460 H ATOM 408 HA ASP A 26 16.810 -2.200 -13.873 1.00 0.460 H ATOM 409 1HB ASP A 26 17.635 -4.052 -12.288 1.00 0.640 H ATOM 410 2HB ASP A 26 15.992 -4.637 -12.237 1.00 0.640 H ATOM 411 N ILE A 27 14.337 -1.678 -14.328 1.00 0.350 N ATOM 412 CA ILE A 27 12.931 -1.469 -14.665 1.00 0.390 C ATOM 413 C ILE A 27 12.304 -2.630 -15.435 1.00 0.390 C ATOM 414 O ILE A 27 11.118 -2.903 -15.291 1.00 0.630 O ATOM 415 CB ILE A 27 12.719 -0.119 -15.379 1.00 0.530 C ATOM 416 CG1 ILE A 27 13.103 1.078 -14.393 1.00 0.530 C ATOM 417 CG2 ILE A 27 11.255 0.018 -15.863 1.00 0.530 C ATOM 418 CD1 ILE A 27 12.295 1.184 -13.066 1.00 0.530 C ATOM 419 H ILE A 27 15.028 -0.973 -14.570 1.00 0.420 H ATOM 420 HA ILE A 27 12.386 -1.413 -13.737 1.00 0.470 H ATOM 421 HB ILE A 27 13.384 -0.054 -16.237 1.00 0.640 H ATOM 422 1HG1 ILE A 27 14.157 0.984 -14.128 1.00 0.640 H ATOM 423 2HG1 ILE A 27 12.966 2.014 -14.935 1.00 0.640 H ATOM 424 1HG2 ILE A 27 11.131 0.976 -16.362 1.00 0.640 H ATOM 425 2HG2 ILE A 27 11.008 -0.773 -16.566 1.00 0.640 H ATOM 426 3HG2 ILE A 27 10.575 -0.041 -15.018 1.00 0.640 H ATOM 427 1HD1 ILE A 27 12.655 2.043 -12.504 1.00 0.640 H ATOM 428 2HD1 ILE A 27 11.237 1.318 -13.275 1.00 0.640 H ATOM 429 3HD1 ILE A 27 12.425 0.303 -12.460 1.00 0.640 H ATOM 430 N LYS A 28 13.031 -3.266 -16.332 1.00 0.250 N ATOM 431 CA LYS A 28 12.428 -4.403 -17.031 1.00 0.250 C ATOM 432 C LYS A 28 12.070 -5.569 -16.067 1.00 0.240 C ATOM 433 O LYS A 28 11.217 -6.416 -16.364 1.00 0.240 O ATOM 434 CB LYS A 28 13.352 -4.898 -18.150 1.00 0.350 C ATOM 435 CG LYS A 28 14.641 -5.554 -17.675 1.00 0.350 C ATOM 436 CD LYS A 28 15.537 -5.957 -18.842 1.00 0.350 C ATOM 437 CE LYS A 28 16.806 -6.671 -18.356 1.00 0.350 C ATOM 438 NZ LYS A 28 17.734 -5.756 -17.604 1.00 0.350 N ATOM 439 H LYS A 28 13.993 -2.997 -16.480 1.00 0.300 H ATOM 440 HA LYS A 28 11.500 -4.063 -17.489 1.00 0.300 H ATOM 441 1HB LYS A 28 12.816 -5.620 -18.765 1.00 0.420 H ATOM 442 2HB LYS A 28 13.623 -4.059 -18.789 1.00 0.420 H ATOM 443 1HG LYS A 28 15.171 -4.865 -17.028 1.00 0.420 H ATOM 444 2HG LYS A 28 14.409 -6.450 -17.101 1.00 0.420 H ATOM 445 1HD LYS A 28 14.989 -6.623 -19.508 1.00 0.420 H ATOM 446 2HD LYS A 28 15.827 -5.068 -19.403 1.00 0.420 H ATOM 447 1HE LYS A 28 16.519 -7.492 -17.700 1.00 0.420 H ATOM 448 2HE LYS A 28 17.334 -7.074 -19.218 1.00 0.420 H ATOM 449 1HZ LYS A 28 18.544 -6.273 -17.305 1.00 0.420 H ATOM 450 2HZ LYS A 28 18.023 -4.998 -18.195 1.00 0.420 H ATOM 451 3HZ LYS A 28 17.275 -5.361 -16.754 1.00 0.420 H ATOM 452 N ASP A 29 12.740 -5.659 -14.916 1.00 0.260 N ATOM 453 CA ASP A 29 12.510 -6.762 -13.999 1.00 0.240 C ATOM 454 C ASP A 29 11.376 -6.397 -13.063 1.00 0.210 C ATOM 455 O ASP A 29 11.590 -5.836 -11.978 1.00 0.230 O ATOM 456 CB ASP A 29 13.793 -7.104 -13.232 1.00 0.340 C ATOM 457 CG ASP A 29 13.676 -8.350 -12.328 1.00 0.340 C ATOM 458 OD1 ASP A 29 12.578 -8.788 -12.083 1.00 0.340 O ATOM 459 OD2 ASP A 29 14.690 -8.856 -11.905 1.00 0.340 O ATOM 460 H ASP A 29 13.385 -4.923 -14.628 1.00 0.310 H ATOM 461 HA ASP A 29 12.210 -7.640 -14.571 1.00 0.290 H ATOM 462 1HB ASP A 29 14.608 -7.260 -13.946 1.00 0.410 H ATOM 463 2HB ASP A 29 14.074 -6.247 -12.625 1.00 0.410 H ATOM 464 N VAL A 30 10.157 -6.722 -13.495 1.00 0.180 N ATOM 465 CA VAL A 30 8.972 -6.335 -12.738 1.00 0.160 C ATOM 466 C VAL A 30 8.439 -7.525 -11.928 1.00 0.140 C ATOM 467 O VAL A 30 8.207 -8.620 -12.444 1.00 0.140 O ATOM 468 CB VAL A 30 7.896 -5.734 -13.680 1.00 0.230 C ATOM 469 CG1 VAL A 30 7.443 -6.747 -14.737 1.00 0.230 C ATOM 470 CG2 VAL A 30 6.720 -5.211 -12.853 1.00 0.230 C ATOM 471 H VAL A 30 10.103 -7.175 -14.409 1.00 0.220 H ATOM 472 HA VAL A 30 9.261 -5.550 -12.044 1.00 0.190 H ATOM 473 HB VAL A 30 8.346 -4.902 -14.220 1.00 0.280 H ATOM 474 1HG1 VAL A 30 6.718 -6.276 -15.398 1.00 0.280 H ATOM 475 2HG1 VAL A 30 8.301 -7.071 -15.322 1.00 0.280 H ATOM 476 3HG1 VAL A 30 6.978 -7.611 -14.272 1.00 0.280 H ATOM 477 1HG2 VAL A 30 5.987 -4.755 -13.512 1.00 0.280 H ATOM 478 2HG2 VAL A 30 6.257 -6.012 -12.314 1.00 0.280 H ATOM 479 3HG2 VAL A 30 7.084 -4.460 -12.143 1.00 0.280 H ATOM 480 N GLY A 31 8.218 -7.262 -10.654 1.00 0.140 N ATOM 481 CA GLY A 31 7.818 -8.242 -9.639 1.00 0.130 C ATOM 482 C GLY A 31 6.328 -8.441 -9.420 1.00 0.140 C ATOM 483 O GLY A 31 5.917 -8.863 -8.336 1.00 0.290 O ATOM 484 H GLY A 31 8.399 -6.287 -10.377 1.00 0.170 H ATOM 485 1HA GLY A 31 8.277 -9.199 -9.882 1.00 0.160 H ATOM 486 2HA GLY A 31 8.247 -7.939 -8.699 1.00 0.160 H ATOM 487 N VAL A 32 5.528 -8.043 -10.394 1.00 0.110 N ATOM 488 CA VAL A 32 4.071 -8.102 -10.329 1.00 0.130 C ATOM 489 C VAL A 32 3.512 -9.517 -10.504 1.00 0.110 C ATOM 490 O VAL A 32 2.465 -9.844 -9.949 1.00 0.140 O ATOM 491 CB VAL A 32 3.458 -7.117 -11.356 1.00 0.170 C ATOM 492 CG1 VAL A 32 3.633 -7.612 -12.811 1.00 0.170 C ATOM 493 CG2 VAL A 32 1.980 -6.917 -11.038 1.00 0.170 C ATOM 494 H VAL A 32 5.986 -7.692 -11.224 1.00 0.130 H ATOM 495 HA VAL A 32 3.776 -7.751 -9.338 1.00 0.160 H ATOM 496 HB VAL A 32 3.984 -6.166 -11.270 1.00 0.210 H ATOM 497 1HG1 VAL A 32 3.213 -6.876 -13.492 1.00 0.210 H ATOM 498 2HG1 VAL A 32 4.684 -7.749 -13.044 1.00 0.210 H ATOM 499 3HG1 VAL A 32 3.110 -8.551 -12.960 1.00 0.210 H ATOM 500 1HG2 VAL A 32 1.554 -6.199 -11.735 1.00 0.210 H ATOM 501 2HG2 VAL A 32 1.445 -7.863 -11.129 1.00 0.210 H ATOM 502 3HG2 VAL A 32 1.875 -6.540 -10.020 1.00 0.210 H ATOM 503 N ASP A 33 4.189 -10.332 -11.320 1.00 0.120 N ATOM 504 CA ASP A 33 3.752 -11.692 -11.644 1.00 0.140 C ATOM 505 C ASP A 33 4.428 -12.747 -10.775 1.00 0.130 C ATOM 506 O ASP A 33 4.338 -13.948 -11.038 1.00 0.150 O ATOM 507 CB ASP A 33 4.052 -11.995 -13.113 1.00 0.190 C ATOM 508 CG ASP A 33 3.229 -11.165 -14.086 1.00 0.190 C ATOM 509 OD1 ASP A 33 2.042 -11.041 -13.897 1.00 0.190 O ATOM 510 OD2 ASP A 33 3.812 -10.631 -14.999 1.00 0.190 O ATOM 511 H ASP A 33 5.031 -9.982 -11.759 1.00 0.140 H ATOM 512 HA ASP A 33 2.675 -11.753 -11.481 1.00 0.170 H ATOM 513 1HB ASP A 33 5.109 -11.813 -13.308 1.00 0.230 H ATOM 514 2HB ASP A 33 3.862 -13.048 -13.311 1.00 0.230 H ATOM 515 N ASN A 34 5.125 -12.288 -9.756 1.00 0.120 N ATOM 516 CA ASN A 34 5.817 -13.142 -8.811 1.00 0.110 C ATOM 517 C ASN A 34 4.808 -14.037 -8.109 1.00 0.100 C ATOM 518 O ASN A 34 3.694 -13.606 -7.813 1.00 0.090 O ATOM 519 CB ASN A 34 6.584 -12.302 -7.803 1.00 0.160 C ATOM 520 CG ASN A 34 7.535 -13.102 -6.939 1.00 0.160 C ATOM 521 OD1 ASN A 34 7.145 -13.792 -5.977 1.00 0.160 O ATOM 522 ND2 ASN A 34 8.799 -13.038 -7.280 1.00 0.160 N ATOM 523 H ASN A 34 5.160 -11.285 -9.619 1.00 0.140 H ATOM 524 HA ASN A 34 6.514 -13.783 -9.354 1.00 0.130 H ATOM 525 1HB ASN A 34 7.152 -11.533 -8.330 1.00 0.190 H ATOM 526 2HB ASN A 34 5.878 -11.786 -7.159 1.00 0.190 H ATOM 527 1HD2 ASN A 34 9.489 -13.543 -6.755 1.00 0.190 H ATOM 528 2HD2 ASN A 34 9.079 -12.489 -8.069 1.00 0.190 H ATOM 529 N ALA A 35 5.193 -15.272 -7.796 1.00 0.100 N ATOM 530 CA ALA A 35 4.271 -16.165 -7.098 1.00 0.090 C ATOM 531 C ALA A 35 3.780 -15.537 -5.794 1.00 0.080 C ATOM 532 O ALA A 35 2.631 -15.756 -5.396 1.00 0.070 O ATOM 533 CB ALA A 35 4.943 -17.487 -6.803 1.00 0.130 C ATOM 534 H ALA A 35 6.115 -15.595 -8.056 1.00 0.120 H ATOM 535 HA ALA A 35 3.410 -16.333 -7.743 1.00 0.110 H ATOM 536 1HB ALA A 35 4.238 -18.148 -6.303 1.00 0.160 H ATOM 537 2HB ALA A 35 5.272 -17.944 -7.736 1.00 0.160 H ATOM 538 3HB ALA A 35 5.803 -17.320 -6.158 1.00 0.160 H ATOM 539 N GLY A 36 4.645 -14.772 -5.125 1.00 0.080 N ATOM 540 CA GLY A 36 4.290 -14.096 -3.899 1.00 0.070 C ATOM 541 C GLY A 36 3.170 -13.113 -4.176 1.00 0.070 C ATOM 542 O GLY A 36 2.105 -13.130 -3.548 1.00 0.060 O ATOM 543 H GLY A 36 5.588 -14.620 -5.476 1.00 0.100 H ATOM 544 1HA GLY A 36 4.003 -14.817 -3.132 1.00 0.080 H ATOM 545 2HA GLY A 36 5.160 -13.553 -3.553 1.00 0.080 H ATOM 546 N ALA A 37 3.385 -12.283 -5.193 1.00 0.070 N ATOM 547 CA ALA A 37 2.408 -11.287 -5.578 1.00 0.070 C ATOM 548 C ALA A 37 1.071 -11.943 -5.903 1.00 0.070 C ATOM 549 O ALA A 37 0.013 -11.434 -5.512 1.00 0.070 O ATOM 550 CB ALA A 37 2.905 -10.518 -6.799 1.00 0.100 C ATOM 551 H ALA A 37 4.273 -12.334 -5.671 1.00 0.080 H ATOM 552 HA ALA A 37 2.266 -10.619 -4.733 1.00 0.080 H ATOM 553 1HB ALA A 37 2.179 -9.764 -7.091 1.00 0.120 H ATOM 554 2HB ALA A 37 3.847 -10.039 -6.588 1.00 0.120 H ATOM 555 3HB ALA A 37 3.039 -11.206 -7.630 1.00 0.120 H ATOM 556 N LYS A 38 1.116 -13.100 -6.569 1.00 0.070 N ATOM 557 CA LYS A 38 -0.101 -13.815 -6.905 1.00 0.070 C ATOM 558 C LYS A 38 -0.822 -14.293 -5.651 1.00 0.060 C ATOM 559 O LYS A 38 -2.048 -14.174 -5.569 1.00 0.060 O ATOM 560 CB LYS A 38 0.201 -14.971 -7.851 1.00 0.100 C ATOM 561 CG LYS A 38 0.568 -14.524 -9.268 1.00 0.100 C ATOM 562 CD LYS A 38 0.917 -15.706 -10.158 1.00 0.100 C ATOM 563 CE LYS A 38 1.196 -15.264 -11.591 1.00 0.100 C ATOM 564 NZ LYS A 38 1.636 -16.402 -12.446 1.00 0.100 N ATOM 565 H LYS A 38 2.030 -13.445 -6.881 1.00 0.080 H ATOM 566 HA LYS A 38 -0.765 -13.126 -7.424 1.00 0.080 H ATOM 567 1HB LYS A 38 1.032 -15.549 -7.457 1.00 0.120 H ATOM 568 2HB LYS A 38 -0.662 -15.632 -7.910 1.00 0.120 H ATOM 569 1HG LYS A 38 -0.265 -13.975 -9.704 1.00 0.120 H ATOM 570 2HG LYS A 38 1.433 -13.854 -9.218 1.00 0.120 H ATOM 571 1HD LYS A 38 1.813 -16.192 -9.766 1.00 0.120 H ATOM 572 2HD LYS A 38 0.101 -16.425 -10.156 1.00 0.120 H ATOM 573 1HE LYS A 38 0.288 -14.839 -12.013 1.00 0.120 H ATOM 574 2HE LYS A 38 1.967 -14.504 -11.588 1.00 0.120 H ATOM 575 1HZ LYS A 38 1.807 -16.070 -13.385 1.00 0.120 H ATOM 576 2HZ LYS A 38 2.490 -16.794 -12.068 1.00 0.120 H ATOM 577 3HZ LYS A 38 0.920 -17.110 -12.466 1.00 0.120 H ATOM 578 N ALA A 39 -0.085 -14.821 -4.661 1.00 0.060 N ATOM 579 CA ALA A 39 -0.715 -15.268 -3.420 1.00 0.060 C ATOM 580 C ALA A 39 -1.406 -14.110 -2.707 1.00 0.060 C ATOM 581 O ALA A 39 -2.529 -14.261 -2.207 1.00 0.060 O ATOM 582 CB ALA A 39 0.325 -15.877 -2.499 1.00 0.080 C ATOM 583 H ALA A 39 0.923 -14.967 -4.805 1.00 0.070 H ATOM 584 HA ALA A 39 -1.463 -16.017 -3.670 1.00 0.070 H ATOM 585 1HB ALA A 39 -0.149 -16.226 -1.588 1.00 0.100 H ATOM 586 2HB ALA A 39 0.807 -16.711 -3.005 1.00 0.100 H ATOM 587 3HB ALA A 39 1.082 -15.129 -2.248 1.00 0.100 H ATOM 588 N GLY A 40 -0.749 -12.948 -2.702 1.00 0.070 N ATOM 589 CA GLY A 40 -1.262 -11.727 -2.085 1.00 0.080 C ATOM 590 C GLY A 40 -2.557 -11.298 -2.760 1.00 0.080 C ATOM 591 O GLY A 40 -3.575 -11.048 -2.101 1.00 0.100 O ATOM 592 H GLY A 40 0.193 -12.933 -3.116 1.00 0.080 H ATOM 593 1HA GLY A 40 -1.430 -11.891 -1.022 1.00 0.100 H ATOM 594 2HA GLY A 40 -0.517 -10.945 -2.173 1.00 0.100 H ATOM 595 N LEU A 41 -2.518 -11.211 -4.090 1.00 0.080 N ATOM 596 CA LEU A 41 -3.681 -10.824 -4.868 1.00 0.080 C ATOM 597 C LEU A 41 -4.812 -11.826 -4.712 1.00 0.070 C ATOM 598 O LEU A 41 -5.972 -11.422 -4.598 1.00 0.090 O ATOM 599 CB LEU A 41 -3.287 -10.729 -6.346 1.00 0.110 C ATOM 600 CG LEU A 41 -2.349 -9.562 -6.738 1.00 0.110 C ATOM 601 CD1 LEU A 41 -1.832 -9.782 -8.143 1.00 0.110 C ATOM 602 CD2 LEU A 41 -3.111 -8.241 -6.671 1.00 0.110 C ATOM 603 H LEU A 41 -1.637 -11.414 -4.575 1.00 0.100 H ATOM 604 HA LEU A 41 -4.032 -9.865 -4.505 1.00 0.100 H ATOM 605 1HB LEU A 41 -2.782 -11.656 -6.616 1.00 0.130 H ATOM 606 2HB LEU A 41 -4.194 -10.650 -6.942 1.00 0.130 H ATOM 607 HG LEU A 41 -1.503 -9.534 -6.071 1.00 0.130 H ATOM 608 1HD1 LEU A 41 -1.163 -8.965 -8.416 1.00 0.130 H ATOM 609 2HD1 LEU A 41 -1.281 -10.724 -8.183 1.00 0.130 H ATOM 610 3HD1 LEU A 41 -2.665 -9.818 -8.843 1.00 0.130 H ATOM 611 1HD2 LEU A 41 -2.445 -7.435 -6.963 1.00 0.130 H ATOM 612 2HD2 LEU A 41 -3.958 -8.274 -7.356 1.00 0.130 H ATOM 613 3HD2 LEU A 41 -3.471 -8.059 -5.665 1.00 0.130 H ATOM 614 N THR A 42 -4.485 -13.126 -4.673 1.00 0.060 N ATOM 615 CA THR A 42 -5.487 -14.172 -4.532 1.00 0.060 C ATOM 616 C THR A 42 -6.216 -13.970 -3.226 1.00 0.050 C ATOM 617 O THR A 42 -7.444 -14.000 -3.193 1.00 0.060 O ATOM 618 CB THR A 42 -4.857 -15.582 -4.570 1.00 0.080 C ATOM 619 OG1 THR A 42 -4.214 -15.788 -5.841 1.00 0.080 O ATOM 620 CG2 THR A 42 -5.948 -16.645 -4.376 1.00 0.080 C ATOM 621 H THR A 42 -3.512 -13.402 -4.790 1.00 0.070 H ATOM 622 HA THR A 42 -6.203 -14.089 -5.347 1.00 0.070 H ATOM 623 HB THR A 42 -4.117 -15.673 -3.779 1.00 0.100 H ATOM 624 HG1 THR A 42 -3.427 -15.202 -5.898 1.00 0.100 H ATOM 625 1HG2 THR A 42 -5.495 -17.632 -4.410 1.00 0.100 H ATOM 626 2HG2 THR A 42 -6.446 -16.515 -3.411 1.00 0.100 H ATOM 627 3HG2 THR A 42 -6.687 -16.557 -5.171 1.00 0.100 H ATOM 628 N PHE A 43 -5.463 -13.726 -2.154 1.00 0.060 N ATOM 629 CA PHE A 43 -6.028 -13.477 -0.843 1.00 0.070 C ATOM 630 C PHE A 43 -7.022 -12.332 -0.866 1.00 0.060 C ATOM 631 O PHE A 43 -8.144 -12.480 -0.369 1.00 0.060 O ATOM 632 CB PHE A 43 -4.906 -13.190 0.134 1.00 0.090 C ATOM 633 CG PHE A 43 -5.313 -12.699 1.463 1.00 0.090 C ATOM 634 CD1 PHE A 43 -5.827 -13.544 2.419 1.00 0.090 C ATOM 635 CD2 PHE A 43 -5.145 -11.361 1.769 1.00 0.090 C ATOM 636 CE1 PHE A 43 -6.170 -13.060 3.656 1.00 0.090 C ATOM 637 CE2 PHE A 43 -5.483 -10.880 2.997 1.00 0.090 C ATOM 638 CZ PHE A 43 -5.996 -11.731 3.946 1.00 0.090 C ATOM 639 H PHE A 43 -4.442 -13.751 -2.251 1.00 0.070 H ATOM 640 HA PHE A 43 -6.550 -14.379 -0.524 1.00 0.080 H ATOM 641 1HB PHE A 43 -4.346 -14.099 0.261 1.00 0.110 H ATOM 642 2HB PHE A 43 -4.226 -12.471 -0.290 1.00 0.110 H ATOM 643 HD1 PHE A 43 -5.960 -14.602 2.187 1.00 0.110 H ATOM 644 HD2 PHE A 43 -4.732 -10.689 1.013 1.00 0.110 H ATOM 645 HE1 PHE A 43 -6.580 -13.733 4.409 1.00 0.110 H ATOM 646 HE2 PHE A 43 -5.348 -9.823 3.228 1.00 0.110 H ATOM 647 HZ PHE A 43 -6.268 -11.348 4.929 1.00 0.110 H ATOM 648 N LEU A 44 -6.628 -11.196 -1.442 1.00 0.070 N ATOM 649 CA LEU A 44 -7.527 -10.053 -1.476 1.00 0.100 C ATOM 650 C LEU A 44 -8.797 -10.392 -2.273 1.00 0.090 C ATOM 651 O LEU A 44 -9.912 -10.032 -1.874 1.00 0.110 O ATOM 652 CB LEU A 44 -6.783 -8.859 -2.094 1.00 0.130 C ATOM 653 CG LEU A 44 -5.589 -8.259 -1.239 1.00 0.130 C ATOM 654 CD1 LEU A 44 -4.820 -7.239 -2.091 1.00 0.130 C ATOM 655 CD2 LEU A 44 -6.128 -7.592 0.036 1.00 0.130 C ATOM 656 H LEU A 44 -5.677 -11.131 -1.825 1.00 0.080 H ATOM 657 HA LEU A 44 -7.826 -9.823 -0.461 1.00 0.120 H ATOM 658 1HB LEU A 44 -6.372 -9.179 -3.054 1.00 0.150 H ATOM 659 2HB LEU A 44 -7.503 -8.061 -2.278 1.00 0.150 H ATOM 660 HG LEU A 44 -4.896 -9.057 -0.965 1.00 0.150 H ATOM 661 1HD1 LEU A 44 -3.986 -6.826 -1.517 1.00 0.150 H ATOM 662 2HD1 LEU A 44 -4.430 -7.730 -2.985 1.00 0.150 H ATOM 663 3HD1 LEU A 44 -5.494 -6.438 -2.378 1.00 0.150 H ATOM 664 1HD2 LEU A 44 -5.302 -7.176 0.600 1.00 0.150 H ATOM 665 2HD2 LEU A 44 -6.811 -6.790 -0.241 1.00 0.150 H ATOM 666 3HD2 LEU A 44 -6.647 -8.312 0.653 1.00 0.150 H ATOM 667 N VAL A 45 -8.646 -11.120 -3.384 1.00 0.090 N ATOM 668 CA VAL A 45 -9.803 -11.513 -4.175 1.00 0.100 C ATOM 669 C VAL A 45 -10.715 -12.436 -3.376 1.00 0.090 C ATOM 670 O VAL A 45 -11.940 -12.288 -3.445 1.00 0.100 O ATOM 671 CB VAL A 45 -9.388 -12.164 -5.505 1.00 0.140 C ATOM 672 CG1 VAL A 45 -10.611 -12.761 -6.215 1.00 0.140 C ATOM 673 CG2 VAL A 45 -8.752 -11.101 -6.391 1.00 0.140 C ATOM 674 H VAL A 45 -7.700 -11.362 -3.700 1.00 0.110 H ATOM 675 HA VAL A 45 -10.365 -10.613 -4.417 1.00 0.120 H ATOM 676 HB VAL A 45 -8.673 -12.965 -5.310 1.00 0.160 H ATOM 677 1HG1 VAL A 45 -10.294 -13.207 -7.154 1.00 0.160 H ATOM 678 2HG1 VAL A 45 -11.068 -13.528 -5.594 1.00 0.160 H ATOM 679 3HG1 VAL A 45 -11.340 -11.972 -6.413 1.00 0.160 H ATOM 680 1HG2 VAL A 45 -8.443 -11.548 -7.334 1.00 0.160 H ATOM 681 2HG2 VAL A 45 -9.475 -10.309 -6.581 1.00 0.160 H ATOM 682 3HG2 VAL A 45 -7.888 -10.679 -5.896 1.00 0.160 H ATOM 683 N ASP A 46 -10.140 -13.416 -2.662 1.00 0.080 N ATOM 684 CA ASP A 46 -10.932 -14.320 -1.844 1.00 0.080 C ATOM 685 C ASP A 46 -11.702 -13.545 -0.775 1.00 0.070 C ATOM 686 O ASP A 46 -12.875 -13.823 -0.545 1.00 0.080 O ATOM 687 CB ASP A 46 -10.059 -15.376 -1.148 1.00 0.110 C ATOM 688 CG ASP A 46 -9.486 -16.499 -2.059 1.00 0.110 C ATOM 689 OD1 ASP A 46 -9.931 -16.672 -3.173 1.00 0.110 O ATOM 690 OD2 ASP A 46 -8.607 -17.186 -1.591 1.00 0.110 O ATOM 691 H ASP A 46 -9.126 -13.540 -2.710 1.00 0.100 H ATOM 692 HA ASP A 46 -11.645 -14.832 -2.487 1.00 0.100 H ATOM 693 1HB ASP A 46 -9.216 -14.867 -0.679 1.00 0.130 H ATOM 694 2HB ASP A 46 -10.631 -15.841 -0.353 1.00 0.130 H ATOM 695 N LEU A 47 -11.091 -12.511 -0.171 1.00 0.070 N ATOM 696 CA LEU A 47 -11.817 -11.731 0.838 1.00 0.070 C ATOM 697 C LEU A 47 -13.043 -11.085 0.204 1.00 0.060 C ATOM 698 O LEU A 47 -14.121 -11.018 0.816 1.00 0.060 O ATOM 699 CB LEU A 47 -10.944 -10.613 1.436 1.00 0.100 C ATOM 700 CG LEU A 47 -9.748 -11.020 2.336 1.00 0.100 C ATOM 701 CD1 LEU A 47 -8.961 -9.763 2.657 1.00 0.100 C ATOM 702 CD2 LEU A 47 -10.229 -11.700 3.615 1.00 0.100 C ATOM 703 H LEU A 47 -10.097 -12.337 -0.360 1.00 0.080 H ATOM 704 HA LEU A 47 -12.155 -12.400 1.620 1.00 0.080 H ATOM 705 1HB LEU A 47 -10.536 -10.032 0.609 1.00 0.120 H ATOM 706 2HB LEU A 47 -11.584 -9.953 2.015 1.00 0.120 H ATOM 707 HG LEU A 47 -9.094 -11.702 1.794 1.00 0.120 H ATOM 708 1HD1 LEU A 47 -8.118 -10.010 3.270 1.00 0.120 H ATOM 709 2HD1 LEU A 47 -8.617 -9.306 1.736 1.00 0.120 H ATOM 710 3HD1 LEU A 47 -9.597 -9.067 3.193 1.00 0.120 H ATOM 711 1HD2 LEU A 47 -9.362 -11.959 4.223 1.00 0.120 H ATOM 712 2HD2 LEU A 47 -10.874 -11.023 4.174 1.00 0.120 H ATOM 713 3HD2 LEU A 47 -10.777 -12.606 3.379 1.00 0.120 H ATOM 714 N ILE A 48 -12.906 -10.621 -1.030 1.00 0.070 N ATOM 715 CA ILE A 48 -14.055 -10.049 -1.708 1.00 0.080 C ATOM 716 C ILE A 48 -15.112 -11.132 -1.981 1.00 0.080 C ATOM 717 O ILE A 48 -16.291 -10.969 -1.659 1.00 0.090 O ATOM 718 CB ILE A 48 -13.628 -9.359 -3.020 1.00 0.110 C ATOM 719 CG1 ILE A 48 -12.766 -8.123 -2.677 1.00 0.110 C ATOM 720 CG2 ILE A 48 -14.853 -8.969 -3.823 1.00 0.110 C ATOM 721 CD1 ILE A 48 -12.010 -7.501 -3.829 1.00 0.110 C ATOM 722 H ILE A 48 -11.974 -10.627 -1.464 1.00 0.080 H ATOM 723 HA ILE A 48 -14.496 -9.305 -1.063 1.00 0.100 H ATOM 724 HB ILE A 48 -13.014 -10.037 -3.603 1.00 0.130 H ATOM 725 1HG1 ILE A 48 -13.421 -7.368 -2.252 1.00 0.130 H ATOM 726 2HG1 ILE A 48 -12.037 -8.413 -1.926 1.00 0.130 H ATOM 727 1HG2 ILE A 48 -14.550 -8.503 -4.737 1.00 0.130 H ATOM 728 2HG2 ILE A 48 -15.446 -9.844 -4.070 1.00 0.130 H ATOM 729 3HG2 ILE A 48 -15.463 -8.276 -3.234 1.00 0.130 H ATOM 730 1HD1 ILE A 48 -11.440 -6.647 -3.458 1.00 0.130 H ATOM 731 2HD1 ILE A 48 -11.324 -8.240 -4.246 1.00 0.130 H ATOM 732 3HD1 ILE A 48 -12.684 -7.170 -4.594 1.00 0.130 H ATOM 733 N LYS A 49 -14.691 -12.259 -2.559 1.00 0.090 N ATOM 734 CA LYS A 49 -15.608 -13.355 -2.892 1.00 0.110 C ATOM 735 C LYS A 49 -16.325 -13.945 -1.681 1.00 0.100 C ATOM 736 O LYS A 49 -17.485 -14.352 -1.772 1.00 0.110 O ATOM 737 CB LYS A 49 -14.890 -14.466 -3.653 1.00 0.150 C ATOM 738 CG LYS A 49 -14.515 -14.114 -5.092 1.00 0.150 C ATOM 739 CD LYS A 49 -13.795 -15.277 -5.765 1.00 0.150 C ATOM 740 CE LYS A 49 -13.486 -14.987 -7.231 1.00 0.150 C ATOM 741 NZ LYS A 49 -12.721 -16.102 -7.864 1.00 0.150 N ATOM 742 H LYS A 49 -13.696 -12.342 -2.788 1.00 0.110 H ATOM 743 HA LYS A 49 -16.375 -12.950 -3.551 1.00 0.130 H ATOM 744 1HB LYS A 49 -13.974 -14.720 -3.121 1.00 0.180 H ATOM 745 2HB LYS A 49 -15.516 -15.356 -3.668 1.00 0.180 H ATOM 746 1HG LYS A 49 -15.416 -13.870 -5.653 1.00 0.180 H ATOM 747 2HG LYS A 49 -13.862 -13.239 -5.087 1.00 0.180 H ATOM 748 1HD LYS A 49 -12.855 -15.467 -5.237 1.00 0.180 H ATOM 749 2HD LYS A 49 -14.411 -16.172 -5.703 1.00 0.180 H ATOM 750 1HE LYS A 49 -14.421 -14.851 -7.771 1.00 0.180 H ATOM 751 2HE LYS A 49 -12.907 -14.075 -7.304 1.00 0.180 H ATOM 752 1HZ LYS A 49 -12.536 -15.879 -8.833 1.00 0.180 H ATOM 753 2HZ LYS A 49 -11.843 -16.231 -7.374 1.00 0.180 H ATOM 754 3HZ LYS A 49 -13.261 -16.955 -7.815 1.00 0.180 H ATOM 755 N ASN A 50 -15.654 -13.941 -0.537 1.00 0.080 N ATOM 756 CA ASN A 50 -16.171 -14.494 0.701 1.00 0.080 C ATOM 757 C ASN A 50 -16.957 -13.477 1.530 1.00 0.080 C ATOM 758 O ASN A 50 -17.324 -13.766 2.671 1.00 0.090 O ATOM 759 CB ASN A 50 -15.028 -15.051 1.516 1.00 0.110 C ATOM 760 CG ASN A 50 -14.400 -16.257 0.886 1.00 0.110 C ATOM 761 OD1 ASN A 50 -15.062 -17.058 0.214 1.00 0.110 O ATOM 762 ND2 ASN A 50 -13.118 -16.411 1.090 1.00 0.110 N ATOM 763 H ASN A 50 -14.681 -13.633 -0.555 1.00 0.100 H ATOM 764 HA ASN A 50 -16.857 -15.304 0.451 1.00 0.100 H ATOM 765 1HB ASN A 50 -14.268 -14.281 1.608 1.00 0.130 H ATOM 766 2HB ASN A 50 -15.370 -15.302 2.519 1.00 0.130 H ATOM 767 1HD2 ASN A 50 -12.640 -17.195 0.692 1.00 0.130 H ATOM 768 2HD2 ASN A 50 -12.614 -15.747 1.639 1.00 0.130 H ATOM 769 N LYS A 51 -17.230 -12.303 0.949 1.00 0.080 N ATOM 770 CA LYS A 51 -17.986 -11.218 1.561 1.00 0.080 C ATOM 771 C LYS A 51 -17.340 -10.589 2.792 1.00 0.080 C ATOM 772 O LYS A 51 -18.035 -10.200 3.733 1.00 0.090 O ATOM 773 CB LYS A 51 -19.399 -11.696 1.927 1.00 0.110 C ATOM 774 CG LYS A 51 -20.204 -12.229 0.748 1.00 0.110 C ATOM 775 CD LYS A 51 -21.612 -12.619 1.167 1.00 0.110 C ATOM 776 CE LYS A 51 -22.399 -13.200 -0.002 1.00 0.110 C ATOM 777 NZ LYS A 51 -23.771 -13.626 0.405 1.00 0.110 N ATOM 778 H LYS A 51 -16.878 -12.112 0.003 1.00 0.100 H ATOM 779 HA LYS A 51 -18.080 -10.431 0.811 1.00 0.100 H ATOM 780 1HB LYS A 51 -19.360 -12.461 2.694 1.00 0.130 H ATOM 781 2HB LYS A 51 -19.958 -10.859 2.344 1.00 0.130 H ATOM 782 1HG LYS A 51 -20.254 -11.465 -0.027 1.00 0.130 H ATOM 783 2HG LYS A 51 -19.699 -13.103 0.333 1.00 0.130 H ATOM 784 1HD LYS A 51 -21.556 -13.362 1.965 1.00 0.130 H ATOM 785 2HD LYS A 51 -22.133 -11.742 1.548 1.00 0.130 H ATOM 786 1HE LYS A 51 -22.482 -12.447 -0.784 1.00 0.130 H ATOM 787 2HE LYS A 51 -21.864 -14.064 -0.398 1.00 0.130 H ATOM 788 1HZ LYS A 51 -24.258 -14.004 -0.396 1.00 0.130 H ATOM 789 2HZ LYS A 51 -23.707 -14.335 1.123 1.00 0.130 H ATOM 790 3HZ LYS A 51 -24.281 -12.831 0.763 1.00 0.130 H ATOM 791 N HIS A 52 -16.016 -10.425 2.768 1.00 0.070 N ATOM 792 CA HIS A 52 -15.333 -9.732 3.846 1.00 0.070 C ATOM 793 C HIS A 52 -14.909 -8.352 3.346 1.00 0.090 C ATOM 794 O HIS A 52 -14.674 -7.432 4.134 1.00 0.130 O ATOM 795 CB HIS A 52 -14.100 -10.507 4.313 1.00 0.100 C ATOM 796 CG HIS A 52 -14.410 -11.859 4.837 1.00 0.100 C ATOM 797 ND1 HIS A 52 -15.180 -12.062 5.960 1.00 0.100 N ATOM 798 CD2 HIS A 52 -14.035 -13.079 4.408 1.00 0.100 C ATOM 799 CE1 HIS A 52 -15.273 -13.360 6.188 1.00 0.100 C ATOM 800 NE2 HIS A 52 -14.582 -13.998 5.262 1.00 0.100 N ATOM 801 H HIS A 52 -15.467 -10.789 1.994 1.00 0.080 H ATOM 802 HA HIS A 52 -16.000 -9.597 4.694 1.00 0.080 H ATOM 803 1HB HIS A 52 -13.416 -10.623 3.477 1.00 0.120 H ATOM 804 2HB HIS A 52 -13.582 -9.943 5.087 1.00 0.120 H ATOM 805 HD1 HIS A 52 -15.873 -11.411 6.278 1.00 0.120 H ATOM 806 HD2 HIS A 52 -13.421 -13.406 3.576 1.00 0.120 H ATOM 807 HE1 HIS A 52 -15.848 -13.733 7.033 1.00 0.120 H ATOM 808 N MET A 53 -14.857 -8.206 2.018 1.00 0.080 N ATOM 809 CA MET A 53 -14.437 -6.975 1.367 1.00 0.100 C ATOM 810 C MET A 53 -15.351 -6.613 0.180 1.00 0.080 C ATOM 811 O MET A 53 -15.914 -7.471 -0.492 1.00 0.150 O ATOM 812 CB MET A 53 -12.977 -7.143 0.941 1.00 0.130 C ATOM 813 CG MET A 53 -12.304 -5.945 0.254 1.00 0.130 C ATOM 814 SD MET A 53 -10.565 -6.295 -0.189 1.00 0.130 S ATOM 815 CE MET A 53 -9.741 -6.250 1.399 1.00 0.130 C ATOM 816 H MET A 53 -15.030 -9.024 1.439 1.00 0.100 H ATOM 817 HA MET A 53 -14.500 -6.163 2.090 1.00 0.120 H ATOM 818 1HB MET A 53 -12.401 -7.381 1.825 1.00 0.160 H ATOM 819 2HB MET A 53 -12.895 -7.995 0.284 1.00 0.160 H ATOM 820 1HG MET A 53 -12.834 -5.683 -0.659 1.00 0.160 H ATOM 821 2HG MET A 53 -12.325 -5.082 0.917 1.00 0.160 H ATOM 822 1HE MET A 53 -8.683 -6.447 1.263 1.00 0.160 H ATOM 823 2HE MET A 53 -9.870 -5.266 1.850 1.00 0.160 H ATOM 824 3HE MET A 53 -10.159 -7.003 2.054 1.00 0.160 H ATOM 825 N ASN A 54 -15.534 -5.315 -0.043 1.00 0.180 N ATOM 826 CA ASN A 54 -16.306 -4.789 -1.173 1.00 0.170 C ATOM 827 C ASN A 54 -15.361 -4.256 -2.250 1.00 0.140 C ATOM 828 O ASN A 54 -14.597 -3.318 -1.999 1.00 0.120 O ATOM 829 CB ASN A 54 -17.324 -3.749 -0.732 1.00 0.240 C ATOM 830 CG ASN A 54 -18.251 -3.289 -1.871 1.00 0.240 C ATOM 831 OD1 ASN A 54 -17.874 -3.194 -3.059 1.00 0.240 O ATOM 832 ND2 ASN A 54 -19.487 -3.001 -1.512 1.00 0.240 N ATOM 833 H ASN A 54 -15.088 -4.656 0.582 1.00 0.220 H ATOM 834 HA ASN A 54 -16.861 -5.614 -1.623 1.00 0.200 H ATOM 835 1HB ASN A 54 -17.940 -4.173 0.061 1.00 0.290 H ATOM 836 2HB ASN A 54 -16.824 -2.889 -0.318 1.00 0.290 H ATOM 837 1HD2 ASN A 54 -20.152 -2.695 -2.199 1.00 0.290 H ATOM 838 2HD2 ASN A 54 -19.765 -3.087 -0.553 1.00 0.290 H ATOM 839 N ALA A 55 -15.389 -4.871 -3.428 1.00 0.140 N ATOM 840 CA ALA A 55 -14.475 -4.557 -4.530 1.00 0.150 C ATOM 841 C ALA A 55 -14.506 -3.094 -4.962 1.00 0.130 C ATOM 842 O ALA A 55 -13.505 -2.580 -5.471 1.00 0.150 O ATOM 843 CB ALA A 55 -14.826 -5.392 -5.745 1.00 0.210 C ATOM 844 H ALA A 55 -16.086 -5.595 -3.553 1.00 0.170 H ATOM 845 HA ALA A 55 -13.465 -4.794 -4.197 1.00 0.180 H ATOM 846 1HB ALA A 55 -14.118 -5.179 -6.546 1.00 0.250 H ATOM 847 2HB ALA A 55 -14.784 -6.430 -5.499 1.00 0.250 H ATOM 848 3HB ALA A 55 -15.835 -5.138 -6.077 1.00 0.250 H ATOM 849 N ASP A 56 -15.647 -2.435 -4.788 1.00 0.100 N ATOM 850 CA ASP A 56 -15.823 -1.063 -5.235 1.00 0.100 C ATOM 851 C ASP A 56 -15.448 -0.037 -4.169 1.00 0.120 C ATOM 852 O ASP A 56 -15.623 1.168 -4.373 1.00 0.170 O ATOM 853 CB ASP A 56 -17.277 -0.846 -5.652 1.00 0.140 C ATOM 854 CG ASP A 56 -17.695 -1.655 -6.895 1.00 0.140 C ATOM 855 OD1 ASP A 56 -16.874 -1.933 -7.742 1.00 0.140 O ATOM 856 OD2 ASP A 56 -18.849 -1.999 -6.966 1.00 0.140 O ATOM 857 H ASP A 56 -16.431 -2.894 -4.322 1.00 0.120 H ATOM 858 HA ASP A 56 -15.186 -0.902 -6.104 1.00 0.120 H ATOM 859 1HB ASP A 56 -17.932 -1.119 -4.824 1.00 0.170 H ATOM 860 2HB ASP A 56 -17.439 0.211 -5.858 1.00 0.170 H ATOM 861 N THR A 57 -14.952 -0.491 -3.020 1.00 0.100 N ATOM 862 CA THR A 57 -14.606 0.453 -1.970 1.00 0.130 C ATOM 863 C THR A 57 -13.522 1.399 -2.465 1.00 0.160 C ATOM 864 O THR A 57 -12.452 0.953 -2.918 1.00 0.180 O ATOM 865 CB THR A 57 -14.056 -0.262 -0.711 1.00 0.170 C ATOM 866 OG1 THR A 57 -14.995 -1.220 -0.258 1.00 0.170 O ATOM 867 CG2 THR A 57 -13.824 0.758 0.414 1.00 0.170 C ATOM 868 H THR A 57 -14.807 -1.491 -2.868 1.00 0.120 H ATOM 869 HA THR A 57 -15.489 1.034 -1.706 1.00 0.160 H ATOM 870 HB THR A 57 -13.121 -0.766 -0.954 1.00 0.200 H ATOM 871 HG1 THR A 57 -14.975 -1.972 -0.883 1.00 0.200 H ATOM 872 1HG2 THR A 57 -13.449 0.240 1.293 1.00 0.200 H ATOM 873 2HG2 THR A 57 -13.098 1.500 0.107 1.00 0.200 H ATOM 874 3HG2 THR A 57 -14.756 1.247 0.658 1.00 0.200 H ATOM 875 N ASP A 58 -13.786 2.690 -2.321 1.00 0.210 N ATOM 876 CA ASP A 58 -12.863 3.751 -2.660 1.00 0.260 C ATOM 877 C ASP A 58 -12.306 4.353 -1.378 1.00 0.170 C ATOM 878 O ASP A 58 -12.719 3.975 -0.274 1.00 0.140 O ATOM 879 CB ASP A 58 -13.579 4.801 -3.524 1.00 0.340 C ATOM 880 CG ASP A 58 -12.642 5.678 -4.384 1.00 0.340 C ATOM 881 OD1 ASP A 58 -11.440 5.622 -4.175 1.00 0.340 O ATOM 882 OD2 ASP A 58 -13.132 6.395 -5.216 1.00 0.340 O ATOM 883 H ASP A 58 -14.695 2.931 -1.967 1.00 0.250 H ATOM 884 HA ASP A 58 -12.033 3.338 -3.223 1.00 0.310 H ATOM 885 1HB ASP A 58 -14.278 4.287 -4.193 1.00 0.410 H ATOM 886 2HB ASP A 58 -14.172 5.453 -2.883 1.00 0.410 H ATOM 887 N TYR A 59 -11.432 5.337 -1.515 1.00 0.190 N ATOM 888 CA TYR A 59 -10.843 5.971 -0.349 1.00 0.200 C ATOM 889 C TYR A 59 -11.879 6.598 0.567 1.00 0.160 C ATOM 890 O TYR A 59 -11.884 6.333 1.771 1.00 0.170 O ATOM 891 CB TYR A 59 -9.834 7.049 -0.739 1.00 0.280 C ATOM 892 CG TYR A 59 -9.282 7.672 0.487 1.00 0.280 C ATOM 893 CD1 TYR A 59 -8.269 7.019 1.152 1.00 0.280 C ATOM 894 CD2 TYR A 59 -9.813 8.852 0.996 1.00 0.280 C ATOM 895 CE1 TYR A 59 -7.795 7.520 2.312 1.00 0.280 C ATOM 896 CE2 TYR A 59 -9.335 9.350 2.172 1.00 0.280 C ATOM 897 CZ TYR A 59 -8.336 8.686 2.833 1.00 0.280 C ATOM 898 OH TYR A 59 -7.885 9.141 4.030 1.00 0.280 O ATOM 899 H TYR A 59 -11.149 5.597 -2.463 1.00 0.230 H ATOM 900 HA TYR A 59 -10.325 5.202 0.225 1.00 0.240 H ATOM 901 1HB TYR A 59 -9.017 6.614 -1.314 1.00 0.330 H ATOM 902 2HB TYR A 59 -10.311 7.818 -1.345 1.00 0.330 H ATOM 903 HD1 TYR A 59 -7.859 6.089 0.755 1.00 0.330 H ATOM 904 HD2 TYR A 59 -10.620 9.365 0.476 1.00 0.330 H ATOM 905 HE1 TYR A 59 -7.005 6.990 2.833 1.00 0.330 H ATOM 906 HE2 TYR A 59 -9.758 10.261 2.591 1.00 0.330 H ATOM 907 HH TYR A 59 -8.430 9.893 4.315 1.00 0.330 H ATOM 908 N SER A 60 -12.748 7.451 0.003 1.00 0.150 N ATOM 909 CA SER A 60 -13.734 8.172 0.802 1.00 0.150 C ATOM 910 C SER A 60 -14.733 7.257 1.485 1.00 0.150 C ATOM 911 O SER A 60 -15.193 7.549 2.593 1.00 0.210 O ATOM 912 CB SER A 60 -14.478 9.147 -0.081 1.00 0.210 C ATOM 913 OG SER A 60 -15.240 8.463 -1.041 1.00 0.210 O ATOM 914 H SER A 60 -12.708 7.620 -0.993 1.00 0.180 H ATOM 915 HA SER A 60 -13.199 8.731 1.573 1.00 0.180 H ATOM 916 1HB SER A 60 -15.132 9.767 0.533 1.00 0.250 H ATOM 917 2HB SER A 60 -13.768 9.807 -0.576 1.00 0.250 H ATOM 918 HG SER A 60 -15.717 9.141 -1.534 1.00 0.250 H ATOM 919 N ILE A 61 -15.017 6.115 0.870 1.00 0.120 N ATOM 920 CA ILE A 61 -15.931 5.161 1.461 1.00 0.120 C ATOM 921 C ILE A 61 -15.286 4.554 2.681 1.00 0.120 C ATOM 922 O ILE A 61 -15.902 4.482 3.748 1.00 0.130 O ATOM 923 CB ILE A 61 -16.319 4.045 0.469 1.00 0.170 C ATOM 924 CG1 ILE A 61 -17.153 4.657 -0.684 1.00 0.170 C ATOM 925 CG2 ILE A 61 -17.105 2.928 1.210 1.00 0.170 C ATOM 926 CD1 ILE A 61 -17.366 3.744 -1.892 1.00 0.170 C ATOM 927 H ILE A 61 -14.623 5.962 -0.047 1.00 0.140 H ATOM 928 HA ILE A 61 -16.834 5.684 1.772 1.00 0.140 H ATOM 929 HB ILE A 61 -15.416 3.623 0.034 1.00 0.200 H ATOM 930 1HG1 ILE A 61 -18.130 4.931 -0.288 1.00 0.200 H ATOM 931 2HG1 ILE A 61 -16.657 5.566 -1.028 1.00 0.200 H ATOM 932 1HG2 ILE A 61 -17.371 2.137 0.517 1.00 0.200 H ATOM 933 2HG2 ILE A 61 -16.500 2.496 2.005 1.00 0.200 H ATOM 934 3HG2 ILE A 61 -18.014 3.350 1.644 1.00 0.200 H ATOM 935 1HD1 ILE A 61 -17.965 4.275 -2.632 1.00 0.200 H ATOM 936 2HD1 ILE A 61 -16.427 3.478 -2.338 1.00 0.200 H ATOM 937 3HD1 ILE A 61 -17.890 2.840 -1.599 1.00 0.200 H ATOM 938 N ALA A 62 -14.045 4.090 2.518 1.00 0.110 N ATOM 939 CA ALA A 62 -13.331 3.483 3.617 1.00 0.110 C ATOM 940 C ALA A 62 -13.114 4.465 4.756 1.00 0.120 C ATOM 941 O ALA A 62 -13.263 4.101 5.929 1.00 0.110 O ATOM 942 CB ALA A 62 -11.990 2.972 3.133 1.00 0.150 C ATOM 943 H ALA A 62 -13.590 4.162 1.601 1.00 0.130 H ATOM 944 HA ALA A 62 -13.924 2.650 3.989 1.00 0.130 H ATOM 945 1HB ALA A 62 -11.461 2.495 3.954 1.00 0.180 H ATOM 946 2HB ALA A 62 -12.142 2.258 2.334 1.00 0.180 H ATOM 947 3HB ALA A 62 -11.402 3.813 2.757 1.00 0.180 H ATOM 948 N GLU A 63 -12.777 5.718 4.423 1.00 0.140 N ATOM 949 CA GLU A 63 -12.533 6.697 5.457 1.00 0.150 C ATOM 950 C GLU A 63 -13.806 6.959 6.237 1.00 0.150 C ATOM 951 O GLU A 63 -13.772 6.992 7.471 1.00 0.140 O ATOM 952 CB GLU A 63 -11.971 8.003 4.896 1.00 0.210 C ATOM 953 CG GLU A 63 -11.576 8.976 6.005 1.00 0.210 C ATOM 954 CD GLU A 63 -10.962 10.260 5.560 1.00 0.210 C ATOM 955 OE1 GLU A 63 -11.203 10.689 4.466 1.00 0.210 O ATOM 956 OE2 GLU A 63 -10.220 10.808 6.339 1.00 0.210 O ATOM 957 H GLU A 63 -12.643 5.974 3.440 1.00 0.170 H ATOM 958 HA GLU A 63 -11.796 6.289 6.146 1.00 0.180 H ATOM 959 1HB GLU A 63 -11.095 7.792 4.281 1.00 0.250 H ATOM 960 2HB GLU A 63 -12.716 8.479 4.257 1.00 0.250 H ATOM 961 1HG GLU A 63 -12.473 9.218 6.559 1.00 0.250 H ATOM 962 2HG GLU A 63 -10.891 8.473 6.687 1.00 0.250 H ATOM 963 N ALA A 64 -14.935 7.139 5.533 1.00 0.160 N ATOM 964 CA ALA A 64 -16.191 7.381 6.209 1.00 0.180 C ATOM 965 C ALA A 64 -16.570 6.209 7.090 1.00 0.160 C ATOM 966 O ALA A 64 -17.022 6.408 8.218 1.00 0.170 O ATOM 967 CB ALA A 64 -17.287 7.619 5.194 1.00 0.240 C ATOM 968 H ALA A 64 -14.919 7.128 4.508 1.00 0.190 H ATOM 969 HA ALA A 64 -16.076 8.263 6.834 1.00 0.220 H ATOM 970 1HB ALA A 64 -18.220 7.817 5.706 1.00 0.290 H ATOM 971 2HB ALA A 64 -17.021 8.471 4.569 1.00 0.290 H ATOM 972 3HB ALA A 64 -17.392 6.730 4.568 1.00 0.290 H ATOM 973 N ALA A 65 -16.372 4.980 6.602 1.00 0.140 N ATOM 974 CA ALA A 65 -16.719 3.809 7.383 1.00 0.140 C ATOM 975 C ALA A 65 -15.920 3.767 8.672 1.00 0.130 C ATOM 976 O ALA A 65 -16.428 3.427 9.753 1.00 0.160 O ATOM 977 CB ALA A 65 -16.457 2.553 6.570 1.00 0.200 C ATOM 978 H ALA A 65 -16.020 4.852 5.646 1.00 0.170 H ATOM 979 HA ALA A 65 -17.778 3.868 7.630 1.00 0.170 H ATOM 980 1HB ALA A 65 -16.735 1.674 7.139 1.00 0.240 H ATOM 981 2HB ALA A 65 -17.050 2.596 5.654 1.00 0.240 H ATOM 982 3HB ALA A 65 -15.401 2.504 6.316 1.00 0.240 H ATOM 983 N PHE A 66 -14.647 4.134 8.597 1.00 0.100 N ATOM 984 CA PHE A 66 -13.872 4.118 9.816 1.00 0.090 C ATOM 985 C PHE A 66 -14.333 5.234 10.753 1.00 0.100 C ATOM 986 O PHE A 66 -14.610 5.009 11.933 1.00 0.120 O ATOM 987 CB PHE A 66 -12.384 4.227 9.534 1.00 0.130 C ATOM 988 CG PHE A 66 -11.617 4.003 10.773 1.00 0.130 C ATOM 989 CD1 PHE A 66 -11.480 2.705 11.255 1.00 0.130 C ATOM 990 CD2 PHE A 66 -11.066 5.031 11.481 1.00 0.130 C ATOM 991 CE1 PHE A 66 -10.845 2.447 12.401 1.00 0.130 C ATOM 992 CE2 PHE A 66 -10.410 4.762 12.641 1.00 0.130 C ATOM 993 CZ PHE A 66 -10.320 3.463 13.102 1.00 0.130 C ATOM 994 H PHE A 66 -14.216 4.352 7.688 1.00 0.120 H ATOM 995 HA PHE A 66 -14.047 3.178 10.329 1.00 0.110 H ATOM 996 1HB PHE A 66 -12.101 3.490 8.796 1.00 0.160 H ATOM 997 2HB PHE A 66 -12.149 5.219 9.136 1.00 0.160 H ATOM 998 HD1 PHE A 66 -11.899 1.889 10.714 1.00 0.160 H ATOM 999 HD2 PHE A 66 -11.173 6.054 11.118 1.00 0.160 H ATOM 1000 HE1 PHE A 66 -10.771 1.420 12.768 1.00 0.160 H ATOM 1001 HE2 PHE A 66 -9.983 5.566 13.214 1.00 0.160 H ATOM 1002 HZ PHE A 66 -9.838 3.241 14.036 1.00 0.160 H ATOM 1003 N ASN A 67 -14.472 6.449 10.221 1.00 0.100 N ATOM 1004 CA ASN A 67 -14.827 7.596 11.047 1.00 0.110 C ATOM 1005 C ASN A 67 -16.197 7.481 11.706 1.00 0.110 C ATOM 1006 O ASN A 67 -16.405 7.973 12.816 1.00 0.130 O ATOM 1007 CB ASN A 67 -14.685 8.866 10.253 1.00 0.150 C ATOM 1008 CG ASN A 67 -13.236 9.192 10.062 1.00 0.150 C ATOM 1009 OD1 ASN A 67 -12.389 8.668 10.785 1.00 0.150 O ATOM 1010 ND2 ASN A 67 -12.928 10.031 9.125 1.00 0.150 N ATOM 1011 H ASN A 67 -14.280 6.588 9.226 1.00 0.120 H ATOM 1012 HA ASN A 67 -14.109 7.649 11.841 1.00 0.130 H ATOM 1013 1HB ASN A 67 -15.155 8.738 9.275 1.00 0.180 H ATOM 1014 2HB ASN A 67 -15.186 9.685 10.760 1.00 0.180 H ATOM 1015 1HD2 ASN A 67 -11.964 10.261 8.959 1.00 0.180 H ATOM 1016 2HD2 ASN A 67 -13.642 10.435 8.554 1.00 0.180 H ATOM 1017 N LYS A 68 -17.124 6.790 11.054 1.00 0.110 N ATOM 1018 CA LYS A 68 -18.463 6.578 11.579 1.00 0.130 C ATOM 1019 C LYS A 68 -18.565 5.347 12.486 1.00 0.140 C ATOM 1020 O LYS A 68 -19.637 5.072 13.031 1.00 0.260 O ATOM 1021 CB LYS A 68 -19.458 6.431 10.429 1.00 0.170 C ATOM 1022 CG LYS A 68 -19.667 7.688 9.590 1.00 0.170 C ATOM 1023 CD LYS A 68 -20.642 7.412 8.450 1.00 0.170 C ATOM 1024 CE LYS A 68 -20.882 8.648 7.596 1.00 0.170 C ATOM 1025 NZ LYS A 68 -21.821 8.367 6.468 1.00 0.170 N ATOM 1026 H LYS A 68 -16.914 6.456 10.108 1.00 0.130 H ATOM 1027 HA LYS A 68 -18.737 7.451 12.171 1.00 0.160 H ATOM 1028 1HB LYS A 68 -19.102 5.645 9.754 1.00 0.210 H ATOM 1029 2HB LYS A 68 -20.422 6.111 10.818 1.00 0.210 H ATOM 1030 1HG LYS A 68 -20.065 8.480 10.223 1.00 0.210 H ATOM 1031 2HG LYS A 68 -18.714 8.019 9.183 1.00 0.210 H ATOM 1032 1HD LYS A 68 -20.232 6.616 7.818 1.00 0.210 H ATOM 1033 2HD LYS A 68 -21.592 7.068 8.859 1.00 0.210 H ATOM 1034 1HE LYS A 68 -21.303 9.435 8.218 1.00 0.210 H ATOM 1035 2HE LYS A 68 -19.931 8.990 7.188 1.00 0.210 H ATOM 1036 1HZ LYS A 68 -21.957 9.208 5.922 1.00 0.210 H ATOM 1037 2HZ LYS A 68 -21.434 7.642 5.878 1.00 0.210 H ATOM 1038 3HZ LYS A 68 -22.710 8.058 6.837 1.00 0.210 H ATOM 1039 N GLY A 69 -17.475 4.582 12.633 1.00 0.120 N ATOM 1040 CA GLY A 69 -17.488 3.369 13.437 1.00 0.110 C ATOM 1041 C GLY A 69 -18.112 2.135 12.760 1.00 0.110 C ATOM 1042 O GLY A 69 -18.554 1.222 13.460 1.00 0.150 O ATOM 1043 H GLY A 69 -16.586 4.857 12.209 1.00 0.140 H ATOM 1044 1HA GLY A 69 -16.458 3.136 13.713 1.00 0.130 H ATOM 1045 2HA GLY A 69 -18.015 3.571 14.367 1.00 0.130 H ATOM 1046 N GLU A 70 -18.192 2.107 11.416 1.00 0.110 N ATOM 1047 CA GLU A 70 -18.787 0.975 10.702 1.00 0.120 C ATOM 1048 C GLU A 70 -17.791 -0.183 10.648 1.00 0.150 C ATOM 1049 O GLU A 70 -18.170 -1.356 10.685 1.00 0.360 O ATOM 1050 CB GLU A 70 -19.186 1.380 9.285 1.00 0.160 C ATOM 1051 CG GLU A 70 -20.306 2.411 9.199 1.00 0.160 C ATOM 1052 CD GLU A 70 -20.618 2.817 7.777 1.00 0.160 C ATOM 1053 OE1 GLU A 70 -19.929 2.366 6.892 1.00 0.160 O ATOM 1054 OE2 GLU A 70 -21.537 3.576 7.580 1.00 0.160 O ATOM 1055 H GLU A 70 -17.783 2.851 10.853 1.00 0.130 H ATOM 1056 HA GLU A 70 -19.675 0.645 11.242 1.00 0.140 H ATOM 1057 1HB GLU A 70 -18.330 1.785 8.791 1.00 0.200 H ATOM 1058 2HB GLU A 70 -19.496 0.497 8.728 1.00 0.200 H ATOM 1059 1HG GLU A 70 -21.202 1.999 9.658 1.00 0.200 H ATOM 1060 2HG GLU A 70 -20.011 3.292 9.769 1.00 0.200 H ATOM 1061 N THR A 71 -16.512 0.172 10.555 1.00 0.120 N ATOM 1062 CA THR A 71 -15.406 -0.788 10.518 1.00 0.090 C ATOM 1063 C THR A 71 -14.476 -0.623 11.699 1.00 0.100 C ATOM 1064 O THR A 71 -14.203 0.485 12.159 1.00 0.120 O ATOM 1065 CB THR A 71 -14.532 -0.731 9.250 1.00 0.140 C ATOM 1066 OG1 THR A 71 -13.402 -1.628 9.461 1.00 0.140 O ATOM 1067 CG2 THR A 71 -14.046 0.638 9.007 1.00 0.140 C ATOM 1068 H THR A 71 -16.325 1.173 10.497 1.00 0.140 H ATOM 1069 HA THR A 71 -15.826 -1.791 10.574 1.00 0.110 H ATOM 1070 HB THR A 71 -15.106 -1.070 8.390 1.00 0.170 H ATOM 1071 HG1 THR A 71 -12.719 -1.526 8.738 1.00 0.170 H ATOM 1072 1HG2 THR A 71 -13.414 0.657 8.120 1.00 0.170 H ATOM 1073 2HG2 THR A 71 -14.886 1.275 8.864 1.00 0.170 H ATOM 1074 3HG2 THR A 71 -13.492 0.956 9.835 1.00 0.170 H ATOM 1075 N ALA A 72 -13.982 -1.744 12.213 1.00 0.090 N ATOM 1076 CA ALA A 72 -13.017 -1.711 13.306 1.00 0.110 C ATOM 1077 C ALA A 72 -11.597 -1.458 12.795 1.00 0.090 C ATOM 1078 O ALA A 72 -10.669 -1.273 13.584 1.00 0.100 O ATOM 1079 CB ALA A 72 -13.056 -3.016 14.084 1.00 0.150 C ATOM 1080 H ALA A 72 -14.262 -2.626 11.806 1.00 0.110 H ATOM 1081 HA ALA A 72 -13.288 -0.890 13.970 1.00 0.130 H ATOM 1082 1HB ALA A 72 -12.350 -2.964 14.913 1.00 0.180 H ATOM 1083 2HB ALA A 72 -14.060 -3.179 14.472 1.00 0.180 H ATOM 1084 3HB ALA A 72 -12.782 -3.836 13.424 1.00 0.180 H ATOM 1085 N MET A 73 -11.419 -1.490 11.477 1.00 0.060 N ATOM 1086 CA MET A 73 -10.105 -1.314 10.878 1.00 0.050 C ATOM 1087 C MET A 73 -10.135 -0.700 9.486 1.00 0.050 C ATOM 1088 O MET A 73 -11.030 -0.968 8.665 1.00 0.070 O ATOM 1089 CB MET A 73 -9.343 -2.650 10.837 1.00 0.070 C ATOM 1090 CG MET A 73 -7.953 -2.577 10.126 1.00 0.070 C ATOM 1091 SD MET A 73 -6.985 -4.079 10.199 1.00 0.070 S ATOM 1092 CE MET A 73 -5.623 -3.565 9.134 1.00 0.070 C ATOM 1093 H MET A 73 -12.232 -1.626 10.881 1.00 0.070 H ATOM 1094 HA MET A 73 -9.543 -0.628 11.510 1.00 0.060 H ATOM 1095 1HB MET A 73 -9.181 -3.003 11.855 1.00 0.090 H ATOM 1096 2HB MET A 73 -9.949 -3.396 10.323 1.00 0.090 H ATOM 1097 1HG MET A 73 -8.100 -2.365 9.070 1.00 0.090 H ATOM 1098 2HG MET A 73 -7.358 -1.773 10.558 1.00 0.090 H ATOM 1099 1HE MET A 73 -4.907 -4.370 9.048 1.00 0.090 H ATOM 1100 2HE MET A 73 -6.011 -3.324 8.147 1.00 0.090 H ATOM 1101 3HE MET A 73 -5.137 -2.683 9.555 1.00 0.090 H ATOM 1102 N THR A 74 -9.080 0.064 9.212 1.00 0.060 N ATOM 1103 CA THR A 74 -8.816 0.656 7.917 1.00 0.090 C ATOM 1104 C THR A 74 -7.310 0.844 7.775 1.00 0.070 C ATOM 1105 O THR A 74 -6.598 0.964 8.776 1.00 0.060 O ATOM 1106 CB THR A 74 -9.533 2.002 7.752 1.00 0.110 C ATOM 1107 OG1 THR A 74 -9.387 2.442 6.403 1.00 0.110 O ATOM 1108 CG2 THR A 74 -8.918 3.061 8.697 1.00 0.110 C ATOM 1109 H THR A 74 -8.410 0.233 9.951 1.00 0.070 H ATOM 1110 HA THR A 74 -9.154 -0.024 7.135 1.00 0.110 H ATOM 1111 HB THR A 74 -10.591 1.870 7.976 1.00 0.140 H ATOM 1112 HG1 THR A 74 -9.970 3.191 6.253 1.00 0.140 H ATOM 1113 1HG2 THR A 74 -9.440 4.006 8.567 1.00 0.140 H ATOM 1114 2HG2 THR A 74 -9.017 2.732 9.727 1.00 0.140 H ATOM 1115 3HG2 THR A 74 -7.865 3.210 8.472 1.00 0.140 H ATOM 1116 N ILE A 75 -6.825 0.862 6.542 1.00 0.090 N ATOM 1117 CA ILE A 75 -5.412 1.108 6.276 1.00 0.090 C ATOM 1118 C ILE A 75 -5.250 2.476 5.655 1.00 0.080 C ATOM 1119 O ILE A 75 -5.872 2.777 4.640 1.00 0.110 O ATOM 1120 CB ILE A 75 -4.801 0.021 5.364 1.00 0.130 C ATOM 1121 CG1 ILE A 75 -4.920 -1.350 6.090 1.00 0.130 C ATOM 1122 CG2 ILE A 75 -3.329 0.378 4.997 1.00 0.130 C ATOM 1123 CD1 ILE A 75 -4.536 -2.570 5.261 1.00 0.130 C ATOM 1124 H ILE A 75 -7.473 0.758 5.771 1.00 0.110 H ATOM 1125 HA ILE A 75 -4.869 1.102 7.220 1.00 0.110 H ATOM 1126 HB ILE A 75 -5.386 -0.046 4.445 1.00 0.150 H ATOM 1127 1HG1 ILE A 75 -4.309 -1.318 6.978 1.00 0.150 H ATOM 1128 2HG1 ILE A 75 -5.953 -1.481 6.398 1.00 0.150 H ATOM 1129 1HG2 ILE A 75 -2.910 -0.382 4.347 1.00 0.150 H ATOM 1130 2HG2 ILE A 75 -3.294 1.332 4.478 1.00 0.150 H ATOM 1131 3HG2 ILE A 75 -2.734 0.447 5.901 1.00 0.150 H ATOM 1132 1HD1 ILE A 75 -4.671 -3.468 5.863 1.00 0.150 H ATOM 1133 2HD1 ILE A 75 -5.175 -2.627 4.378 1.00 0.150 H ATOM 1134 3HD1 ILE A 75 -3.498 -2.507 4.949 1.00 0.150 H ATOM 1135 N ASN A 76 -4.420 3.306 6.271 1.00 0.100 N ATOM 1136 CA ASN A 76 -4.237 4.656 5.782 1.00 0.110 C ATOM 1137 C ASN A 76 -2.881 5.195 6.208 1.00 0.080 C ATOM 1138 O ASN A 76 -2.135 4.510 6.911 1.00 0.100 O ATOM 1139 CB ASN A 76 -5.364 5.508 6.339 1.00 0.150 C ATOM 1140 CG ASN A 76 -5.773 6.619 5.479 1.00 0.150 C ATOM 1141 OD1 ASN A 76 -4.944 7.228 4.775 1.00 0.150 O ATOM 1142 ND2 ASN A 76 -7.045 6.906 5.518 1.00 0.150 N ATOM 1143 H ASN A 76 -3.933 2.992 7.101 1.00 0.120 H ATOM 1144 HA ASN A 76 -4.286 4.653 4.699 1.00 0.130 H ATOM 1145 1HB ASN A 76 -6.236 4.879 6.525 1.00 0.180 H ATOM 1146 2HB ASN A 76 -5.053 5.920 7.303 1.00 0.180 H ATOM 1147 1HD2 ASN A 76 -7.404 7.665 4.966 1.00 0.180 H ATOM 1148 2HD2 ASN A 76 -7.662 6.381 6.102 1.00 0.180 H ATOM 1149 N GLY A 77 -2.573 6.426 5.814 1.00 0.100 N ATOM 1150 CA GLY A 77 -1.327 7.031 6.246 1.00 0.100 C ATOM 1151 C GLY A 77 -1.617 8.171 7.222 1.00 0.070 C ATOM 1152 O GLY A 77 -2.785 8.517 7.425 1.00 0.130 O ATOM 1153 H GLY A 77 -3.233 6.932 5.228 1.00 0.120 H ATOM 1154 1HA GLY A 77 -0.719 6.266 6.724 1.00 0.120 H ATOM 1155 2HA GLY A 77 -0.785 7.400 5.376 1.00 0.120 H ATOM 1156 N PRO A 78 -0.562 8.860 7.712 1.00 0.080 N ATOM 1157 CA PRO A 78 -0.566 9.967 8.670 1.00 0.090 C ATOM 1158 C PRO A 78 -1.517 11.095 8.321 1.00 0.100 C ATOM 1159 O PRO A 78 -2.111 11.732 9.192 1.00 0.140 O ATOM 1160 CB PRO A 78 0.887 10.430 8.617 1.00 0.140 C ATOM 1161 CG PRO A 78 1.650 9.185 8.257 1.00 0.140 C ATOM 1162 CD PRO A 78 0.798 8.478 7.270 1.00 0.140 C ATOM 1163 HA PRO A 78 -0.783 9.585 9.649 1.00 0.110 H ATOM 1164 1HB PRO A 78 1.008 11.235 7.878 1.00 0.160 H ATOM 1165 2HB PRO A 78 1.180 10.845 9.591 1.00 0.160 H ATOM 1166 1HG PRO A 78 2.650 9.440 7.859 1.00 0.160 H ATOM 1167 2HG PRO A 78 1.800 8.562 9.139 1.00 0.160 H ATOM 1168 1HD PRO A 78 1.011 8.840 6.251 1.00 0.160 H ATOM 1169 2HD PRO A 78 0.993 7.409 7.384 1.00 0.160 H ATOM 1170 N TRP A 79 -1.698 11.310 7.030 1.00 0.110 N ATOM 1171 CA TRP A 79 -2.566 12.338 6.500 1.00 0.150 C ATOM 1172 C TRP A 79 -3.970 12.293 7.083 1.00 0.200 C ATOM 1173 O TRP A 79 -4.577 13.325 7.359 1.00 0.370 O ATOM 1174 CB TRP A 79 -2.639 12.197 4.979 1.00 0.190 C ATOM 1175 CG TRP A 79 -3.488 13.225 4.317 1.00 0.190 C ATOM 1176 CD1 TRP A 79 -3.080 14.458 3.918 1.00 0.190 C ATOM 1177 CD2 TRP A 79 -4.887 13.129 3.952 1.00 0.190 C ATOM 1178 NE1 TRP A 79 -4.117 15.135 3.344 1.00 0.190 N ATOM 1179 CE2 TRP A 79 -5.231 14.339 3.356 1.00 0.190 C ATOM 1180 CE3 TRP A 79 -5.859 12.132 4.081 1.00 0.190 C ATOM 1181 CZ2 TRP A 79 -6.506 14.586 2.889 1.00 0.190 C ATOM 1182 CZ3 TRP A 79 -7.133 12.386 3.617 1.00 0.190 C ATOM 1183 CH2 TRP A 79 -7.448 13.576 3.037 1.00 0.190 C ATOM 1184 H TRP A 79 -1.174 10.773 6.357 1.00 0.130 H ATOM 1185 HA TRP A 79 -2.128 13.306 6.739 1.00 0.180 H ATOM 1186 1HB TRP A 79 -1.637 12.264 4.561 1.00 0.230 H ATOM 1187 2HB TRP A 79 -3.034 11.214 4.726 1.00 0.230 H ATOM 1188 HD1 TRP A 79 -2.072 14.850 4.040 1.00 0.230 H ATOM 1189 HE1 TRP A 79 -4.071 16.070 2.969 1.00 0.230 H ATOM 1190 HE3 TRP A 79 -5.618 11.179 4.538 1.00 0.230 H ATOM 1191 HZ2 TRP A 79 -6.778 15.532 2.421 1.00 0.230 H ATOM 1192 HZ3 TRP A 79 -7.885 11.620 3.723 1.00 0.230 H ATOM 1193 HH2 TRP A 79 -8.466 13.736 2.683 1.00 0.230 H ATOM 1194 N ALA A 80 -4.532 11.092 7.206 1.00 0.150 N ATOM 1195 CA ALA A 80 -5.915 10.951 7.634 1.00 0.190 C ATOM 1196 C ALA A 80 -6.112 11.001 9.135 1.00 0.170 C ATOM 1197 O ALA A 80 -7.252 10.931 9.610 1.00 0.180 O ATOM 1198 CB ALA A 80 -6.470 9.647 7.138 1.00 0.250 C ATOM 1199 H ALA A 80 -3.980 10.244 7.031 1.00 0.180 H ATOM 1200 HA ALA A 80 -6.480 11.771 7.190 1.00 0.230 H ATOM 1201 1HB ALA A 80 -7.523 9.563 7.416 1.00 0.300 H ATOM 1202 2HB ALA A 80 -6.375 9.609 6.063 1.00 0.300 H ATOM 1203 3HB ALA A 80 -5.903 8.831 7.586 1.00 0.300 H ATOM 1204 N TRP A 81 -5.042 11.093 9.912 1.00 0.180 N ATOM 1205 CA TRP A 81 -5.250 11.024 11.341 1.00 0.190 C ATOM 1206 C TRP A 81 -6.008 12.247 11.858 1.00 0.230 C ATOM 1207 O TRP A 81 -6.738 12.135 12.843 1.00 0.280 O ATOM 1208 CB TRP A 81 -3.915 10.794 12.045 1.00 0.260 C ATOM 1209 CG TRP A 81 -3.279 9.445 11.632 1.00 0.260 C ATOM 1210 CD1 TRP A 81 -3.877 8.438 10.916 1.00 0.260 C ATOM 1211 CD2 TRP A 81 -1.929 8.991 11.872 1.00 0.260 C ATOM 1212 NE1 TRP A 81 -2.994 7.420 10.700 1.00 0.260 N ATOM 1213 CE2 TRP A 81 -1.805 7.732 11.266 1.00 0.260 C ATOM 1214 CE3 TRP A 81 -0.821 9.544 12.510 1.00 0.260 C ATOM 1215 CZ2 TRP A 81 -0.622 7.027 11.282 1.00 0.260 C ATOM 1216 CZ3 TRP A 81 0.362 8.830 12.511 1.00 0.260 C ATOM 1217 CH2 TRP A 81 0.462 7.612 11.920 1.00 0.260 C ATOM 1218 H TRP A 81 -4.097 11.211 9.526 1.00 0.220 H ATOM 1219 HA TRP A 81 -5.872 10.159 11.556 1.00 0.230 H ATOM 1220 1HB TRP A 81 -3.222 11.595 11.778 1.00 0.310 H ATOM 1221 2HB TRP A 81 -4.053 10.810 13.126 1.00 0.310 H ATOM 1222 HD1 TRP A 81 -4.890 8.436 10.545 1.00 0.310 H ATOM 1223 HE1 TRP A 81 -3.192 6.567 10.176 1.00 0.310 H ATOM 1224 HE3 TRP A 81 -0.877 10.522 12.985 1.00 0.310 H ATOM 1225 HZ2 TRP A 81 -0.525 6.051 10.805 1.00 0.310 H ATOM 1226 HZ3 TRP A 81 1.212 9.272 13.000 1.00 0.310 H ATOM 1227 HH2 TRP A 81 1.416 7.088 11.949 1.00 0.310 H ATOM 1228 N SER A 82 -5.884 13.410 11.198 1.00 0.310 N ATOM 1229 CA SER A 82 -6.609 14.583 11.667 1.00 0.370 C ATOM 1230 C SER A 82 -8.126 14.432 11.511 1.00 0.310 C ATOM 1231 O SER A 82 -8.889 14.961 12.333 1.00 0.450 O ATOM 1232 CB SER A 82 -6.143 15.815 10.920 1.00 0.490 C ATOM 1233 OG SER A 82 -6.492 15.739 9.569 1.00 0.490 O ATOM 1234 H SER A 82 -5.285 13.495 10.384 1.00 0.370 H ATOM 1235 HA SER A 82 -6.389 14.715 12.729 1.00 0.440 H ATOM 1236 1HB SER A 82 -6.595 16.701 11.365 1.00 0.590 H ATOM 1237 2HB SER A 82 -5.064 15.912 11.015 1.00 0.590 H ATOM 1238 HG SER A 82 -6.190 16.561 9.167 1.00 0.590 H ATOM 1239 N ASN A 83 -8.572 13.646 10.522 1.00 0.210 N ATOM 1240 CA ASN A 83 -9.998 13.448 10.316 1.00 0.150 C ATOM 1241 C ASN A 83 -10.525 12.464 11.346 1.00 0.140 C ATOM 1242 O ASN A 83 -11.634 12.626 11.877 1.00 0.190 O ATOM 1243 CB ASN A 83 -10.272 12.972 8.906 1.00 0.230 C ATOM 1244 CG ASN A 83 -10.057 14.055 7.877 1.00 0.230 C ATOM 1245 OD1 ASN A 83 -10.066 15.255 8.185 1.00 0.230 O ATOM 1246 ND2 ASN A 83 -9.874 13.659 6.649 1.00 0.230 N ATOM 1247 H ASN A 83 -7.908 13.232 9.874 1.00 0.250 H ATOM 1248 HA ASN A 83 -10.511 14.397 10.472 1.00 0.180 H ATOM 1249 1HB ASN A 83 -9.610 12.131 8.672 1.00 0.280 H ATOM 1250 2HB ASN A 83 -11.295 12.609 8.831 1.00 0.280 H ATOM 1251 1HD2 ASN A 83 -9.740 14.333 5.927 1.00 0.280 H ATOM 1252 2HD2 ASN A 83 -9.892 12.662 6.426 1.00 0.280 H ATOM 1253 N ILE A 84 -9.703 11.464 11.658 1.00 0.160 N ATOM 1254 CA ILE A 84 -10.086 10.442 12.620 1.00 0.190 C ATOM 1255 C ILE A 84 -10.233 11.073 14.015 1.00 0.250 C ATOM 1256 O ILE A 84 -11.204 10.792 14.738 1.00 0.320 O ATOM 1257 CB ILE A 84 -9.075 9.280 12.632 1.00 0.250 C ATOM 1258 CG1 ILE A 84 -9.113 8.538 11.265 1.00 0.250 C ATOM 1259 CG2 ILE A 84 -9.476 8.311 13.709 1.00 0.250 C ATOM 1260 CD1 ILE A 84 -7.979 7.557 11.020 1.00 0.250 C ATOM 1261 H ILE A 84 -8.815 11.385 11.146 1.00 0.190 H ATOM 1262 HA ILE A 84 -11.053 10.042 12.334 1.00 0.230 H ATOM 1263 HB ILE A 84 -8.065 9.653 12.806 1.00 0.300 H ATOM 1264 1HG1 ILE A 84 -10.038 8.002 11.194 1.00 0.300 H ATOM 1265 2HG1 ILE A 84 -9.088 9.283 10.469 1.00 0.300 H ATOM 1266 1HG2 ILE A 84 -8.809 7.507 13.708 1.00 0.300 H ATOM 1267 2HG2 ILE A 84 -9.459 8.783 14.690 1.00 0.300 H ATOM 1268 3HG2 ILE A 84 -10.479 7.953 13.489 1.00 0.300 H ATOM 1269 1HD1 ILE A 84 -8.101 7.107 10.037 1.00 0.300 H ATOM 1270 2HD1 ILE A 84 -7.040 8.084 11.059 1.00 0.300 H ATOM 1271 3HD1 ILE A 84 -7.982 6.774 11.763 1.00 0.300 H ATOM 1272 N ASP A 85 -9.254 11.915 14.406 1.00 0.250 N ATOM 1273 CA ASP A 85 -9.329 12.599 15.697 1.00 0.300 C ATOM 1274 C ASP A 85 -10.547 13.522 15.764 1.00 0.240 C ATOM 1275 O ASP A 85 -11.266 13.533 16.765 1.00 0.460 O ATOM 1276 CB ASP A 85 -8.076 13.441 15.972 1.00 0.400 C ATOM 1277 CG ASP A 85 -6.801 12.649 16.328 1.00 0.400 C ATOM 1278 OD1 ASP A 85 -6.874 11.474 16.607 1.00 0.400 O ATOM 1279 OD2 ASP A 85 -5.760 13.263 16.346 1.00 0.400 O ATOM 1280 H ASP A 85 -8.437 12.063 13.805 1.00 0.300 H ATOM 1281 HA ASP A 85 -9.422 11.846 16.479 1.00 0.360 H ATOM 1282 1HB ASP A 85 -7.858 14.037 15.082 1.00 0.480 H ATOM 1283 2HB ASP A 85 -8.285 14.138 16.780 1.00 0.480 H ATOM 1284 N THR A 86 -10.841 14.227 14.667 1.00 0.150 N ATOM 1285 CA THR A 86 -11.979 15.142 14.586 1.00 0.230 C ATOM 1286 C THR A 86 -13.289 14.402 14.816 1.00 0.340 C ATOM 1287 O THR A 86 -14.205 14.901 15.478 1.00 0.460 O ATOM 1288 CB THR A 86 -12.018 15.878 13.224 1.00 0.290 C ATOM 1289 OG1 THR A 86 -10.827 16.669 13.065 1.00 0.290 O ATOM 1290 CG2 THR A 86 -13.234 16.799 13.150 1.00 0.290 C ATOM 1291 H THR A 86 -10.212 14.196 13.862 1.00 0.180 H ATOM 1292 HA THR A 86 -11.871 15.891 15.370 1.00 0.280 H ATOM 1293 HB THR A 86 -12.069 15.150 12.417 1.00 0.350 H ATOM 1294 HG1 THR A 86 -10.059 16.084 12.890 1.00 0.350 H ATOM 1295 1HG2 THR A 86 -13.236 17.308 12.189 1.00 0.350 H ATOM 1296 2HG2 THR A 86 -14.153 16.225 13.249 1.00 0.350 H ATOM 1297 3HG2 THR A 86 -13.179 17.534 13.951 1.00 0.350 H ATOM 1298 N SER A 87 -13.361 13.195 14.273 1.00 0.320 N ATOM 1299 CA SER A 87 -14.530 12.334 14.296 1.00 0.510 C ATOM 1300 C SER A 87 -14.809 11.649 15.645 1.00 0.550 C ATOM 1301 O SER A 87 -15.835 10.981 15.778 1.00 1.410 O ATOM 1302 CB SER A 87 -14.375 11.289 13.209 1.00 0.640 C ATOM 1303 OG SER A 87 -14.341 11.891 11.938 1.00 0.640 O ATOM 1304 H SER A 87 -12.560 12.886 13.716 1.00 0.380 H ATOM 1305 HA SER A 87 -15.395 12.951 14.052 1.00 0.610 H ATOM 1306 1HB SER A 87 -13.454 10.732 13.364 1.00 0.770 H ATOM 1307 2HB SER A 87 -15.202 10.579 13.261 1.00 0.770 H ATOM 1308 HG SER A 87 -13.431 12.252 11.840 1.00 0.770 H ATOM 1309 N LYS A 88 -13.910 11.810 16.628 1.00 0.870 N ATOM 1310 CA LYS A 88 -13.998 11.221 17.969 1.00 0.860 C ATOM 1311 C LYS A 88 -13.980 9.701 17.981 1.00 0.630 C ATOM 1312 O LYS A 88 -14.667 9.066 18.786 1.00 0.590 O ATOM 1313 CB LYS A 88 -15.250 11.723 18.697 1.00 1.210 C ATOM 1314 CG LYS A 88 -15.303 13.233 18.868 1.00 1.210 C ATOM 1315 CD LYS A 88 -16.535 13.661 19.648 1.00 1.210 C ATOM 1316 CE LYS A 88 -16.615 15.177 19.766 1.00 1.210 C ATOM 1317 NZ LYS A 88 -17.841 15.616 20.496 1.00 1.210 N ATOM 1318 H LYS A 88 -13.091 12.399 16.446 1.00 1.040 H ATOM 1319 HA LYS A 88 -13.124 11.558 18.529 1.00 1.030 H ATOM 1320 1HB LYS A 88 -16.147 11.405 18.174 1.00 1.450 H ATOM 1321 2HB LYS A 88 -15.285 11.282 19.693 1.00 1.450 H ATOM 1322 1HG LYS A 88 -14.408 13.568 19.388 1.00 1.450 H ATOM 1323 2HG LYS A 88 -15.324 13.704 17.883 1.00 1.450 H ATOM 1324 1HD LYS A 88 -17.427 13.295 19.138 1.00 1.450 H ATOM 1325 2HD LYS A 88 -16.503 13.225 20.646 1.00 1.450 H ATOM 1326 1HE LYS A 88 -15.737 15.539 20.299 1.00 1.450 H ATOM 1327 2HE LYS A 88 -16.625 15.611 18.765 1.00 1.450 H ATOM 1328 1HZ LYS A 88 -17.857 16.625 20.552 1.00 1.450 H ATOM 1329 2HZ LYS A 88 -18.662 15.294 20.002 1.00 1.450 H ATOM 1330 3HZ LYS A 88 -17.837 15.228 21.429 1.00 1.450 H ATOM 1331 N VAL A 89 -13.146 9.125 17.126 1.00 0.760 N ATOM 1332 CA VAL A 89 -12.986 7.687 17.051 1.00 0.600 C ATOM 1333 C VAL A 89 -11.900 7.221 18.006 1.00 0.380 C ATOM 1334 O VAL A 89 -10.799 7.778 18.027 1.00 0.450 O ATOM 1335 CB VAL A 89 -12.560 7.277 15.642 1.00 0.900 C ATOM 1336 CG1 VAL A 89 -12.358 5.767 15.542 1.00 0.900 C ATOM 1337 CG2 VAL A 89 -13.549 7.735 14.657 1.00 0.900 C ATOM 1338 H VAL A 89 -12.599 9.721 16.491 1.00 0.910 H ATOM 1339 HA VAL A 89 -13.933 7.211 17.310 1.00 0.720 H ATOM 1340 HB VAL A 89 -11.618 7.744 15.430 1.00 1.080 H ATOM 1341 1HG1 VAL A 89 -12.057 5.534 14.549 1.00 1.080 H ATOM 1342 2HG1 VAL A 89 -11.601 5.418 16.230 1.00 1.080 H ATOM 1343 3HG1 VAL A 89 -13.297 5.260 15.753 1.00 1.080 H ATOM 1344 1HG2 VAL A 89 -13.179 7.449 13.699 1.00 1.080 H ATOM 1345 2HG2 VAL A 89 -14.516 7.269 14.840 1.00 1.080 H ATOM 1346 3HG2 VAL A 89 -13.658 8.809 14.706 1.00 1.080 H ATOM 1347 N ASN A 90 -12.168 6.174 18.778 1.00 0.280 N ATOM 1348 CA ASN A 90 -11.157 5.636 19.688 1.00 0.220 C ATOM 1349 C ASN A 90 -10.166 4.778 18.888 1.00 0.280 C ATOM 1350 O ASN A 90 -10.237 3.551 18.875 1.00 0.730 O ATOM 1351 CB ASN A 90 -11.803 4.828 20.798 1.00 0.330 C ATOM 1352 CG ASN A 90 -10.829 4.449 21.887 1.00 0.330 C ATOM 1353 OD1 ASN A 90 -9.742 5.033 21.992 1.00 0.330 O ATOM 1354 ND2 ASN A 90 -11.201 3.490 22.701 1.00 0.330 N ATOM 1355 H ASN A 90 -13.086 5.755 18.735 1.00 0.340 H ATOM 1356 HA ASN A 90 -10.599 6.465 20.127 1.00 0.260 H ATOM 1357 1HB ASN A 90 -12.617 5.405 21.239 1.00 0.400 H ATOM 1358 2HB ASN A 90 -12.236 3.918 20.383 1.00 0.400 H ATOM 1359 1HD2 ASN A 90 -10.594 3.198 23.443 1.00 0.400 H ATOM 1360 2HD2 ASN A 90 -12.088 3.046 22.580 1.00 0.400 H ATOM 1361 N TYR A 91 -9.287 5.467 18.181 1.00 0.280 N ATOM 1362 CA TYR A 91 -8.312 4.931 17.234 1.00 0.350 C ATOM 1363 C TYR A 91 -6.874 4.865 17.713 1.00 0.320 C ATOM 1364 O TYR A 91 -6.396 5.774 18.389 1.00 0.460 O ATOM 1365 CB TYR A 91 -8.376 5.811 15.992 1.00 0.460 C ATOM 1366 CG TYR A 91 -7.279 5.662 14.940 1.00 0.460 C ATOM 1367 CD1 TYR A 91 -7.237 4.580 14.113 1.00 0.460 C ATOM 1368 CD2 TYR A 91 -6.355 6.689 14.767 1.00 0.460 C ATOM 1369 CE1 TYR A 91 -6.319 4.496 13.120 1.00 0.460 C ATOM 1370 CE2 TYR A 91 -5.424 6.603 13.770 1.00 0.460 C ATOM 1371 CZ TYR A 91 -5.419 5.504 12.943 1.00 0.460 C ATOM 1372 OH TYR A 91 -4.514 5.410 11.938 1.00 0.460 O ATOM 1373 H TYR A 91 -9.371 6.481 18.280 1.00 0.340 H ATOM 1374 HA TYR A 91 -8.620 3.919 16.977 1.00 0.420 H ATOM 1375 1HB TYR A 91 -9.321 5.632 15.499 1.00 0.550 H ATOM 1376 2HB TYR A 91 -8.389 6.854 16.311 1.00 0.550 H ATOM 1377 HD1 TYR A 91 -7.920 3.792 14.241 1.00 0.550 H ATOM 1378 HD2 TYR A 91 -6.383 7.565 15.416 1.00 0.550 H ATOM 1379 HE1 TYR A 91 -6.301 3.624 12.468 1.00 0.550 H ATOM 1380 HE2 TYR A 91 -4.701 7.405 13.621 1.00 0.550 H ATOM 1381 HH TYR A 91 -3.914 6.156 12.000 1.00 0.550 H ATOM 1382 N GLY A 92 -6.186 3.779 17.364 1.00 0.220 N ATOM 1383 CA GLY A 92 -4.760 3.681 17.631 1.00 0.170 C ATOM 1384 C GLY A 92 -4.043 3.378 16.322 1.00 0.140 C ATOM 1385 O GLY A 92 -4.681 3.093 15.311 1.00 0.200 O ATOM 1386 H GLY A 92 -6.649 3.039 16.856 1.00 0.260 H ATOM 1387 1HA GLY A 92 -4.390 4.619 18.047 1.00 0.200 H ATOM 1388 2HA GLY A 92 -4.567 2.894 18.357 1.00 0.200 H ATOM 1389 N VAL A 93 -2.719 3.366 16.358 1.00 0.130 N ATOM 1390 CA VAL A 93 -1.916 3.065 15.180 1.00 0.110 C ATOM 1391 C VAL A 93 -1.000 1.895 15.460 1.00 0.130 C ATOM 1392 O VAL A 93 -0.273 1.887 16.451 1.00 0.130 O ATOM 1393 CB VAL A 93 -1.110 4.305 14.751 1.00 0.160 C ATOM 1394 CG1 VAL A 93 -0.202 4.003 13.570 1.00 0.160 C ATOM 1395 CG2 VAL A 93 -2.085 5.394 14.343 1.00 0.160 C ATOM 1396 H VAL A 93 -2.251 3.593 17.228 1.00 0.160 H ATOM 1397 HA VAL A 93 -2.583 2.792 14.361 1.00 0.130 H ATOM 1398 HB VAL A 93 -0.489 4.630 15.582 1.00 0.190 H ATOM 1399 1HG1 VAL A 93 0.343 4.903 13.303 1.00 0.190 H ATOM 1400 2HG1 VAL A 93 0.513 3.222 13.834 1.00 0.190 H ATOM 1401 3HG1 VAL A 93 -0.800 3.675 12.721 1.00 0.190 H ATOM 1402 1HG2 VAL A 93 -1.548 6.283 14.036 1.00 0.190 H ATOM 1403 2HG2 VAL A 93 -2.666 5.026 13.523 1.00 0.190 H ATOM 1404 3HG2 VAL A 93 -2.743 5.644 15.169 1.00 0.190 H ATOM 1405 N THR A 94 -1.045 0.893 14.601 1.00 0.170 N ATOM 1406 CA THR A 94 -0.209 -0.276 14.805 1.00 0.210 C ATOM 1407 C THR A 94 0.427 -0.794 13.532 1.00 0.150 C ATOM 1408 O THR A 94 0.350 -0.166 12.473 1.00 0.230 O ATOM 1409 CB THR A 94 -0.993 -1.403 15.493 1.00 0.280 C ATOM 1410 OG1 THR A 94 -0.068 -2.429 15.883 1.00 0.280 O ATOM 1411 CG2 THR A 94 -2.070 -1.977 14.561 1.00 0.280 C ATOM 1412 H THR A 94 -1.658 0.948 13.801 1.00 0.200 H ATOM 1413 HA THR A 94 0.604 0.003 15.474 1.00 0.250 H ATOM 1414 HB THR A 94 -1.471 -1.005 16.388 1.00 0.330 H ATOM 1415 HG1 THR A 94 -0.510 -3.039 16.490 1.00 0.330 H ATOM 1416 1HG2 THR A 94 -2.608 -2.766 15.081 1.00 0.330 H ATOM 1417 2HG2 THR A 94 -2.765 -1.186 14.286 1.00 0.330 H ATOM 1418 3HG2 THR A 94 -1.626 -2.391 13.659 1.00 0.330 H ATOM 1419 N VAL A 95 1.072 -1.939 13.672 1.00 0.100 N ATOM 1420 CA VAL A 95 1.768 -2.629 12.602 1.00 0.110 C ATOM 1421 C VAL A 95 0.778 -3.456 11.792 1.00 0.110 C ATOM 1422 O VAL A 95 -0.010 -4.220 12.348 1.00 0.140 O ATOM 1423 CB VAL A 95 2.885 -3.515 13.195 1.00 0.150 C ATOM 1424 CG1 VAL A 95 3.581 -4.330 12.101 1.00 0.150 C ATOM 1425 CG2 VAL A 95 3.891 -2.619 13.917 1.00 0.150 C ATOM 1426 H VAL A 95 1.033 -2.358 14.598 1.00 0.120 H ATOM 1427 HA VAL A 95 2.222 -1.888 11.945 1.00 0.130 H ATOM 1428 HB VAL A 95 2.446 -4.219 13.902 1.00 0.180 H ATOM 1429 1HG1 VAL A 95 4.359 -4.945 12.551 1.00 0.180 H ATOM 1430 2HG1 VAL A 95 2.865 -4.979 11.602 1.00 0.180 H ATOM 1431 3HG1 VAL A 95 4.030 -3.658 11.373 1.00 0.180 H ATOM 1432 1HG2 VAL A 95 4.678 -3.232 14.355 1.00 0.180 H ATOM 1433 2HG2 VAL A 95 4.328 -1.919 13.206 1.00 0.180 H ATOM 1434 3HG2 VAL A 95 3.388 -2.062 14.706 1.00 0.180 H ATOM 1435 N LEU A 96 0.835 -3.328 10.476 1.00 0.110 N ATOM 1436 CA LEU A 96 -0.074 -4.059 9.613 1.00 0.100 C ATOM 1437 C LEU A 96 0.099 -5.574 9.799 1.00 0.100 C ATOM 1438 O LEU A 96 1.226 -6.039 9.982 1.00 0.110 O ATOM 1439 CB LEU A 96 0.178 -3.669 8.152 1.00 0.140 C ATOM 1440 CG LEU A 96 -0.180 -2.237 7.710 1.00 0.140 C ATOM 1441 CD1 LEU A 96 0.274 -2.051 6.243 1.00 0.140 C ATOM 1442 CD2 LEU A 96 -1.684 -2.004 7.842 1.00 0.140 C ATOM 1443 H LEU A 96 1.512 -2.690 10.081 1.00 0.130 H ATOM 1444 HA LEU A 96 -1.073 -3.774 9.909 1.00 0.120 H ATOM 1445 1HB LEU A 96 1.245 -3.753 8.003 1.00 0.170 H ATOM 1446 2HB LEU A 96 -0.316 -4.372 7.487 1.00 0.170 H ATOM 1447 HG LEU A 96 0.352 -1.515 8.328 1.00 0.170 H ATOM 1448 1HD1 LEU A 96 0.038 -1.039 5.912 1.00 0.170 H ATOM 1449 2HD1 LEU A 96 1.351 -2.214 6.165 1.00 0.170 H ATOM 1450 3HD1 LEU A 96 -0.246 -2.766 5.607 1.00 0.170 H ATOM 1451 1HD2 LEU A 96 -1.911 -0.997 7.518 1.00 0.170 H ATOM 1452 2HD2 LEU A 96 -2.217 -2.717 7.218 1.00 0.170 H ATOM 1453 3HD2 LEU A 96 -2.008 -2.113 8.868 1.00 0.170 H ATOM 1454 N PRO A 97 -1.001 -6.359 9.704 1.00 0.110 N ATOM 1455 CA PRO A 97 -1.077 -7.801 9.909 1.00 0.130 C ATOM 1456 C PRO A 97 -0.266 -8.592 8.908 1.00 0.120 C ATOM 1457 O PRO A 97 0.033 -8.114 7.812 1.00 0.180 O ATOM 1458 CB PRO A 97 -2.575 -8.098 9.749 1.00 0.200 C ATOM 1459 CG PRO A 97 -3.119 -6.962 8.920 1.00 0.200 C ATOM 1460 CD PRO A 97 -2.307 -5.758 9.327 1.00 0.200 C ATOM 1461 HA PRO A 97 -0.746 -8.032 10.932 1.00 0.160 H ATOM 1462 1HB PRO A 97 -2.702 -9.080 9.256 1.00 0.230 H ATOM 1463 2HB PRO A 97 -3.050 -8.174 10.738 1.00 0.230 H ATOM 1464 1HG PRO A 97 -3.007 -7.199 7.847 1.00 0.230 H ATOM 1465 2HG PRO A 97 -4.199 -6.838 9.107 1.00 0.230 H ATOM 1466 1HD PRO A 97 -2.232 -5.099 8.461 1.00 0.230 H ATOM 1467 2HD PRO A 97 -2.772 -5.265 10.198 1.00 0.230 H ATOM 1468 N THR A 98 0.119 -9.795 9.314 1.00 0.110 N ATOM 1469 CA THR A 98 0.905 -10.670 8.474 1.00 0.110 C ATOM 1470 C THR A 98 0.086 -11.426 7.441 1.00 0.110 C ATOM 1471 O THR A 98 -1.144 -11.513 7.520 1.00 0.110 O ATOM 1472 CB THR A 98 1.671 -11.705 9.335 1.00 0.150 C ATOM 1473 OG1 THR A 98 0.733 -12.520 10.047 1.00 0.150 O ATOM 1474 CG2 THR A 98 2.587 -11.024 10.319 1.00 0.150 C ATOM 1475 H THR A 98 -0.150 -10.142 10.225 1.00 0.130 H ATOM 1476 HA THR A 98 1.619 -10.047 7.943 1.00 0.130 H ATOM 1477 HB THR A 98 2.257 -12.341 8.688 1.00 0.180 H ATOM 1478 HG1 THR A 98 1.205 -13.183 10.560 1.00 0.180 H ATOM 1479 1HG2 THR A 98 3.111 -11.781 10.903 1.00 0.180 H ATOM 1480 2HG2 THR A 98 3.301 -10.434 9.796 1.00 0.180 H ATOM 1481 3HG2 THR A 98 2.010 -10.388 10.984 1.00 0.180 H ATOM 1482 N PHE A 99 0.802 -11.995 6.483 1.00 0.120 N ATOM 1483 CA PHE A 99 0.263 -12.840 5.440 1.00 0.110 C ATOM 1484 C PHE A 99 1.199 -14.014 5.252 1.00 0.110 C ATOM 1485 O PHE A 99 2.385 -13.842 4.982 1.00 0.130 O ATOM 1486 CB PHE A 99 0.095 -12.044 4.161 1.00 0.160 C ATOM 1487 CG PHE A 99 -0.436 -12.838 3.044 1.00 0.160 C ATOM 1488 CD1 PHE A 99 -1.691 -13.403 3.105 1.00 0.160 C ATOM 1489 CD2 PHE A 99 0.328 -13.029 1.918 1.00 0.160 C ATOM 1490 CE1 PHE A 99 -2.154 -14.152 2.072 1.00 0.160 C ATOM 1491 CE2 PHE A 99 -0.143 -13.774 0.873 1.00 0.160 C ATOM 1492 CZ PHE A 99 -1.388 -14.340 0.953 1.00 0.160 C ATOM 1493 H PHE A 99 1.803 -11.810 6.497 1.00 0.140 H ATOM 1494 HA PHE A 99 -0.709 -13.215 5.759 1.00 0.130 H ATOM 1495 1HB PHE A 99 -0.575 -11.221 4.352 1.00 0.190 H ATOM 1496 2HB PHE A 99 1.055 -11.631 3.865 1.00 0.190 H ATOM 1497 HD1 PHE A 99 -2.313 -13.256 3.990 1.00 0.190 H ATOM 1498 HD2 PHE A 99 1.318 -12.579 1.871 1.00 0.190 H ATOM 1499 HE1 PHE A 99 -3.137 -14.602 2.141 1.00 0.190 H ATOM 1500 HE2 PHE A 99 0.473 -13.922 -0.017 1.00 0.190 H ATOM 1501 HZ PHE A 99 -1.771 -14.940 0.127 1.00 0.190 H ATOM 1502 N LYS A 100 0.686 -15.218 5.496 1.00 0.110 N ATOM 1503 CA LYS A 100 1.502 -16.428 5.457 1.00 0.140 C ATOM 1504 C LYS A 100 2.728 -16.289 6.368 1.00 0.190 C ATOM 1505 O LYS A 100 3.821 -16.761 6.049 1.00 0.260 O ATOM 1506 CB LYS A 100 1.916 -16.753 4.023 1.00 0.180 C ATOM 1507 CG LYS A 100 0.750 -17.093 3.088 1.00 0.180 C ATOM 1508 CD LYS A 100 1.203 -17.177 1.632 1.00 0.180 C ATOM 1509 CE LYS A 100 2.161 -18.357 1.376 1.00 0.180 C ATOM 1510 NZ LYS A 100 2.468 -18.518 -0.063 1.00 0.180 N ATOM 1511 H LYS A 100 -0.299 -15.290 5.709 1.00 0.130 H ATOM 1512 HA LYS A 100 0.904 -17.259 5.835 1.00 0.170 H ATOM 1513 1HB LYS A 100 2.470 -15.918 3.587 1.00 0.220 H ATOM 1514 2HB LYS A 100 2.588 -17.605 4.049 1.00 0.220 H ATOM 1515 1HG LYS A 100 0.306 -18.040 3.385 1.00 0.220 H ATOM 1516 2HG LYS A 100 -0.007 -16.315 3.168 1.00 0.220 H ATOM 1517 1HD LYS A 100 0.333 -17.274 0.985 1.00 0.220 H ATOM 1518 2HD LYS A 100 1.713 -16.253 1.373 1.00 0.220 H ATOM 1519 1HE LYS A 100 3.097 -18.158 1.890 1.00 0.220 H ATOM 1520 2HE LYS A 100 1.731 -19.281 1.758 1.00 0.220 H ATOM 1521 1HZ LYS A 100 3.123 -19.266 -0.195 1.00 0.220 H ATOM 1522 2HZ LYS A 100 1.627 -18.717 -0.572 1.00 0.220 H ATOM 1523 3HZ LYS A 100 2.885 -17.624 -0.396 1.00 0.220 H ATOM 1524 N GLY A 101 2.531 -15.626 7.510 1.00 0.160 N ATOM 1525 CA GLY A 101 3.563 -15.414 8.513 1.00 0.200 C ATOM 1526 C GLY A 101 4.475 -14.212 8.247 1.00 0.200 C ATOM 1527 O GLY A 101 5.285 -13.858 9.106 1.00 0.260 O ATOM 1528 H GLY A 101 1.601 -15.278 7.714 1.00 0.190 H ATOM 1529 1HA GLY A 101 3.087 -15.291 9.485 1.00 0.240 H ATOM 1530 2HA GLY A 101 4.173 -16.314 8.582 1.00 0.240 H ATOM 1531 N GLN A 102 4.347 -13.563 7.092 1.00 0.160 N ATOM 1532 CA GLN A 102 5.221 -12.446 6.788 1.00 0.180 C ATOM 1533 C GLN A 102 4.532 -11.114 7.051 1.00 0.140 C ATOM 1534 O GLN A 102 3.360 -10.981 6.729 1.00 0.210 O ATOM 1535 CB GLN A 102 5.646 -12.517 5.328 1.00 0.240 C ATOM 1536 CG GLN A 102 6.357 -13.787 4.983 1.00 0.240 C ATOM 1537 CD GLN A 102 7.622 -13.920 5.757 1.00 0.240 C ATOM 1538 OE1 GLN A 102 8.466 -13.016 5.744 1.00 0.240 O ATOM 1539 NE2 GLN A 102 7.777 -15.033 6.458 1.00 0.240 N ATOM 1540 H GLN A 102 3.659 -13.858 6.394 1.00 0.190 H ATOM 1541 HA GLN A 102 6.105 -12.559 7.392 1.00 0.220 H ATOM 1542 1HB GLN A 102 4.758 -12.458 4.691 1.00 0.290 H ATOM 1543 2HB GLN A 102 6.285 -11.669 5.076 1.00 0.290 H ATOM 1544 1HG GLN A 102 5.711 -14.639 5.212 1.00 0.290 H ATOM 1545 2HG GLN A 102 6.593 -13.775 3.918 1.00 0.290 H ATOM 1546 1HE2 GLN A 102 8.605 -15.171 7.002 1.00 0.290 H ATOM 1547 2HE2 GLN A 102 7.063 -15.739 6.453 1.00 0.290 H ATOM 1548 N PRO A 103 5.209 -10.095 7.593 1.00 0.250 N ATOM 1549 CA PRO A 103 4.678 -8.758 7.809 1.00 0.250 C ATOM 1550 C PRO A 103 4.259 -8.141 6.502 1.00 0.160 C ATOM 1551 O PRO A 103 4.832 -8.468 5.466 1.00 0.280 O ATOM 1552 CB PRO A 103 5.879 -8.001 8.388 1.00 0.380 C ATOM 1553 CG PRO A 103 6.756 -9.066 9.001 1.00 0.380 C ATOM 1554 CD PRO A 103 6.582 -10.287 8.120 1.00 0.380 C ATOM 1555 HA PRO A 103 3.837 -8.773 8.510 1.00 0.300 H ATOM 1556 1HB PRO A 103 6.378 -7.429 7.584 1.00 0.450 H ATOM 1557 2HB PRO A 103 5.527 -7.262 9.125 1.00 0.450 H ATOM 1558 1HG PRO A 103 7.800 -8.717 9.037 1.00 0.450 H ATOM 1559 2HG PRO A 103 6.449 -9.256 10.040 1.00 0.450 H ATOM 1560 1HD PRO A 103 7.322 -10.327 7.301 1.00 0.450 H ATOM 1561 2HD PRO A 103 6.645 -11.148 8.802 1.00 0.450 H ATOM 1562 N SER A 104 3.260 -7.271 6.547 1.00 0.160 N ATOM 1563 CA SER A 104 2.867 -6.546 5.350 1.00 0.140 C ATOM 1564 C SER A 104 4.032 -5.651 4.976 1.00 0.150 C ATOM 1565 O SER A 104 4.764 -5.202 5.864 1.00 0.190 O ATOM 1566 CB SER A 104 1.602 -5.762 5.557 1.00 0.200 C ATOM 1567 OG SER A 104 0.468 -6.585 5.707 1.00 0.200 O ATOM 1568 H SER A 104 2.817 -7.053 7.433 1.00 0.190 H ATOM 1569 HA SER A 104 2.697 -7.243 4.549 1.00 0.170 H ATOM 1570 1HB SER A 104 1.729 -5.156 6.412 1.00 0.240 H ATOM 1571 2HB SER A 104 1.464 -5.126 4.731 1.00 0.240 H ATOM 1572 HG SER A 104 0.526 -7.047 6.569 1.00 0.240 H ATOM 1573 N LYS A 105 4.230 -5.406 3.684 1.00 0.140 N ATOM 1574 CA LYS A 105 5.344 -4.568 3.249 1.00 0.140 C ATOM 1575 C LYS A 105 4.917 -3.382 2.361 1.00 0.140 C ATOM 1576 O LYS A 105 5.030 -3.471 1.141 1.00 0.140 O ATOM 1577 CB LYS A 105 6.361 -5.452 2.536 1.00 0.200 C ATOM 1578 CG LYS A 105 7.006 -6.481 3.440 1.00 0.200 C ATOM 1579 CD LYS A 105 7.964 -7.380 2.694 1.00 0.200 C ATOM 1580 CE LYS A 105 8.582 -8.402 3.639 1.00 0.200 C ATOM 1581 NZ LYS A 105 9.490 -9.348 2.933 1.00 0.200 N ATOM 1582 H LYS A 105 3.569 -5.794 3.002 1.00 0.170 H ATOM 1583 HA LYS A 105 5.847 -4.196 4.131 1.00 0.170 H ATOM 1584 1HB LYS A 105 5.863 -6.018 1.789 1.00 0.240 H ATOM 1585 2HB LYS A 105 7.132 -4.847 2.059 1.00 0.240 H ATOM 1586 1HG LYS A 105 7.527 -5.978 4.253 1.00 0.240 H ATOM 1587 2HG LYS A 105 6.234 -7.106 3.871 1.00 0.240 H ATOM 1588 1HD LYS A 105 7.427 -7.911 1.908 1.00 0.240 H ATOM 1589 2HD LYS A 105 8.750 -6.784 2.236 1.00 0.240 H ATOM 1590 1HE LYS A 105 9.148 -7.874 4.404 1.00 0.240 H ATOM 1591 2HE LYS A 105 7.780 -8.972 4.122 1.00 0.240 H ATOM 1592 1HZ LYS A 105 9.874 -10.003 3.599 1.00 0.240 H ATOM 1593 2HZ LYS A 105 8.967 -9.859 2.231 1.00 0.240 H ATOM 1594 3HZ LYS A 105 10.238 -8.837 2.491 1.00 0.240 H ATOM 1595 N PRO A 106 4.432 -2.263 2.942 1.00 0.150 N ATOM 1596 CA PRO A 106 3.891 -1.097 2.257 1.00 0.160 C ATOM 1597 C PRO A 106 4.977 -0.293 1.572 1.00 0.170 C ATOM 1598 O PRO A 106 6.132 -0.335 1.998 1.00 0.180 O ATOM 1599 CB PRO A 106 3.282 -0.279 3.408 1.00 0.240 C ATOM 1600 CG PRO A 106 4.099 -0.653 4.613 1.00 0.240 C ATOM 1601 CD PRO A 106 4.461 -2.114 4.415 1.00 0.240 C ATOM 1602 HA PRO A 106 3.133 -1.416 1.531 1.00 0.190 H ATOM 1603 1HB PRO A 106 3.353 0.801 3.168 1.00 0.290 H ATOM 1604 2HB PRO A 106 2.229 -0.503 3.547 1.00 0.290 H ATOM 1605 1HG PRO A 106 4.993 -0.005 4.670 1.00 0.290 H ATOM 1606 2HG PRO A 106 3.521 -0.480 5.533 1.00 0.290 H ATOM 1607 1HD PRO A 106 5.472 -2.238 4.817 1.00 0.290 H ATOM 1608 2HD PRO A 106 3.729 -2.775 4.901 1.00 0.290 H ATOM 1609 N PHE A 107 4.602 0.484 0.557 1.00 0.170 N ATOM 1610 CA PHE A 107 5.565 1.392 -0.044 1.00 0.190 C ATOM 1611 C PHE A 107 5.740 2.563 0.913 1.00 0.170 C ATOM 1612 O PHE A 107 4.765 3.039 1.509 1.00 0.230 O ATOM 1613 CB PHE A 107 5.097 1.977 -1.388 1.00 0.260 C ATOM 1614 CG PHE A 107 5.047 1.109 -2.621 1.00 0.260 C ATOM 1615 CD1 PHE A 107 3.822 0.860 -3.243 1.00 0.260 C ATOM 1616 CD2 PHE A 107 6.196 0.574 -3.189 1.00 0.260 C ATOM 1617 CE1 PHE A 107 3.758 0.109 -4.400 1.00 0.260 C ATOM 1618 CE2 PHE A 107 6.126 -0.185 -4.344 1.00 0.260 C ATOM 1619 CZ PHE A 107 4.908 -0.413 -4.949 1.00 0.260 C ATOM 1620 H PHE A 107 3.648 0.467 0.223 1.00 0.200 H ATOM 1621 HA PHE A 107 6.521 0.882 -0.166 1.00 0.230 H ATOM 1622 1HB PHE A 107 4.111 2.321 -1.250 1.00 0.310 H ATOM 1623 2HB PHE A 107 5.707 2.853 -1.620 1.00 0.310 H ATOM 1624 HD1 PHE A 107 2.905 1.273 -2.818 1.00 0.310 H ATOM 1625 HD2 PHE A 107 7.163 0.762 -2.722 1.00 0.310 H ATOM 1626 HE1 PHE A 107 2.796 -0.077 -4.879 1.00 0.310 H ATOM 1627 HE2 PHE A 107 7.032 -0.599 -4.776 1.00 0.310 H ATOM 1628 HZ PHE A 107 4.850 -1.010 -5.856 1.00 0.310 H ATOM 1629 N VAL A 108 6.964 3.059 1.034 1.00 0.170 N ATOM 1630 CA VAL A 108 7.232 4.208 1.886 1.00 0.220 C ATOM 1631 C VAL A 108 7.899 5.302 1.061 1.00 0.200 C ATOM 1632 O VAL A 108 8.833 5.030 0.304 1.00 0.180 O ATOM 1633 CB VAL A 108 8.100 3.786 3.094 1.00 0.290 C ATOM 1634 CG1 VAL A 108 8.403 5.000 4.000 1.00 0.290 C ATOM 1635 CG2 VAL A 108 7.359 2.682 3.881 1.00 0.290 C ATOM 1636 H VAL A 108 7.726 2.629 0.527 1.00 0.200 H ATOM 1637 HA VAL A 108 6.288 4.596 2.267 1.00 0.260 H ATOM 1638 HB VAL A 108 9.053 3.404 2.735 1.00 0.350 H ATOM 1639 1HG1 VAL A 108 9.020 4.681 4.836 1.00 0.350 H ATOM 1640 2HG1 VAL A 108 8.937 5.768 3.436 1.00 0.350 H ATOM 1641 3HG1 VAL A 108 7.472 5.416 4.379 1.00 0.350 H ATOM 1642 1HG2 VAL A 108 7.965 2.370 4.729 1.00 0.350 H ATOM 1643 2HG2 VAL A 108 6.405 3.068 4.238 1.00 0.350 H ATOM 1644 3HG2 VAL A 108 7.177 1.818 3.241 1.00 0.350 H ATOM 1645 N GLY A 109 7.370 6.521 1.153 1.00 0.260 N ATOM 1646 CA GLY A 109 7.909 7.644 0.400 1.00 0.260 C ATOM 1647 C GLY A 109 8.896 8.461 1.222 1.00 0.260 C ATOM 1648 O GLY A 109 9.210 8.133 2.376 1.00 0.270 O ATOM 1649 H GLY A 109 6.613 6.684 1.812 1.00 0.310 H ATOM 1650 1HA GLY A 109 8.398 7.277 -0.502 1.00 0.310 H ATOM 1651 2HA GLY A 109 7.090 8.286 0.079 1.00 0.310 H ATOM 1652 N VAL A 110 9.312 9.600 0.677 1.00 0.260 N ATOM 1653 CA VAL A 110 10.293 10.406 1.378 1.00 0.260 C ATOM 1654 C VAL A 110 9.644 11.124 2.532 1.00 0.240 C ATOM 1655 O VAL A 110 8.743 11.939 2.346 1.00 0.230 O ATOM 1656 CB VAL A 110 10.943 11.411 0.402 1.00 0.360 C ATOM 1657 CG1 VAL A 110 11.910 12.340 1.137 1.00 0.360 C ATOM 1658 CG2 VAL A 110 11.688 10.630 -0.681 1.00 0.360 C ATOM 1659 H VAL A 110 8.980 9.868 -0.237 1.00 0.310 H ATOM 1660 HA VAL A 110 11.070 9.748 1.768 1.00 0.310 H ATOM 1661 HB VAL A 110 10.170 12.028 -0.054 1.00 0.440 H ATOM 1662 1HG1 VAL A 110 12.355 13.034 0.425 1.00 0.440 H ATOM 1663 2HG1 VAL A 110 11.371 12.906 1.886 1.00 0.440 H ATOM 1664 3HG1 VAL A 110 12.697 11.756 1.612 1.00 0.440 H ATOM 1665 1HG2 VAL A 110 12.145 11.327 -1.383 1.00 0.440 H ATOM 1666 2HG2 VAL A 110 12.464 10.020 -0.217 1.00 0.440 H ATOM 1667 3HG2 VAL A 110 10.998 9.984 -1.216 1.00 0.440 H ATOM 1668 N LEU A 111 10.124 10.783 3.729 1.00 0.280 N ATOM 1669 CA LEU A 111 9.611 11.283 4.992 1.00 0.310 C ATOM 1670 C LEU A 111 8.107 11.047 5.130 1.00 0.270 C ATOM 1671 O LEU A 111 7.417 11.840 5.771 1.00 0.280 O ATOM 1672 CB LEU A 111 9.917 12.782 5.118 1.00 0.420 C ATOM 1673 CG LEU A 111 11.416 13.198 5.012 1.00 0.420 C ATOM 1674 CD1 LEU A 111 11.501 14.707 5.035 1.00 0.420 C ATOM 1675 CD2 LEU A 111 12.222 12.603 6.163 1.00 0.420 C ATOM 1676 H LEU A 111 10.873 10.105 3.747 1.00 0.340 H ATOM 1677 HA LEU A 111 10.097 10.743 5.800 1.00 0.370 H ATOM 1678 1HB LEU A 111 9.366 13.318 4.346 1.00 0.510 H ATOM 1679 2HB LEU A 111 9.550 13.124 6.085 1.00 0.510 H ATOM 1680 HG LEU A 111 11.826 12.848 4.084 1.00 0.510 H ATOM 1681 1HD1 LEU A 111 12.543 15.016 4.948 1.00 0.510 H ATOM 1682 2HD1 LEU A 111 10.932 15.114 4.198 1.00 0.510 H ATOM 1683 3HD1 LEU A 111 11.089 15.082 5.970 1.00 0.510 H ATOM 1684 1HD2 LEU A 111 13.263 12.915 6.070 1.00 0.510 H ATOM 1685 2HD2 LEU A 111 11.821 12.960 7.112 1.00 0.510 H ATOM 1686 3HD2 LEU A 111 12.179 11.522 6.138 1.00 0.510 H ATOM 1687 N SER A 112 7.583 9.948 4.552 1.00 0.270 N ATOM 1688 CA SER A 112 6.141 9.702 4.636 1.00 0.260 C ATOM 1689 C SER A 112 5.696 9.051 5.944 1.00 0.330 C ATOM 1690 O SER A 112 4.499 8.900 6.185 1.00 0.340 O ATOM 1691 CB SER A 112 5.650 8.860 3.465 1.00 0.370 C ATOM 1692 OG SER A 112 6.085 7.526 3.540 1.00 0.370 O ATOM 1693 H SER A 112 8.173 9.287 4.035 1.00 0.320 H ATOM 1694 HA SER A 112 5.642 10.669 4.568 1.00 0.310 H ATOM 1695 1HB SER A 112 4.563 8.890 3.424 1.00 0.440 H ATOM 1696 2HB SER A 112 6.021 9.308 2.544 1.00 0.440 H ATOM 1697 HG SER A 112 5.490 7.089 4.171 1.00 0.440 H ATOM 1698 N ALA A 113 6.641 8.588 6.752 1.00 0.440 N ATOM 1699 CA ALA A 113 6.314 7.950 8.020 1.00 0.580 C ATOM 1700 C ALA A 113 5.699 8.963 8.982 1.00 0.580 C ATOM 1701 O ALA A 113 6.129 10.116 9.024 1.00 0.580 O ATOM 1702 CB ALA A 113 7.558 7.334 8.631 1.00 0.760 C ATOM 1703 H ALA A 113 7.603 8.726 6.487 1.00 0.530 H ATOM 1704 HA ALA A 113 5.579 7.168 7.832 1.00 0.700 H ATOM 1705 1HB ALA A 113 7.294 6.847 9.571 1.00 0.910 H ATOM 1706 2HB ALA A 113 7.976 6.599 7.944 1.00 0.910 H ATOM 1707 3HB ALA A 113 8.290 8.116 8.821 1.00 0.910 H ATOM 1708 N GLY A 114 4.732 8.538 9.793 1.00 0.670 N ATOM 1709 CA GLY A 114 4.171 9.452 10.783 1.00 0.720 C ATOM 1710 C GLY A 114 4.519 9.029 12.191 1.00 0.690 C ATOM 1711 O GLY A 114 5.261 8.068 12.401 1.00 0.850 O ATOM 1712 H GLY A 114 4.395 7.589 9.726 1.00 0.800 H ATOM 1713 1HA GLY A 114 4.539 10.461 10.604 1.00 0.860 H ATOM 1714 2HA GLY A 114 3.092 9.494 10.688 1.00 0.860 H ATOM 1715 N ILE A 115 3.958 9.743 13.158 1.00 0.600 N ATOM 1716 CA ILE A 115 4.183 9.474 14.569 1.00 0.660 C ATOM 1717 C ILE A 115 2.857 9.317 15.286 1.00 0.420 C ATOM 1718 O ILE A 115 1.997 10.191 15.165 1.00 0.520 O ATOM 1719 CB ILE A 115 4.998 10.612 15.230 1.00 0.900 C ATOM 1720 CG1 ILE A 115 6.381 10.746 14.517 1.00 0.900 C ATOM 1721 CG2 ILE A 115 5.163 10.339 16.749 1.00 0.900 C ATOM 1722 CD1 ILE A 115 7.193 11.964 14.915 1.00 0.900 C ATOM 1723 H ILE A 115 3.355 10.513 12.901 1.00 0.720 H ATOM 1724 HA ILE A 115 4.736 8.540 14.668 1.00 0.790 H ATOM 1725 HB ILE A 115 4.470 11.555 15.096 1.00 1.080 H ATOM 1726 1HG1 ILE A 115 6.967 9.851 14.723 1.00 1.080 H ATOM 1727 2HG1 ILE A 115 6.222 10.812 13.449 1.00 1.080 H ATOM 1728 1HG2 ILE A 115 5.718 11.141 17.217 1.00 1.080 H ATOM 1729 2HG2 ILE A 115 4.187 10.274 17.230 1.00 1.080 H ATOM 1730 3HG2 ILE A 115 5.697 9.399 16.894 1.00 1.080 H ATOM 1731 1HD1 ILE A 115 8.128 11.967 14.354 1.00 1.080 H ATOM 1732 2HD1 ILE A 115 6.629 12.870 14.683 1.00 1.080 H ATOM 1733 3HD1 ILE A 115 7.420 11.944 15.973 1.00 1.080 H ATOM 1734 N ASN A 116 2.700 8.223 16.020 1.00 0.420 N ATOM 1735 CA ASN A 116 1.492 7.978 16.792 1.00 0.460 C ATOM 1736 C ASN A 116 1.735 6.900 17.825 1.00 0.790 C ATOM 1737 O ASN A 116 1.353 7.065 18.979 1.00 0.970 O ATOM 1738 OXT ASN A 116 2.589 6.050 17.591 1.00 0.690 O ATOM 1739 CB ASN A 116 0.321 7.630 15.905 1.00 0.600 C ATOM 1740 CG ASN A 116 -1.004 7.509 16.651 1.00 0.600 C ATOM 1741 OD1 ASN A 116 -1.310 6.509 17.321 1.00 0.600 O ATOM 1742 ND2 ASN A 116 -1.808 8.540 16.538 1.00 0.600 N ATOM 1743 H ASN A 116 3.450 7.545 16.056 1.00 0.500 H ATOM 1744 HA ASN A 116 1.239 8.890 17.336 1.00 0.550 H ATOM 1745 1HB ASN A 116 0.194 8.406 15.181 1.00 0.720 H ATOM 1746 2HB ASN A 116 0.535 6.717 15.367 1.00 0.720 H ATOM 1747 1HD2 ASN A 116 -2.699 8.538 17.001 1.00 0.720 H ATOM 1748 2HD2 ASN A 116 -1.519 9.335 16.008 1.00 0.720 H TER # All scores below are weighted scores, not raw scores. #BEGIN_POSE_ENERGIES_TABLE model03_0001.pdb label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 coordinate_constraint omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.5 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA pose -529.918 53.7362 402.34 -35.8222 10.418 22.69 194.093 -224.543 -0.99602 -6.18023 -178.006 -28.6193 -54.5739 -14.5639 -14.672 -7.80729 0 10.2358 -1.97328 4.05519 42.0228 88.0737 -30.3309 26.1445 -5.49113 -7.8268 56.5981 -230.916 GLN:NtermProteinFull_1 -3.39512 0.19338 4.19338 -0.72728 0.06058 0.95407 1.85048 -1.79956 -0.0246 -0.10344 -2.52559 1.46048 0 0 -0.91186 0 0 0.13399 0.00417 0.01786 0 2.50704 0 0 -0.18838 0 0.17596 1.87558 GLU_2 -3.5441 0.58155 3.38428 -0.33086 0.06756 0.44761 1.33785 -1.43252 -0 -0 -1.43887 -0.35401 0 0 0 0 0 0.06327 -0.05693 0.01281 0 2.88919 0.08975 0 -2.7348 -0.1246 0.96811 -0.1747 PRO_3 -3.52206 0.71934 3.21727 -0.06805 0 0.04259 2.21798 -1.48666 -0 -0 -2.25448 0.6045 0 0 0 0 0 0.01996 -0.06734 0.04156 0.18632 0 -0.56581 0 -2.4119 0.00086 0.9865 -2.33942 TYR_4 -6.17382 0.8724 3.47838 -1.06574 0.21338 0.53897 1.74967 -1.99297 -0.00026 -0.0042 -1.52527 -0.26975 0 0 -0.41919 0 0 0.01628 0.07051 0.00918 0 2.00632 -0.09303 0.26112 1.2797 0.30928 0.49229 -0.24673 PHE_5 -6.09542 0.70665 2.47008 -0.65747 0.06298 0.38025 1.18727 -1.81906 -0 -0 -1.56902 0.09138 0 0 0 0 0 0.04181 -0.00735 0.03938 0 2.02215 -0.14253 0 1.0402 -0.08545 0.50349 -1.83067 THR_6 -5.37925 0.56426 4.21251 -0.10813 0.07136 0.05883 2.9213 -2.27428 -0 -0 -2.07834 -1.53881 0 0 0 0 0 0.03904 -0.00711 0.07706 0.316 0 -0.56443 2.28357 -1.0874 -0.30452 1.12596 -1.67238 TRP_7 -11.6345 1.95116 5.17775 -1.57244 0.29127 0.81829 3.18122 -3.89274 -0.01104 -0.06459 -2.74935 -0.26194 0 0 0 0 0 0.03513 -0.01473 0.0214 0 1.92566 -0.28241 0 1.6906 5.94064 2.50449 3.05382 PRO_8 -8.08305 1.33446 3.97678 -0.06879 0 0.04261 2.07781 -2.14146 -2e-05 -0.00019 -1.99098 0.63466 0 0 0 0 0 0.06772 -0.14059 0.06644 0.18221 0 -0.1215 0 -2.4119 6.02084 1.92108 1.36613 LEU_9 -6.49914 0.4761 2.89245 -0.73237 0.41499 0.2099 1.61428 -2.12784 -0.00518 -0.01764 -1.04251 0.30162 0 0 0 0 0 0.09888 -0.04824 0.08994 2.63648 0 -0.27006 0 0.18072 -0.02792 0.59961 -1.25593 ILE_10 -8.61526 0.79375 3.92372 -0.48159 0.31857 0.08606 2.81795 -2.91762 -0.00051 -0.00775 -1.91685 0.18749 0 0 0 0 0 0.03768 -0.02824 0.03228 0.47643 0 -0.49011 0 0.73287 0.01684 0.77433 -4.25996 ALA_11 -6.1767 0.8542 3.9779 -0.02277 0 0 2.3894 -2.88037 -0.03756 -0.1512 -2.64797 -0.34138 0 0 0 0 0 0.03745 -0.06148 0 0 0 -0.31852 0 1.8394 -0.25429 0.94209 -2.8518 ALA_12 -5.48064 0.48335 3.71449 -0.02445 5e-05 0 2.21321 -2.49256 -0.07155 -0.4055 -0.4059 -0.37148 0 0 0 0 0 0.0396 -0.08875 0 0 0 -0.42338 0 1.8394 -0.56409 0.81204 -1.22618 ASP_13 -4.52321 0.68874 5.68805 -0.2787 0.04028 0.91533 1.92438 -2.47167 -0.08902 -0.6147 -3.93236 0.31937 0 0 0 -0.74743 0 0.00575 -0.0454 0.00076 0 3.54865 -0.36944 0 -2.3716 -0.4413 0.60878 -2.14474 GLY_14 -2.53462 0.12588 2.86202 -7e-05 0 0 1.17439 -1.50335 -0.01311 -0.08902 -1.22842 -0.31937 0 0 0 0 0 0.00277 -0.10286 0 0 0 -1.54027 0 0.83697 -0.13066 0.66837 -1.79135 GLY_15 -3.97255 0.20186 2.57558 -0.00029 0 0 1.13913 -1.7732 -0.03981 -0.17114 -0.94491 -0.21099 0 0 0 0 0 0.012 -0.07148 0 0 0 0.3473 0 0.83697 0.12781 0.5011 -1.44261 TYR_16 -7.54925 1.04083 4.39001 -0.87611 0.04227 0.50262 2.01294 -2.96828 -0.00649 -0.09667 -1.92334 -0.34645 0 0 0 -0.64092 0 0.02881 -0.01015 0.06564 0 1.53866 -0.33864 0.00884 1.2797 -0.1033 0.47446 -3.47482 ALA_17 -3.71423 0.3356 1.5602 -0.01656 0 0 1.23019 -1.45069 -0 -0 -0.50027 -0.29067 0 0 0 0 0 0.01251 0.11047 0 0 0 0.41359 0 1.8394 0.88004 0.52085 0.93042 PHE_18 -7.82082 0.83251 1.38971 -0.64353 0.04507 0.37349 1.27742 -1.97396 -0 -0 -0.83822 0.17957 0 0 0 0 0 0.00998 -0.01021 0.05485 0 2.15682 -0.13707 0 1.0402 0.96371 0.23533 -2.86515 LYS_19 -6.23306 0.42335 8.01922 -0.56251 0.18609 0.28069 2.90186 -2.99521 -0.01011 -0.03251 -5.82322 0.25118 0 0 0 0 0 0.00814 -0.06203 0.01107 2.62096 0 0.0021 0 -1.5107 -0.36058 0.27718 -2.60809 TYR_20 -6.38451 1.02883 2.56797 -0.66934 0.04836 0.08984 0.76411 -2.01213 -0 -0 -0.8224 -0.39941 0 0 -0.2955 0 0 0.03967 -0.06734 0.23595 0 2.55391 -0.01504 0.29749 1.2797 -0.2651 0.51346 -1.51147 GLU_21 -3.9928 0.29787 5.43335 -0.20118 0.01905 0.29796 1.92377 -2.2451 -0.01011 -0.03251 -2.36375 -0.60949 0 0 0 0 0 0.15773 0.10791 0.0415 0 3.40444 -0.10435 0 -2.7348 0.15688 0.5037 0.05007 ASN_22 -1.37024 0.11076 1.57047 -0.20096 0.04075 0.3402 0.42902 -0.72702 -0 -0 0.38798 -1.0382 0 0 0 0 0 0.32949 -0.07212 0.04072 0 1.8322 -1.022 0 -0.93687 -0.32862 0.22603 -0.38841 GLY_23 -2.3119 0.48231 2.0106 -6e-05 0 0 0.2841 -1.12906 -0 -0 -0.91333 -0.37462 0 0 -0.2955 0 0 0.25699 -0.14519 0 0 0 -1.49553 0 0.83697 -0.92116 0.36325 -3.35213 LYS_24 -3.93534 0.32765 4.32781 -0.46542 0.12239 0.25612 2.28097 -2.17256 -0.00077 -0.00205 -1.91947 -0.03032 0 0 0 0 0 0.02231 0.01197 0.01142 1.79419 0 0.009 0 -1.5107 -0.54376 0.45675 -0.95981 TYR_25 -5.70163 0.59216 1.41151 -0.60385 0.0261 0.27711 0.53574 -1.32081 -0 -0 -0.52801 -0.12672 0 0 0 0 0 0.03133 0.00593 0.02747 0 2.14243 -0.1173 0.00113 1.2797 -0.19685 0.29907 -1.96546 ASP_26 -5.25531 0.22034 7.99633 -0.21818 0.03243 0.7084 3.82702 -3.19899 -0.03436 -0.18664 -6.14712 -0.82573 0 0 0 -0.88178 0 0.02247 0.17279 0.06243 0 2.01036 -0.78739 0 -2.3716 -0.22209 0.48259 -4.59403 ILE_27 -4.52002 0.58297 1.85291 -0.68892 0.69383 0.16573 1.19723 -1.51393 -0 -0 -0.19616 0.118 0 0 0 0 0 0.21106 -0.01476 0.0107 0.83107 0 -0.05603 0 0.73287 -0.1675 0.93559 0.17466 LYS_28 -2.65481 0.21293 4.0278 -0.4749 0.08226 0.31986 1.67766 -1.66499 -0.01576 -0.05742 -3.20633 0.55455 0 0 0 -0.88178 0 0.01202 -0.05197 0.01527 1.98921 0 -0.02655 0 -1.5107 -0.41229 0.8671 -1.19884 ASP_29 -5.82137 0.57268 7.80701 -0.24712 0.06025 0.82591 3.68999 -3.20305 -0.0208 -0.13566 -4.46267 -0.86282 0 0 0 -0.64092 0 0.01927 -0.02363 0.00606 0 1.86496 -0.81118 0 -2.3716 -0.44967 0.45081 -3.75355 VAL_30 -4.31373 0.33122 2.12583 -0.3739 0.31913 0.09161 1.76649 -1.64693 -0 -0 -0.95079 -0.08462 0 0 0 0 0 0.00394 0.14378 0.04589 1.18352 0 -0.61182 0 1.9342 -0.30591 0.52949 0.1874 GLY_31 -4.51159 0.51595 3.47809 -6e-05 0 0 1.93558 -2.20146 -0.00547 -0.03711 -2.08153 -0.37883 0 0 0 0 0 0.05404 -0.04621 0 0 0 0.22542 0 0.83697 0.08599 0.69285 -1.43736 VAL_32 -3.40513 0.33652 2.32453 -0.35985 0.2038 0.08762 1.20129 -1.55593 -0 -0 0.21044 -0.01574 0 0 0 0 0 0.03494 -0.01505 9e-05 0.87744 0 -0.02546 0 1.9342 0.25517 0.50057 2.58946 ASP_33 -2.71307 0.2652 2.69602 -0.12354 0.02548 0.3837 0.43463 -1.3367 -0 -0 -0.66734 -0.3779 0 0 0 0 0 0.00978 -0.05397 0.00023 0 2.65056 -0.40108 0 -2.3716 -0.41633 0.25009 -1.74585 ASN_34 -5.91484 0.42813 5.97499 -0.2286 0.00903 0.33677 3.06848 -3.1074 -0.01939 -0.24091 -2.1739 -0.47539 0 0 -1.03113 0 0 0.0171 -0.04617 0.01181 0 2.71593 0.30892 0 -0.93687 -0.50663 0.16377 -1.6463 ALA_35 -2.97825 0.15132 3.19907 -0.02318 0 0 1.48542 -1.69083 -0.01838 -0.16335 -0.57766 -0.3852 0 0 0 0 0 0.01306 0.02319 0 0 0 -0.42577 0 1.8394 -0.39233 0.14481 0.20132 GLY_36 -4.88363 0.72437 4.72877 -5e-05 0 0 2.38225 -2.67856 -0.00339 -0.0175 -2.24318 -0.41342 0 0 -1.03113 0 0 0.01251 -0.0569 0 0 0 0.34602 0 0.83697 0.22608 0.18814 -1.88264 ALA_37 -6.45876 0.55249 4.52924 -0.02139 0 0 2.59851 -3.15116 -0 -0 -1.82006 -0.36964 0 0 0 0 0 0.01147 0.0123 0 0 0 -0.34395 0 1.8394 0.26693 0.23759 -2.11703 LYS_38 -5.91711 0.35711 6.73271 -0.30393 0.02908 0.1337 3.15653 -3.09905 -0 -0 -3.81071 -0.0371 0 0 0 0 0 0.01081 0.06106 0.08033 1.77251 0 0.01053 0 -1.5107 -0.40542 0.2701 -2.46957 ALA_39 -4.95775 0.18542 4.52308 -0.02141 0 0 2.88752 -2.65334 -0 -0 -2.6164 -0.35803 0 0 0 0 0 0.00287 0.01369 0 0 0 -0.23844 0 1.8394 -0.37292 0.28 -1.48631 GLY_40 -5.10149 0.39373 4.80509 -5e-05 0 0 2.22191 -2.5785 -0.00051 -0.00775 -2.69055 -0.41294 0 0 0 0 0 0.01382 -0.04436 0 0 0 0.33285 0 0.83697 0.30496 0.14783 -1.77898 LEU_41 -5.98735 0.454 4.98401 -0.48549 0.20844 0.11546 2.65747 -2.70835 -0 -0 -2.61316 0.22889 0 0 0 0 0 0.00582 -0.02744 0.13229 0.3289 0 -0.27861 0 0.18072 0.34067 0.15487 -2.30884 THR_42 -5.01631 0.21418 6.47387 -0.20162 0.11467 0.07306 3.12438 -3.00644 -0 -0 -3.37215 -0.11687 0 0 0 0 0 0.00363 0.06686 0.00015 0.06557 0 -0.00589 2.29706 -1.0874 -0.11429 0.22928 -0.25828 PHE_43 -7.82622 0.80573 4.26232 -0.90117 0.04427 0.27481 2.63042 -2.74176 -0 -0 -2.35785 -0.08483 0 0 0 0 0 0.01694 -0.01022 0.19359 0 1.79489 -0.50244 0 1.0402 0.10281 0.27959 -2.97891 LEU_44 -7.73843 0.41605 4.41862 -0.46378 0.20114 0.10453 2.64174 -2.7464 -0 -0 -1.87231 0.22334 0 0 0 0 0 0.02166 0.05888 0.03666 0.34369 0 -0.2714 0 0.18072 -0.11057 0.34984 -4.20603 VAL_45 -5.64161 0.41211 5.59558 -0.31796 0.23376 0.07328 3.03149 -2.84699 -0 -0 -2.58939 -0.22458 0 0 0 0 0 0.00267 -0.01682 0.00893 0.09665 0 -0.28592 0 1.9342 -0.23457 0.36932 -0.39984 ASP_46 -5.75418 0.32586 7.11511 -0.10194 0.00468 0.3052 3.07913 -3.35343 -0 -0 -2.96778 -0.36659 0 0 0 0 0 0.01124 0.03178 0.00884 0 1.68348 0.16887 0 -2.3716 -0.22451 0.46942 -1.93645 LEU_47 -8.38256 0.4906 5.47915 -0.47426 0.17637 0.10738 3.08383 -3.15289 -0.01546 -0.08033 -3.43425 0.2118 0 0 0 0 0 0.01166 0.12917 0.00214 0.30754 0 -0.27844 0 0.18072 -0.32728 0.54253 -5.42258 ILE_48 -7.67915 0.69771 5.721 -0.4933 0.34824 0.09592 2.66891 -3.09314 -0 -0 -1.55313 0.10677 0 0 0 0 0 0.01178 -0.06903 0.01689 0.4794 0 -0.48891 0 0.73287 -0.09821 0.43474 -2.16062 LYS_49 -4.0087 0.2164 3.92665 -0.30546 0.0245 0.13609 1.70323 -1.88751 -0 -0 -1.11038 -0.02989 0 0 0 0 0 0.00633 -0.08307 0.06612 1.75326 0 -0.06671 0 -1.5107 -0.23352 0.39215 -1.01121 ASN_50 -4.486 0.39206 4.74075 -0.19796 0.04019 0.31642 1.41557 -2.29607 -0 -0 -1.28221 -0.41322 0 0 0 0 0 0.00627 -0.06449 0.02373 0 2.02253 -0.49391 0 -0.93687 -0.63324 0.3342 -1.51224 LYS_51 -2.53317 0.24717 3.1985 -0.33752 0.07091 0.22169 1.21971 -1.52331 -0.00477 -0.02218 -1.31519 -0.39293 0 0 0 0 0 0.00375 0.0353 0.02176 1.48351 0 -0.09145 0 -1.5107 -0.37688 0.32786 -1.27793 HIS_D_52 -3.90208 0.19385 3.08265 -0.40097 0.00632 0.51247 0.98526 -1.59697 -0.00477 -0.02218 -0.75776 -0.29223 0 0 0 0 0 0.02186 -0.02974 0.03457 0 1.6969 -0.30646 0 -0.45461 0.04383 0.38335 -0.80671 MET_53 -5.65926 0.41409 3.36643 -0.33311 0.12457 0.07355 1.10856 -1.62344 -0.02155 -0.09873 0.03166 0.10578 0 0 0 0 0 0.0562 -0.00129 0.00882 1.60598 0 -0.11927 0 0.60916 0.15422 0.38409 0.18648 ASN_54 -3.56628 0.2923 3.88877 -0.27819 0.09154 0.45291 2.09535 -1.80158 -0.01149 -0.1006 -2.13911 -0.82681 0 0 -0.83351 0 0 0.05466 -0.01312 0.02279 0 2.13214 -0.04257 0 -0.93687 0.09323 0.35892 -1.06751 ALA_55 -2.77963 0.22562 2.18742 -0.02466 0.00022 0 1.13551 -1.37515 -0.00609 -0.01839 -0.28159 -0.3701 0 0 -0.91186 0 0 0.02481 -0.07005 0 0 0 -0.3375 0 1.8394 -0.25209 0.30274 -0.71141 ASP_56 -2.88974 0.27021 3.33147 -0.12148 0.0214 0.37807 1.31076 -1.64637 -0 -0 -1.17809 -0.22373 0 0 -0.83351 0 0 0.00445 -0.07691 0.00696 0 2.3771 -0.35311 0 -2.3716 -0.71177 0.26635 -2.43953 THR_57 -4.6359 0.35008 4.07392 -0.17343 0.07775 0.0641 2.50389 -2.22344 -0.01149 -0.1006 -3.16243 0.21461 0 0 0 0 0 0.01135 0.06548 0.06911 0.03756 0 0.07011 2.26955 -1.0874 -0.56899 0.32445 -1.83173 ASP_58 -4.67552 0.36409 5.56461 -0.10709 0.01121 0.31564 2.8962 -2.52943 -0.0246 -0.10344 -2.54702 -1.17994 0 0 -0.63365 0 0 0.03836 -0.02243 0.00341 0 2.20296 -0.05562 0 -2.3716 -0.00161 0.35277 -2.50269 TYR_59 -5.51834 0.53816 5.047 -1.11094 0.17014 0.46816 2.78601 -2.59839 -0 -0 -3.31079 -0.25953 0 0 -0.63365 -0.72976 0 0.02543 0.02927 0.01631 0 1.71645 -0.41147 0.01794 1.2797 0.25245 0.50251 -1.72334 SER_60 -3.26155 0.12403 3.62554 -0.02721 0 0.04143 1.38936 -1.83026 -0 -0 -1.08666 -1.08231 0 0 0 0 0 0.01059 0.03871 0.00205 0.30416 0 0.1186 0.60447 -0.77834 -0.15943 0.45317 -1.51365 ILE_61 -5.45198 0.32256 4.02899 -0.48979 0.34169 0.0976 2.58637 -2.44287 -0 -0 -0.74442 0.01549 0 0 0 0 0 0.00426 -0.05127 0.00522 0.51479 0 -0.50365 0 0.73287 -0.19548 0.24541 -0.9842 ALA_62 -4.38988 0.16268 3.87749 -0.02211 0 0 2.42225 -2.42975 -0 -0 -1.95925 -0.35492 0 0 0 0 0 0.00934 -0.04143 0 0 0 -0.21955 0 1.8394 -0.12346 0.25934 -0.96985 GLU_63 -6.48956 0.29777 7.91079 -0.33764 0.08011 0.37608 3.55517 -3.58514 -0.02666 -0.16756 -4.58549 -0.63534 0 0 0 -0.90375 0 0.0073 0.02314 0.05708 0 3.67215 -0.10668 0 -2.7348 -0.30459 0.30436 -3.59327 ALA_64 -4.69994 0.27354 4.9693 -0.02215 0 0 2.73356 -2.6756 -0 -0 -2.38965 -0.35593 0 0 0 0 0 0.00277 -0.02723 0 0 0 -0.20771 0 1.8394 -0.28641 0.30022 -0.54583 ALA_65 -5.91915 0.41805 5.1566 -0.02151 0 0 3.20037 -3.14419 -0.0204 -0.1296 -3.4263 -0.36883 0 0 0 0 0 0.00172 0.00951 0 0 0 -0.27336 0 1.8394 -0.41565 0.31619 -2.77713 PHE_66 -9.40273 1.34235 3.53476 -0.9762 0.07592 0.32898 2.38068 -3.00355 -0 -0 -1.89265 0.00968 0 0 0 0 0 0.00352 -0.01316 0.22916 0 2.05052 -0.18285 0 1.0402 -0.19322 0.62921 -4.03938 ASN_67 -6.59161 0.57313 5.76622 -0.19485 0.11916 0.30223 2.66784 -2.92537 -0.00581 -0.02375 -1.41259 -0.28514 0 0 0 0 0 0.00432 0.01514 2e-05 0 1.47574 0.10795 0 -0.93687 -0.00689 0.65621 -0.69492 LYS_68 -3.63266 0.20964 3.99 -0.32727 0.04399 0.18032 1.24609 -1.76069 -0 -0 -1.43529 -0.15368 0 0 0 0 0 0.02362 -0.06949 0.02374 1.76426 0 -0.09154 0 -1.5107 -0.3386 0.37342 -1.46486 GLY_69 -1.96098 0.09477 2.63887 -5e-05 0 0 1.02619 -1.30796 -0 -0 -0.90754 -0.37446 0 0 0 0 0 0.01346 -0.17397 0 0 0 -1.34773 0 0.83697 -0.69913 0.37447 -1.78708 GLU_70 -3.32668 0.19749 3.45708 -0.21292 0.03185 0.30629 1.18978 -1.59157 -0 -0 -1.50764 -0.60702 0 0 0 0 0 0.01279 0.0987 0.02145 0 3.08186 -0.27281 0 -2.7348 -0.55117 0.34044 -2.06687 THR_71 -4.76771 0.59895 3.29699 -0.22624 0.23513 0.10696 1.93029 -2.15668 -0.0204 -0.1296 -1.00574 -1.42837 0 0 -1.16094 0 0 0.00766 -0.00392 0.35515 1.51275 0 -0.20487 2.77645 -1.0874 -0.09005 0.47036 -0.99124 ALA_72 -1.21511 0.05007 0.79354 -0.02632 0.00247 0 0.12712 -0.49126 -0 -0 0.09176 -0.42665 0 0 0 0 0 0.00507 -0.05787 0 0 0 0.00694 0 1.8394 -0.25196 0.41325 0.86047 MET_73 -3.99042 0.36235 2.02832 -0.27451 0.0576 0.05779 1.17862 -1.30191 -0 -0 -1.50511 -0.02505 0 0 -1.16094 0 0 0.00204 0.04091 0.06665 2.22692 0 -0.13368 0 0.60916 -0.15325 0.30348 -1.61105 THR_74 -3.54135 0.3552 1.32753 -0.22895 0.1922 0.09138 0.21061 -0.95602 -0.00538 -0.01784 -0.00984 -1.28609 0 0 0 0 0 0.00204 -0.00802 0.01489 0.53667 0 0.02921 2.28638 -1.0874 0.15133 0.3844 -1.55904 ILE_75 -3.37771 0.25782 0.09579 -0.46322 0.30289 0.09809 0.29476 -0.68808 -0 -0 0.10709 -0.02733 0 0 0 0 0 0.01173 -0.04381 0.01759 0.40703 0 -0.7687 0 0.73287 -0.26546 0.28118 -3.02748 ASN_76 -3.69525 0.51648 2.2768 -0.16513 0.01161 0.22204 1.19356 -1.42452 -0.00538 -0.01784 -0.78045 -0.88128 0 0 -0.99588 -0.72976 0 0.04961 0.04605 0.01861 0 1.8557 -0.20434 0 -0.93687 -0.27238 0.32925 -3.58934 GLY_77 -2.58849 0.4396 2.93734 -0.00069 0 0 1.71441 -1.49115 -0 -0 -1.08008 -0.23607 0 0 -0.99588 0 0 0.07666 -0.13993 0 0 0 -0.22725 0 0.83697 0.22973 0.71057 0.18576 PRO_78 -4.75983 0.98515 2.4365 -0.06947 0 0.04284 1.13291 -1.32258 -0.03078 -0.16462 -0.61709 0.62568 0 0 0 0 0 0.02128 -0.17192 0.00151 0.21441 0 -0.42949 0 -2.4119 0.27646 0.79695 -3.444 TRP_79 -3.19587 0.35876 2.34025 -1.3385 0.08328 0.5878 1.07338 -1.39567 -0.00158 -0.01724 0.32602 -0.24143 0 0 0 0 0 0.02972 0.0879 0.00404 0 1.9199 -0.15895 0 1.6906 0.02135 0.40742 2.5812 ALA_80 -5.1888 0.49416 3.46296 -0.02827 0.00861 0 1.98258 -2.40126 -0.02085 -0.14381 -2.40635 -0.42428 0 0 0 0 0 0.03835 0.05039 0 0 0 0.03622 0 1.8394 -0.34254 0.47459 -2.56891 TRP_81 -10.4567 1.20951 5.02144 -0.73008 0.3008 0.44897 2.87717 -3.48408 -0 -0 -2.25619 -0.50957 0 0 0 0 0 0.05294 0.00162 0.19923 0 2.8137 0.01062 0 1.6906 -0.53726 0.72259 -2.62469 SER_82 -2.98483 0.16584 4.21713 -0.02698 0 0.04169 1.74854 -1.95788 -0.03078 -0.16462 -1.85605 -1.09508 0 0 0 0 0 0.09887 -0.01168 0 0.29491 0 0.10726 0.6016 -0.77834 -0.46054 0.50065 -1.59028 ASN_83 -5.16791 0.18391 6.36753 -0.17243 0.02594 0.25497 2.97305 -2.93201 -0.00158 -0.01724 -2.97486 -0.28385 0 0 0 -0.90375 0 0.01998 -0.00429 0.0016 0 1.57834 0.23508 0 -0.93687 -0.1309 0.2087 -1.67657 ILE_84 -8.84612 0.89003 4.10631 -0.49892 0.3976 0.09885 2.77311 -2.99933 -0 -0 -1.50621 0.0209 0 0 0 0 0 0.02754 0.01139 0.04629 0.57221 0 -0.45609 0 0.73287 0.11188 0.41082 -4.10688 ASP_85 -3.44296 0.15906 4.70255 -0.10326 0.00603 0.31062 1.6592 -2.18649 -0 -0 -1.69772 -0.31712 0 0 0 0 0 0.14483 -0.00503 0.01933 0 1.70616 0.22782 0 -2.3716 -0.12615 0.50796 -0.80677 THR_86 -3.16033 0.1874 4.22396 -0.20894 0.15622 0.07688 1.83278 -1.87322 -0 -0 -1.76282 -0.1524 0 0 0 0 0 0.02732 -0.03707 0.00058 0.27358 0 0.15295 2.28017 -1.0874 -0.1757 0.41872 1.17266 SER_87 -4.34354 0.32378 4.48449 -0.03567 0.00699 0.02707 1.96752 -2.12027 -0 -0 -1.6684 0.04729 0 0 0 0 0 0.20885 -0.05851 0.01164 1.06208 0 -0.33718 1.76673 -0.77834 -0.25286 0.49946 0.81114 LYS_88 -2.16915 0.1919 2.7841 -0.33797 0.06779 0.21902 1.02024 -1.29427 -0.00039 -0.00105 -1.18971 -0.38215 0 0 0 0 0 0.48037 -0.10129 0.00966 1.5056 0 -0.10899 0 -1.5107 -0.30488 0.40815 -0.71373 VAL_89 -5.32052 0.89075 1.70863 -0.28665 0.20707 0.05899 1.5128 -1.74152 -0.01332 -0.17649 -0.92403 0.09025 0 0 0 0 0 0.35893 -0.04348 0.07164 0.1396 0 -0.46334 0 1.9342 -0.3281 0.3788 -1.94582 ASN_90 -1.05419 0.09275 0.88711 -0.32046 0.05596 0.62242 0.04774 -0.51118 -0.00598 -0.09749 0.32393 -0.7939 0 0 0 0 0 0.10971 0.0201 0.00407 0 1.85787 -0.53639 0 -0.93687 -0.17566 0.53528 0.12483 TYR_91 -6.72849 1.31005 1.30881 -0.78604 0.02622 0.14946 1.24963 -1.69209 -0.01562 -0.14124 -1.11168 -0.35032 0 0 0 0 0 0.18342 0.19796 0.27552 0 2.96339 -0.22755 0.01407 1.2797 -0.04828 0.85732 -1.28575 GLY_92 -1.89461 0.21133 1.22256 -0.00117 0 0 0.36264 -0.85528 -0.00751 -0.04952 0.03287 -0.30209 0 0 0 0 0 0.04064 -0.10372 0 0 0 0.26008 0 0.83697 0.35165 0.64445 0.74929 VAL_93 -4.06881 0.62058 0.27742 -0.27087 0.15469 0.0561 0.14835 -0.93448 -0.01571 -0.19232 -0.03775 -0.28961 0 0 0 0 0 0.00922 -0.07632 0.02109 0.26624 0 -0.78284 0 1.9342 0.23356 0.17058 -2.77669 THR_94 -1.80706 0.1324 1.16852 -0.1854 0.09294 0.06587 0.36753 -0.74888 -0.00586 -0.04909 -0.86812 -1.00397 0 0 0 0 0 0.00875 -0.04045 0.0015 0.69381 0 -0.66788 2.29988 -1.0874 -0.06409 0.31986 -1.37713 VAL_95 -2.00782 0.17166 1.08775 -0.27526 0.15621 0.05475 0.56107 -0.7013 -0 -0 -0.8218 0.04064 0 0 0 0 0 0.01678 -0.08228 0.00098 0.09241 0 -0.43635 0 1.9342 -0.12414 0.28681 -0.04571 LEU_96 -4.41891 0.79471 0.98236 -0.46084 0.26351 0.07746 0.56448 -0.95208 -0 -0 -0.15233 0.39315 0 0 0 0 0 0.00875 0.16202 0.02006 0.47961 0 0.05327 0 0.18072 -0.4889 0.70458 -1.78836 PRO_97 -2.79086 0.40897 2.10672 -0.17224 0.00018 0.11888 0.99713 -0.9309 -0.01277 -0.09059 -1.40103 0.18156 0 0 -0.40555 0 0 0.02133 0.01943 0.00585 0.90519 0 -1.13679 0 -2.4119 -0.50914 0.76525 -4.33128 THR_98 -3.75372 0.509 1.99106 -0.11284 0.05041 0.0746 0.44485 -1.2348 -0.01596 -0.09644 -0.80651 -0.61794 0 0 0 0 0 0.00864 0.00453 0.00941 0.04437 0 -0.38235 2.45015 -1.0874 -0.57215 0.32902 -2.76408 PHE_99 -8.09483 0.82892 3.37868 -0.80301 0.07819 0.09884 2.25646 -2.4553 -0 -0 -1.48602 -0.50876 0 0 0 0 0 0.00804 0.0235 0.05656 0 2.44394 -0.26424 0 1.0402 -0.02918 0.37082 -3.0572 LYS_100 -3.6209 0.25317 4.12402 -0.491 0.19403 0.26516 1.551 -1.62461 -0.02126 -0.11606 -2.44932 -0.2799 0 0 0 -0.74743 0 0.02312 -0.08181 0.31024 2.5509 0 -0.10693 0 -1.5107 0.09641 0.30515 -1.37671 GLY_101 -2.20302 0.25454 1.97286 -6e-05 0 0 0.1651 -1.02535 -0.01596 -0.09644 0.14142 -0.39225 0 0 0 0 0 0.00655 -0.14398 0 0 0 -1.45752 0 0.83697 -0.59768 0.27954 -2.27527 GLN_102 -5.35733 0.82622 5.82389 -0.65861 0.14265 0.68624 3.05625 -2.72716 -0.03402 -0.20665 -3.19274 -0.66788 0 0 0 0 0 0.0107 0.00746 0.02579 0 2.48569 0.11206 0 -0.18838 -0.49104 0.90881 0.56195 PRO_103 -3.56708 0.55296 2.14593 -0.1277 0.00072 0.09473 0.95051 -1.08401 -0.0211 -0.12438 -0.99312 0.23733 0 0 0 0 0 0.01343 0.05103 0.02288 0.1867 0 -1.13817 0 -2.4119 -0.41629 1.01818 -4.60936 SER_104 -4.81501 0.71694 3.29603 -0.03186 0 0.02061 1.23203 -1.61976 -0 -0 -1.56351 -0.1467 0 0 -0.40555 0 0 0.02928 0.04619 0.15983 0.49363 0 -0.101 1.87262 -0.77834 -0.65897 0.56231 -1.69122 LYS_105 -5.44327 0.75991 4.56213 -0.34169 0.06319 0.21715 1.77477 -2.21908 -0.05702 -0.20669 -1.31027 -0.34624 0 0 0 0 0 0.00753 -0.00562 0.02979 1.9282 0 0.11839 0 -1.5107 -0.22719 1.03901 -1.1677 PRO_106 -3.95876 0.51948 1.38347 -0.19879 0.00481 0.14308 0.11707 -0.71689 -0 -0 -0.13886 0.02676 0 0 0 0 0 0.02088 0.04584 0.00257 0.43223 0 -0.94546 0 -2.4119 -0.14827 0.91717 -4.90556 PHE_107 -5.36205 0.6937 1.28922 -0.46646 0.02307 0.17256 0.64231 -1.37362 -0.00026 -0.0042 -1.26617 0.08048 0 0 -0.41919 0 0 0.0174 -0.01678 0.00226 0 2.55242 -0.07389 0 1.0402 -0.44071 0.64996 -2.25977 VAL_108 -2.30235 0.17533 1.10935 -0.25378 0.13522 0.05015 0.50105 -0.87386 -0 -0 -0.22161 -0.28573 0 0 0 0 0 0.01899 -0.07185 0.01938 0.30958 0 -0.79282 0 1.9342 -0.45202 0.5995 -0.40126 GLY_109 -2.12016 0.08139 2.33854 -0.00039 0 0 1.22794 -1.2175 -0 -0 -1.3874 -0.19656 0 0 -0.64877 0 0 0.01727 -0.10281 0 0 0 -0.77408 0 0.83697 -0.15895 0.27563 -1.82887 VAL_110 -1.86544 0.32864 1.25814 -0.28683 0.16553 0.06357 0.27858 -0.77443 -0 -0 0.49587 0.0093 0 0 0 0 0 0.00767 -0.08819 0.00912 0.01819 0 -0.28226 0 1.9342 -0.0178 0.30108 1.55494 LEU_111 -1.90314 0.2282 1.4355 -0.52039 0.2155 0.16194 0.6151 -0.86312 -0 -0 0.57212 -0.0857 0 0 0 0 0 0.01314 -0.03879 0.03664 0.29917 0 0.53229 0 0.18072 0.10385 0.2929 1.27594 SER_112 -2.89998 0.23229 3.53667 -0.03891 0.00223 0.05768 1.47609 -1.67522 -0 -0 -1.0198 -0.84915 0 0 -0.64877 0 0 0.01017 -0.01965 0.05858 0.31151 0 -0.28467 1.75528 -0.77834 -0.18071 0.36245 -0.59225 ALA_113 -1.38817 0.11766 1.33681 -0.02451 0 0 0.40767 -0.76626 -0 -0 0.25088 -0.22269 0 0 0 0 0 0.00725 -0.02592 0 0 0 -0.07107 0 1.8394 -0.76898 0.29766 0.98974 GLY_114 -1.86377 0.32213 1.00659 -0.00055 0 0 0.18972 -0.63013 -0 -0 0.26881 -0.21431 0 0 0 0 0 0.01522 -0.17923 0 0 0 -0.4179 0 0.83697 -0.15367 0.10214 -0.718 ILE_115 -1.6325 0.27932 0.99187 -0.46272 0.32519 0.0996 0.09229 -0.61637 -0.01753 -0.09855 -0.28557 -0.05373 0 0 0 0 0 0.0391 -0.04335 0.00121 0.31365 0 -0.65636 0 0.73287 0.09475 0.14998 -0.74684 ASN:CtermProteinFull_116 -2.92624 0.50756 1.06527 -0.38206 0.01598 0.90765 0.17113 -0.77137 -0.02776 -0.25344 -0.77285 0.01224 0 0 0 0 0 0.35109 0 0.00156 0 2.22063 0 0 -0.93687 -0.16033 0.31836 -0.65945 VRT_117 0 0 0 0 0 0 0 -0 -0 -0 0 0 0 0 0 0 0 5.11791 0 0 0 0 0 0 0 0 0 5.11791 #END_POSE_ENERGIES_TABLE model03_0001.pdb ENDMDL REMARK ID 96494 DOMAINID 91535 MODEL 2 2021-07-17_00000178_2_11 MODEL 2 REMARK Rerank model01.pdb to model02.pdb score: 229.806 tmscore: 0.94885 6wbjA_201 prob: 99.85 ident: 25.69 ATOM 1 N GLN A 1 -9.142 1.411 -4.159 1.00 0.650 N ATOM 2 CA GLN A 1 -8.975 1.717 -5.581 1.00 0.260 C ATOM 3 C GLN A 1 -7.510 1.976 -5.960 1.00 0.270 C ATOM 4 O GLN A 1 -6.934 1.236 -6.755 1.00 0.370 O ATOM 5 CB GLN A 1 -9.863 2.902 -5.989 1.00 0.520 C ATOM 6 CG GLN A 1 -11.361 2.592 -5.952 1.00 0.520 C ATOM 7 CD GLN A 1 -11.752 1.543 -6.955 1.00 0.520 C ATOM 8 OE1 GLN A 1 -11.518 1.703 -8.155 1.00 0.520 O ATOM 9 NE2 GLN A 1 -12.320 0.452 -6.475 1.00 0.520 N ATOM 10 1H GLN A 1 -10.093 1.101 -3.953 1.00 0.780 H ATOM 11 2H GLN A 1 -8.489 0.687 -3.894 1.00 0.780 H ATOM 12 3H GLN A 1 -8.965 2.238 -3.611 1.00 0.780 H ATOM 13 HA GLN A 1 -9.302 0.847 -6.149 1.00 0.310 H ATOM 14 1HB GLN A 1 -9.693 3.746 -5.316 1.00 0.620 H ATOM 15 2HB GLN A 1 -9.604 3.227 -6.996 1.00 0.620 H ATOM 16 1HG GLN A 1 -11.634 2.220 -4.978 1.00 0.620 H ATOM 17 2HG GLN A 1 -11.921 3.505 -6.169 1.00 0.620 H ATOM 18 1HE2 GLN A 1 -12.596 -0.294 -7.092 1.00 0.620 H ATOM 19 2HE2 GLN A 1 -12.478 0.348 -5.483 1.00 0.620 H ATOM 20 N GLU A 2 -6.920 3.049 -5.434 1.00 0.210 N ATOM 21 CA GLU A 2 -5.537 3.391 -5.760 1.00 0.200 C ATOM 22 C GLU A 2 -4.515 2.284 -5.376 1.00 0.180 C ATOM 23 O GLU A 2 -4.458 1.914 -4.196 1.00 0.160 O ATOM 24 CB GLU A 2 -5.169 4.691 -5.038 1.00 0.280 C ATOM 25 CG GLU A 2 -3.784 5.224 -5.344 1.00 0.280 C ATOM 26 CD GLU A 2 -3.475 6.490 -4.624 1.00 0.280 C ATOM 27 OE1 GLU A 2 -4.312 6.962 -3.898 1.00 0.280 O ATOM 28 OE2 GLU A 2 -2.391 6.987 -4.795 1.00 0.280 O ATOM 29 H GLU A 2 -7.424 3.652 -4.800 1.00 0.250 H ATOM 30 HA GLU A 2 -5.514 3.608 -6.818 1.00 0.240 H ATOM 31 1HB GLU A 2 -5.885 5.466 -5.310 1.00 0.340 H ATOM 32 2HB GLU A 2 -5.244 4.547 -3.969 1.00 0.340 H ATOM 33 1HG GLU A 2 -3.053 4.491 -5.060 1.00 0.340 H ATOM 34 2HG GLU A 2 -3.697 5.394 -6.414 1.00 0.340 H ATOM 35 N PRO A 3 -3.628 1.827 -6.315 1.00 0.210 N ATOM 36 CA PRO A 3 -2.589 0.797 -6.146 1.00 0.200 C ATOM 37 C PRO A 3 -1.699 0.998 -4.930 1.00 0.180 C ATOM 38 O PRO A 3 -1.243 0.033 -4.312 1.00 0.160 O ATOM 39 CB PRO A 3 -1.776 0.938 -7.438 1.00 0.300 C ATOM 40 CG PRO A 3 -2.775 1.404 -8.459 1.00 0.300 C ATOM 41 CD PRO A 3 -3.699 2.342 -7.714 1.00 0.300 C ATOM 42 HA PRO A 3 -3.076 -0.190 -6.101 1.00 0.240 H ATOM 43 1HB PRO A 3 -0.949 1.651 -7.292 1.00 0.360 H ATOM 44 2HB PRO A 3 -1.321 -0.028 -7.701 1.00 0.360 H ATOM 45 1HG PRO A 3 -2.258 1.895 -9.300 1.00 0.360 H ATOM 46 2HG PRO A 3 -3.311 0.539 -8.881 1.00 0.360 H ATOM 47 1HD PRO A 3 -3.353 3.383 -7.787 1.00 0.360 H ATOM 48 2HD PRO A 3 -4.706 2.184 -8.142 1.00 0.360 H ATOM 49 N TYR A 4 -1.450 2.252 -4.564 1.00 0.210 N ATOM 50 CA TYR A 4 -0.640 2.572 -3.400 1.00 0.260 C ATOM 51 C TYR A 4 -1.005 1.723 -2.186 1.00 0.180 C ATOM 52 O TYR A 4 -0.138 1.346 -1.397 1.00 0.290 O ATOM 53 CB TYR A 4 -0.755 4.049 -3.012 1.00 0.340 C ATOM 54 CG TYR A 4 0.125 4.374 -1.816 1.00 0.340 C ATOM 55 CD1 TYR A 4 1.470 4.621 -2.008 1.00 0.340 C ATOM 56 CD2 TYR A 4 -0.395 4.386 -0.530 1.00 0.340 C ATOM 57 CE1 TYR A 4 2.284 4.862 -0.926 1.00 0.340 C ATOM 58 CE2 TYR A 4 0.427 4.625 0.553 1.00 0.340 C ATOM 59 CZ TYR A 4 1.779 4.848 0.347 1.00 0.340 C ATOM 60 OH TYR A 4 2.644 5.060 1.409 1.00 0.340 O ATOM 61 H TYR A 4 -1.792 3.031 -5.111 1.00 0.250 H ATOM 62 HA TYR A 4 0.400 2.360 -3.644 1.00 0.310 H ATOM 63 1HB TYR A 4 -0.464 4.685 -3.849 1.00 0.410 H ATOM 64 2HB TYR A 4 -1.788 4.286 -2.758 1.00 0.410 H ATOM 65 HD1 TYR A 4 1.889 4.617 -3.014 1.00 0.410 H ATOM 66 HD2 TYR A 4 -1.440 4.189 -0.380 1.00 0.410 H ATOM 67 HE1 TYR A 4 3.337 5.055 -1.068 1.00 0.410 H ATOM 68 HE2 TYR A 4 0.017 4.617 1.563 1.00 0.410 H ATOM 69 HH TYR A 4 3.580 4.883 1.112 1.00 0.410 H ATOM 70 N PHE A 5 -2.304 1.468 -1.996 1.00 0.130 N ATOM 71 CA PHE A 5 -2.779 0.800 -0.803 1.00 0.110 C ATOM 72 C PHE A 5 -2.953 -0.713 -0.962 1.00 0.120 C ATOM 73 O PHE A 5 -3.522 -1.357 -0.077 1.00 0.130 O ATOM 74 CB PHE A 5 -4.121 1.418 -0.418 1.00 0.160 C ATOM 75 CG PHE A 5 -4.033 2.895 -0.096 1.00 0.160 C ATOM 76 CD1 PHE A 5 -4.296 3.821 -1.098 1.00 0.160 C ATOM 77 CD2 PHE A 5 -3.706 3.370 1.174 1.00 0.160 C ATOM 78 CE1 PHE A 5 -4.232 5.174 -0.859 1.00 0.160 C ATOM 79 CE2 PHE A 5 -3.644 4.743 1.414 1.00 0.160 C ATOM 80 CZ PHE A 5 -3.908 5.637 0.389 1.00 0.160 C ATOM 81 H PHE A 5 -3.000 1.750 -2.697 1.00 0.160 H ATOM 82 HA PHE A 5 -2.059 0.981 -0.005 1.00 0.130 H ATOM 83 1HB PHE A 5 -4.823 1.289 -1.244 1.00 0.190 H ATOM 84 2HB PHE A 5 -4.530 0.902 0.449 1.00 0.190 H ATOM 85 HD1 PHE A 5 -4.552 3.462 -2.093 1.00 0.190 H ATOM 86 HD2 PHE A 5 -3.502 2.662 1.981 1.00 0.190 H ATOM 87 HE1 PHE A 5 -4.439 5.881 -1.672 1.00 0.190 H ATOM 88 HE2 PHE A 5 -3.390 5.116 2.397 1.00 0.190 H ATOM 89 HZ PHE A 5 -3.864 6.705 0.562 1.00 0.190 H ATOM 90 N THR A 6 -2.487 -1.294 -2.079 1.00 0.140 N ATOM 91 CA THR A 6 -2.574 -2.735 -2.271 1.00 0.170 C ATOM 92 C THR A 6 -1.142 -3.185 -2.383 1.00 0.180 C ATOM 93 O THR A 6 -0.755 -4.299 -1.984 1.00 0.170 O ATOM 94 CB THR A 6 -3.322 -3.106 -3.565 1.00 0.230 C ATOM 95 OG1 THR A 6 -2.590 -2.630 -4.698 1.00 0.230 O ATOM 96 CG2 THR A 6 -4.691 -2.457 -3.560 1.00 0.230 C ATOM 97 H THR A 6 -2.020 -0.748 -2.808 1.00 0.170 H ATOM 98 HA THR A 6 -3.039 -3.212 -1.408 1.00 0.200 H ATOM 99 HB THR A 6 -3.417 -4.161 -3.635 1.00 0.270 H ATOM 100 HG1 THR A 6 -2.984 -2.981 -5.502 1.00 0.270 H ATOM 101 1HG2 THR A 6 -5.220 -2.716 -4.475 1.00 0.270 H ATOM 102 2HG2 THR A 6 -5.253 -2.814 -2.698 1.00 0.270 H ATOM 103 3HG2 THR A 6 -4.585 -1.371 -3.501 1.00 0.270 H ATOM 104 N TRP A 7 -0.329 -2.211 -2.771 1.00 0.200 N ATOM 105 CA TRP A 7 1.082 -2.406 -2.990 1.00 0.220 C ATOM 106 C TRP A 7 1.832 -3.076 -1.848 1.00 0.200 C ATOM 107 O TRP A 7 2.612 -3.991 -2.112 1.00 0.240 O ATOM 108 CB TRP A 7 1.793 -1.102 -3.333 1.00 0.300 C ATOM 109 CG TRP A 7 3.197 -1.342 -3.521 1.00 0.300 C ATOM 110 CD1 TRP A 7 4.220 -1.056 -2.678 1.00 0.300 C ATOM 111 CD2 TRP A 7 3.769 -1.970 -4.656 1.00 0.300 C ATOM 112 NE1 TRP A 7 5.390 -1.457 -3.221 1.00 0.300 N ATOM 113 CE2 TRP A 7 5.130 -2.030 -4.440 1.00 0.300 C ATOM 114 CE3 TRP A 7 3.236 -2.485 -5.829 1.00 0.300 C ATOM 115 CZ2 TRP A 7 5.972 -2.591 -5.353 1.00 0.300 C ATOM 116 CZ3 TRP A 7 4.075 -3.043 -6.738 1.00 0.300 C ATOM 117 CH2 TRP A 7 5.391 -3.101 -6.511 1.00 0.300 C ATOM 118 H TRP A 7 -0.767 -1.334 -3.089 1.00 0.240 H ATOM 119 HA TRP A 7 1.176 -3.050 -3.860 1.00 0.260 H ATOM 120 1HB TRP A 7 1.382 -0.701 -4.259 1.00 0.360 H ATOM 121 2HB TRP A 7 1.664 -0.346 -2.582 1.00 0.360 H ATOM 122 HD1 TRP A 7 4.116 -0.586 -1.719 1.00 0.360 H ATOM 123 HE1 TRP A 7 6.298 -1.355 -2.776 1.00 0.360 H ATOM 124 HE3 TRP A 7 2.165 -2.445 -6.021 1.00 0.360 H ATOM 125 HZ2 TRP A 7 7.039 -2.645 -5.184 1.00 0.360 H ATOM 126 HZ3 TRP A 7 3.653 -3.449 -7.656 1.00 0.360 H ATOM 127 HH2 TRP A 7 5.983 -3.558 -7.258 1.00 0.360 H ATOM 128 N PRO A 8 1.678 -2.678 -0.560 1.00 0.160 N ATOM 129 CA PRO A 8 2.430 -3.262 0.523 1.00 0.170 C ATOM 130 C PRO A 8 2.362 -4.790 0.516 1.00 0.170 C ATOM 131 O PRO A 8 3.351 -5.458 0.849 1.00 0.240 O ATOM 132 CB PRO A 8 1.705 -2.700 1.754 1.00 0.260 C ATOM 133 CG PRO A 8 1.133 -1.386 1.301 1.00 0.260 C ATOM 134 CD PRO A 8 0.698 -1.643 -0.111 1.00 0.260 C ATOM 135 HA PRO A 8 3.464 -2.916 0.455 1.00 0.200 H ATOM 136 1HB PRO A 8 0.942 -3.410 2.108 1.00 0.310 H ATOM 137 2HB PRO A 8 2.419 -2.565 2.560 1.00 0.310 H ATOM 138 1HG PRO A 8 0.281 -1.115 1.946 1.00 0.310 H ATOM 139 2HG PRO A 8 1.839 -0.582 1.390 1.00 0.310 H ATOM 140 1HD PRO A 8 -0.320 -2.032 -0.079 1.00 0.310 H ATOM 141 2HD PRO A 8 0.771 -0.735 -0.668 1.00 0.310 H ATOM 142 N LEU A 9 1.201 -5.349 0.128 1.00 0.140 N ATOM 143 CA LEU A 9 1.037 -6.786 0.089 1.00 0.160 C ATOM 144 C LEU A 9 1.801 -7.412 -1.043 1.00 0.160 C ATOM 145 O LEU A 9 2.448 -8.444 -0.894 1.00 0.190 O ATOM 146 CB LEU A 9 -0.407 -7.166 -0.097 1.00 0.220 C ATOM 147 CG LEU A 9 -0.671 -8.658 -0.162 1.00 0.220 C ATOM 148 CD1 LEU A 9 -0.327 -9.359 1.117 1.00 0.220 C ATOM 149 CD2 LEU A 9 -1.994 -8.833 -0.523 1.00 0.220 C ATOM 150 H LEU A 9 0.404 -4.790 -0.185 1.00 0.170 H ATOM 151 HA LEU A 9 1.411 -7.180 1.029 1.00 0.190 H ATOM 152 1HB LEU A 9 -0.978 -6.756 0.731 1.00 0.260 H ATOM 153 2HB LEU A 9 -0.771 -6.711 -1.018 1.00 0.260 H ATOM 154 HG LEU A 9 -0.060 -9.097 -0.932 1.00 0.260 H ATOM 155 1HD1 LEU A 9 -0.547 -10.409 0.988 1.00 0.260 H ATOM 156 2HD1 LEU A 9 0.724 -9.240 1.347 1.00 0.260 H ATOM 157 3HD1 LEU A 9 -0.926 -8.962 1.933 1.00 0.260 H ATOM 158 1HD2 LEU A 9 -2.178 -9.872 -0.633 1.00 0.260 H ATOM 159 2HD2 LEU A 9 -2.655 -8.401 0.224 1.00 0.260 H ATOM 160 3HD2 LEU A 9 -2.107 -8.333 -1.466 1.00 0.260 H ATOM 161 N ILE A 10 1.686 -6.799 -2.205 1.00 0.140 N ATOM 162 CA ILE A 10 2.312 -7.322 -3.410 1.00 0.130 C ATOM 163 C ILE A 10 3.819 -7.360 -3.236 1.00 0.110 C ATOM 164 O ILE A 10 4.487 -8.373 -3.514 1.00 0.160 O ATOM 165 CB ILE A 10 1.889 -6.431 -4.604 1.00 0.190 C ATOM 166 CG1 ILE A 10 0.556 -6.957 -5.190 1.00 0.190 C ATOM 167 CG2 ILE A 10 2.984 -6.276 -5.687 1.00 0.190 C ATOM 168 CD1 ILE A 10 -0.619 -7.079 -4.185 1.00 0.190 C ATOM 169 H ILE A 10 1.106 -5.951 -2.236 1.00 0.170 H ATOM 170 HA ILE A 10 1.970 -8.334 -3.582 1.00 0.160 H ATOM 171 HB ILE A 10 1.673 -5.436 -4.216 1.00 0.220 H ATOM 172 1HG1 ILE A 10 0.246 -6.287 -5.991 1.00 0.220 H ATOM 173 2HG1 ILE A 10 0.742 -7.945 -5.612 1.00 0.220 H ATOM 174 1HG2 ILE A 10 2.608 -5.622 -6.467 1.00 0.220 H ATOM 175 2HG2 ILE A 10 3.890 -5.840 -5.278 1.00 0.220 H ATOM 176 3HG2 ILE A 10 3.216 -7.216 -6.107 1.00 0.220 H ATOM 177 1HD1 ILE A 10 -1.485 -7.450 -4.694 1.00 0.220 H ATOM 178 2HD1 ILE A 10 -0.383 -7.765 -3.390 1.00 0.220 H ATOM 179 3HD1 ILE A 10 -0.846 -6.104 -3.764 1.00 0.220 H ATOM 180 N ALA A 11 4.325 -6.261 -2.699 1.00 0.120 N ATOM 181 CA ALA A 11 5.722 -6.071 -2.394 1.00 0.150 C ATOM 182 C ALA A 11 6.242 -7.084 -1.366 1.00 0.130 C ATOM 183 O ALA A 11 7.378 -7.558 -1.463 1.00 0.140 O ATOM 184 CB ALA A 11 5.907 -4.670 -1.906 1.00 0.200 C ATOM 185 H ALA A 11 3.684 -5.481 -2.515 1.00 0.140 H ATOM 186 HA ALA A 11 6.286 -6.200 -3.313 1.00 0.180 H ATOM 187 1HB ALA A 11 6.956 -4.472 -1.719 1.00 0.240 H ATOM 188 2HB ALA A 11 5.548 -4.016 -2.654 1.00 0.240 H ATOM 189 3HB ALA A 11 5.330 -4.523 -0.998 1.00 0.240 H ATOM 190 N ALA A 12 5.394 -7.476 -0.413 1.00 0.150 N ATOM 191 CA ALA A 12 5.777 -8.386 0.659 1.00 0.130 C ATOM 192 C ALA A 12 6.361 -9.706 0.178 1.00 0.170 C ATOM 193 O ALA A 12 7.265 -10.241 0.814 1.00 0.190 O ATOM 194 CB ALA A 12 4.574 -8.732 1.515 1.00 0.190 C ATOM 195 H ALA A 12 4.485 -7.017 -0.351 1.00 0.180 H ATOM 196 HA ALA A 12 6.517 -7.873 1.275 1.00 0.160 H ATOM 197 1HB ALA A 12 4.891 -9.370 2.345 1.00 0.230 H ATOM 198 2HB ALA A 12 4.138 -7.848 1.887 1.00 0.230 H ATOM 199 3HB ALA A 12 3.843 -9.257 0.917 1.00 0.230 H ATOM 200 N ASP A 13 5.891 -10.248 -0.953 1.00 0.210 N ATOM 201 CA ASP A 13 6.407 -11.548 -1.374 1.00 0.260 C ATOM 202 C ASP A 13 7.374 -11.443 -2.538 1.00 0.200 C ATOM 203 O ASP A 13 7.678 -12.449 -3.178 1.00 0.210 O ATOM 204 CB ASP A 13 5.260 -12.506 -1.728 1.00 0.340 C ATOM 205 CG ASP A 13 5.662 -14.028 -1.810 1.00 0.340 C ATOM 206 OD1 ASP A 13 6.521 -14.441 -1.078 1.00 0.340 O ATOM 207 OD2 ASP A 13 5.036 -14.772 -2.567 1.00 0.340 O ATOM 208 H ASP A 13 5.208 -9.768 -1.550 1.00 0.250 H ATOM 209 HA ASP A 13 6.948 -11.989 -0.536 1.00 0.310 H ATOM 210 1HB ASP A 13 4.510 -12.414 -0.976 1.00 0.410 H ATOM 211 2HB ASP A 13 4.804 -12.195 -2.657 1.00 0.410 H ATOM 212 N GLY A 14 7.904 -10.247 -2.807 1.00 0.160 N ATOM 213 CA GLY A 14 8.857 -10.116 -3.894 1.00 0.130 C ATOM 214 C GLY A 14 8.431 -9.226 -5.056 1.00 0.090 C ATOM 215 O GLY A 14 9.201 -9.074 -6.004 1.00 0.090 O ATOM 216 H GLY A 14 7.670 -9.408 -2.262 1.00 0.190 H ATOM 217 1HA GLY A 14 9.788 -9.724 -3.484 1.00 0.160 H ATOM 218 2HA GLY A 14 9.098 -11.105 -4.281 1.00 0.160 H ATOM 219 N GLY A 15 7.230 -8.641 -5.041 1.00 0.080 N ATOM 220 CA GLY A 15 6.896 -7.753 -6.144 1.00 0.080 C ATOM 221 C GLY A 15 7.739 -6.486 -6.020 1.00 0.070 C ATOM 222 O GLY A 15 8.165 -6.127 -4.919 1.00 0.080 O ATOM 223 H GLY A 15 6.529 -8.772 -4.305 1.00 0.100 H ATOM 224 1HA GLY A 15 7.088 -8.241 -7.101 1.00 0.100 H ATOM 225 2HA GLY A 15 5.839 -7.500 -6.101 1.00 0.100 H ATOM 226 N TYR A 16 7.972 -5.815 -7.138 1.00 0.120 N ATOM 227 CA TYR A 16 8.727 -4.556 -7.138 1.00 0.160 C ATOM 228 C TYR A 16 8.294 -3.683 -8.298 1.00 0.200 C ATOM 229 O TYR A 16 7.677 -4.169 -9.239 1.00 0.190 O ATOM 230 CB TYR A 16 10.248 -4.809 -7.136 1.00 0.210 C ATOM 231 CG TYR A 16 10.823 -5.581 -8.328 1.00 0.210 C ATOM 232 CD1 TYR A 16 11.293 -4.928 -9.463 1.00 0.210 C ATOM 233 CD2 TYR A 16 10.892 -6.959 -8.259 1.00 0.210 C ATOM 234 CE1 TYR A 16 11.830 -5.666 -10.529 1.00 0.210 C ATOM 235 CE2 TYR A 16 11.417 -7.684 -9.301 1.00 0.210 C ATOM 236 CZ TYR A 16 11.888 -7.051 -10.437 1.00 0.210 C ATOM 237 OH TYR A 16 12.412 -7.824 -11.470 1.00 0.210 O ATOM 238 H TYR A 16 7.598 -6.204 -8.008 1.00 0.140 H ATOM 239 HA TYR A 16 8.495 -4.022 -6.222 1.00 0.190 H ATOM 240 1HB TYR A 16 10.764 -3.849 -7.087 1.00 0.250 H ATOM 241 2HB TYR A 16 10.510 -5.356 -6.229 1.00 0.250 H ATOM 242 HD1 TYR A 16 11.238 -3.856 -9.516 1.00 0.250 H ATOM 243 HD2 TYR A 16 10.529 -7.475 -7.370 1.00 0.250 H ATOM 244 HE1 TYR A 16 12.195 -5.163 -11.425 1.00 0.250 H ATOM 245 HE2 TYR A 16 11.464 -8.769 -9.229 1.00 0.250 H ATOM 246 HH TYR A 16 12.678 -7.259 -12.248 1.00 0.250 H ATOM 247 N ALA A 17 8.567 -2.380 -8.238 1.00 0.240 N ATOM 248 CA ALA A 17 8.181 -1.570 -9.385 1.00 0.260 C ATOM 249 C ALA A 17 9.224 -1.694 -10.473 1.00 0.240 C ATOM 250 O ALA A 17 8.930 -2.211 -11.552 1.00 0.220 O ATOM 251 CB ALA A 17 7.993 -0.118 -8.983 1.00 0.360 C ATOM 252 H ALA A 17 9.044 -1.983 -7.440 1.00 0.290 H ATOM 253 HA ALA A 17 7.236 -1.948 -9.775 1.00 0.310 H ATOM 254 1HB ALA A 17 7.689 0.457 -9.859 1.00 0.430 H ATOM 255 2HB ALA A 17 7.222 -0.056 -8.222 1.00 0.430 H ATOM 256 3HB ALA A 17 8.921 0.285 -8.593 1.00 0.430 H ATOM 257 N PHE A 18 10.454 -1.265 -10.172 1.00 0.260 N ATOM 258 CA PHE A 18 11.529 -1.345 -11.145 1.00 0.250 C ATOM 259 C PHE A 18 12.785 -1.824 -10.453 1.00 0.260 C ATOM 260 O PHE A 18 13.061 -1.427 -9.318 1.00 0.280 O ATOM 261 CB PHE A 18 11.813 0.011 -11.775 1.00 0.350 C ATOM 262 CG PHE A 18 10.658 0.628 -12.434 1.00 0.350 C ATOM 263 CD1 PHE A 18 9.951 1.624 -11.792 1.00 0.350 C ATOM 264 CD2 PHE A 18 10.245 0.219 -13.664 1.00 0.350 C ATOM 265 CE1 PHE A 18 8.863 2.206 -12.390 1.00 0.350 C ATOM 266 CE2 PHE A 18 9.162 0.797 -14.269 1.00 0.350 C ATOM 267 CZ PHE A 18 8.471 1.790 -13.637 1.00 0.350 C ATOM 268 H PHE A 18 10.643 -0.870 -9.265 1.00 0.310 H ATOM 269 HA PHE A 18 11.255 -2.055 -11.918 1.00 0.300 H ATOM 270 1HB PHE A 18 12.143 0.683 -11.019 1.00 0.420 H ATOM 271 2HB PHE A 18 12.620 -0.092 -12.511 1.00 0.420 H ATOM 272 HD1 PHE A 18 10.269 1.950 -10.801 1.00 0.420 H ATOM 273 HD2 PHE A 18 10.792 -0.584 -14.175 1.00 0.420 H ATOM 274 HE1 PHE A 18 8.314 2.995 -11.878 1.00 0.420 H ATOM 275 HE2 PHE A 18 8.858 0.458 -15.262 1.00 0.420 H ATOM 276 HZ PHE A 18 7.611 2.246 -14.121 1.00 0.420 H ATOM 277 N LYS A 19 13.557 -2.659 -11.122 1.00 0.250 N ATOM 278 CA LYS A 19 14.816 -3.099 -10.526 1.00 0.280 C ATOM 279 C LYS A 19 15.746 -1.917 -10.277 1.00 0.330 C ATOM 280 O LYS A 19 15.960 -1.084 -11.159 1.00 0.370 O ATOM 281 CB LYS A 19 15.506 -4.148 -11.382 1.00 0.380 C ATOM 282 CG LYS A 19 16.798 -4.714 -10.791 1.00 0.380 C ATOM 283 CD LYS A 19 17.333 -5.806 -11.684 1.00 0.380 C ATOM 284 CE LYS A 19 18.623 -6.401 -11.181 1.00 0.380 C ATOM 285 NZ LYS A 19 19.099 -7.459 -12.102 1.00 0.380 N ATOM 286 H LYS A 19 13.240 -2.985 -12.046 1.00 0.300 H ATOM 287 HA LYS A 19 14.593 -3.554 -9.560 1.00 0.340 H ATOM 288 1HB LYS A 19 14.825 -4.983 -11.539 1.00 0.460 H ATOM 289 2HB LYS A 19 15.740 -3.732 -12.355 1.00 0.460 H ATOM 290 1HG LYS A 19 17.552 -3.926 -10.714 1.00 0.460 H ATOM 291 2HG LYS A 19 16.607 -5.116 -9.798 1.00 0.460 H ATOM 292 1HD LYS A 19 16.587 -6.603 -11.754 1.00 0.460 H ATOM 293 2HD LYS A 19 17.489 -5.405 -12.689 1.00 0.460 H ATOM 294 1HE LYS A 19 19.382 -5.621 -11.105 1.00 0.460 H ATOM 295 2HE LYS A 19 18.460 -6.835 -10.196 1.00 0.460 H ATOM 296 1HZ LYS A 19 19.960 -7.861 -11.760 1.00 0.460 H ATOM 297 2HZ LYS A 19 18.384 -8.173 -12.165 1.00 0.460 H ATOM 298 3HZ LYS A 19 19.250 -7.054 -13.019 1.00 0.460 H ATOM 299 N TYR A 20 16.330 -1.848 -9.085 1.00 0.350 N ATOM 300 CA TYR A 20 17.223 -0.737 -8.776 1.00 0.430 C ATOM 301 C TYR A 20 18.641 -1.228 -8.546 1.00 0.510 C ATOM 302 O TYR A 20 18.862 -2.118 -7.721 1.00 0.560 O ATOM 303 CB TYR A 20 16.706 -0.004 -7.545 1.00 0.570 C ATOM 304 CG TYR A 20 17.462 1.243 -7.185 1.00 0.570 C ATOM 305 CD1 TYR A 20 17.305 2.331 -7.974 1.00 0.570 C ATOM 306 CD2 TYR A 20 18.266 1.316 -6.070 1.00 0.570 C ATOM 307 CE1 TYR A 20 17.920 3.495 -7.698 1.00 0.570 C ATOM 308 CE2 TYR A 20 18.906 2.508 -5.778 1.00 0.570 C ATOM 309 CZ TYR A 20 18.727 3.596 -6.604 1.00 0.570 C ATOM 310 OH TYR A 20 19.355 4.800 -6.340 1.00 0.570 O ATOM 311 H TYR A 20 16.136 -2.552 -8.387 1.00 0.420 H ATOM 312 HA TYR A 20 17.245 -0.051 -9.618 1.00 0.520 H ATOM 313 1HB TYR A 20 15.671 0.254 -7.698 1.00 0.680 H ATOM 314 2HB TYR A 20 16.743 -0.676 -6.691 1.00 0.680 H ATOM 315 HD1 TYR A 20 16.682 2.261 -8.835 1.00 0.680 H ATOM 316 HD2 TYR A 20 18.394 0.446 -5.425 1.00 0.680 H ATOM 317 HE1 TYR A 20 17.774 4.354 -8.352 1.00 0.680 H ATOM 318 HE2 TYR A 20 19.547 2.588 -4.901 1.00 0.680 H ATOM 319 HH TYR A 20 19.420 5.332 -7.177 1.00 0.680 H ATOM 320 N GLU A 21 19.587 -0.658 -9.296 1.00 0.570 N ATOM 321 CA GLU A 21 20.998 -1.034 -9.188 1.00 0.700 C ATOM 322 C GLU A 21 21.930 0.090 -9.649 1.00 0.770 C ATOM 323 O GLU A 21 21.615 0.862 -10.553 1.00 0.740 O ATOM 324 CB GLU A 21 21.268 -2.334 -9.963 1.00 0.930 C ATOM 325 CG GLU A 21 22.715 -2.863 -9.879 1.00 0.930 C ATOM 326 CD GLU A 21 23.188 -3.177 -8.462 1.00 0.930 C ATOM 327 OE1 GLU A 21 23.410 -2.240 -7.698 1.00 0.930 O ATOM 328 OE2 GLU A 21 23.339 -4.335 -8.150 1.00 0.930 O ATOM 329 H GLU A 21 19.296 0.078 -9.949 1.00 0.680 H ATOM 330 HA GLU A 21 21.209 -1.225 -8.136 1.00 0.840 H ATOM 331 1HB GLU A 21 20.609 -3.121 -9.590 1.00 1.110 H ATOM 332 2HB GLU A 21 21.028 -2.182 -11.014 1.00 1.110 H ATOM 333 1HG GLU A 21 22.762 -3.783 -10.458 1.00 1.110 H ATOM 334 2HG GLU A 21 23.384 -2.166 -10.345 1.00 1.110 H ATOM 335 N ASN A 22 23.092 0.186 -9.009 1.00 0.890 N ATOM 336 CA ASN A 22 24.116 1.189 -9.320 1.00 0.980 C ATOM 337 C ASN A 22 23.553 2.611 -9.245 1.00 0.960 C ATOM 338 O ASN A 22 23.950 3.493 -10.005 1.00 1.010 O ATOM 339 CB ASN A 22 24.744 0.952 -10.690 1.00 1.340 C ATOM 340 CG ASN A 22 25.520 -0.325 -10.779 1.00 1.340 C ATOM 341 OD1 ASN A 22 26.220 -0.720 -9.837 1.00 1.340 O ATOM 342 ND2 ASN A 22 25.421 -0.982 -11.908 1.00 1.340 N ATOM 343 H ASN A 22 23.284 -0.529 -8.296 1.00 1.070 H ATOM 344 HA ASN A 22 24.904 1.116 -8.568 1.00 1.180 H ATOM 345 1HB ASN A 22 23.972 0.945 -11.457 1.00 1.600 H ATOM 346 2HB ASN A 22 25.417 1.776 -10.922 1.00 1.600 H ATOM 347 1HD2 ASN A 22 25.918 -1.842 -12.032 1.00 1.600 H ATOM 348 2HD2 ASN A 22 24.847 -0.625 -12.646 1.00 1.600 H ATOM 349 N GLY A 23 22.626 2.832 -8.317 1.00 0.910 N ATOM 350 CA GLY A 23 22.009 4.129 -8.097 1.00 0.910 C ATOM 351 C GLY A 23 20.831 4.488 -9.025 1.00 0.800 C ATOM 352 O GLY A 23 20.166 5.507 -8.785 1.00 0.820 O ATOM 353 H GLY A 23 22.360 2.074 -7.704 1.00 1.090 H ATOM 354 1HA GLY A 23 21.677 4.177 -7.061 1.00 1.090 H ATOM 355 2HA GLY A 23 22.775 4.895 -8.199 1.00 1.090 H ATOM 356 N LYS A 24 20.508 3.644 -10.018 1.00 0.720 N ATOM 357 CA LYS A 24 19.441 3.954 -10.983 1.00 0.640 C ATOM 358 C LYS A 24 18.372 2.873 -11.137 1.00 0.560 C ATOM 359 O LYS A 24 18.598 1.694 -10.851 1.00 0.540 O ATOM 360 CB LYS A 24 20.046 4.212 -12.369 1.00 0.930 C ATOM 361 CG LYS A 24 21.065 5.365 -12.463 1.00 0.930 C ATOM 362 CD LYS A 24 20.425 6.742 -12.267 1.00 0.930 C ATOM 363 CE LYS A 24 21.447 7.857 -12.465 1.00 0.930 C ATOM 364 NZ LYS A 24 20.858 9.209 -12.220 1.00 0.930 N ATOM 365 H LYS A 24 21.049 2.783 -10.148 1.00 0.860 H ATOM 366 HA LYS A 24 18.930 4.852 -10.646 1.00 0.770 H ATOM 367 1HB LYS A 24 20.557 3.304 -12.698 1.00 1.110 H ATOM 368 2HB LYS A 24 19.245 4.405 -13.083 1.00 1.110 H ATOM 369 1HG LYS A 24 21.840 5.220 -11.706 1.00 1.110 H ATOM 370 2HG LYS A 24 21.542 5.336 -13.440 1.00 1.110 H ATOM 371 1HD LYS A 24 19.605 6.874 -12.972 1.00 1.110 H ATOM 372 2HD LYS A 24 20.032 6.823 -11.254 1.00 1.110 H ATOM 373 1HE LYS A 24 22.275 7.702 -11.774 1.00 1.110 H ATOM 374 2HE LYS A 24 21.825 7.817 -13.486 1.00 1.110 H ATOM 375 1HZ LYS A 24 21.567 9.916 -12.360 1.00 1.110 H ATOM 376 2HZ LYS A 24 20.094 9.369 -12.863 1.00 1.110 H ATOM 377 3HZ LYS A 24 20.514 9.260 -11.270 1.00 1.110 H ATOM 378 N TYR A 25 17.186 3.276 -11.605 1.00 0.520 N ATOM 379 CA TYR A 25 16.142 2.292 -11.883 1.00 0.460 C ATOM 380 C TYR A 25 16.216 1.823 -13.324 1.00 0.430 C ATOM 381 O TYR A 25 16.328 2.633 -14.248 1.00 0.470 O ATOM 382 CB TYR A 25 14.747 2.858 -11.619 1.00 0.670 C ATOM 383 CG TYR A 25 14.456 3.095 -10.178 1.00 0.670 C ATOM 384 CD1 TYR A 25 14.636 4.352 -9.633 1.00 0.670 C ATOM 385 CD2 TYR A 25 14.021 2.051 -9.383 1.00 0.670 C ATOM 386 CE1 TYR A 25 14.378 4.564 -8.297 1.00 0.670 C ATOM 387 CE2 TYR A 25 13.757 2.262 -8.053 1.00 0.670 C ATOM 388 CZ TYR A 25 13.935 3.513 -7.507 1.00 0.670 C ATOM 389 OH TYR A 25 13.680 3.725 -6.173 1.00 0.670 O ATOM 390 H TYR A 25 17.025 4.254 -11.801 1.00 0.620 H ATOM 391 HA TYR A 25 16.291 1.423 -11.247 1.00 0.550 H ATOM 392 1HB TYR A 25 14.627 3.800 -12.153 1.00 0.800 H ATOM 393 2HB TYR A 25 14.002 2.167 -12.009 1.00 0.800 H ATOM 394 HD1 TYR A 25 14.985 5.174 -10.256 1.00 0.800 H ATOM 395 HD2 TYR A 25 13.898 1.058 -9.802 1.00 0.800 H ATOM 396 HE1 TYR A 25 14.521 5.552 -7.863 1.00 0.800 H ATOM 397 HE2 TYR A 25 13.416 1.434 -7.430 1.00 0.800 H ATOM 398 HH TYR A 25 13.397 2.903 -5.766 1.00 0.800 H ATOM 399 N ASP A 26 16.119 0.514 -13.501 1.00 0.390 N ATOM 400 CA ASP A 26 16.101 -0.118 -14.806 1.00 0.390 C ATOM 401 C ASP A 26 14.630 -0.174 -15.185 1.00 0.370 C ATOM 402 O ASP A 26 13.907 -1.073 -14.766 1.00 0.390 O ATOM 403 CB ASP A 26 16.724 -1.520 -14.712 1.00 0.550 C ATOM 404 CG ASP A 26 16.930 -2.258 -16.056 1.00 0.550 C ATOM 405 OD1 ASP A 26 16.604 -1.720 -17.101 1.00 0.550 O ATOM 406 OD2 ASP A 26 17.424 -3.362 -16.018 1.00 0.550 O ATOM 407 H ASP A 26 16.060 -0.074 -12.668 1.00 0.470 H ATOM 408 HA ASP A 26 16.646 0.492 -15.525 1.00 0.470 H ATOM 409 1HB ASP A 26 17.691 -1.441 -14.213 1.00 0.660 H ATOM 410 2HB ASP A 26 16.099 -2.137 -14.074 1.00 0.660 H ATOM 411 N ILE A 27 14.172 0.807 -15.947 1.00 0.400 N ATOM 412 CA ILE A 27 12.746 0.975 -16.202 1.00 0.440 C ATOM 413 C ILE A 27 12.104 -0.213 -16.912 1.00 0.420 C ATOM 414 O ILE A 27 10.937 -0.515 -16.684 1.00 0.580 O ATOM 415 CB ILE A 27 12.468 2.308 -16.920 1.00 0.600 C ATOM 416 CG1 ILE A 27 12.897 3.524 -15.971 1.00 0.600 C ATOM 417 CG2 ILE A 27 10.979 2.418 -17.317 1.00 0.600 C ATOM 418 CD1 ILE A 27 12.191 3.626 -14.581 1.00 0.600 C ATOM 419 H ILE A 27 14.830 1.485 -16.314 1.00 0.480 H ATOM 420 HA ILE A 27 12.261 1.038 -15.245 1.00 0.530 H ATOM 421 HB ILE A 27 13.080 2.370 -17.817 1.00 0.720 H ATOM 422 1HG1 ILE A 27 13.970 3.457 -15.786 1.00 0.720 H ATOM 423 2HG1 ILE A 27 12.697 4.450 -16.508 1.00 0.720 H ATOM 424 1HG2 ILE A 27 10.814 3.368 -17.822 1.00 0.720 H ATOM 425 2HG2 ILE A 27 10.702 1.613 -17.992 1.00 0.720 H ATOM 426 3HG2 ILE A 27 10.354 2.367 -16.434 1.00 0.720 H ATOM 427 1HD1 ILE A 27 12.573 4.500 -14.057 1.00 0.720 H ATOM 428 2HD1 ILE A 27 11.116 3.733 -14.708 1.00 0.720 H ATOM 429 3HD1 ILE A 27 12.390 2.754 -13.974 1.00 0.720 H ATOM 430 N LYS A 28 12.801 -0.825 -17.850 1.00 0.310 N ATOM 431 CA LYS A 28 12.231 -1.980 -18.538 1.00 0.290 C ATOM 432 C LYS A 28 12.047 -3.203 -17.608 1.00 0.250 C ATOM 433 O LYS A 28 11.273 -4.121 -17.902 1.00 0.260 O ATOM 434 CB LYS A 28 13.085 -2.348 -19.755 1.00 0.410 C ATOM 435 CG LYS A 28 14.458 -2.897 -19.425 1.00 0.410 C ATOM 436 CD LYS A 28 15.273 -3.184 -20.679 1.00 0.410 C ATOM 437 CE LYS A 28 16.647 -3.763 -20.330 1.00 0.410 C ATOM 438 NZ LYS A 28 17.530 -2.768 -19.621 1.00 0.410 N ATOM 439 H LYS A 28 13.744 -0.515 -18.041 1.00 0.370 H ATOM 440 HA LYS A 28 11.242 -1.700 -18.900 1.00 0.350 H ATOM 441 1HB LYS A 28 12.561 -3.094 -20.352 1.00 0.500 H ATOM 442 2HB LYS A 28 13.221 -1.466 -20.378 1.00 0.500 H ATOM 443 1HG LYS A 28 14.981 -2.178 -18.811 1.00 0.500 H ATOM 444 2HG LYS A 28 14.361 -3.823 -18.859 1.00 0.500 H ATOM 445 1HD LYS A 28 14.736 -3.897 -21.304 1.00 0.500 H ATOM 446 2HD LYS A 28 15.411 -2.262 -21.244 1.00 0.500 H ATOM 447 1HE LYS A 28 16.511 -4.630 -19.685 1.00 0.500 H ATOM 448 2HE LYS A 28 17.140 -4.077 -21.247 1.00 0.500 H ATOM 449 1HZ LYS A 28 18.415 -3.197 -19.411 1.00 0.500 H ATOM 450 2HZ LYS A 28 17.680 -1.964 -20.204 1.00 0.500 H ATOM 451 3HZ LYS A 28 17.103 -2.454 -18.720 1.00 0.500 H ATOM 452 N ASP A 29 12.779 -3.262 -16.493 1.00 0.240 N ATOM 453 CA ASP A 29 12.703 -4.424 -15.621 1.00 0.200 C ATOM 454 C ASP A 29 11.597 -4.197 -14.610 1.00 0.190 C ATOM 455 O ASP A 29 11.824 -3.665 -13.514 1.00 0.210 O ATOM 456 CB ASP A 29 14.062 -4.690 -14.959 1.00 0.300 C ATOM 457 CG ASP A 29 14.125 -5.992 -14.120 1.00 0.300 C ATOM 458 OD1 ASP A 29 13.088 -6.515 -13.777 1.00 0.300 O ATOM 459 OD2 ASP A 29 15.215 -6.458 -13.859 1.00 0.300 O ATOM 460 H ASP A 29 13.344 -2.466 -16.196 1.00 0.290 H ATOM 461 HA ASP A 29 12.444 -5.298 -16.219 1.00 0.240 H ATOM 462 1HB ASP A 29 14.836 -4.733 -15.731 1.00 0.360 H ATOM 463 2HB ASP A 29 14.309 -3.844 -14.322 1.00 0.360 H ATOM 464 N VAL A 30 10.383 -4.582 -15.013 1.00 0.190 N ATOM 465 CA VAL A 30 9.191 -4.339 -14.213 1.00 0.210 C ATOM 466 C VAL A 30 8.802 -5.580 -13.401 1.00 0.210 C ATOM 467 O VAL A 30 8.586 -6.665 -13.941 1.00 0.310 O ATOM 468 CB VAL A 30 8.035 -3.881 -15.119 1.00 0.290 C ATOM 469 CG1 VAL A 30 6.776 -3.635 -14.295 1.00 0.290 C ATOM 470 CG2 VAL A 30 8.462 -2.620 -15.837 1.00 0.290 C ATOM 471 H VAL A 30 10.321 -5.002 -15.945 1.00 0.230 H ATOM 472 HA VAL A 30 9.411 -3.529 -13.522 1.00 0.250 H ATOM 473 HB VAL A 30 7.812 -4.660 -15.845 1.00 0.340 H ATOM 474 1HG1 VAL A 30 5.968 -3.312 -14.948 1.00 0.340 H ATOM 475 2HG1 VAL A 30 6.486 -4.528 -13.799 1.00 0.340 H ATOM 476 3HG1 VAL A 30 6.978 -2.855 -13.551 1.00 0.340 H ATOM 477 1HG2 VAL A 30 7.664 -2.276 -16.489 1.00 0.340 H ATOM 478 2HG2 VAL A 30 8.681 -1.866 -15.101 1.00 0.340 H ATOM 479 3HG2 VAL A 30 9.353 -2.805 -16.432 1.00 0.340 H ATOM 480 N GLY A 31 8.669 -5.380 -12.103 1.00 0.170 N ATOM 481 CA GLY A 31 8.411 -6.431 -11.110 1.00 0.150 C ATOM 482 C GLY A 31 6.952 -6.749 -10.797 1.00 0.210 C ATOM 483 O GLY A 31 6.655 -7.250 -9.711 1.00 0.470 O ATOM 484 H GLY A 31 8.813 -4.409 -11.794 1.00 0.200 H ATOM 485 1HA GLY A 31 8.916 -7.341 -11.431 1.00 0.180 H ATOM 486 2HA GLY A 31 8.886 -6.139 -10.188 1.00 0.180 H ATOM 487 N VAL A 32 6.047 -6.373 -11.691 1.00 0.170 N ATOM 488 CA VAL A 32 4.605 -6.544 -11.502 1.00 0.210 C ATOM 489 C VAL A 32 4.124 -7.982 -11.725 1.00 0.160 C ATOM 490 O VAL A 32 3.123 -8.395 -11.144 1.00 0.190 O ATOM 491 CB VAL A 32 3.822 -5.559 -12.406 1.00 0.280 C ATOM 492 CG1 VAL A 32 3.831 -5.999 -13.889 1.00 0.280 C ATOM 493 CG2 VAL A 32 2.390 -5.431 -11.893 1.00 0.280 C ATOM 494 H VAL A 32 6.408 -5.955 -12.538 1.00 0.200 H ATOM 495 HA VAL A 32 4.379 -6.277 -10.469 1.00 0.250 H ATOM 496 HB VAL A 32 4.316 -4.589 -12.355 1.00 0.330 H ATOM 497 1HG1 VAL A 32 3.297 -5.261 -14.483 1.00 0.330 H ATOM 498 2HG1 VAL A 32 4.844 -6.085 -14.261 1.00 0.330 H ATOM 499 3HG1 VAL A 32 3.328 -6.957 -14.004 1.00 0.330 H ATOM 500 1HG2 VAL A 32 1.850 -4.711 -12.504 1.00 0.330 H ATOM 501 2HG2 VAL A 32 1.882 -6.394 -11.946 1.00 0.330 H ATOM 502 3HG2 VAL A 32 2.404 -5.089 -10.858 1.00 0.330 H ATOM 503 N ASP A 33 4.795 -8.710 -12.628 1.00 0.150 N ATOM 504 CA ASP A 33 4.420 -10.075 -13.012 1.00 0.170 C ATOM 505 C ASP A 33 5.211 -11.135 -12.256 1.00 0.210 C ATOM 506 O ASP A 33 5.189 -12.320 -12.599 1.00 0.290 O ATOM 507 CB ASP A 33 4.639 -10.272 -14.513 1.00 0.230 C ATOM 508 CG ASP A 33 3.705 -9.444 -15.382 1.00 0.230 C ATOM 509 OD1 ASP A 33 2.529 -9.399 -15.106 1.00 0.230 O ATOM 510 OD2 ASP A 33 4.189 -8.836 -16.306 1.00 0.230 O ATOM 511 H ASP A 33 5.589 -8.290 -13.094 1.00 0.180 H ATOM 512 HA ASP A 33 3.361 -10.214 -12.787 1.00 0.200 H ATOM 513 1HB ASP A 33 5.667 -10.010 -14.762 1.00 0.280 H ATOM 514 2HB ASP A 33 4.502 -11.323 -14.764 1.00 0.280 H ATOM 515 N ASN A 34 5.933 -10.694 -11.248 1.00 0.230 N ATOM 516 CA ASN A 34 6.737 -11.541 -10.391 1.00 0.350 C ATOM 517 C ASN A 34 5.840 -12.530 -9.660 1.00 0.260 C ATOM 518 O ASN A 34 4.714 -12.194 -9.293 1.00 0.270 O ATOM 519 CB ASN A 34 7.514 -10.689 -9.402 1.00 0.440 C ATOM 520 CG ASN A 34 8.578 -11.445 -8.642 1.00 0.440 C ATOM 521 OD1 ASN A 34 8.309 -12.173 -7.667 1.00 0.440 O ATOM 522 ND2 ASN A 34 9.800 -11.305 -9.091 1.00 0.440 N ATOM 523 H ASN A 34 5.904 -9.701 -11.051 1.00 0.280 H ATOM 524 HA ASN A 34 7.434 -12.112 -11.007 1.00 0.420 H ATOM 525 1HB ASN A 34 7.988 -9.860 -9.933 1.00 0.530 H ATOM 526 2HB ASN A 34 6.822 -10.249 -8.688 1.00 0.530 H ATOM 527 1HD2 ASN A 34 10.560 -11.779 -8.642 1.00 0.530 H ATOM 528 2HD2 ASN A 34 9.973 -10.736 -9.897 1.00 0.530 H ATOM 529 N ALA A 35 6.339 -13.737 -9.397 1.00 0.200 N ATOM 530 CA ALA A 35 5.536 -14.712 -8.663 1.00 0.190 C ATOM 531 C ALA A 35 5.083 -14.146 -7.316 1.00 0.150 C ATOM 532 O ALA A 35 3.983 -14.459 -6.851 1.00 0.160 O ATOM 533 CB ALA A 35 6.328 -15.982 -8.441 1.00 0.270 C ATOM 534 H ALA A 35 7.267 -13.980 -9.716 1.00 0.240 H ATOM 535 HA ALA A 35 4.651 -14.937 -9.256 1.00 0.230 H ATOM 536 1HB ALA A 35 5.710 -16.706 -7.912 1.00 0.320 H ATOM 537 2HB ALA A 35 6.630 -16.395 -9.402 1.00 0.320 H ATOM 538 3HB ALA A 35 7.212 -15.758 -7.847 1.00 0.320 H ATOM 539 N GLY A 36 5.927 -13.324 -6.689 1.00 0.140 N ATOM 540 CA GLY A 36 5.606 -12.698 -5.427 1.00 0.150 C ATOM 541 C GLY A 36 4.392 -11.803 -5.591 1.00 0.150 C ATOM 542 O GLY A 36 3.417 -11.866 -4.830 1.00 0.160 O ATOM 543 H GLY A 36 6.833 -13.096 -7.093 1.00 0.170 H ATOM 544 1HA GLY A 36 5.436 -13.456 -4.664 1.00 0.180 H ATOM 545 2HA GLY A 36 6.452 -12.093 -5.128 1.00 0.180 H ATOM 546 N ALA A 37 4.460 -10.937 -6.597 1.00 0.140 N ATOM 547 CA ALA A 37 3.385 -10.011 -6.881 1.00 0.140 C ATOM 548 C ALA A 37 2.091 -10.756 -7.157 1.00 0.150 C ATOM 549 O ALA A 37 1.020 -10.350 -6.692 1.00 0.170 O ATOM 550 CB ALA A 37 3.752 -9.154 -8.087 1.00 0.200 C ATOM 551 H ALA A 37 5.300 -10.920 -7.158 1.00 0.170 H ATOM 552 HA ALA A 37 3.235 -9.394 -6.000 1.00 0.170 H ATOM 553 1HB ALA A 37 2.950 -8.449 -8.299 1.00 0.240 H ATOM 554 2HB ALA A 37 4.665 -8.610 -7.901 1.00 0.240 H ATOM 555 3HB ALA A 37 3.894 -9.797 -8.956 1.00 0.240 H ATOM 556 N LYS A 38 2.188 -11.880 -7.871 1.00 0.150 N ATOM 557 CA LYS A 38 1.014 -12.673 -8.173 1.00 0.160 C ATOM 558 C LYS A 38 0.411 -13.263 -6.908 1.00 0.160 C ATOM 559 O LYS A 38 -0.814 -13.253 -6.752 1.00 0.160 O ATOM 560 CB LYS A 38 1.348 -13.756 -9.192 1.00 0.220 C ATOM 561 CG LYS A 38 1.588 -13.217 -10.604 1.00 0.220 C ATOM 562 CD LYS A 38 1.983 -14.323 -11.568 1.00 0.220 C ATOM 563 CE LYS A 38 2.124 -13.800 -12.992 1.00 0.220 C ATOM 564 NZ LYS A 38 2.619 -14.851 -13.922 1.00 0.220 N ATOM 565 H LYS A 38 3.106 -12.143 -8.246 1.00 0.180 H ATOM 566 HA LYS A 38 0.268 -12.017 -8.619 1.00 0.190 H ATOM 567 1HB LYS A 38 2.249 -14.278 -8.876 1.00 0.260 H ATOM 568 2HB LYS A 38 0.540 -14.485 -9.232 1.00 0.260 H ATOM 569 1HG LYS A 38 0.684 -12.728 -10.965 1.00 0.260 H ATOM 570 2HG LYS A 38 2.392 -12.474 -10.572 1.00 0.260 H ATOM 571 1HD LYS A 38 2.945 -14.736 -11.256 1.00 0.260 H ATOM 572 2HD LYS A 38 1.240 -15.116 -11.547 1.00 0.260 H ATOM 573 1HE LYS A 38 1.152 -13.454 -13.339 1.00 0.260 H ATOM 574 2HE LYS A 38 2.813 -12.964 -13.001 1.00 0.260 H ATOM 575 1HZ LYS A 38 2.695 -14.468 -14.853 1.00 0.260 H ATOM 576 2HZ LYS A 38 3.530 -15.166 -13.612 1.00 0.260 H ATOM 577 3HZ LYS A 38 1.978 -15.628 -13.930 1.00 0.260 H ATOM 578 N ALA A 39 1.246 -13.771 -5.994 1.00 0.170 N ATOM 579 CA ALA A 39 0.739 -14.324 -4.744 1.00 0.170 C ATOM 580 C ALA A 39 0.004 -13.265 -3.934 1.00 0.160 C ATOM 581 O ALA A 39 -1.065 -13.530 -3.368 1.00 0.170 O ATOM 582 CB ALA A 39 1.877 -14.881 -3.925 1.00 0.240 C ATOM 583 H ALA A 39 2.252 -13.824 -6.203 1.00 0.200 H ATOM 584 HA ALA A 39 0.038 -15.122 -4.986 1.00 0.200 H ATOM 585 1HB ALA A 39 1.485 -15.305 -3.014 1.00 0.290 H ATOM 586 2HB ALA A 39 2.392 -15.647 -4.500 1.00 0.290 H ATOM 587 3HB ALA A 39 2.585 -14.083 -3.683 1.00 0.290 H ATOM 588 N GLY A 40 0.565 -12.054 -3.912 1.00 0.160 N ATOM 589 CA GLY A 40 -0.020 -10.921 -3.210 1.00 0.150 C ATOM 590 C GLY A 40 -1.386 -10.589 -3.797 1.00 0.130 C ATOM 591 O GLY A 40 -2.392 -10.500 -3.083 1.00 0.130 O ATOM 592 H GLY A 40 1.476 -11.931 -4.374 1.00 0.190 H ATOM 593 1HA GLY A 40 -0.113 -11.157 -2.152 1.00 0.180 H ATOM 594 2HA GLY A 40 0.641 -10.068 -3.298 1.00 0.180 H ATOM 595 N LEU A 41 -1.434 -10.426 -5.121 1.00 0.130 N ATOM 596 CA LEU A 41 -2.684 -10.107 -5.789 1.00 0.120 C ATOM 597 C LEU A 41 -3.704 -11.205 -5.592 1.00 0.120 C ATOM 598 O LEU A 41 -4.888 -10.914 -5.409 1.00 0.130 O ATOM 599 CB LEU A 41 -2.451 -9.922 -7.293 1.00 0.170 C ATOM 600 CG LEU A 41 -1.676 -8.671 -7.733 1.00 0.170 C ATOM 601 CD1 LEU A 41 -1.305 -8.812 -9.192 1.00 0.170 C ATOM 602 CD2 LEU A 41 -2.544 -7.407 -7.535 1.00 0.170 C ATOM 603 H LEU A 41 -0.572 -10.514 -5.671 1.00 0.160 H ATOM 604 HA LEU A 41 -3.086 -9.200 -5.356 1.00 0.140 H ATOM 605 1HB LEU A 41 -1.890 -10.788 -7.647 1.00 0.210 H ATOM 606 2HB LEU A 41 -3.416 -9.915 -7.795 1.00 0.210 H ATOM 607 HG LEU A 41 -0.774 -8.590 -7.163 1.00 0.210 H ATOM 608 1HD1 LEU A 41 -0.742 -7.934 -9.512 1.00 0.210 H ATOM 609 2HD1 LEU A 41 -0.686 -9.701 -9.324 1.00 0.210 H ATOM 610 3HD1 LEU A 41 -2.207 -8.903 -9.795 1.00 0.210 H ATOM 611 1HD2 LEU A 41 -1.980 -6.534 -7.858 1.00 0.210 H ATOM 612 2HD2 LEU A 41 -3.451 -7.495 -8.131 1.00 0.210 H ATOM 613 3HD2 LEU A 41 -2.816 -7.283 -6.502 1.00 0.210 H ATOM 614 N THR A 42 -3.261 -12.466 -5.622 1.00 0.140 N ATOM 615 CA THR A 42 -4.159 -13.594 -5.451 1.00 0.150 C ATOM 616 C THR A 42 -4.818 -13.489 -4.095 1.00 0.140 C ATOM 617 O THR A 42 -6.035 -13.605 -3.989 1.00 0.140 O ATOM 618 CB THR A 42 -3.421 -14.944 -5.572 1.00 0.210 C ATOM 619 OG1 THR A 42 -2.850 -15.062 -6.888 1.00 0.210 O ATOM 620 CG2 THR A 42 -4.404 -16.099 -5.339 1.00 0.210 C ATOM 621 H THR A 42 -2.276 -12.650 -5.811 1.00 0.170 H ATOM 622 HA THR A 42 -4.932 -13.549 -6.216 1.00 0.180 H ATOM 623 HB THR A 42 -2.625 -14.993 -4.835 1.00 0.250 H ATOM 624 HG1 THR A 42 -2.123 -14.407 -6.981 1.00 0.250 H ATOM 625 1HG2 THR A 42 -3.875 -17.043 -5.433 1.00 0.250 H ATOM 626 2HG2 THR A 42 -4.844 -16.035 -4.339 1.00 0.250 H ATOM 627 3HG2 THR A 42 -5.201 -16.054 -6.080 1.00 0.250 H ATOM 628 N PHE A 43 -4.027 -13.217 -3.058 1.00 0.140 N ATOM 629 CA PHE A 43 -4.554 -13.074 -1.713 1.00 0.130 C ATOM 630 C PHE A 43 -5.657 -12.013 -1.674 1.00 0.120 C ATOM 631 O PHE A 43 -6.727 -12.266 -1.111 1.00 0.140 O ATOM 632 CB PHE A 43 -3.430 -12.738 -0.753 1.00 0.190 C ATOM 633 CG PHE A 43 -3.820 -12.547 0.678 1.00 0.190 C ATOM 634 CD1 PHE A 43 -4.000 -13.638 1.501 1.00 0.190 C ATOM 635 CD2 PHE A 43 -3.986 -11.289 1.215 1.00 0.190 C ATOM 636 CE1 PHE A 43 -4.330 -13.469 2.823 1.00 0.190 C ATOM 637 CE2 PHE A 43 -4.304 -11.118 2.523 1.00 0.190 C ATOM 638 CZ PHE A 43 -4.478 -12.206 3.334 1.00 0.190 C ATOM 639 H PHE A 43 -3.013 -13.163 -3.209 1.00 0.170 H ATOM 640 HA PHE A 43 -4.987 -14.029 -1.414 1.00 0.160 H ATOM 641 1HB PHE A 43 -2.697 -13.528 -0.806 1.00 0.220 H ATOM 642 2HB PHE A 43 -2.940 -11.855 -1.093 1.00 0.220 H ATOM 643 HD1 PHE A 43 -3.874 -14.642 1.093 1.00 0.220 H ATOM 644 HD2 PHE A 43 -3.867 -10.426 0.591 1.00 0.220 H ATOM 645 HE1 PHE A 43 -4.469 -14.338 3.467 1.00 0.220 H ATOM 646 HE2 PHE A 43 -4.424 -10.113 2.925 1.00 0.220 H ATOM 647 HZ PHE A 43 -4.737 -12.068 4.382 1.00 0.220 H ATOM 648 N LEU A 44 -5.416 -10.830 -2.265 1.00 0.110 N ATOM 649 CA LEU A 44 -6.449 -9.784 -2.246 1.00 0.120 C ATOM 650 C LEU A 44 -7.706 -10.256 -2.962 1.00 0.120 C ATOM 651 O LEU A 44 -8.829 -10.019 -2.500 1.00 0.130 O ATOM 652 CB LEU A 44 -5.961 -8.531 -2.976 1.00 0.160 C ATOM 653 CG LEU A 44 -4.834 -7.801 -2.331 1.00 0.160 C ATOM 654 CD1 LEU A 44 -4.306 -6.742 -3.267 1.00 0.160 C ATOM 655 CD2 LEU A 44 -5.266 -7.156 -1.010 1.00 0.160 C ATOM 656 H LEU A 44 -4.495 -10.668 -2.692 1.00 0.130 H ATOM 657 HA LEU A 44 -6.711 -9.570 -1.217 1.00 0.140 H ATOM 658 1HB LEU A 44 -5.633 -8.826 -3.974 1.00 0.200 H ATOM 659 2HB LEU A 44 -6.799 -7.841 -3.080 1.00 0.200 H ATOM 660 HG LEU A 44 -4.073 -8.502 -2.163 1.00 0.200 H ATOM 661 1HD1 LEU A 44 -3.455 -6.256 -2.791 1.00 0.200 H ATOM 662 2HD1 LEU A 44 -3.986 -7.202 -4.197 1.00 0.200 H ATOM 663 3HD1 LEU A 44 -5.086 -6.011 -3.474 1.00 0.200 H ATOM 664 1HD2 LEU A 44 -4.411 -6.645 -0.568 1.00 0.200 H ATOM 665 2HD2 LEU A 44 -6.059 -6.434 -1.205 1.00 0.200 H ATOM 666 3HD2 LEU A 44 -5.622 -7.902 -0.313 1.00 0.200 H ATOM 667 N VAL A 45 -7.531 -10.945 -4.089 1.00 0.120 N ATOM 668 CA VAL A 45 -8.677 -11.443 -4.827 1.00 0.120 C ATOM 669 C VAL A 45 -9.449 -12.446 -3.989 1.00 0.120 C ATOM 670 O VAL A 45 -10.683 -12.402 -3.978 1.00 0.130 O ATOM 671 CB VAL A 45 -8.265 -12.049 -6.179 1.00 0.170 C ATOM 672 CG1 VAL A 45 -9.454 -12.757 -6.833 1.00 0.170 C ATOM 673 CG2 VAL A 45 -7.774 -10.929 -7.086 1.00 0.170 C ATOM 674 H VAL A 45 -6.580 -11.078 -4.453 1.00 0.140 H ATOM 675 HA VAL A 45 -9.335 -10.600 -5.035 1.00 0.140 H ATOM 676 HB VAL A 45 -7.470 -12.778 -6.022 1.00 0.200 H ATOM 677 1HG1 VAL A 45 -9.141 -13.171 -7.788 1.00 0.200 H ATOM 678 2HG1 VAL A 45 -9.807 -13.565 -6.195 1.00 0.200 H ATOM 679 3HG1 VAL A 45 -10.263 -12.042 -6.992 1.00 0.200 H ATOM 680 1HG2 VAL A 45 -7.468 -11.342 -8.045 1.00 0.200 H ATOM 681 2HG2 VAL A 45 -8.577 -10.209 -7.238 1.00 0.200 H ATOM 682 3HG2 VAL A 45 -6.932 -10.427 -6.629 1.00 0.200 H ATOM 683 N ASP A 46 -8.744 -13.365 -3.316 1.00 0.130 N ATOM 684 CA ASP A 46 -9.400 -14.343 -2.466 1.00 0.140 C ATOM 685 C ASP A 46 -10.177 -13.647 -1.349 1.00 0.130 C ATOM 686 O ASP A 46 -11.312 -14.023 -1.071 1.00 0.140 O ATOM 687 CB ASP A 46 -8.391 -15.310 -1.830 1.00 0.190 C ATOM 688 CG ASP A 46 -7.758 -16.361 -2.786 1.00 0.190 C ATOM 689 OD1 ASP A 46 -8.246 -16.572 -3.875 1.00 0.190 O ATOM 690 OD2 ASP A 46 -6.784 -16.951 -2.378 1.00 0.190 O ATOM 691 H ASP A 46 -7.730 -13.389 -3.423 1.00 0.160 H ATOM 692 HA ASP A 46 -10.096 -14.917 -3.073 1.00 0.170 H ATOM 693 1HB ASP A 46 -7.581 -14.725 -1.395 1.00 0.230 H ATOM 694 2HB ASP A 46 -8.873 -15.838 -1.014 1.00 0.230 H ATOM 695 N LEU A 47 -9.628 -12.571 -0.762 1.00 0.140 N ATOM 696 CA LEU A 47 -10.366 -11.869 0.292 1.00 0.150 C ATOM 697 C LEU A 47 -11.670 -11.319 -0.267 1.00 0.140 C ATOM 698 O LEU A 47 -12.712 -11.341 0.403 1.00 0.160 O ATOM 699 CB LEU A 47 -9.565 -10.688 0.867 1.00 0.210 C ATOM 700 CG LEU A 47 -8.296 -10.997 1.697 1.00 0.210 C ATOM 701 CD1 LEU A 47 -7.615 -9.676 2.002 1.00 0.210 C ATOM 702 CD2 LEU A 47 -8.647 -11.738 2.984 1.00 0.210 C ATOM 703 H LEU A 47 -8.664 -12.308 -0.997 1.00 0.170 H ATOM 704 HA LEU A 47 -10.608 -12.575 1.078 1.00 0.180 H ATOM 705 1HB LEU A 47 -9.254 -10.060 0.031 1.00 0.250 H ATOM 706 2HB LEU A 47 -10.229 -10.098 1.490 1.00 0.250 H ATOM 707 HG LEU A 47 -7.611 -11.607 1.112 1.00 0.250 H ATOM 708 1HD1 LEU A 47 -6.724 -9.850 2.569 1.00 0.250 H ATOM 709 2HD1 LEU A 47 -7.361 -9.173 1.073 1.00 0.250 H ATOM 710 3HD1 LEU A 47 -8.289 -9.051 2.581 1.00 0.250 H ATOM 711 1HD2 LEU A 47 -7.731 -11.926 3.543 1.00 0.250 H ATOM 712 2HD2 LEU A 47 -9.323 -11.133 3.588 1.00 0.250 H ATOM 713 3HD2 LEU A 47 -9.120 -12.687 2.756 1.00 0.250 H ATOM 714 N ILE A 48 -11.640 -10.828 -1.498 1.00 0.140 N ATOM 715 CA ILE A 48 -12.868 -10.343 -2.100 1.00 0.170 C ATOM 716 C ILE A 48 -13.843 -11.510 -2.345 1.00 0.170 C ATOM 717 O ILE A 48 -15.013 -11.457 -1.958 1.00 0.190 O ATOM 718 CB ILE A 48 -12.572 -9.577 -3.407 1.00 0.230 C ATOM 719 CG1 ILE A 48 -11.803 -8.276 -3.056 1.00 0.230 C ATOM 720 CG2 ILE A 48 -13.869 -9.268 -4.134 1.00 0.230 C ATOM 721 CD1 ILE A 48 -11.162 -7.546 -4.216 1.00 0.230 C ATOM 722 H ILE A 48 -10.737 -10.756 -1.985 1.00 0.170 H ATOM 723 HA ILE A 48 -13.336 -9.656 -1.411 1.00 0.200 H ATOM 724 HB ILE A 48 -11.930 -10.182 -4.042 1.00 0.270 H ATOM 725 1HG1 ILE A 48 -12.499 -7.599 -2.569 1.00 0.270 H ATOM 726 2HG1 ILE A 48 -11.014 -8.526 -2.354 1.00 0.270 H ATOM 727 1HG2 ILE A 48 -13.655 -8.745 -5.046 1.00 0.270 H ATOM 728 2HG2 ILE A 48 -14.396 -10.184 -4.383 1.00 0.270 H ATOM 729 3HG2 ILE A 48 -14.504 -8.651 -3.490 1.00 0.270 H ATOM 730 1HD1 ILE A 48 -10.652 -6.659 -3.837 1.00 0.270 H ATOM 731 2HD1 ILE A 48 -10.436 -8.205 -4.695 1.00 0.270 H ATOM 732 3HD1 ILE A 48 -11.901 -7.248 -4.934 1.00 0.270 H ATOM 733 N LYS A 49 -13.360 -12.587 -2.969 1.00 0.160 N ATOM 734 CA LYS A 49 -14.199 -13.750 -3.277 1.00 0.160 C ATOM 735 C LYS A 49 -14.798 -14.419 -2.043 1.00 0.150 C ATOM 736 O LYS A 49 -15.924 -14.919 -2.081 1.00 0.170 O ATOM 737 CB LYS A 49 -13.435 -14.786 -4.099 1.00 0.220 C ATOM 738 CG LYS A 49 -13.172 -14.386 -5.552 1.00 0.220 C ATOM 739 CD LYS A 49 -12.399 -15.478 -6.282 1.00 0.220 C ATOM 740 CE LYS A 49 -12.196 -15.150 -7.758 1.00 0.220 C ATOM 741 NZ LYS A 49 -11.379 -16.192 -8.447 1.00 0.220 N ATOM 742 H LYS A 49 -12.376 -12.583 -3.250 1.00 0.190 H ATOM 743 HA LYS A 49 -15.032 -13.401 -3.886 1.00 0.190 H ATOM 744 1HB LYS A 49 -12.471 -14.970 -3.625 1.00 0.270 H ATOM 745 2HB LYS A 49 -13.984 -15.727 -4.095 1.00 0.270 H ATOM 746 1HG LYS A 49 -14.120 -14.210 -6.059 1.00 0.270 H ATOM 747 2HG LYS A 49 -12.593 -13.461 -5.568 1.00 0.270 H ATOM 748 1HD LYS A 49 -11.419 -15.597 -5.808 1.00 0.270 H ATOM 749 2HD LYS A 49 -12.936 -16.421 -6.199 1.00 0.270 H ATOM 750 1HE LYS A 49 -13.168 -15.086 -8.244 1.00 0.270 H ATOM 751 2HE LYS A 49 -11.699 -14.192 -7.848 1.00 0.270 H ATOM 752 1HZ LYS A 49 -11.267 -15.945 -9.421 1.00 0.270 H ATOM 753 2HZ LYS A 49 -10.468 -16.253 -8.007 1.00 0.270 H ATOM 754 3HZ LYS A 49 -11.844 -17.086 -8.380 1.00 0.270 H ATOM 755 N ASN A 50 -14.068 -14.381 -0.936 1.00 0.140 N ATOM 756 CA ASN A 50 -14.475 -14.997 0.314 1.00 0.160 C ATOM 757 C ASN A 50 -15.286 -14.057 1.209 1.00 0.210 C ATOM 758 O ASN A 50 -15.566 -14.394 2.361 1.00 0.250 O ATOM 759 CB ASN A 50 -13.251 -15.484 1.054 1.00 0.220 C ATOM 760 CG ASN A 50 -12.570 -16.627 0.363 1.00 0.220 C ATOM 761 OD1 ASN A 50 -13.207 -17.465 -0.289 1.00 0.220 O ATOM 762 ND2 ASN A 50 -11.269 -16.688 0.493 1.00 0.220 N ATOM 763 H ASN A 50 -13.126 -13.992 -0.996 1.00 0.170 H ATOM 764 HA ASN A 50 -15.112 -15.850 0.081 1.00 0.190 H ATOM 765 1HB ASN A 50 -12.547 -14.662 1.125 1.00 0.260 H ATOM 766 2HB ASN A 50 -13.520 -15.781 2.066 1.00 0.260 H ATOM 767 1HD2 ASN A 50 -10.757 -17.425 0.052 1.00 0.260 H ATOM 768 2HD2 ASN A 50 -10.785 -15.996 1.026 1.00 0.260 H ATOM 769 N LYS A 51 -15.676 -12.895 0.672 1.00 0.220 N ATOM 770 CA LYS A 51 -16.471 -11.881 1.354 1.00 0.280 C ATOM 771 C LYS A 51 -15.805 -11.245 2.572 1.00 0.290 C ATOM 772 O LYS A 51 -16.476 -10.930 3.556 1.00 0.340 O ATOM 773 CB LYS A 51 -17.829 -12.463 1.772 1.00 0.370 C ATOM 774 CG LYS A 51 -18.656 -13.013 0.617 1.00 0.370 C ATOM 775 CD LYS A 51 -20.013 -13.509 1.092 1.00 0.370 C ATOM 776 CE LYS A 51 -20.820 -14.105 -0.056 1.00 0.370 C ATOM 777 NZ LYS A 51 -22.138 -14.634 0.404 1.00 0.370 N ATOM 778 H LYS A 51 -15.396 -12.660 -0.287 1.00 0.260 H ATOM 779 HA LYS A 51 -16.654 -11.081 0.634 1.00 0.340 H ATOM 780 1HB LYS A 51 -17.698 -13.249 2.509 1.00 0.440 H ATOM 781 2HB LYS A 51 -18.419 -11.680 2.245 1.00 0.440 H ATOM 782 1HG LYS A 51 -18.795 -12.231 -0.128 1.00 0.440 H ATOM 783 2HG LYS A 51 -18.117 -13.839 0.150 1.00 0.440 H ATOM 784 1HD LYS A 51 -19.869 -14.270 1.861 1.00 0.440 H ATOM 785 2HD LYS A 51 -20.569 -12.680 1.527 1.00 0.440 H ATOM 786 1HE LYS A 51 -20.991 -13.336 -0.808 1.00 0.440 H ATOM 787 2HE LYS A 51 -20.250 -14.918 -0.506 1.00 0.440 H ATOM 788 1HZ LYS A 51 -22.640 -15.019 -0.384 1.00 0.440 H ATOM 789 2HZ LYS A 51 -21.991 -15.357 1.094 1.00 0.440 H ATOM 790 3HZ LYS A 51 -22.680 -13.885 0.813 1.00 0.440 H ATOM 791 N HIS A 52 -14.496 -10.998 2.491 1.00 0.230 N ATOM 792 CA HIS A 52 -13.803 -10.297 3.559 1.00 0.230 C ATOM 793 C HIS A 52 -13.504 -8.874 3.093 1.00 0.260 C ATOM 794 O HIS A 52 -13.321 -7.964 3.905 1.00 0.430 O ATOM 795 CB HIS A 52 -12.497 -10.996 3.932 1.00 0.320 C ATOM 796 CG HIS A 52 -12.683 -12.380 4.422 1.00 0.320 C ATOM 797 ND1 HIS A 52 -13.383 -12.674 5.570 1.00 0.320 N ATOM 798 CD2 HIS A 52 -12.237 -13.554 3.938 1.00 0.320 C ATOM 799 CE1 HIS A 52 -13.370 -13.981 5.758 1.00 0.320 C ATOM 800 NE2 HIS A 52 -12.675 -14.536 4.783 1.00 0.320 N ATOM 801 H HIS A 52 -13.968 -11.299 1.679 1.00 0.280 H ATOM 802 HA HIS A 52 -14.432 -10.240 4.444 1.00 0.280 H ATOM 803 1HB HIS A 52 -11.856 -11.036 3.057 1.00 0.390 H ATOM 804 2HB HIS A 52 -11.977 -10.421 4.695 1.00 0.390 H ATOM 805 HD1 HIS A 52 -14.104 -12.084 5.943 1.00 0.390 H ATOM 806 HD2 HIS A 52 -11.638 -13.809 3.071 1.00 0.390 H ATOM 807 HE1 HIS A 52 -13.877 -14.422 6.614 1.00 0.390 H ATOM 808 N MET A 53 -13.499 -8.683 1.770 1.00 0.170 N ATOM 809 CA MET A 53 -13.212 -7.397 1.155 1.00 0.130 C ATOM 810 C MET A 53 -14.232 -7.044 0.059 1.00 0.190 C ATOM 811 O MET A 53 -14.749 -7.902 -0.650 1.00 0.440 O ATOM 812 CB MET A 53 -11.781 -7.430 0.618 1.00 0.200 C ATOM 813 CG MET A 53 -11.269 -6.156 -0.073 1.00 0.200 C ATOM 814 SD MET A 53 -9.542 -6.326 -0.641 1.00 0.200 S ATOM 815 CE MET A 53 -8.634 -6.181 0.896 1.00 0.200 C ATOM 816 H MET A 53 -13.609 -9.493 1.165 1.00 0.200 H ATOM 817 HA MET A 53 -13.278 -6.626 1.921 1.00 0.160 H ATOM 818 1HB MET A 53 -11.120 -7.650 1.444 1.00 0.240 H ATOM 819 2HB MET A 53 -11.687 -8.249 -0.080 1.00 0.240 H ATOM 820 1HG MET A 53 -11.884 -5.921 -0.939 1.00 0.240 H ATOM 821 2HG MET A 53 -11.324 -5.316 0.618 1.00 0.240 H ATOM 822 1HE MET A 53 -7.571 -6.268 0.700 1.00 0.240 H ATOM 823 2HE MET A 53 -8.839 -5.211 1.351 1.00 0.240 H ATOM 824 3HE MET A 53 -8.933 -6.967 1.577 1.00 0.240 H ATOM 825 N ASN A 54 -14.562 -5.764 -0.044 1.00 0.190 N ATOM 826 CA ASN A 54 -15.457 -5.252 -1.082 1.00 0.190 C ATOM 827 C ASN A 54 -14.636 -4.612 -2.197 1.00 0.120 C ATOM 828 O ASN A 54 -13.925 -3.630 -1.961 1.00 0.100 O ATOM 829 CB ASN A 54 -16.505 -4.307 -0.517 1.00 0.270 C ATOM 830 CG ASN A 54 -17.550 -3.870 -1.557 1.00 0.270 C ATOM 831 OD1 ASN A 54 -17.275 -3.691 -2.762 1.00 0.270 O ATOM 832 ND2 ASN A 54 -18.771 -3.699 -1.093 1.00 0.270 N ATOM 833 H ASN A 54 -14.146 -5.107 0.604 1.00 0.230 H ATOM 834 HA ASN A 54 -15.988 -6.096 -1.526 1.00 0.230 H ATOM 835 1HB ASN A 54 -17.025 -4.806 0.302 1.00 0.320 H ATOM 836 2HB ASN A 54 -16.034 -3.431 -0.103 1.00 0.320 H ATOM 837 1HD2 ASN A 54 -19.509 -3.414 -1.712 1.00 0.320 H ATOM 838 2HD2 ASN A 54 -18.967 -3.850 -0.121 1.00 0.320 H ATOM 839 N ALA A 55 -14.704 -5.183 -3.394 1.00 0.130 N ATOM 840 CA ALA A 55 -13.900 -4.756 -4.542 1.00 0.130 C ATOM 841 C ALA A 55 -14.078 -3.281 -4.906 1.00 0.150 C ATOM 842 O ALA A 55 -13.179 -2.665 -5.478 1.00 0.190 O ATOM 843 CB ALA A 55 -14.268 -5.575 -5.761 1.00 0.180 C ATOM 844 H ALA A 55 -15.347 -5.958 -3.503 1.00 0.160 H ATOM 845 HA ALA A 55 -12.852 -4.922 -4.290 1.00 0.160 H ATOM 846 1HB ALA A 55 -13.639 -5.278 -6.600 1.00 0.220 H ATOM 847 2HB ALA A 55 -14.124 -6.616 -5.556 1.00 0.220 H ATOM 848 3HB ALA A 55 -15.315 -5.395 -6.012 1.00 0.220 H ATOM 849 N ASP A 56 -15.242 -2.719 -4.604 1.00 0.160 N ATOM 850 CA ASP A 56 -15.532 -1.343 -4.976 1.00 0.220 C ATOM 851 C ASP A 56 -15.150 -0.334 -3.895 1.00 0.250 C ATOM 852 O ASP A 56 -15.426 0.861 -4.033 1.00 0.350 O ATOM 853 CB ASP A 56 -17.020 -1.206 -5.290 1.00 0.280 C ATOM 854 CG ASP A 56 -17.465 -1.989 -6.537 1.00 0.280 C ATOM 855 OD1 ASP A 56 -16.692 -2.160 -7.458 1.00 0.280 O ATOM 856 OD2 ASP A 56 -18.590 -2.425 -6.541 1.00 0.280 O ATOM 857 H ASP A 56 -15.950 -3.248 -4.093 1.00 0.190 H ATOM 858 HA ASP A 56 -14.965 -1.107 -5.875 1.00 0.260 H ATOM 859 1HB ASP A 56 -17.599 -1.556 -4.434 1.00 0.340 H ATOM 860 2HB ASP A 56 -17.263 -0.154 -5.436 1.00 0.340 H ATOM 861 N THR A 57 -14.537 -0.795 -2.807 1.00 0.180 N ATOM 862 CA THR A 57 -14.175 0.119 -1.736 1.00 0.210 C ATOM 863 C THR A 57 -13.200 1.166 -2.249 1.00 0.210 C ATOM 864 O THR A 57 -12.168 0.827 -2.854 1.00 0.280 O ATOM 865 CB THR A 57 -13.489 -0.614 -0.558 1.00 0.280 C ATOM 866 OG1 THR A 57 -14.326 -1.654 -0.092 1.00 0.280 O ATOM 867 CG2 THR A 57 -13.246 0.368 0.604 1.00 0.280 C ATOM 868 H THR A 57 -14.309 -1.787 -2.719 1.00 0.220 H ATOM 869 HA THR A 57 -15.074 0.620 -1.378 1.00 0.250 H ATOM 870 HB THR A 57 -12.542 -1.039 -0.889 1.00 0.340 H ATOM 871 HG1 THR A 57 -14.305 -2.369 -0.759 1.00 0.340 H ATOM 872 1HG2 THR A 57 -12.776 -0.165 1.428 1.00 0.340 H ATOM 873 2HG2 THR A 57 -12.594 1.172 0.289 1.00 0.340 H ATOM 874 3HG2 THR A 57 -14.190 0.780 0.937 1.00 0.340 H ATOM 875 N ASP A 58 -13.527 2.424 -1.987 1.00 0.210 N ATOM 876 CA ASP A 58 -12.691 3.552 -2.332 1.00 0.220 C ATOM 877 C ASP A 58 -12.102 4.139 -1.056 1.00 0.180 C ATOM 878 O ASP A 58 -12.432 3.699 0.052 1.00 0.180 O ATOM 879 CB ASP A 58 -13.508 4.586 -3.122 1.00 0.300 C ATOM 880 CG ASP A 58 -12.657 5.546 -3.982 1.00 0.300 C ATOM 881 OD1 ASP A 58 -11.445 5.524 -3.840 1.00 0.300 O ATOM 882 OD2 ASP A 58 -13.217 6.280 -4.751 1.00 0.300 O ATOM 883 H ASP A 58 -14.404 2.586 -1.523 1.00 0.250 H ATOM 884 HA ASP A 58 -11.869 3.210 -2.952 1.00 0.260 H ATOM 885 1HB ASP A 58 -14.201 4.055 -3.783 1.00 0.360 H ATOM 886 2HB ASP A 58 -14.111 5.176 -2.432 1.00 0.360 H ATOM 887 N TYR A 59 -11.299 5.178 -1.203 1.00 0.210 N ATOM 888 CA TYR A 59 -10.662 5.819 -0.066 1.00 0.220 C ATOM 889 C TYR A 59 -11.667 6.359 0.948 1.00 0.230 C ATOM 890 O TYR A 59 -11.571 6.052 2.139 1.00 0.200 O ATOM 891 CB TYR A 59 -9.756 6.952 -0.543 1.00 0.300 C ATOM 892 CG TYR A 59 -9.036 7.615 0.575 1.00 0.300 C ATOM 893 CD1 TYR A 59 -7.852 7.054 1.037 1.00 0.300 C ATOM 894 CD2 TYR A 59 -9.552 8.755 1.169 1.00 0.300 C ATOM 895 CE1 TYR A 59 -7.192 7.631 2.079 1.00 0.300 C ATOM 896 CE2 TYR A 59 -8.892 9.328 2.221 1.00 0.300 C ATOM 897 CZ TYR A 59 -7.719 8.774 2.676 1.00 0.300 C ATOM 898 OH TYR A 59 -7.068 9.338 3.732 1.00 0.300 O ATOM 899 H TYR A 59 -11.088 5.479 -2.157 1.00 0.250 H ATOM 900 HA TYR A 59 -10.051 5.074 0.444 1.00 0.260 H ATOM 901 1HB TYR A 59 -9.018 6.561 -1.244 1.00 0.360 H ATOM 902 2HB TYR A 59 -10.346 7.700 -1.069 1.00 0.360 H ATOM 903 HD1 TYR A 59 -7.450 6.153 0.570 1.00 0.360 H ATOM 904 HD2 TYR A 59 -10.484 9.190 0.813 1.00 0.360 H ATOM 905 HE1 TYR A 59 -6.262 7.191 2.443 1.00 0.360 H ATOM 906 HE2 TYR A 59 -9.301 10.219 2.703 1.00 0.360 H ATOM 907 HH TYR A 59 -7.557 10.122 4.029 1.00 0.360 H ATOM 908 N SER A 60 -12.628 7.172 0.480 1.00 0.260 N ATOM 909 CA SER A 60 -13.604 7.794 1.374 1.00 0.270 C ATOM 910 C SER A 60 -14.506 6.788 2.071 1.00 0.240 C ATOM 911 O SER A 60 -14.913 7.000 3.218 1.00 0.260 O ATOM 912 CB SER A 60 -14.459 8.761 0.587 1.00 0.370 C ATOM 913 OG SER A 60 -15.237 8.077 -0.360 1.00 0.370 O ATOM 914 H SER A 60 -12.669 7.380 -0.509 1.00 0.310 H ATOM 915 HA SER A 60 -13.055 8.348 2.137 1.00 0.320 H ATOM 916 1HB SER A 60 -15.108 9.309 1.269 1.00 0.450 H ATOM 917 2HB SER A 60 -13.821 9.486 0.085 1.00 0.450 H ATOM 918 HG SER A 60 -15.781 8.746 -0.791 1.00 0.450 H ATOM 919 N ILE A 61 -14.760 5.660 1.418 1.00 0.240 N ATOM 920 CA ILE A 61 -15.580 4.620 2.005 1.00 0.220 C ATOM 921 C ILE A 61 -14.833 3.994 3.155 1.00 0.180 C ATOM 922 O ILE A 61 -15.383 3.828 4.248 1.00 0.170 O ATOM 923 CB ILE A 61 -15.950 3.532 0.975 1.00 0.320 C ATOM 924 CG1 ILE A 61 -16.881 4.145 -0.099 1.00 0.320 C ATOM 925 CG2 ILE A 61 -16.617 2.326 1.690 1.00 0.320 C ATOM 926 CD1 ILE A 61 -17.101 3.283 -1.343 1.00 0.320 C ATOM 927 H ILE A 61 -14.414 5.575 0.472 1.00 0.290 H ATOM 928 HA ILE A 61 -16.494 5.069 2.390 1.00 0.260 H ATOM 929 HB ILE A 61 -15.047 3.195 0.473 1.00 0.380 H ATOM 930 1HG1 ILE A 61 -17.851 4.333 0.360 1.00 0.380 H ATOM 931 2HG1 ILE A 61 -16.465 5.101 -0.418 1.00 0.380 H ATOM 932 1HG2 ILE A 61 -16.867 1.557 0.968 1.00 0.380 H ATOM 933 2HG2 ILE A 61 -15.942 1.895 2.427 1.00 0.380 H ATOM 934 3HG2 ILE A 61 -17.527 2.660 2.193 1.00 0.380 H ATOM 935 1HD1 ILE A 61 -17.772 3.810 -2.022 1.00 0.380 H ATOM 936 2HD1 ILE A 61 -16.171 3.104 -1.849 1.00 0.380 H ATOM 937 3HD1 ILE A 61 -17.549 2.332 -1.075 1.00 0.380 H ATOM 938 N ALA A 62 -13.580 3.617 2.901 1.00 0.160 N ATOM 939 CA ALA A 62 -12.770 3.000 3.926 1.00 0.130 C ATOM 940 C ALA A 62 -12.550 3.934 5.104 1.00 0.120 C ATOM 941 O ALA A 62 -12.614 3.501 6.262 1.00 0.120 O ATOM 942 CB ALA A 62 -11.433 2.597 3.343 1.00 0.190 C ATOM 943 H ALA A 62 -13.181 3.764 1.968 1.00 0.190 H ATOM 944 HA ALA A 62 -13.293 2.114 4.283 1.00 0.160 H ATOM 945 1HB ALA A 62 -10.832 2.111 4.106 1.00 0.230 H ATOM 946 2HB ALA A 62 -11.590 1.916 2.515 1.00 0.230 H ATOM 947 3HB ALA A 62 -10.917 3.489 2.982 1.00 0.230 H ATOM 948 N GLU A 63 -12.308 5.222 4.825 1.00 0.140 N ATOM 949 CA GLU A 63 -12.068 6.149 5.906 1.00 0.150 C ATOM 950 C GLU A 63 -13.315 6.282 6.755 1.00 0.150 C ATOM 951 O GLU A 63 -13.224 6.247 7.986 1.00 0.140 O ATOM 952 CB GLU A 63 -11.606 7.513 5.400 1.00 0.210 C ATOM 953 CG GLU A 63 -11.178 8.429 6.540 1.00 0.210 C ATOM 954 CD GLU A 63 -10.638 9.755 6.127 1.00 0.210 C ATOM 955 OE1 GLU A 63 -10.868 10.174 5.023 1.00 0.210 O ATOM 956 OE2 GLU A 63 -9.974 10.351 6.939 1.00 0.210 O ATOM 957 H GLU A 63 -12.241 5.542 3.853 1.00 0.170 H ATOM 958 HA GLU A 63 -11.276 5.745 6.534 1.00 0.180 H ATOM 959 1HB GLU A 63 -10.769 7.390 4.710 1.00 0.250 H ATOM 960 2HB GLU A 63 -12.419 7.993 4.851 1.00 0.250 H ATOM 961 1HG GLU A 63 -12.038 8.601 7.175 1.00 0.250 H ATOM 962 2HG GLU A 63 -10.428 7.913 7.138 1.00 0.250 H ATOM 963 N ALA A 64 -14.488 6.420 6.116 1.00 0.170 N ATOM 964 CA ALA A 64 -15.721 6.541 6.865 1.00 0.190 C ATOM 965 C ALA A 64 -15.970 5.303 7.705 1.00 0.180 C ATOM 966 O ALA A 64 -16.368 5.417 8.864 1.00 0.190 O ATOM 967 CB ALA A 64 -16.885 6.747 5.921 1.00 0.260 C ATOM 968 H ALA A 64 -14.524 6.469 5.093 1.00 0.200 H ATOM 969 HA ALA A 64 -15.634 7.399 7.527 1.00 0.230 H ATOM 970 1HB ALA A 64 -17.800 6.854 6.489 1.00 0.310 H ATOM 971 2HB ALA A 64 -16.712 7.644 5.326 1.00 0.310 H ATOM 972 3HB ALA A 64 -16.962 5.883 5.256 1.00 0.310 H ATOM 973 N ALA A 65 -15.704 4.116 7.150 1.00 0.160 N ATOM 974 CA ALA A 65 -15.920 2.886 7.888 1.00 0.160 C ATOM 975 C ALA A 65 -15.061 2.841 9.145 1.00 0.150 C ATOM 976 O ALA A 65 -15.492 2.391 10.217 1.00 0.160 O ATOM 977 CB ALA A 65 -15.599 1.694 7.004 1.00 0.220 C ATOM 978 H ALA A 65 -15.400 4.061 6.172 1.00 0.190 H ATOM 979 HA ALA A 65 -16.968 2.848 8.182 1.00 0.190 H ATOM 980 1HB ALA A 65 -15.783 0.770 7.541 1.00 0.270 H ATOM 981 2HB ALA A 65 -16.234 1.732 6.117 1.00 0.270 H ATOM 982 3HB ALA A 65 -14.555 1.740 6.705 1.00 0.270 H ATOM 983 N PHE A 66 -13.824 3.319 9.052 1.00 0.130 N ATOM 984 CA PHE A 66 -12.991 3.294 10.244 1.00 0.130 C ATOM 985 C PHE A 66 -13.475 4.371 11.225 1.00 0.140 C ATOM 986 O PHE A 66 -13.711 4.093 12.402 1.00 0.160 O ATOM 987 CB PHE A 66 -11.514 3.399 9.858 1.00 0.180 C ATOM 988 CG PHE A 66 -10.491 3.150 10.984 1.00 0.180 C ATOM 989 CD1 PHE A 66 -10.445 1.923 11.652 1.00 0.180 C ATOM 990 CD2 PHE A 66 -9.524 4.080 11.306 1.00 0.180 C ATOM 991 CE1 PHE A 66 -9.506 1.661 12.607 1.00 0.180 C ATOM 992 CE2 PHE A 66 -8.568 3.806 12.273 1.00 0.180 C ATOM 993 CZ PHE A 66 -8.569 2.599 12.921 1.00 0.180 C ATOM 994 H PHE A 66 -13.456 3.634 8.143 1.00 0.160 H ATOM 995 HA PHE A 66 -13.123 2.334 10.736 1.00 0.160 H ATOM 996 1HB PHE A 66 -11.320 2.690 9.061 1.00 0.220 H ATOM 997 2HB PHE A 66 -11.334 4.394 9.444 1.00 0.220 H ATOM 998 HD1 PHE A 66 -11.162 1.159 11.431 1.00 0.220 H ATOM 999 HD2 PHE A 66 -9.507 5.034 10.781 1.00 0.220 H ATOM 1000 HE1 PHE A 66 -9.507 0.690 13.115 1.00 0.220 H ATOM 1001 HE2 PHE A 66 -7.806 4.544 12.515 1.00 0.220 H ATOM 1002 HZ PHE A 66 -7.818 2.382 13.676 1.00 0.220 H ATOM 1003 N ASN A 67 -13.739 5.589 10.729 1.00 0.130 N ATOM 1004 CA ASN A 67 -14.167 6.696 11.594 1.00 0.140 C ATOM 1005 C ASN A 67 -15.473 6.399 12.337 1.00 0.160 C ATOM 1006 O ASN A 67 -15.665 6.827 13.474 1.00 0.180 O ATOM 1007 CB ASN A 67 -14.357 7.982 10.804 1.00 0.190 C ATOM 1008 CG ASN A 67 -13.077 8.661 10.336 1.00 0.190 C ATOM 1009 OD1 ASN A 67 -11.960 8.374 10.771 1.00 0.190 O ATOM 1010 ND2 ASN A 67 -13.251 9.607 9.454 1.00 0.190 N ATOM 1011 H ASN A 67 -13.585 5.768 9.733 1.00 0.160 H ATOM 1012 HA ASN A 67 -13.407 6.862 12.339 1.00 0.170 H ATOM 1013 1HB ASN A 67 -14.963 7.759 9.925 1.00 0.230 H ATOM 1014 2HB ASN A 67 -14.922 8.688 11.409 1.00 0.230 H ATOM 1015 1HD2 ASN A 67 -12.466 10.123 9.107 1.00 0.230 H ATOM 1016 2HD2 ASN A 67 -14.169 9.825 9.128 1.00 0.230 H ATOM 1017 N LYS A 68 -16.370 5.651 11.702 1.00 0.170 N ATOM 1018 CA LYS A 68 -17.657 5.294 12.284 1.00 0.190 C ATOM 1019 C LYS A 68 -17.623 4.018 13.130 1.00 0.190 C ATOM 1020 O LYS A 68 -18.646 3.630 13.697 1.00 0.220 O ATOM 1021 CB LYS A 68 -18.697 5.122 11.178 1.00 0.260 C ATOM 1022 CG LYS A 68 -19.051 6.398 10.423 1.00 0.260 C ATOM 1023 CD LYS A 68 -20.060 6.104 9.319 1.00 0.260 C ATOM 1024 CE LYS A 68 -20.441 7.360 8.550 1.00 0.260 C ATOM 1025 NZ LYS A 68 -21.412 7.064 7.455 1.00 0.260 N ATOM 1026 H LYS A 68 -16.179 5.374 10.735 1.00 0.200 H ATOM 1027 HA LYS A 68 -17.970 6.111 12.933 1.00 0.230 H ATOM 1028 1HB LYS A 68 -18.313 4.407 10.443 1.00 0.310 H ATOM 1029 2HB LYS A 68 -19.610 4.703 11.593 1.00 0.310 H ATOM 1030 1HG LYS A 68 -19.476 7.120 11.120 1.00 0.310 H ATOM 1031 2HG LYS A 68 -18.150 6.828 9.988 1.00 0.310 H ATOM 1032 1HD LYS A 68 -19.623 5.378 8.623 1.00 0.310 H ATOM 1033 2HD LYS A 68 -20.956 5.662 9.753 1.00 0.310 H ATOM 1034 1HE LYS A 68 -20.889 8.076 9.236 1.00 0.310 H ATOM 1035 2HE LYS A 68 -19.542 7.799 8.117 1.00 0.310 H ATOM 1036 1HZ LYS A 68 -21.643 7.918 6.965 1.00 0.310 H ATOM 1037 2HZ LYS A 68 -21.001 6.406 6.807 1.00 0.310 H ATOM 1038 3HZ LYS A 68 -22.254 6.664 7.848 1.00 0.310 H ATOM 1039 N GLY A 69 -16.472 3.341 13.192 1.00 0.180 N ATOM 1040 CA GLY A 69 -16.352 2.093 13.931 1.00 0.180 C ATOM 1041 C GLY A 69 -16.921 0.852 13.218 1.00 0.190 C ATOM 1042 O GLY A 69 -17.260 -0.126 13.888 1.00 0.210 O ATOM 1043 H GLY A 69 -15.628 3.711 12.748 1.00 0.220 H ATOM 1044 1HA GLY A 69 -15.295 1.925 14.143 1.00 0.220 H ATOM 1045 2HA GLY A 69 -16.843 2.209 14.895 1.00 0.220 H ATOM 1046 N GLU A 70 -17.075 0.888 11.880 1.00 0.180 N ATOM 1047 CA GLU A 70 -17.624 -0.248 11.137 1.00 0.190 C ATOM 1048 C GLU A 70 -16.545 -1.317 10.971 1.00 0.180 C ATOM 1049 O GLU A 70 -16.825 -2.517 10.990 1.00 0.190 O ATOM 1050 CB GLU A 70 -18.126 0.198 9.764 1.00 0.260 C ATOM 1051 CG GLU A 70 -19.321 1.145 9.791 1.00 0.260 C ATOM 1052 CD GLU A 70 -19.732 1.604 8.410 1.00 0.260 C ATOM 1053 OE1 GLU A 70 -19.060 1.253 7.468 1.00 0.260 O ATOM 1054 OE2 GLU A 70 -20.710 2.306 8.300 1.00 0.260 O ATOM 1055 H GLU A 70 -16.750 1.686 11.339 1.00 0.220 H ATOM 1056 HA GLU A 70 -18.454 -0.673 11.702 1.00 0.230 H ATOM 1057 1HB GLU A 70 -17.329 0.690 9.250 1.00 0.310 H ATOM 1058 2HB GLU A 70 -18.402 -0.677 9.178 1.00 0.310 H ATOM 1059 1HG GLU A 70 -20.160 0.642 10.265 1.00 0.310 H ATOM 1060 2HG GLU A 70 -19.063 2.013 10.397 1.00 0.310 H ATOM 1061 N THR A 71 -15.306 -0.853 10.806 1.00 0.150 N ATOM 1062 CA THR A 71 -14.137 -1.725 10.660 1.00 0.140 C ATOM 1063 C THR A 71 -13.176 -1.560 11.813 1.00 0.130 C ATOM 1064 O THR A 71 -12.976 -0.467 12.340 1.00 0.120 O ATOM 1065 CB THR A 71 -13.322 -1.535 9.362 1.00 0.200 C ATOM 1066 OG1 THR A 71 -12.149 -2.395 9.456 1.00 0.200 O ATOM 1067 CG2 THR A 71 -12.884 -0.130 9.195 1.00 0.200 C ATOM 1068 H THR A 71 -15.203 0.161 10.783 1.00 0.180 H ATOM 1069 HA THR A 71 -14.482 -2.759 10.671 1.00 0.170 H ATOM 1070 HB THR A 71 -13.924 -1.832 8.506 1.00 0.240 H ATOM 1071 HG1 THR A 71 -11.507 -2.204 8.714 1.00 0.240 H ATOM 1072 1HG2 THR A 71 -12.301 -0.032 8.280 1.00 0.240 H ATOM 1073 2HG2 THR A 71 -13.746 0.485 9.137 1.00 0.240 H ATOM 1074 3HG2 THR A 71 -12.288 0.156 10.012 1.00 0.240 H ATOM 1075 N ALA A 72 -12.565 -2.664 12.221 1.00 0.140 N ATOM 1076 CA ALA A 72 -11.553 -2.618 13.270 1.00 0.140 C ATOM 1077 C ALA A 72 -10.189 -2.213 12.709 1.00 0.120 C ATOM 1078 O ALA A 72 -9.242 -1.985 13.465 1.00 0.120 O ATOM 1079 CB ALA A 72 -11.443 -3.968 13.958 1.00 0.200 C ATOM 1080 H ALA A 72 -12.789 -3.538 11.765 1.00 0.170 H ATOM 1081 HA ALA A 72 -11.855 -1.868 14.000 1.00 0.170 H ATOM 1082 1HB ALA A 72 -10.701 -3.908 14.754 1.00 0.240 H ATOM 1083 2HB ALA A 72 -12.408 -4.242 14.380 1.00 0.240 H ATOM 1084 3HB ALA A 72 -11.136 -4.719 13.232 1.00 0.240 H ATOM 1085 N MET A 73 -10.077 -2.164 11.385 1.00 0.100 N ATOM 1086 CA MET A 73 -8.816 -1.842 10.735 1.00 0.090 C ATOM 1087 C MET A 73 -8.965 -1.195 9.365 1.00 0.070 C ATOM 1088 O MET A 73 -9.876 -1.513 8.580 1.00 0.080 O ATOM 1089 CB MET A 73 -7.933 -3.099 10.618 1.00 0.130 C ATOM 1090 CG MET A 73 -6.588 -2.880 9.846 1.00 0.130 C ATOM 1091 SD MET A 73 -5.486 -4.292 9.834 1.00 0.130 S ATOM 1092 CE MET A 73 -4.224 -3.646 8.716 1.00 0.130 C ATOM 1093 H MET A 73 -10.905 -2.343 10.821 1.00 0.120 H ATOM 1094 HA MET A 73 -8.294 -1.122 11.364 1.00 0.110 H ATOM 1095 1HB MET A 73 -7.691 -3.463 11.616 1.00 0.160 H ATOM 1096 2HB MET A 73 -8.491 -3.885 10.109 1.00 0.160 H ATOM 1097 1HG MET A 73 -6.801 -2.656 8.804 1.00 0.160 H ATOM 1098 2HG MET A 73 -6.047 -2.035 10.275 1.00 0.160 H ATOM 1099 1HE MET A 73 -3.446 -4.386 8.581 1.00 0.160 H ATOM 1100 2HE MET A 73 -4.678 -3.422 7.753 1.00 0.160 H ATOM 1101 3HE MET A 73 -3.793 -2.733 9.133 1.00 0.160 H ATOM 1102 N THR A 74 -7.992 -0.340 9.063 1.00 0.060 N ATOM 1103 CA THR A 74 -7.834 0.293 7.769 1.00 0.060 C ATOM 1104 C THR A 74 -6.362 0.617 7.581 1.00 0.070 C ATOM 1105 O THR A 74 -5.618 0.746 8.558 1.00 0.080 O ATOM 1106 CB THR A 74 -8.659 1.574 7.630 1.00 0.080 C ATOM 1107 OG1 THR A 74 -8.600 2.020 6.274 1.00 0.080 O ATOM 1108 CG2 THR A 74 -8.081 2.656 8.522 1.00 0.080 C ATOM 1109 H THR A 74 -7.308 -0.125 9.776 1.00 0.070 H ATOM 1110 HA THR A 74 -8.135 -0.405 6.988 1.00 0.070 H ATOM 1111 HB THR A 74 -9.692 1.369 7.906 1.00 0.100 H ATOM 1112 HG1 THR A 74 -9.187 2.773 6.169 1.00 0.100 H ATOM 1113 1HG2 THR A 74 -8.677 3.560 8.417 1.00 0.100 H ATOM 1114 2HG2 THR A 74 -8.107 2.314 9.549 1.00 0.100 H ATOM 1115 3HG2 THR A 74 -7.055 2.884 8.249 1.00 0.100 H ATOM 1116 N ILE A 75 -5.938 0.741 6.336 1.00 0.070 N ATOM 1117 CA ILE A 75 -4.567 1.114 6.029 1.00 0.080 C ATOM 1118 C ILE A 75 -4.528 2.519 5.474 1.00 0.090 C ATOM 1119 O ILE A 75 -5.213 2.825 4.499 1.00 0.110 O ATOM 1120 CB ILE A 75 -3.928 0.121 5.036 1.00 0.110 C ATOM 1121 CG1 ILE A 75 -3.919 -1.283 5.702 1.00 0.110 C ATOM 1122 CG2 ILE A 75 -2.508 0.601 4.606 1.00 0.110 C ATOM 1123 CD1 ILE A 75 -3.488 -2.428 4.809 1.00 0.110 C ATOM 1124 H ILE A 75 -6.612 0.623 5.587 1.00 0.080 H ATOM 1125 HA ILE A 75 -3.984 1.100 6.949 1.00 0.100 H ATOM 1126 HB ILE A 75 -4.557 0.050 4.148 1.00 0.130 H ATOM 1127 1HG1 ILE A 75 -3.281 -1.245 6.567 1.00 0.130 H ATOM 1128 2HG1 ILE A 75 -4.927 -1.505 6.040 1.00 0.130 H ATOM 1129 1HG2 ILE A 75 -2.075 -0.099 3.899 1.00 0.130 H ATOM 1130 2HG2 ILE A 75 -2.573 1.576 4.127 1.00 0.130 H ATOM 1131 3HG2 ILE A 75 -1.866 0.675 5.478 1.00 0.130 H ATOM 1132 1HD1 ILE A 75 -3.535 -3.359 5.371 1.00 0.130 H ATOM 1133 2HD1 ILE A 75 -4.157 -2.491 3.948 1.00 0.130 H ATOM 1134 3HD1 ILE A 75 -2.471 -2.277 4.462 1.00 0.130 H ATOM 1135 N ASN A 76 -3.736 3.378 6.100 1.00 0.120 N ATOM 1136 CA ASN A 76 -3.647 4.750 5.647 1.00 0.150 C ATOM 1137 C ASN A 76 -2.328 5.368 6.091 1.00 0.190 C ATOM 1138 O ASN A 76 -1.534 4.722 6.778 1.00 0.220 O ATOM 1139 CB ASN A 76 -4.844 5.520 6.193 1.00 0.200 C ATOM 1140 CG ASN A 76 -5.297 6.622 5.316 1.00 0.200 C ATOM 1141 OD1 ASN A 76 -4.472 7.223 4.622 1.00 0.200 O ATOM 1142 ND2 ASN A 76 -6.569 6.911 5.335 1.00 0.200 N ATOM 1143 H ASN A 76 -3.201 3.068 6.901 1.00 0.140 H ATOM 1144 HA ASN A 76 -3.674 4.763 4.563 1.00 0.180 H ATOM 1145 1HB ASN A 76 -5.678 4.838 6.355 1.00 0.240 H ATOM 1146 2HB ASN A 76 -4.578 5.945 7.164 1.00 0.240 H ATOM 1147 1HD2 ASN A 76 -6.902 7.669 4.765 1.00 0.240 H ATOM 1148 2HD2 ASN A 76 -7.200 6.397 5.916 1.00 0.240 H ATOM 1149 N GLY A 77 -2.109 6.622 5.729 1.00 0.230 N ATOM 1150 CA GLY A 77 -0.909 7.320 6.137 1.00 0.270 C ATOM 1151 C GLY A 77 -1.225 8.303 7.254 1.00 0.230 C ATOM 1152 O GLY A 77 -2.392 8.472 7.621 1.00 0.200 O ATOM 1153 H GLY A 77 -2.809 7.085 5.158 1.00 0.280 H ATOM 1154 1HA GLY A 77 -0.162 6.600 6.468 1.00 0.320 H ATOM 1155 2HA GLY A 77 -0.508 7.829 5.278 1.00 0.320 H ATOM 1156 N PRO A 78 -0.221 9.058 7.733 1.00 0.250 N ATOM 1157 CA PRO A 78 -0.316 10.009 8.825 1.00 0.250 C ATOM 1158 C PRO A 78 -1.271 11.158 8.586 1.00 0.240 C ATOM 1159 O PRO A 78 -1.795 11.749 9.530 1.00 0.250 O ATOM 1160 CB PRO A 78 1.132 10.495 8.971 1.00 0.380 C ATOM 1161 CG PRO A 78 1.784 10.222 7.634 1.00 0.380 C ATOM 1162 CD PRO A 78 1.128 8.961 7.130 1.00 0.380 C ATOM 1163 HA PRO A 78 -0.615 9.463 9.710 1.00 0.300 H ATOM 1164 1HB PRO A 78 1.141 11.563 9.240 1.00 0.450 H ATOM 1165 2HB PRO A 78 1.618 9.959 9.797 1.00 0.450 H ATOM 1166 1HG PRO A 78 1.643 11.081 6.957 1.00 0.450 H ATOM 1167 2HG PRO A 78 2.872 10.105 7.767 1.00 0.450 H ATOM 1168 1HD PRO A 78 1.113 9.011 6.040 1.00 0.450 H ATOM 1169 2HD PRO A 78 1.657 8.068 7.502 1.00 0.450 H ATOM 1170 N TRP A 79 -1.553 11.459 7.326 1.00 0.250 N ATOM 1171 CA TRP A 79 -2.441 12.559 7.016 1.00 0.270 C ATOM 1172 C TRP A 79 -3.872 12.311 7.471 1.00 0.240 C ATOM 1173 O TRP A 79 -4.657 13.249 7.604 1.00 0.260 O ATOM 1174 CB TRP A 79 -2.450 12.813 5.510 1.00 0.370 C ATOM 1175 CG TRP A 79 -2.903 11.618 4.716 1.00 0.370 C ATOM 1176 CD1 TRP A 79 -4.191 11.258 4.467 1.00 0.370 C ATOM 1177 CD2 TRP A 79 -2.078 10.638 4.037 1.00 0.370 C ATOM 1178 NE1 TRP A 79 -4.231 10.127 3.716 1.00 0.370 N ATOM 1179 CE2 TRP A 79 -2.949 9.730 3.433 1.00 0.370 C ATOM 1180 CE3 TRP A 79 -0.691 10.465 3.889 1.00 0.370 C ATOM 1181 CZ2 TRP A 79 -2.492 8.653 2.697 1.00 0.370 C ATOM 1182 CZ3 TRP A 79 -0.231 9.384 3.132 1.00 0.370 C ATOM 1183 CH2 TRP A 79 -1.115 8.498 2.555 1.00 0.370 C ATOM 1184 H TRP A 79 -1.132 10.958 6.558 1.00 0.300 H ATOM 1185 HA TRP A 79 -2.068 13.449 7.520 1.00 0.320 H ATOM 1186 1HB TRP A 79 -3.118 13.645 5.285 1.00 0.440 H ATOM 1187 2HB TRP A 79 -1.454 13.093 5.180 1.00 0.440 H ATOM 1188 HD1 TRP A 79 -5.068 11.791 4.827 1.00 0.440 H ATOM 1189 HE1 TRP A 79 -5.101 9.670 3.426 1.00 0.440 H ATOM 1190 HE3 TRP A 79 0.012 11.159 4.342 1.00 0.440 H ATOM 1191 HZ2 TRP A 79 -3.177 7.955 2.239 1.00 0.440 H ATOM 1192 HZ3 TRP A 79 0.845 9.254 3.013 1.00 0.440 H ATOM 1193 HH2 TRP A 79 -0.727 7.660 1.973 1.00 0.440 H ATOM 1194 N ALA A 80 -4.229 11.047 7.697 1.00 0.210 N ATOM 1195 CA ALA A 80 -5.580 10.704 8.095 1.00 0.190 C ATOM 1196 C ALA A 80 -5.764 10.725 9.605 1.00 0.190 C ATOM 1197 O ALA A 80 -6.882 10.535 10.105 1.00 0.170 O ATOM 1198 CB ALA A 80 -5.930 9.339 7.556 1.00 0.270 C ATOM 1199 H ALA A 80 -3.537 10.293 7.601 1.00 0.250 H ATOM 1200 HA ALA A 80 -6.256 11.439 7.661 1.00 0.230 H ATOM 1201 1HB ALA A 80 -6.959 9.091 7.816 1.00 0.330 H ATOM 1202 2HB ALA A 80 -5.819 9.357 6.474 1.00 0.330 H ATOM 1203 3HB ALA A 80 -5.250 8.600 7.982 1.00 0.330 H ATOM 1204 N TRP A 81 -4.689 10.961 10.358 1.00 0.210 N ATOM 1205 CA TRP A 81 -4.826 10.871 11.797 1.00 0.230 C ATOM 1206 C TRP A 81 -5.687 11.987 12.376 1.00 0.230 C ATOM 1207 O TRP A 81 -6.369 11.788 13.383 1.00 0.240 O ATOM 1208 CB TRP A 81 -3.460 10.761 12.452 1.00 0.310 C ATOM 1209 CG TRP A 81 -2.780 9.432 12.090 1.00 0.310 C ATOM 1210 CD1 TRP A 81 -3.371 8.313 11.534 1.00 0.310 C ATOM 1211 CD2 TRP A 81 -1.388 9.101 12.230 1.00 0.310 C ATOM 1212 NE1 TRP A 81 -2.440 7.349 11.321 1.00 0.310 N ATOM 1213 CE2 TRP A 81 -1.225 7.803 11.729 1.00 0.310 C ATOM 1214 CE3 TRP A 81 -0.277 9.790 12.711 1.00 0.310 C ATOM 1215 CZ2 TRP A 81 0.003 7.190 11.688 1.00 0.310 C ATOM 1216 CZ3 TRP A 81 0.958 9.165 12.674 1.00 0.310 C ATOM 1217 CH2 TRP A 81 1.093 7.901 12.173 1.00 0.310 C ATOM 1218 H TRP A 81 -3.775 11.177 9.941 1.00 0.250 H ATOM 1219 HA TRP A 81 -5.315 9.943 12.017 1.00 0.280 H ATOM 1220 1HB TRP A 81 -2.824 11.583 12.117 1.00 0.380 H ATOM 1221 2HB TRP A 81 -3.557 10.824 13.534 1.00 0.380 H ATOM 1222 HD1 TRP A 81 -4.416 8.194 11.276 1.00 0.380 H ATOM 1223 HE1 TRP A 81 -2.617 6.442 10.911 1.00 0.380 H ATOM 1224 HE3 TRP A 81 -0.379 10.800 13.102 1.00 0.380 H ATOM 1225 HZ2 TRP A 81 0.131 6.185 11.290 1.00 0.380 H ATOM 1226 HZ3 TRP A 81 1.822 9.709 13.050 1.00 0.380 H ATOM 1227 HH2 TRP A 81 2.079 7.441 12.154 1.00 0.380 H ATOM 1228 N SER A 82 -5.722 13.145 11.726 1.00 0.220 N ATOM 1229 CA SER A 82 -6.532 14.244 12.218 1.00 0.220 C ATOM 1230 C SER A 82 -8.016 13.883 12.218 1.00 0.210 C ATOM 1231 O SER A 82 -8.759 14.266 13.137 1.00 0.200 O ATOM 1232 CB SER A 82 -6.320 15.472 11.350 1.00 0.310 C ATOM 1233 OG SER A 82 -5.006 15.957 11.462 1.00 0.310 O ATOM 1234 H SER A 82 -5.148 13.290 10.904 1.00 0.260 H ATOM 1235 HA SER A 82 -6.229 14.470 13.241 1.00 0.260 H ATOM 1236 1HB SER A 82 -6.529 15.218 10.309 1.00 0.370 H ATOM 1237 2HB SER A 82 -7.025 16.249 11.644 1.00 0.370 H ATOM 1238 HG SER A 82 -4.956 16.721 10.880 1.00 0.370 H ATOM 1239 N ASN A 83 -8.454 13.149 11.190 1.00 0.220 N ATOM 1240 CA ASN A 83 -9.860 12.819 11.044 1.00 0.200 C ATOM 1241 C ASN A 83 -10.290 11.747 12.031 1.00 0.180 C ATOM 1242 O ASN A 83 -11.380 11.835 12.617 1.00 0.180 O ATOM 1243 CB ASN A 83 -10.134 12.384 9.624 1.00 0.290 C ATOM 1244 CG ASN A 83 -10.041 13.528 8.648 1.00 0.290 C ATOM 1245 OD1 ASN A 83 -10.126 14.708 9.016 1.00 0.290 O ATOM 1246 ND2 ASN A 83 -9.863 13.201 7.399 1.00 0.290 N ATOM 1247 H ASN A 83 -7.791 12.830 10.489 1.00 0.260 H ATOM 1248 HA ASN A 83 -10.448 13.712 11.257 1.00 0.240 H ATOM 1249 1HB ASN A 83 -9.412 11.614 9.332 1.00 0.350 H ATOM 1250 2HB ASN A 83 -11.125 11.939 9.559 1.00 0.350 H ATOM 1251 1HD2 ASN A 83 -9.791 13.908 6.699 1.00 0.350 H ATOM 1252 2HD2 ASN A 83 -9.810 12.216 7.132 1.00 0.350 H ATOM 1253 N ILE A 84 -9.433 10.750 12.237 1.00 0.190 N ATOM 1254 CA ILE A 84 -9.768 9.673 13.163 1.00 0.200 C ATOM 1255 C ILE A 84 -9.765 10.177 14.625 1.00 0.250 C ATOM 1256 O ILE A 84 -10.536 9.697 15.472 1.00 0.320 O ATOM 1257 CB ILE A 84 -8.867 8.443 12.905 1.00 0.280 C ATOM 1258 CG1 ILE A 84 -9.370 7.176 13.593 1.00 0.280 C ATOM 1259 CG2 ILE A 84 -7.513 8.722 13.290 1.00 0.280 C ATOM 1260 CD1 ILE A 84 -10.703 6.676 13.074 1.00 0.280 C ATOM 1261 H ILE A 84 -8.562 10.723 11.692 1.00 0.230 H ATOM 1262 HA ILE A 84 -10.780 9.377 12.930 1.00 0.240 H ATOM 1263 HB ILE A 84 -8.876 8.240 11.834 1.00 0.330 H ATOM 1264 1HG1 ILE A 84 -8.638 6.415 13.423 1.00 0.330 H ATOM 1265 2HG1 ILE A 84 -9.441 7.338 14.667 1.00 0.330 H ATOM 1266 1HG2 ILE A 84 -6.863 7.880 13.056 1.00 0.330 H ATOM 1267 2HG2 ILE A 84 -7.225 9.566 12.748 1.00 0.330 H ATOM 1268 3HG2 ILE A 84 -7.468 8.930 14.323 1.00 0.330 H ATOM 1269 1HD1 ILE A 84 -10.960 5.754 13.561 1.00 0.330 H ATOM 1270 2HD1 ILE A 84 -11.469 7.399 13.272 1.00 0.330 H ATOM 1271 3HD1 ILE A 84 -10.650 6.502 12.014 1.00 0.330 H ATOM 1272 N ASP A 85 -8.881 11.150 14.924 1.00 0.250 N ATOM 1273 CA ASP A 85 -8.823 11.762 16.246 1.00 0.290 C ATOM 1274 C ASP A 85 -10.105 12.581 16.470 1.00 0.220 C ATOM 1275 O ASP A 85 -10.776 12.442 17.496 1.00 0.340 O ATOM 1276 CB ASP A 85 -7.576 12.647 16.358 1.00 0.390 C ATOM 1277 CG ASP A 85 -7.290 13.191 17.762 1.00 0.390 C ATOM 1278 OD1 ASP A 85 -6.981 12.413 18.638 1.00 0.390 O ATOM 1279 OD2 ASP A 85 -7.374 14.385 17.934 1.00 0.390 O ATOM 1280 H ASP A 85 -8.206 11.459 14.217 1.00 0.300 H ATOM 1281 HA ASP A 85 -8.771 10.974 16.998 1.00 0.350 H ATOM 1282 1HB ASP A 85 -6.709 12.078 16.020 1.00 0.470 H ATOM 1283 2HB ASP A 85 -7.679 13.493 15.674 1.00 0.470 H ATOM 1284 N THR A 86 -10.511 13.352 15.453 1.00 0.180 N ATOM 1285 CA THR A 86 -11.717 14.177 15.493 1.00 0.240 C ATOM 1286 C THR A 86 -12.952 13.314 15.742 1.00 0.280 C ATOM 1287 O THR A 86 -13.864 13.696 16.481 1.00 0.370 O ATOM 1288 CB THR A 86 -11.887 14.978 14.179 1.00 0.310 C ATOM 1289 OG1 THR A 86 -10.765 15.860 14.004 1.00 0.310 O ATOM 1290 CG2 THR A 86 -13.167 15.810 14.222 1.00 0.310 C ATOM 1291 H THR A 86 -9.920 13.438 14.627 1.00 0.220 H ATOM 1292 HA THR A 86 -11.622 14.884 16.315 1.00 0.290 H ATOM 1293 HB THR A 86 -11.933 14.292 13.336 1.00 0.370 H ATOM 1294 HG1 THR A 86 -9.963 15.335 13.790 1.00 0.370 H ATOM 1295 1HG2 THR A 86 -13.259 16.368 13.293 1.00 0.370 H ATOM 1296 2HG2 THR A 86 -14.036 15.164 14.337 1.00 0.370 H ATOM 1297 3HG2 THR A 86 -13.120 16.503 15.060 1.00 0.370 H ATOM 1298 N SER A 87 -12.958 12.135 15.129 1.00 0.270 N ATOM 1299 CA SER A 87 -14.049 11.173 15.183 1.00 0.420 C ATOM 1300 C SER A 87 -14.148 10.406 16.514 1.00 0.430 C ATOM 1301 O SER A 87 -15.061 9.618 16.705 1.00 1.300 O ATOM 1302 CB SER A 87 -13.894 10.192 14.036 1.00 0.530 C ATOM 1303 OG SER A 87 -13.994 10.853 12.800 1.00 0.530 O ATOM 1304 H SER A 87 -12.177 11.931 14.504 1.00 0.320 H ATOM 1305 HA SER A 87 -14.981 11.720 15.042 1.00 0.500 H ATOM 1306 1HB SER A 87 -12.931 9.690 14.109 1.00 0.630 H ATOM 1307 2HB SER A 87 -14.667 9.426 14.105 1.00 0.630 H ATOM 1308 HG SER A 87 -13.118 11.274 12.651 1.00 0.630 H ATOM 1309 N LYS A 88 -13.208 10.598 17.426 1.00 0.910 N ATOM 1310 CA LYS A 88 -13.198 9.933 18.726 1.00 0.950 C ATOM 1311 C LYS A 88 -13.148 8.415 18.662 1.00 0.680 C ATOM 1312 O LYS A 88 -13.758 7.727 19.486 1.00 0.510 O ATOM 1313 CB LYS A 88 -14.408 10.371 19.561 1.00 1.310 C ATOM 1314 CG LYS A 88 -14.468 11.867 19.823 1.00 1.310 C ATOM 1315 CD LYS A 88 -15.655 12.231 20.699 1.00 1.310 C ATOM 1316 CE LYS A 88 -15.746 13.737 20.908 1.00 1.310 C ATOM 1317 NZ LYS A 88 -16.930 14.115 21.735 1.00 1.310 N ATOM 1318 H LYS A 88 -12.451 11.262 17.238 1.00 1.090 H ATOM 1319 HA LYS A 88 -12.297 10.260 19.247 1.00 1.140 H ATOM 1320 1HB LYS A 88 -15.334 10.069 19.083 1.00 1.580 H ATOM 1321 2HB LYS A 88 -14.370 9.873 20.529 1.00 1.580 H ATOM 1322 1HG LYS A 88 -13.547 12.185 20.308 1.00 1.580 H ATOM 1323 2HG LYS A 88 -14.553 12.394 18.870 1.00 1.580 H ATOM 1324 1HD LYS A 88 -16.572 11.882 20.221 1.00 1.580 H ATOM 1325 2HD LYS A 88 -15.558 11.739 21.666 1.00 1.580 H ATOM 1326 1HE LYS A 88 -14.842 14.082 21.408 1.00 1.580 H ATOM 1327 2HE LYS A 88 -15.821 14.228 19.937 1.00 1.580 H ATOM 1328 1HZ LYS A 88 -16.955 15.119 21.850 1.00 1.580 H ATOM 1329 2HZ LYS A 88 -17.777 13.810 21.274 1.00 1.580 H ATOM 1330 3HZ LYS A 88 -16.866 13.675 22.642 1.00 1.580 H ATOM 1331 N VAL A 89 -12.382 7.888 17.719 1.00 0.830 N ATOM 1332 CA VAL A 89 -12.200 6.457 17.631 1.00 0.630 C ATOM 1333 C VAL A 89 -10.949 6.090 18.388 1.00 0.390 C ATOM 1334 O VAL A 89 -9.902 6.715 18.225 1.00 0.580 O ATOM 1335 CB VAL A 89 -12.101 6.000 16.181 1.00 0.960 C ATOM 1336 CG1 VAL A 89 -11.796 4.472 16.079 1.00 0.960 C ATOM 1337 CG2 VAL A 89 -13.407 6.316 15.490 1.00 0.960 C ATOM 1338 H VAL A 89 -11.890 8.504 17.059 1.00 1.000 H ATOM 1339 HA VAL A 89 -13.053 5.962 18.094 1.00 0.760 H ATOM 1340 HB VAL A 89 -11.305 6.529 15.717 1.00 1.150 H ATOM 1341 1HG1 VAL A 89 -11.735 4.177 15.031 1.00 1.150 H ATOM 1342 2HG1 VAL A 89 -10.850 4.237 16.562 1.00 1.150 H ATOM 1343 3HG1 VAL A 89 -12.596 3.911 16.557 1.00 1.150 H ATOM 1344 1HG2 VAL A 89 -13.342 6.008 14.461 1.00 1.150 H ATOM 1345 2HG2 VAL A 89 -14.221 5.780 15.970 1.00 1.150 H ATOM 1346 3HG2 VAL A 89 -13.612 7.384 15.536 1.00 1.150 H ATOM 1347 N ASN A 90 -11.035 5.084 19.235 1.00 0.220 N ATOM 1348 CA ASN A 90 -9.853 4.692 19.973 1.00 0.340 C ATOM 1349 C ASN A 90 -8.974 3.859 19.053 1.00 0.370 C ATOM 1350 O ASN A 90 -9.142 2.645 18.949 1.00 0.780 O ATOM 1351 CB ASN A 90 -10.225 3.910 21.221 1.00 0.430 C ATOM 1352 CG ASN A 90 -9.039 3.621 22.105 1.00 0.430 C ATOM 1353 OD1 ASN A 90 -7.948 4.162 21.890 1.00 0.430 O ATOM 1354 ND2 ASN A 90 -9.234 2.783 23.098 1.00 0.430 N ATOM 1355 H ASN A 90 -11.912 4.600 19.359 1.00 0.260 H ATOM 1356 HA ASN A 90 -9.290 5.583 20.257 1.00 0.410 H ATOM 1357 1HB ASN A 90 -10.961 4.474 21.794 1.00 0.510 H ATOM 1358 2HB ASN A 90 -10.688 2.966 20.935 1.00 0.510 H ATOM 1359 1HD2 ASN A 90 -8.481 2.556 23.718 1.00 0.510 H ATOM 1360 2HD2 ASN A 90 -10.134 2.370 23.235 1.00 0.510 H ATOM 1361 N TYR A 91 -8.047 4.519 18.379 1.00 0.340 N ATOM 1362 CA TYR A 91 -7.226 3.851 17.378 1.00 0.360 C ATOM 1363 C TYR A 91 -5.765 3.887 17.796 1.00 0.310 C ATOM 1364 O TYR A 91 -5.358 4.734 18.592 1.00 0.360 O ATOM 1365 CB TYR A 91 -7.346 4.578 16.023 1.00 0.500 C ATOM 1366 CG TYR A 91 -6.529 5.885 15.951 1.00 0.500 C ATOM 1367 CD1 TYR A 91 -5.260 5.861 15.352 1.00 0.500 C ATOM 1368 CD2 TYR A 91 -6.982 7.061 16.518 1.00 0.500 C ATOM 1369 CE1 TYR A 91 -4.479 6.993 15.308 1.00 0.500 C ATOM 1370 CE2 TYR A 91 -6.185 8.198 16.485 1.00 0.500 C ATOM 1371 CZ TYR A 91 -4.940 8.162 15.877 1.00 0.500 C ATOM 1372 OH TYR A 91 -4.152 9.290 15.841 1.00 0.500 O ATOM 1373 H TYR A 91 -8.008 5.528 18.518 1.00 0.410 H ATOM 1374 HA TYR A 91 -7.537 2.811 17.284 1.00 0.430 H ATOM 1375 1HB TYR A 91 -7.000 3.925 15.232 1.00 0.600 H ATOM 1376 2HB TYR A 91 -8.393 4.818 15.824 1.00 0.600 H ATOM 1377 HD1 TYR A 91 -4.888 4.940 14.913 1.00 0.600 H ATOM 1378 HD2 TYR A 91 -7.949 7.100 16.990 1.00 0.600 H ATOM 1379 HE1 TYR A 91 -3.499 6.962 14.834 1.00 0.600 H ATOM 1380 HE2 TYR A 91 -6.545 9.124 16.936 1.00 0.600 H ATOM 1381 HH TYR A 91 -4.612 10.015 16.276 1.00 0.600 H ATOM 1382 N GLY A 92 -4.971 2.976 17.246 1.00 0.250 N ATOM 1383 CA GLY A 92 -3.537 3.018 17.463 1.00 0.220 C ATOM 1384 C GLY A 92 -2.835 2.988 16.120 1.00 0.180 C ATOM 1385 O GLY A 92 -3.483 2.903 15.074 1.00 0.210 O ATOM 1386 H GLY A 92 -5.362 2.275 16.634 1.00 0.300 H ATOM 1387 1HA GLY A 92 -3.265 3.924 18.004 1.00 0.260 H ATOM 1388 2HA GLY A 92 -3.226 2.166 18.066 1.00 0.260 H ATOM 1389 N VAL A 93 -1.511 3.008 16.150 1.00 0.240 N ATOM 1390 CA VAL A 93 -0.708 2.959 14.940 1.00 0.220 C ATOM 1391 C VAL A 93 0.226 1.773 15.056 1.00 0.240 C ATOM 1392 O VAL A 93 1.020 1.701 15.994 1.00 0.280 O ATOM 1393 CB VAL A 93 0.082 4.273 14.765 1.00 0.320 C ATOM 1394 CG1 VAL A 93 0.949 4.206 13.510 1.00 0.320 C ATOM 1395 CG2 VAL A 93 -0.910 5.459 14.684 1.00 0.320 C ATOM 1396 H VAL A 93 -1.046 3.061 17.047 1.00 0.290 H ATOM 1397 HA VAL A 93 -1.358 2.813 14.077 1.00 0.260 H ATOM 1398 HB VAL A 93 0.748 4.409 15.617 1.00 0.380 H ATOM 1399 1HG1 VAL A 93 1.507 5.133 13.411 1.00 0.380 H ATOM 1400 2HG1 VAL A 93 1.653 3.374 13.583 1.00 0.380 H ATOM 1401 3HG1 VAL A 93 0.315 4.066 12.637 1.00 0.380 H ATOM 1402 1HG2 VAL A 93 -0.361 6.391 14.571 1.00 0.380 H ATOM 1403 2HG2 VAL A 93 -1.573 5.323 13.830 1.00 0.380 H ATOM 1404 3HG2 VAL A 93 -1.505 5.510 15.592 1.00 0.380 H ATOM 1405 N THR A 94 0.124 0.846 14.115 1.00 0.220 N ATOM 1406 CA THR A 94 0.903 -0.378 14.162 1.00 0.260 C ATOM 1407 C THR A 94 1.606 -0.685 12.850 1.00 0.230 C ATOM 1408 O THR A 94 1.368 -0.041 11.827 1.00 0.240 O ATOM 1409 CB THR A 94 -0.001 -1.575 14.538 1.00 0.350 C ATOM 1410 OG1 THR A 94 -0.953 -1.810 13.487 1.00 0.350 O ATOM 1411 CG2 THR A 94 -0.764 -1.272 15.834 1.00 0.350 C ATOM 1412 H THR A 94 -0.539 0.974 13.363 1.00 0.260 H ATOM 1413 HA THR A 94 1.670 -0.271 14.929 1.00 0.310 H ATOM 1414 HB THR A 94 0.608 -2.466 14.677 1.00 0.420 H ATOM 1415 HG1 THR A 94 -0.512 -2.227 12.732 1.00 0.420 H ATOM 1416 1HG2 THR A 94 -1.392 -2.123 16.087 1.00 0.420 H ATOM 1417 2HG2 THR A 94 -0.051 -1.092 16.638 1.00 0.420 H ATOM 1418 3HG2 THR A 94 -1.393 -0.397 15.707 1.00 0.420 H ATOM 1419 N VAL A 95 2.458 -1.701 12.900 1.00 0.240 N ATOM 1420 CA VAL A 95 3.172 -2.223 11.747 1.00 0.250 C ATOM 1421 C VAL A 95 2.225 -3.122 10.959 1.00 0.240 C ATOM 1422 O VAL A 95 1.510 -3.932 11.546 1.00 0.250 O ATOM 1423 CB VAL A 95 4.431 -2.989 12.208 1.00 0.350 C ATOM 1424 CG1 VAL A 95 5.141 -3.643 11.022 1.00 0.350 C ATOM 1425 CG2 VAL A 95 5.368 -2.010 12.914 1.00 0.350 C ATOM 1426 H VAL A 95 2.591 -2.151 13.794 1.00 0.290 H ATOM 1427 HA VAL A 95 3.477 -1.391 11.112 1.00 0.300 H ATOM 1428 HB VAL A 95 4.139 -3.782 12.895 1.00 0.420 H ATOM 1429 1HG1 VAL A 95 6.021 -4.176 11.379 1.00 0.420 H ATOM 1430 2HG1 VAL A 95 4.478 -4.353 10.530 1.00 0.420 H ATOM 1431 3HG1 VAL A 95 5.447 -2.879 10.310 1.00 0.420 H ATOM 1432 1HG2 VAL A 95 6.258 -2.539 13.257 1.00 0.420 H ATOM 1433 2HG2 VAL A 95 5.660 -1.223 12.218 1.00 0.420 H ATOM 1434 3HG2 VAL A 95 4.865 -1.564 13.768 1.00 0.420 H ATOM 1435 N LEU A 96 2.199 -2.961 9.643 1.00 0.240 N ATOM 1436 CA LEU A 96 1.315 -3.758 8.808 1.00 0.250 C ATOM 1437 C LEU A 96 1.653 -5.248 8.903 1.00 0.250 C ATOM 1438 O LEU A 96 2.828 -5.598 9.027 1.00 0.250 O ATOM 1439 CB LEU A 96 1.410 -3.290 7.352 1.00 0.350 C ATOM 1440 CG LEU A 96 0.867 -1.894 7.017 1.00 0.350 C ATOM 1441 CD1 LEU A 96 1.155 -1.623 5.549 1.00 0.350 C ATOM 1442 CD2 LEU A 96 -0.630 -1.811 7.299 1.00 0.350 C ATOM 1443 H LEU A 96 2.808 -2.272 9.226 1.00 0.290 H ATOM 1444 HA LEU A 96 0.317 -3.601 9.185 1.00 0.300 H ATOM 1445 1HB LEU A 96 2.464 -3.250 7.119 1.00 0.420 H ATOM 1446 2HB LEU A 96 0.949 -4.017 6.688 1.00 0.420 H ATOM 1447 HG LEU A 96 1.386 -1.144 7.612 1.00 0.420 H ATOM 1448 1HD1 LEU A 96 0.800 -0.627 5.278 1.00 0.420 H ATOM 1449 2HD1 LEU A 96 2.226 -1.685 5.389 1.00 0.420 H ATOM 1450 3HD1 LEU A 96 0.650 -2.366 4.930 1.00 0.420 H ATOM 1451 1HD2 LEU A 96 -0.978 -0.820 7.039 1.00 0.420 H ATOM 1452 2HD2 LEU A 96 -1.150 -2.552 6.697 1.00 0.420 H ATOM 1453 3HD2 LEU A 96 -0.844 -1.984 8.345 1.00 0.420 H ATOM 1454 N PRO A 97 0.637 -6.138 8.803 1.00 0.260 N ATOM 1455 CA PRO A 97 0.721 -7.587 8.915 1.00 0.270 C ATOM 1456 C PRO A 97 1.551 -8.228 7.826 1.00 0.220 C ATOM 1457 O PRO A 97 1.756 -7.652 6.755 1.00 0.260 O ATOM 1458 CB PRO A 97 -0.747 -8.031 8.817 1.00 0.410 C ATOM 1459 CG PRO A 97 -1.455 -6.911 8.098 1.00 0.410 C ATOM 1460 CD PRO A 97 -0.750 -5.657 8.543 1.00 0.410 C ATOM 1461 HA PRO A 97 1.132 -7.841 9.902 1.00 0.320 H ATOM 1462 1HB PRO A 97 -0.802 -8.989 8.266 1.00 0.490 H ATOM 1463 2HB PRO A 97 -1.149 -8.217 9.822 1.00 0.490 H ATOM 1464 1HG PRO A 97 -1.384 -7.067 7.007 1.00 0.490 H ATOM 1465 2HG PRO A 97 -2.527 -6.914 8.352 1.00 0.490 H ATOM 1466 1HD PRO A 97 -0.806 -4.943 7.724 1.00 0.490 H ATOM 1467 2HD PRO A 97 -1.207 -5.277 9.472 1.00 0.490 H ATOM 1468 N THR A 98 2.065 -9.411 8.135 1.00 0.190 N ATOM 1469 CA THR A 98 2.880 -10.168 7.211 1.00 0.160 C ATOM 1470 C THR A 98 2.082 -10.979 6.202 1.00 0.170 C ATOM 1471 O THR A 98 0.875 -11.199 6.353 1.00 0.210 O ATOM 1472 CB THR A 98 3.810 -11.133 7.983 1.00 0.240 C ATOM 1473 OG1 THR A 98 3.018 -12.061 8.733 1.00 0.240 O ATOM 1474 CG2 THR A 98 4.717 -10.375 8.916 1.00 0.240 C ATOM 1475 H THR A 98 1.873 -9.834 9.033 1.00 0.230 H ATOM 1476 HA THR A 98 3.485 -9.454 6.660 1.00 0.190 H ATOM 1477 HB THR A 98 4.411 -11.685 7.277 1.00 0.280 H ATOM 1478 HG1 THR A 98 3.594 -12.685 9.183 1.00 0.280 H ATOM 1479 1HG2 THR A 98 5.363 -11.081 9.439 1.00 0.280 H ATOM 1480 2HG2 THR A 98 5.321 -9.698 8.355 1.00 0.280 H ATOM 1481 3HG2 THR A 98 4.126 -9.820 9.639 1.00 0.280 H ATOM 1482 N PHE A 99 2.791 -11.442 5.181 1.00 0.180 N ATOM 1483 CA PHE A 99 2.272 -12.311 4.141 1.00 0.170 C ATOM 1484 C PHE A 99 3.308 -13.377 3.855 1.00 0.210 C ATOM 1485 O PHE A 99 4.451 -13.076 3.525 1.00 0.210 O ATOM 1486 CB PHE A 99 1.946 -11.503 2.904 1.00 0.240 C ATOM 1487 CG PHE A 99 1.393 -12.299 1.785 1.00 0.240 C ATOM 1488 CD1 PHE A 99 0.187 -12.970 1.902 1.00 0.240 C ATOM 1489 CD2 PHE A 99 2.070 -12.355 0.593 1.00 0.240 C ATOM 1490 CE1 PHE A 99 -0.306 -13.685 0.851 1.00 0.240 C ATOM 1491 CE2 PHE A 99 1.573 -13.068 -0.463 1.00 0.240 C ATOM 1492 CZ PHE A 99 0.381 -13.736 -0.332 1.00 0.240 C ATOM 1493 H PHE A 99 3.769 -11.152 5.143 1.00 0.220 H ATOM 1494 HA PHE A 99 1.366 -12.792 4.504 1.00 0.200 H ATOM 1495 1HB PHE A 99 1.228 -10.734 3.171 1.00 0.290 H ATOM 1496 2HB PHE A 99 2.847 -11.004 2.557 1.00 0.290 H ATOM 1497 HD1 PHE A 99 -0.373 -12.926 2.838 1.00 0.290 H ATOM 1498 HD2 PHE A 99 3.011 -11.818 0.503 1.00 0.290 H ATOM 1499 HE1 PHE A 99 -1.248 -14.212 0.954 1.00 0.290 H ATOM 1500 HE2 PHE A 99 2.122 -13.103 -1.404 1.00 0.290 H ATOM 1501 HZ PHE A 99 -0.023 -14.305 -1.167 1.00 0.290 H ATOM 1502 N LYS A 100 2.939 -14.633 4.087 1.00 0.260 N ATOM 1503 CA LYS A 100 3.868 -15.757 3.977 1.00 0.320 C ATOM 1504 C LYS A 100 5.100 -15.525 4.854 1.00 0.320 C ATOM 1505 O LYS A 100 6.220 -15.877 4.480 1.00 0.350 O ATOM 1506 CB LYS A 100 4.324 -15.995 2.544 1.00 0.420 C ATOM 1507 CG LYS A 100 3.261 -16.365 1.549 1.00 0.420 C ATOM 1508 CD LYS A 100 3.965 -16.679 0.262 1.00 0.420 C ATOM 1509 CE LYS A 100 3.074 -17.108 -0.856 1.00 0.420 C ATOM 1510 NZ LYS A 100 3.905 -17.355 -2.091 1.00 0.420 N ATOM 1511 H LYS A 100 1.979 -14.813 4.348 1.00 0.310 H ATOM 1512 HA LYS A 100 3.369 -16.658 4.336 1.00 0.380 H ATOM 1513 1HB LYS A 100 4.831 -15.107 2.163 1.00 0.510 H ATOM 1514 2HB LYS A 100 5.058 -16.799 2.541 1.00 0.510 H ATOM 1515 1HG LYS A 100 2.693 -17.226 1.897 1.00 0.510 H ATOM 1516 2HG LYS A 100 2.584 -15.523 1.400 1.00 0.510 H ATOM 1517 1HD LYS A 100 4.497 -15.791 -0.052 1.00 0.510 H ATOM 1518 2HD LYS A 100 4.699 -17.462 0.433 1.00 0.510 H ATOM 1519 1HE LYS A 100 2.562 -18.027 -0.581 1.00 0.510 H ATOM 1520 2HE LYS A 100 2.337 -16.337 -1.062 1.00 0.510 H ATOM 1521 1HZ LYS A 100 3.338 -17.664 -2.862 1.00 0.510 H ATOM 1522 2HZ LYS A 100 4.396 -16.460 -2.338 1.00 0.510 H ATOM 1523 3HZ LYS A 100 4.593 -18.061 -1.895 1.00 0.510 H ATOM 1524 N GLY A 101 4.887 -14.903 6.014 1.00 0.290 N ATOM 1525 CA GLY A 101 5.942 -14.616 6.972 1.00 0.290 C ATOM 1526 C GLY A 101 6.741 -13.347 6.662 1.00 0.240 C ATOM 1527 O GLY A 101 7.585 -12.942 7.463 1.00 0.240 O ATOM 1528 H GLY A 101 3.938 -14.656 6.268 1.00 0.350 H ATOM 1529 1HA GLY A 101 5.502 -14.527 7.964 1.00 0.350 H ATOM 1530 2HA GLY A 101 6.623 -15.465 7.011 1.00 0.350 H ATOM 1531 N GLN A 102 6.473 -12.695 5.531 1.00 0.220 N ATOM 1532 CA GLN A 102 7.227 -11.513 5.174 1.00 0.210 C ATOM 1533 C GLN A 102 6.479 -10.239 5.538 1.00 0.200 C ATOM 1534 O GLN A 102 5.268 -10.187 5.363 1.00 0.230 O ATOM 1535 CB GLN A 102 7.506 -11.529 3.680 1.00 0.300 C ATOM 1536 CG GLN A 102 8.283 -12.727 3.245 1.00 0.300 C ATOM 1537 CD GLN A 102 9.613 -12.737 3.896 1.00 0.300 C ATOM 1538 OE1 GLN A 102 10.301 -11.715 3.856 1.00 0.300 O ATOM 1539 NE2 GLN A 102 9.988 -13.844 4.517 1.00 0.300 N ATOM 1540 H GLN A 102 5.765 -13.041 4.879 1.00 0.260 H ATOM 1541 HA GLN A 102 8.171 -11.576 5.685 1.00 0.250 H ATOM 1542 1HB GLN A 102 6.559 -11.536 3.132 1.00 0.360 H ATOM 1543 2HB GLN A 102 8.044 -10.627 3.386 1.00 0.360 H ATOM 1544 1HG GLN A 102 7.742 -13.635 3.520 1.00 0.360 H ATOM 1545 2HG GLN A 102 8.418 -12.682 2.163 1.00 0.360 H ATOM 1546 1HE2 GLN A 102 10.874 -13.884 4.979 1.00 0.360 H ATOM 1547 2HE2 GLN A 102 9.380 -14.643 4.544 1.00 0.360 H ATOM 1548 N PRO A 103 7.145 -9.180 6.012 1.00 0.250 N ATOM 1549 CA PRO A 103 6.554 -7.888 6.314 1.00 0.290 C ATOM 1550 C PRO A 103 5.937 -7.272 5.086 1.00 0.270 C ATOM 1551 O PRO A 103 6.401 -7.532 3.978 1.00 0.240 O ATOM 1552 CB PRO A 103 7.762 -7.056 6.761 1.00 0.430 C ATOM 1553 CG PRO A 103 8.777 -8.061 7.241 1.00 0.430 C ATOM 1554 CD PRO A 103 8.581 -9.279 6.367 1.00 0.430 C ATOM 1555 HA PRO A 103 5.811 -7.974 7.114 1.00 0.350 H ATOM 1556 1HB PRO A 103 8.118 -6.440 5.915 1.00 0.520 H ATOM 1557 2HB PRO A 103 7.452 -6.354 7.550 1.00 0.520 H ATOM 1558 1HG PRO A 103 9.792 -7.640 7.157 1.00 0.520 H ATOM 1559 2HG PRO A 103 8.616 -8.283 8.307 1.00 0.520 H ATOM 1560 1HD PRO A 103 9.219 -9.260 5.465 1.00 0.520 H ATOM 1561 2HD PRO A 103 8.789 -10.137 7.023 1.00 0.520 H ATOM 1562 N SER A 104 4.897 -6.471 5.281 1.00 0.300 N ATOM 1563 CA SER A 104 4.343 -5.709 4.174 1.00 0.270 C ATOM 1564 C SER A 104 5.402 -4.691 3.782 1.00 0.260 C ATOM 1565 O SER A 104 6.119 -4.193 4.655 1.00 0.350 O ATOM 1566 CB SER A 104 3.031 -5.058 4.538 1.00 0.390 C ATOM 1567 OG SER A 104 1.987 -5.999 4.705 1.00 0.390 O ATOM 1568 H SER A 104 4.532 -6.329 6.215 1.00 0.360 H ATOM 1569 HA SER A 104 4.167 -6.360 3.337 1.00 0.320 H ATOM 1570 1HB SER A 104 3.168 -4.501 5.438 1.00 0.470 H ATOM 1571 2HB SER A 104 2.766 -4.372 3.773 1.00 0.470 H ATOM 1572 HG SER A 104 2.142 -6.502 5.535 1.00 0.470 H ATOM 1573 N LYS A 105 5.506 -4.353 2.497 1.00 0.190 N ATOM 1574 CA LYS A 105 6.512 -3.375 2.064 1.00 0.180 C ATOM 1575 C LYS A 105 5.951 -2.197 1.232 1.00 0.170 C ATOM 1576 O LYS A 105 6.045 -2.226 0.007 1.00 0.150 O ATOM 1577 CB LYS A 105 7.592 -4.123 1.285 1.00 0.260 C ATOM 1578 CG LYS A 105 8.371 -5.130 2.112 1.00 0.260 C ATOM 1579 CD LYS A 105 9.348 -5.919 1.266 1.00 0.260 C ATOM 1580 CE LYS A 105 10.091 -6.941 2.114 1.00 0.260 C ATOM 1581 NZ LYS A 105 11.011 -7.788 1.301 1.00 0.260 N ATOM 1582 H LYS A 105 4.863 -4.783 1.823 1.00 0.230 H ATOM 1583 HA LYS A 105 6.994 -2.965 2.950 1.00 0.220 H ATOM 1584 1HB LYS A 105 7.130 -4.699 0.521 1.00 0.310 H ATOM 1585 2HB LYS A 105 8.282 -3.421 0.819 1.00 0.310 H ATOM 1586 1HG LYS A 105 8.901 -4.615 2.913 1.00 0.310 H ATOM 1587 2HG LYS A 105 7.681 -5.835 2.561 1.00 0.310 H ATOM 1588 1HD LYS A 105 8.802 -6.445 0.479 1.00 0.310 H ATOM 1589 2HD LYS A 105 10.062 -5.243 0.802 1.00 0.310 H ATOM 1590 1HE LYS A 105 10.670 -6.415 2.870 1.00 0.310 H ATOM 1591 2HE LYS A 105 9.361 -7.588 2.615 1.00 0.310 H ATOM 1592 1HZ LYS A 105 11.481 -8.448 1.905 1.00 0.310 H ATOM 1593 2HZ LYS A 105 10.479 -8.300 0.605 1.00 0.310 H ATOM 1594 3HZ LYS A 105 11.694 -7.206 0.841 1.00 0.310 H ATOM 1595 N PRO A 106 5.349 -1.166 1.873 1.00 0.210 N ATOM 1596 CA PRO A 106 4.707 0.007 1.282 1.00 0.230 C ATOM 1597 C PRO A 106 5.647 0.904 0.513 1.00 0.200 C ATOM 1598 O PRO A 106 6.839 0.959 0.821 1.00 0.190 O ATOM 1599 CB PRO A 106 4.212 0.798 2.499 1.00 0.350 C ATOM 1600 CG PRO A 106 4.158 -0.181 3.611 1.00 0.350 C ATOM 1601 CD PRO A 106 5.288 -1.145 3.349 1.00 0.350 C ATOM 1602 HA PRO A 106 3.887 -0.316 0.631 1.00 0.280 H ATOM 1603 1HB PRO A 106 4.903 1.638 2.697 1.00 0.410 H ATOM 1604 2HB PRO A 106 3.233 1.251 2.279 1.00 0.410 H ATOM 1605 1HG PRO A 106 4.261 0.335 4.579 1.00 0.410 H ATOM 1606 2HG PRO A 106 3.187 -0.653 3.615 1.00 0.410 H ATOM 1607 1HD PRO A 106 6.236 -0.775 3.772 1.00 0.410 H ATOM 1608 2HD PRO A 106 4.989 -2.080 3.770 1.00 0.410 H ATOM 1609 N PHE A 107 5.104 1.650 -0.447 1.00 0.220 N ATOM 1610 CA PHE A 107 5.913 2.656 -1.108 1.00 0.210 C ATOM 1611 C PHE A 107 6.063 3.811 -0.125 1.00 0.150 C ATOM 1612 O PHE A 107 5.113 4.157 0.594 1.00 0.170 O ATOM 1613 CB PHE A 107 5.275 3.230 -2.387 1.00 0.300 C ATOM 1614 CG PHE A 107 5.222 2.406 -3.648 1.00 0.300 C ATOM 1615 CD1 PHE A 107 3.991 2.066 -4.208 1.00 0.300 C ATOM 1616 CD2 PHE A 107 6.378 2.006 -4.304 1.00 0.300 C ATOM 1617 CE1 PHE A 107 3.927 1.358 -5.392 1.00 0.300 C ATOM 1618 CE2 PHE A 107 6.310 1.290 -5.483 1.00 0.300 C ATOM 1619 CZ PHE A 107 5.086 0.971 -6.028 1.00 0.300 C ATOM 1620 H PHE A 107 4.128 1.549 -0.687 1.00 0.260 H ATOM 1621 HA PHE A 107 6.898 2.245 -1.333 1.00 0.250 H ATOM 1622 1HB PHE A 107 4.268 3.456 -2.160 1.00 0.360 H ATOM 1623 2HB PHE A 107 5.764 4.175 -2.627 1.00 0.360 H ATOM 1624 HD1 PHE A 107 3.070 2.373 -3.713 1.00 0.360 H ATOM 1625 HD2 PHE A 107 7.350 2.267 -3.886 1.00 0.360 H ATOM 1626 HE1 PHE A 107 2.960 1.099 -5.822 1.00 0.360 H ATOM 1627 HE2 PHE A 107 7.223 0.983 -5.983 1.00 0.360 H ATOM 1628 HZ PHE A 107 5.031 0.406 -6.957 1.00 0.360 H ATOM 1629 N VAL A 108 7.233 4.427 -0.105 1.00 0.180 N ATOM 1630 CA VAL A 108 7.456 5.566 0.765 1.00 0.170 C ATOM 1631 C VAL A 108 7.863 6.780 -0.055 1.00 0.220 C ATOM 1632 O VAL A 108 8.816 6.722 -0.831 1.00 0.300 O ATOM 1633 CB VAL A 108 8.530 5.217 1.817 1.00 0.240 C ATOM 1634 CG1 VAL A 108 8.804 6.414 2.728 1.00 0.240 C ATOM 1635 CG2 VAL A 108 8.045 4.006 2.638 1.00 0.240 C ATOM 1636 H VAL A 108 7.981 4.102 -0.705 1.00 0.220 H ATOM 1637 HA VAL A 108 6.529 5.799 1.287 1.00 0.200 H ATOM 1638 HB VAL A 108 9.462 4.969 1.313 1.00 0.290 H ATOM 1639 1HG1 VAL A 108 9.568 6.145 3.457 1.00 0.290 H ATOM 1640 2HG1 VAL A 108 9.160 7.262 2.139 1.00 0.290 H ATOM 1641 3HG1 VAL A 108 7.892 6.695 3.250 1.00 0.290 H ATOM 1642 1HG2 VAL A 108 8.797 3.744 3.378 1.00 0.290 H ATOM 1643 2HG2 VAL A 108 7.111 4.259 3.140 1.00 0.290 H ATOM 1644 3HG2 VAL A 108 7.877 3.149 1.985 1.00 0.290 H ATOM 1645 N GLY A 109 7.117 7.869 0.103 1.00 0.190 N ATOM 1646 CA GLY A 109 7.401 9.092 -0.632 1.00 0.250 C ATOM 1647 C GLY A 109 8.302 10.022 0.164 1.00 0.280 C ATOM 1648 O GLY A 109 8.842 9.648 1.206 1.00 0.290 O ATOM 1649 H GLY A 109 6.344 7.844 0.753 1.00 0.230 H ATOM 1650 1HA GLY A 109 7.877 8.844 -1.580 1.00 0.300 H ATOM 1651 2HA GLY A 109 6.467 9.600 -0.866 1.00 0.300 H ATOM 1652 N VAL A 110 8.451 11.247 -0.328 1.00 0.320 N ATOM 1653 CA VAL A 110 9.301 12.239 0.314 1.00 0.360 C ATOM 1654 C VAL A 110 8.551 13.534 0.561 1.00 0.310 C ATOM 1655 O VAL A 110 7.927 14.079 -0.348 1.00 0.320 O ATOM 1656 CB VAL A 110 10.549 12.524 -0.554 1.00 0.490 C ATOM 1657 CG1 VAL A 110 11.435 13.604 0.105 1.00 0.490 C ATOM 1658 CG2 VAL A 110 11.339 11.227 -0.742 1.00 0.490 C ATOM 1659 H VAL A 110 7.964 11.494 -1.179 1.00 0.380 H ATOM 1660 HA VAL A 110 9.630 11.845 1.276 1.00 0.430 H ATOM 1661 HB VAL A 110 10.234 12.906 -1.525 1.00 0.590 H ATOM 1662 1HG1 VAL A 110 12.302 13.790 -0.526 1.00 0.590 H ATOM 1663 2HG1 VAL A 110 10.881 14.538 0.224 1.00 0.590 H ATOM 1664 3HG1 VAL A 110 11.768 13.258 1.083 1.00 0.590 H ATOM 1665 1HG2 VAL A 110 12.214 11.421 -1.358 1.00 0.590 H ATOM 1666 2HG2 VAL A 110 11.653 10.850 0.231 1.00 0.590 H ATOM 1667 3HG2 VAL A 110 10.720 10.480 -1.231 1.00 0.590 H ATOM 1668 N LEU A 111 8.612 14.025 1.788 1.00 0.310 N ATOM 1669 CA LEU A 111 7.971 15.283 2.115 1.00 0.270 C ATOM 1670 C LEU A 111 9.034 16.351 2.283 1.00 0.360 C ATOM 1671 O LEU A 111 10.137 16.061 2.751 1.00 0.440 O ATOM 1672 CB LEU A 111 7.156 15.143 3.403 1.00 0.390 C ATOM 1673 CG LEU A 111 6.064 14.036 3.407 1.00 0.390 C ATOM 1674 CD1 LEU A 111 5.423 13.988 4.783 1.00 0.390 C ATOM 1675 CD2 LEU A 111 5.012 14.314 2.325 1.00 0.390 C ATOM 1676 H LEU A 111 9.132 13.524 2.495 1.00 0.370 H ATOM 1677 HA LEU A 111 7.326 15.589 1.295 1.00 0.320 H ATOM 1678 1HB LEU A 111 7.843 14.936 4.222 1.00 0.470 H ATOM 1679 2HB LEU A 111 6.667 16.095 3.604 1.00 0.470 H ATOM 1680 HG LEU A 111 6.527 13.068 3.215 1.00 0.470 H ATOM 1681 1HD1 LEU A 111 4.667 13.203 4.804 1.00 0.470 H ATOM 1682 2HD1 LEU A 111 6.185 13.775 5.533 1.00 0.470 H ATOM 1683 3HD1 LEU A 111 4.954 14.946 5.004 1.00 0.470 H ATOM 1684 1HD2 LEU A 111 4.258 13.528 2.349 1.00 0.470 H ATOM 1685 2HD2 LEU A 111 4.537 15.276 2.513 1.00 0.470 H ATOM 1686 3HD2 LEU A 111 5.475 14.324 1.340 1.00 0.470 H ATOM 1687 N SER A 112 8.698 17.584 1.928 1.00 0.350 N ATOM 1688 CA SER A 112 9.607 18.706 2.106 1.00 0.440 C ATOM 1689 C SER A 112 8.846 20.021 2.168 1.00 0.420 C ATOM 1690 O SER A 112 7.708 20.119 1.702 1.00 0.400 O ATOM 1691 CB SER A 112 10.622 18.741 0.978 1.00 0.580 C ATOM 1692 OG SER A 112 10.006 19.008 -0.252 1.00 0.580 O ATOM 1693 H SER A 112 7.790 17.758 1.522 1.00 0.420 H ATOM 1694 HA SER A 112 10.138 18.575 3.049 1.00 0.530 H ATOM 1695 1HB SER A 112 11.364 19.511 1.186 1.00 0.700 H ATOM 1696 2HB SER A 112 11.146 17.788 0.927 1.00 0.700 H ATOM 1697 HG SER A 112 10.711 19.027 -0.901 1.00 0.700 H ATOM 1698 N ALA A 113 9.475 21.031 2.765 1.00 0.480 N ATOM 1699 CA ALA A 113 8.908 22.373 2.814 1.00 0.480 C ATOM 1700 C ALA A 113 8.808 22.956 1.416 1.00 0.520 C ATOM 1701 O ALA A 113 9.692 22.738 0.586 1.00 0.620 O ATOM 1702 CB ALA A 113 9.755 23.280 3.687 1.00 0.670 C ATOM 1703 H ALA A 113 10.390 20.868 3.156 1.00 0.580 H ATOM 1704 HA ALA A 113 7.903 22.306 3.228 1.00 0.580 H ATOM 1705 1HB ALA A 113 9.304 24.273 3.717 1.00 0.810 H ATOM 1706 2HB ALA A 113 9.808 22.873 4.695 1.00 0.810 H ATOM 1707 3HB ALA A 113 10.757 23.352 3.269 1.00 0.810 H ATOM 1708 N GLY A 114 7.764 23.739 1.168 1.00 0.510 N ATOM 1709 CA GLY A 114 7.626 24.401 -0.117 1.00 0.640 C ATOM 1710 C GLY A 114 8.251 25.787 -0.079 1.00 0.730 C ATOM 1711 O GLY A 114 8.971 26.138 0.858 1.00 0.740 O ATOM 1712 H GLY A 114 7.061 23.873 1.879 1.00 0.610 H ATOM 1713 1HA GLY A 114 8.105 23.800 -0.891 1.00 0.770 H ATOM 1714 2HA GLY A 114 6.571 24.479 -0.376 1.00 0.770 H ATOM 1715 N ILE A 115 7.961 26.584 -1.100 1.00 0.850 N ATOM 1716 CA ILE A 115 8.521 27.922 -1.214 1.00 0.970 C ATOM 1717 C ILE A 115 7.438 28.983 -1.241 1.00 0.970 C ATOM 1718 O ILE A 115 6.497 28.893 -2.028 1.00 1.000 O ATOM 1719 CB ILE A 115 9.397 28.038 -2.484 1.00 1.310 C ATOM 1720 CG1 ILE A 115 10.570 27.013 -2.393 1.00 1.310 C ATOM 1721 CG2 ILE A 115 9.919 29.493 -2.647 1.00 1.310 C ATOM 1722 CD1 ILE A 115 11.370 26.841 -3.669 1.00 1.310 C ATOM 1723 H ILE A 115 7.342 26.247 -1.824 1.00 1.020 H ATOM 1724 HA ILE A 115 9.150 28.111 -0.345 1.00 1.160 H ATOM 1725 HB ILE A 115 8.801 27.776 -3.357 1.00 1.570 H ATOM 1726 1HG1 ILE A 115 11.244 27.325 -1.597 1.00 1.570 H ATOM 1727 2HG1 ILE A 115 10.166 26.040 -2.136 1.00 1.570 H ATOM 1728 1HG2 ILE A 115 10.521 29.578 -3.541 1.00 1.570 H ATOM 1729 2HG2 ILE A 115 9.083 30.192 -2.732 1.00 1.570 H ATOM 1730 3HG2 ILE A 115 10.522 29.765 -1.780 1.00 1.570 H ATOM 1731 1HD1 ILE A 115 12.152 26.100 -3.502 1.00 1.570 H ATOM 1732 2HD1 ILE A 115 10.712 26.497 -4.468 1.00 1.570 H ATOM 1733 3HD1 ILE A 115 11.830 27.776 -3.961 1.00 1.570 H ATOM 1734 N ASN A 116 7.586 29.975 -0.375 1.00 1.040 N ATOM 1735 CA ASN A 116 6.662 31.096 -0.302 1.00 1.090 C ATOM 1736 C ASN A 116 7.311 32.341 -0.911 1.00 1.370 C ATOM 1737 O ASN A 116 6.870 32.867 -1.928 1.00 1.440 O ATOM 1738 OXT ASN A 116 8.394 32.709 -0.473 1.00 1.640 O ATOM 1739 CB ASN A 116 6.252 31.356 1.133 1.00 1.440 C ATOM 1740 CG ASN A 116 5.465 30.220 1.739 1.00 1.440 C ATOM 1741 OD1 ASN A 116 4.566 29.638 1.119 1.00 1.440 O ATOM 1742 ND2 ASN A 116 5.789 29.895 2.968 1.00 1.440 N ATOM 1743 H ASN A 116 8.385 29.938 0.243 1.00 1.250 H ATOM 1744 HA ASN A 116 5.773 30.865 -0.891 1.00 1.310 H ATOM 1745 1HB ASN A 116 7.141 31.530 1.738 1.00 1.730 H ATOM 1746 2HB ASN A 116 5.647 32.262 1.176 1.00 1.730 H ATOM 1747 1HD2 ASN A 116 5.305 29.152 3.433 1.00 1.730 H ATOM 1748 2HD2 ASN A 116 6.517 30.390 3.443 1.00 1.730 H TER # All scores below are weighted scores, not raw scores. #BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 coordinate_constraint omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.5 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA pose -516.029 53.2627 388.536 -35.4651 10.3766 23.2749 188.498 -218.848 -1.00787 -6.42669 -169.63 -27.9588 -53.7493 -14.7748 -13.6213 -8.55548 0 9.73095 -1.89395 4.07215 40.4225 92.1304 -31.6385 24.9045 -5.49113 -11.1931 54.4487 -226.625 GLN:NtermProteinFull_1 -2.91962 0.11658 3.46087 -0.67222 0.07862 0.81207 1.2894 -1.41051 -0.02544 -0.15613 -2.01148 1.2752 0 0 0 0 0 0.18146 0.02615 0.02708 0 2.62869 0 0 -0.18838 0 0.12749 2.63982 GLU_2 -3.60262 0.6146 3.39072 -0.32573 0.06401 0.43056 1.37069 -1.43094 -0 -0 -1.83793 -0.33956 0 0 0 0 0 0.02649 -0.08077 0.00562 0 2.74206 -0.0022 0 -2.7348 -0.20873 0.9758 -0.94273 PRO_3 -3.49992 0.70936 3.22804 -0.06824 0 0.04258 2.28059 -1.47682 -0 -0 -2.10769 0.60234 0 0 0 0 0 0.03243 -0.10032 0.04369 0.19626 0 -0.50505 0 -2.4119 -0.12015 1.05248 -2.10229 TYR_4 -6.19568 0.77476 3.42317 -1.06343 0.16148 0.54185 1.74671 -1.97188 -1e-05 -0.00021 -1.51582 -0.268 0 0 -0.4104 0 0 0.05049 0.0938 0.0165 0 2.03918 -0.0341 0.22789 1.2797 0.25571 0.51046 -0.33782 PHE_5 -6.38681 0.62159 2.17552 -0.6392 0.06884 0.37636 1.19562 -1.76345 -0 -0 -1.54428 0.09725 0 0 0 0 0 0.00609 -0.00428 0.09104 0 2.06799 -0.13829 0 1.0402 -0.10075 0.52868 -2.30787 THR_6 -4.82455 0.58756 4.00303 -0.10726 0.06931 0.05834 2.63218 -2.13611 -0 -0 -2.03099 -1.49354 0 0 0 0 0 0.01478 0.00916 0.06238 0.31133 0 -0.60063 2.28589 -1.0874 -0.28771 1.00092 -1.53332 TRP_7 -11.1157 1.73519 5.03169 -1.54827 0.20324 0.84298 3.08724 -3.74047 -0.00417 -0.02729 -2.4477 -0.23313 0 0 0 0 0 0.01511 -0.01274 0.00079 0 1.89635 -0.29933 0 1.6906 5.95605 2.32487 3.35532 PRO_8 -8.10258 1.27471 4.23827 -0.06923 0 0.0429 2.16449 -2.16121 -0 -0 -1.96365 0.64529 0 0 0 0 0 0.05098 -0.14015 0.0473 0.1726 0 -0.14574 0 -2.4119 6.04016 1.81212 1.49435 LEU_9 -7.90788 1.48851 2.59524 -0.77661 0.47201 0.30743 2.37507 -2.484 -0.00355 -0.01009 -0.99734 0.20272 0 0 0 0 0 0.01747 -0.03179 0.15308 0.7755 0 -0.19206 0 0.18072 0.08143 0.86263 -2.8915 ILE_10 -9.22783 0.86662 3.55069 -0.63141 0.56014 0.14114 2.6061 -3.08471 -0 -0 -1.76305 0.17026 0 0 0 0 0 0.13843 0.00886 0.14523 3.3294 0 -0.40346 0 0.73287 0.01326 1.07598 -1.77149 ALA_11 -6.22818 0.86511 3.98398 -0.02255 0 0 2.38092 -2.91994 -0.03741 -0.15528 -2.57933 -0.35461 0 0 0 0 0 0.09485 -0.06565 0 0 0 -0.3156 0 1.8394 -0.35317 0.82168 -3.04578 ALA_12 -5.54993 0.56931 3.82052 -0.02411 0 0 2.53341 -2.57624 -0.06635 -0.41024 -0.59255 -0.35803 0 0 0 0 0 0.04636 -0.08081 0 0 0 -0.42847 0 1.8394 -0.59795 0.75791 -1.11777 ASP_13 -4.55807 0.81249 5.65818 -0.29439 0.06133 0.97889 1.93442 -2.47992 -0.07915 -0.5401 -3.87474 0.41511 0 0 0 -0.64295 0 0.01651 -0.04692 0.04989 0 3.63694 -0.38849 0 -2.3716 -0.50761 0.67023 -1.54994 GLY_14 -2.53483 0.14401 2.8863 -7e-05 0 0 1.16601 -1.51248 -0.01629 -0.11425 -1.16065 -0.3235 0 0 0 0 0 0.00842 -0.09956 0 0 0 -1.54021 0 0.83697 -0.18049 0.69339 -1.74723 GLY_15 -3.94712 0.16818 2.59078 -0.0003 0 0 1.16533 -1.77825 -0.03551 -0.15557 -1.02424 -0.21384 0 0 0 0 0 0.00966 -0.07074 0 0 0 0.36881 0 0.83697 0.11813 0.51173 -1.45599 TYR_16 -7.4426 0.99423 4.34003 -0.88491 0.04408 0.50871 1.97844 -2.92958 -0.00627 -0.09852 -1.96583 -0.34373 0 0 0 -0.62312 0 0.02648 -0.00397 0.05907 0 1.53819 -0.33711 0.00409 1.2797 -0.10063 0.46214 -3.50113 ALA_17 -3.60713 0.21841 1.44123 -0.01712 0 0 1.12047 -1.38463 -0 -0 -0.30858 -0.29396 0 0 0 0 0 0.00867 0.05385 0 0 0 0.43041 0 1.8394 0.74687 0.46509 0.71299 PHE_18 -7.32561 0.86141 1.2183 -0.63036 0.03664 0.36726 1.13484 -1.83469 -0 -0 -1.00285 0.14202 0 0 0 0 0 0.00164 -0.00697 0.10534 0 2.17777 -0.13347 0 1.0402 0.84094 0.24618 -2.76142 LYS_19 -4.89047 0.32722 5.40746 -0.37785 0.05099 0.17205 2.29648 -2.23119 -0.04056 -0.15093 -3.5371 0.17243 0 0 0 0 0 0.00955 -0.06843 0.00608 1.72168 0 -0.00124 0 -1.5107 -0.34718 0.33396 -2.65775 TYR_20 -6.15954 0.96568 2.50911 -0.74425 0.04178 0.11295 0.77301 -1.9737 -0 -0 -0.83871 -0.42674 0 0 -0.32004 0 0 0.0031 -0.06767 0.15322 0 2.43794 -0.01153 0.28992 1.2797 -0.27076 0.41842 -1.82812 GLU_21 -3.76555 0.40683 5.04074 -0.48362 0.13786 0.75301 2.37849 -2.2238 -0.01198 -0.04107 -2.13898 -1.51371 0 0 -1.04208 0 0 0.01038 0.02014 0.05176 0 4.5913 -0.1125 0 -2.7348 0.22099 0.43276 -0.02384 ASN_22 -2.1282 0.29861 2.836 -0.18722 0.04189 0.31772 1.15193 -1.18338 -0 -0 -0.73669 -0.98177 0 0 -1.04208 0 0 0.00358 -0.08688 0.00231 0 1.80958 -0.9779 0 -0.93687 -0.23744 0.2574 -1.77941 GLY_23 -2.31239 0.52944 2.01316 -5e-05 0 0 0.31898 -1.13103 -0 -0 -1.02367 -0.38127 0 0 -0.32004 0 0 0.00417 -0.11937 0 0 0 -1.44883 0 0.83697 -0.91785 0.37614 -3.57564 LYS_24 -4.00667 0.32233 4.35106 -0.46113 0.11962 0.24848 2.15252 -2.1864 -0.00083 -0.00223 -1.74674 -0.01108 0 0 0 0 0 0.0061 0.0138 0.00549 1.80151 0 0.03055 0 -1.5107 -0.54321 0.50276 -0.91478 TYR_25 -5.5484 0.60155 1.37714 -0.6109 0.02708 0.29232 0.41229 -1.27485 -0 -0 -0.47512 -0.11875 0 0 0 0 0 0.01487 -0.00535 0.0016 0 2.16718 -0.11087 0.00023 1.2797 -0.18432 0.28756 -1.86703 ASP_26 -4.89285 0.19138 7.302 -0.19568 0.02081 0.62777 3.54532 -2.98978 -0.02751 -0.16024 -5.24734 -0.9705 0 0 0 -0.89394 0 0.02098 0.17361 0.09467 0 2.05474 -0.81271 0 -2.3716 -0.27546 0.4639 -4.34243 ILE_27 -4.34327 0.43681 1.75157 -0.68678 0.6544 0.16603 1.17848 -1.4914 -0 -0 0.01529 0.11529 0 0 0 0 0 0.12387 -0.04867 0.02296 0.73215 0 -0.1436 0 0.73287 -0.23864 0.88979 -0.13283 LYS_28 -2.74931 0.22413 3.92967 -0.49049 0.09095 0.35008 1.672 -1.6761 -0.00868 -0.0288 -3.30242 0.61334 0 0 0 -0.89394 0 0.01667 -0.02926 0.02368 1.99823 0 -0.03188 0 -1.5107 -0.40629 0.82141 -1.38769 ASP_29 -5.51527 0.49455 7.14929 -0.24287 0.04911 0.80514 3.26031 -3.00128 -0.04862 -0.24469 -3.56944 -0.81967 0 0 0 -0.62312 0 0.0096 -0.01498 0.00679 0 1.91303 -0.79928 0 -2.3716 -0.4099 0.49451 -3.47838 VAL_30 -4.26087 0.42465 2.12078 -0.27999 0.18845 0.05727 1.8939 -1.71283 -0 -0 -0.83273 -0.11183 0 0 0 0 0 0.01512 0.07648 0.03638 0.16045 0 -0.56015 0 1.9342 -0.31326 0.43559 -0.7284 GLY_31 -4.38667 0.49025 3.43385 -6e-05 0 0 1.87528 -2.15545 -0.0069 -0.05561 -2.03476 -0.37642 0 0 0 0 0 0.03156 -0.03741 0 0 0 0.21422 0 0.83697 0.08127 0.55707 -1.53282 VAL_32 -3.239 0.37989 2.40502 -0.36783 0.23369 0.09117 1.13127 -1.51421 -0 -0 0.23225 -0.09866 0 0 0 0 0 0.05848 -0.0029 0.03891 0.88546 0 0.03973 0 1.9342 0.28997 0.50891 3.00637 ASP_33 -2.68378 0.25174 2.68459 -0.12346 0.02711 0.38354 0.42974 -1.32339 -0 -0 -0.66561 -0.36761 0 0 0 0 0 0.01465 -0.05198 0.00068 0 2.63195 -0.40634 0 -2.3716 -0.39036 0.29524 -1.66488 ASN_34 -5.80023 0.39103 5.90663 -0.22684 0.00759 0.3322 3.00725 -3.05492 -0.01951 -0.23924 -2.17071 -0.46189 0 0 -1.04675 0 0 0.04927 -0.04142 0.01076 0 2.80783 0.31582 0 -0.93687 -0.48893 0.18983 -1.46911 ALA_35 -2.95577 0.13595 3.19065 -0.02314 0 0 1.47416 -1.68374 -0.02111 -0.14616 -0.72866 -0.38473 0 0 0 0 0 0.02001 0.01401 0 0 0 -0.42512 0 1.8394 -0.38466 0.14781 0.0689 GLY_36 -4.9127 0.77532 4.69961 -5e-05 0 0 2.3156 -2.66556 -0 -0 -2.31286 -0.41766 0 0 -1.04675 0 0 0.01812 -0.0632 0 0 0 0.33763 0 0.83697 0.22467 0.15289 -2.05795 ALA_37 -6.41852 0.45766 4.53785 -0.02156 0 0 2.5912 -3.10238 -0 -0 -1.77121 -0.36697 0 0 0 0 0 0.01201 0.00139 0 0 0 -0.33188 0 1.8394 0.25244 0.18807 -2.13251 LYS_38 -5.88096 0.33697 6.69208 -0.30482 0.02905 0.13426 3.14285 -3.07627 -0 -0 -3.79089 -0.04035 0 0 0 0 0 0.01089 0.06135 0.10862 1.77761 0 0.00592 0 -1.5107 -0.4177 0.24047 -2.48162 ALA_39 -5.08877 0.22692 4.56696 -0.02174 0 0 2.78199 -2.69959 -0 -0 -2.5077 -0.3596 0 0 0 0 0 0.00537 0.03769 0 0 0 -0.24067 0 1.8394 -0.37017 0.25628 -1.57365 GLY_40 -5.75591 0.53662 4.55363 -5e-05 0 0 2.49057 -2.70714 -0 -0 -2.45324 -0.41261 0 0 0 0 0 0.02137 -0.06272 0 0 0 0.30698 0 0.83697 0.31779 0.14383 -2.18391 LEU_41 -6.22282 0.4936 5.12145 -0.48378 0.1748 0.11766 2.64889 -2.81745 -0 -0 -2.57729 0.20734 0 0 0 0 0 0.03882 -0.03508 0.12933 0.31006 0 -0.27924 0 0.18072 0.34634 0.17704 -2.4696 THR_42 -5.13557 0.27786 6.60398 -0.20114 0.11447 0.07261 3.18638 -3.07335 -0 -0 -3.39688 -0.10864 0 0 0 0 0 0.00732 0.03189 0.00029 0.0628 0 -0.00433 2.30145 -1.0874 -0.11644 0.25636 -0.20833 PHE_43 -7.32321 0.88985 4.22271 -0.83709 0.02995 0.27636 2.61672 -2.69215 -0 -0 -2.41514 -0.03452 0 0 0 0 0 0.00549 -0.00353 0.01295 0 1.81312 -0.44582 0 1.0402 0.07323 0.33493 -2.43594 LEU_44 -7.86475 0.80917 4.22863 -0.5011 0.26964 0.11458 2.51064 -2.78796 -0 -0 -1.90149 0.25051 0 0 0 0 0 0.03188 0.00499 0.07656 0.37758 0 -0.2612 0 0.18072 -0.13403 0.49527 -4.10035 VAL_45 -5.72797 0.40871 5.69703 -0.31704 0.22363 0.07283 3.08439 -2.89072 -0 -0 -2.6183 -0.20825 0 0 0 0 0 0.02198 -0.02053 0.00847 0.08337 0 -0.28087 0 1.9342 -0.2187 0.45524 -0.29251 ASP_46 -5.76843 0.33036 7.11282 -0.10188 0.00458 0.30467 3.04706 -3.35757 -0 -0 -3.02355 -0.3641 0 0 0 0 0 0.01205 0.0334 0.00423 0 1.6873 0.18913 0 -2.3716 -0.21067 0.44848 -2.02373 LEU_47 -8.41155 0.48194 5.60946 -0.47776 0.17625 0.10908 3.10045 -3.18719 -0.01148 -0.05694 -3.52729 0.21178 0 0 0 0 0 0.00601 0.11846 0.00449 0.30492 0 -0.28034 0 0.18072 -0.31783 0.54562 -5.42119 ILE_48 -7.58297 0.64378 5.73958 -0.49015 0.32549 0.09544 2.65088 -3.07868 -0 -0 -1.6449 0.09259 0 0 0 0 0 0.00647 -0.06798 0.01541 0.48883 0 -0.49316 0 0.73287 -0.10529 0.46287 -2.20893 LYS_49 -3.99137 0.21451 3.91378 -0.30433 0.02375 0.13495 1.70937 -1.88201 -0 -0 -1.15771 -0.03176 0 0 0 0 0 0.007 -0.08248 0.07253 1.75053 0 -0.06741 0 -1.5107 -0.2382 0.40696 -1.0326 ASN_50 -4.48282 0.39145 4.73861 -0.19728 0.0397 0.31529 1.40922 -2.29524 -0 -0 -1.25849 -0.41458 0 0 0 0 0 0.00673 -0.06879 0.02317 0 2.01841 -0.49603 0 -0.93687 -0.64021 0.32426 -1.52346 LYS_51 -2.53123 0.23755 3.19572 -0.33744 0.07083 0.22126 1.17212 -1.52284 -0.00455 -0.02133 -1.3093 -0.39095 0 0 0 0 0 0.0066 0.0249 0.01979 1.4948 0 -0.09411 0 -1.5107 -0.40936 0.31094 -1.37729 HIS_D_52 -3.9396 0.20821 3.10013 -0.40144 0.00672 0.51233 0.98603 -1.60946 -0.00455 -0.02133 -0.73928 -0.2906 0 0 0 0 0 0.00582 0.00485 0.03263 0 1.73066 -0.29196 0 -0.45461 0.04716 0.37455 -0.74376 MET_53 -5.76689 0.40409 3.43104 -0.33946 0.12099 0.07572 1.06431 -1.6397 -0.01414 -0.06435 -0.07307 0.10798 0 0 0 0 0 0.02658 0.00173 0.03112 1.57353 0 -0.08143 0 0.60916 0.19574 0.35194 0.0149 ASN_54 -3.54168 0.30594 3.89899 -0.27862 0.08823 0.45339 2.10854 -1.79733 -0.01365 -0.11737 -2.07339 -0.81908 0 0 -0.8574 0 0 0.0414 -0.03197 0.0219 0 2.09984 -0.10943 0 -0.93687 0.08335 0.3166 -1.1586 ALA_55 -2.60682 0.21322 1.98247 -0.02471 0.0002 0 0.75724 -1.27009 -0.00266 -0.0074 0.06838 -0.37353 0 0 0 0 0 0.01574 -0.0899 0 0 0 -0.31009 0 1.8394 -0.27151 0.28236 0.20229 ASP_56 -2.64147 0.21607 3.14711 -0.12178 0.0225 0.37963 1.26723 -1.52803 -0.00151 -0.02654 -1.20543 -0.22515 0 0 -0.8574 0 0 0.0062 -0.07438 0.0063 0 2.39363 -0.358 0 -2.3716 -0.70698 0.24257 -2.43703 THR_57 -4.34681 0.34676 3.70167 -0.16952 0.07598 0.06207 2.36663 -2.04514 -0.01365 -0.11737 -2.79252 0.23559 0 0 0 0 0 0.02334 0.04394 0.07328 0.04248 0 0.055 2.26932 -1.0874 -0.59895 0.28361 -1.59169 ASP_58 -4.77652 0.38344 5.54046 -0.10765 0.01412 0.31951 2.80015 -2.50348 -0.02393 -0.12959 -2.70403 -1.20809 0 0 -0.60164 0 0 0.02312 -0.0144 0.00562 0 2.18716 0.01457 0 -2.3716 0.00313 0.33256 -2.8171 TYR_59 -5.12441 0.31342 5.00674 -0.95624 0.08701 0.34757 3.06351 -2.53422 -0 -0 -3.31636 -0.26617 0 0 -0.60164 -1.23758 0 0.02061 0.01132 0.09776 0 1.7506 -0.41389 0.00048 1.2797 0.29163 0.26368 -1.91648 SER_60 -3.13964 0.09246 3.55921 -0.02716 0 0.04133 1.36441 -1.78403 -0 -0 -1.08786 -1.08404 0 0 0 0 0 0.01979 0.03589 0.00226 0.30988 0 0.12558 0.60385 -0.77834 -0.14855 0.2023 -1.69267 ILE_61 -5.44531 0.31196 4.0332 -0.49013 0.34265 0.09758 2.60389 -2.44402 -0 -0 -0.73734 0.02512 0 0 0 0 0 0.00583 -0.0529 0.00581 0.51117 0 -0.503 0 0.73287 -0.18668 0.23695 -0.95236 ALA_62 -4.39402 0.17184 3.86774 -0.02204 0 0 2.39928 -2.42765 -0 -0 -1.89617 -0.35576 0 0 0 0 0 0.01 -0.04186 0 0 0 -0.22124 0 1.8394 -0.12269 0.26435 -0.92883 GLU_63 -5.88458 0.23519 7.40674 -0.33425 0.06657 0.37542 3.4406 -3.37698 -0.03214 -0.30018 -3.99346 -0.63407 0 0 0 -0.88014 0 0.01684 0.02124 0.10418 0 3.57465 -0.12264 0 -2.7348 -0.32303 0.30319 -3.07166 ALA_64 -4.80509 0.27421 5.04279 -0.02208 0 0 2.78953 -2.72429 -0 -0 -2.39298 -0.35556 0 0 0 0 0 0.00872 -0.02357 0 0 0 -0.23092 0 1.8394 -0.32246 0.29209 -0.6302 ALA_65 -5.94735 0.42228 5.17563 -0.02178 0 0 3.23344 -3.15394 -0.02022 -0.12325 -3.49146 -0.36747 0 0 0 0 0 0.01548 -0.00859 0 0 0 -0.29266 0 1.8394 -0.45254 0.29991 -2.89311 PHE_66 -8.64885 1.05624 3.94223 -0.65318 0.0518 0.19989 2.38012 -3.00232 -0 -0 -2.08962 -0.06574 0 0 0 0 0 0.03077 -0.0327 0.23483 0 2.65457 -0.13247 0 1.0402 -0.2087 0.70471 -2.53823 ASN_67 -6.54959 0.51096 5.48571 -0.16608 0.00932 0.25017 2.70829 -2.9241 -0.01099 -0.15287 -1.30283 -0.3515 0 0 0 0 0 0.01457 -0.05908 0.00181 0 1.51171 0.19776 0 -0.93687 0.02704 0.73766 -0.9989 LYS_68 -3.75373 0.21368 4.03881 -0.33009 0.04693 0.18407 1.25835 -1.79412 -0 -0 -1.40449 -0.15406 0 0 0 0 0 0.0083 -0.0682 0.02218 1.764 0 -0.09199 0 -1.5107 -0.30911 0.36617 -1.51399 GLY_69 -2.0262 0.08394 2.65606 -5e-05 0 0 1.0364 -1.3353 -0 -0 -0.89804 -0.37698 0 0 0 0 0 0.00934 -0.17342 0 0 0 -1.33554 0 0.83697 -0.71482 0.3836 -1.85402 GLU_70 -3.34765 0.20542 3.51277 -0.21169 0.03211 0.30393 1.21245 -1.60739 -0 -0 -1.495 -0.60635 0 0 0 0 0 0.01216 0.10341 0.02482 0 3.1022 -0.26931 0 -2.7348 -0.55539 0.33704 -1.98127 THR_71 -4.83418 0.56835 3.31697 -0.22518 0.19345 0.1047 1.96234 -2.17108 -0.02022 -0.12325 -1.19145 -1.39538 0 0 -1.18117 0 0 0.01104 0.00695 0.24197 1.50589 0 -0.18285 2.79549 -1.0874 -0.07725 0.48159 -1.30068 ALA_72 -1.26864 0.05347 0.80313 -0.02621 0.00227 0 0.1325 -0.50633 -0 -0 0.06202 -0.42685 0 0 0 0 0 0.00539 -0.05497 0 0 0 0.00974 0 1.8394 -0.23731 0.42676 0.81437 MET_73 -4.06442 0.36057 1.99577 -0.26879 0.05425 0.05807 1.18567 -1.32029 -0 -0 -1.53938 -0.02727 0 0 -1.18117 0 0 0.00605 0.07688 0.0759 2.22177 0 -0.11014 0 0.60916 -0.13329 0.29878 -1.70187 THR_74 -3.61134 0.44012 1.48559 -0.23172 0.24983 0.09103 0.21334 -1.00544 -0.00602 -0.02 -0.01478 -1.28171 0 0 0 0 0 0.01427 -0.00656 0.01543 0.57388 0 0.03575 2.32334 -1.0874 0.16239 0.40177 -1.25823 ILE_75 -3.34512 0.27193 0.16713 -0.46868 0.31759 0.09971 0.34455 -0.69415 -0 -0 -0.00695 -0.04403 0 0 0 0 0 0.02139 -0.0499 0.02298 0.40582 0 -0.77038 0 0.73287 -0.26184 0.30472 -2.95236 ASN_76 -4.334 0.4603 2.5012 -0.16292 0.01873 0.22112 1.50219 -1.611 -0.02374 -0.10801 -0.71977 -0.91505 0 0 -0.97232 -0.70778 0 0.03623 0.0033 0.01886 0 1.81219 -0.2006 0 -0.93687 -0.27077 0.26041 -4.1283 GLY_77 -3.53136 0.61622 3.01181 -0.00055 0 0 1.94211 -1.76852 -0 -0 -1.19252 -0.21703 0 0 -0.97232 0 0 0.03493 -0.0751 0 0 0 -0.35905 0 0.83697 0.03361 0.60221 -1.0386 PRO_78 -4.0439 0.70631 1.53089 -0.08474 0 0.05238 1.03813 -1.00798 -0.02639 -0.16045 -0.43605 0.69582 0 0 0 0 0 0.00349 -0.14121 0.00329 0.52907 0 -0.28254 0 -2.4119 -0.22311 0.76121 -3.49768 TRP_79 -5.89782 0.64106 3.04689 -1.22306 0.1185 0.90745 1.73575 -2.06412 -0.01779 -0.08911 -0.03872 -0.76439 0 0 0 -0.5298 0 0.01371 -0.07011 0.03428 0 2.82494 -0.05748 0 1.6906 -0.46343 0.3642 0.16153 ALA_80 -4.64967 0.50382 3.60764 -0.02687 0.00312 0 2.11835 -2.30918 -0.02115 -0.14731 -2.17469 -0.42427 0 0 0 0 0 0.02068 0.04411 0 0 0 0.17086 0 1.8394 -0.44228 0.29812 -1.58933 TRP_81 -7.48708 0.97518 3.63222 -0.74074 0.38064 0.4428 2.68646 -2.63096 -0 -0 -2.43195 -0.43402 0 0 0 0 0 0.0183 0.00677 0.05253 0 2.74603 -0.00658 0 1.6906 -0.44409 0.57068 -0.97324 SER_82 -2.94986 0.14014 3.91394 -0.02416 0 0.02205 1.48997 -1.83199 -0.03168 -0.23354 -2.04609 -0.3815 0 0 0 0 0 0.00944 -0.02862 3e-05 0.5572 0 0.26956 0.60018 -0.77834 -0.30923 0.41882 -1.19368 ASN_83 -4.86864 0.19303 5.96737 -0.17765 0.02774 0.26438 2.86353 -2.76916 -8e-05 -0.0011 -3.19806 -0.24273 0 0 0 -0.88014 0 0.01753 0.00208 0.02548 0 1.54766 0.32948 0 -0.93687 0.04085 0.11814 -1.67714 ILE_84 -9.13819 1.73618 3.50126 -0.72041 0.50735 0.23886 2.49254 -2.92484 -0 -0 -1.25197 0.47877 0 0 0 0 0 0.11243 0.07866 0.0033 0.959 0 0.00018 0 0.73287 0.0809 0.74736 -2.36577 ASP_85 -3.88355 0.28648 4.73473 -0.18869 0.00023 0.61631 1.77133 -2.26544 -0.00529 -0.07309 -1.90619 -0.25368 0 0 0 0 0 0.10759 0.04511 0.00836 0 3.14686 0.24413 0 -2.3716 -0.06377 0.87658 0.82643 THR_86 -3.20845 0.1773 4.37783 -0.20805 0.1452 0.07636 1.81055 -1.93627 -0 -0 -1.68227 -0.12132 0 0 0 0 0 0.014 -0.05995 0.00015 0.27925 0 0.18827 2.28794 -1.0874 -0.04463 0.40499 1.41352 SER_87 -4.49746 0.30927 4.60399 -0.03582 0.0064 0.02677 1.89111 -2.17609 -0 -0 -1.54166 0.03706 0 0 0 0 0 0.82067 -0.04687 0.01888 1.06062 0 -0.33495 1.75902 -0.77834 -0.23566 0.42277 1.30972 LYS_88 -2.29645 0.24081 2.94697 -0.34 0.07087 0.22016 1.08908 -1.3688 -0.00038 -0.00099 -1.37033 -0.37441 0 0 0 0 0 0.67065 -0.02549 0.0121 1.53036 0 -0.10999 0 -1.5107 -0.35454 0.36043 -0.61066 VAL_89 -5.17088 0.80611 2.29417 -0.27042 0.14495 0.05405 1.51859 -1.87017 -0.01518 -0.21523 -0.67109 -0.05015 0 0 0 0 0 0.1696 -0.07257 0.01043 0.16737 0 -0.51409 0 1.9342 -0.37014 0.35418 -1.76626 ASN_90 -1.27846 0.09957 0.98984 -0.30202 0.05948 0.57058 0.08604 -0.59342 -0.02022 -0.22181 0.35173 -0.83337 0 0 0 0 0 0.04225 -0.03599 0.01055 0 2.04031 -0.60655 0 -0.93687 -0.1594 0.38071 -0.35705 TYR_91 -5.81594 0.60824 1.68849 -1.19232 0.13586 0.70418 0.9924 -1.46411 -0.01907 -0.18413 -0.65559 -0.10563 0 0 0 0 0 0.03402 0.11335 0.57885 0 2.75918 -0.38581 3e-05 1.2797 -0.06168 0.38807 -0.60191 GLY_92 -1.50731 0.15881 0.82114 -0.00113 0 0 0.07179 -0.62034 -0 -0 -0.03561 -0.28672 0 0 0 0 0 0.04489 -0.11815 0 0 0 -0.00121 0 0.83697 0.30069 0.27206 -0.06412 VAL_93 -2.55908 0.2828 -0.03805 -0.27257 0.14108 0.05882 0.00117 -0.61449 -0 -0 -0.0823 -0.39824 0 0 0 0 0 0.01133 -0.00588 1e-05 0.19215 0 -0.70403 0 1.9342 0.24967 0.15968 -1.64374 THR_94 -1.70037 0.13551 1.21833 -0.10691 0.07472 0.07159 0.16493 -0.76057 -0 -0 -0.37451 -0.49524 0 0 0 0 0 0.01625 0.01509 0.0033 0.12673 0 -0.64311 2.27245 -1.0874 -0.37045 0.24329 -1.19637 VAL_95 -1.62935 0.10981 1.06815 -0.26783 0.14209 0.05153 0.41123 -0.596 -0 -0 -0.1718 0.15384 0 0 0 0 0 0.01261 -0.07408 0.00027 0.10823 0 -0.37483 0 1.9342 -0.46248 0.21981 0.63541 LEU_96 -4.38973 0.84742 0.90951 -0.47156 0.29032 0.07825 0.53657 -0.90771 -0 -0 -0.05063 0.40281 0 0 0 0 0 0.01436 0.12636 0.03478 0.43441 0 0.0449 0 0.18072 -0.48062 0.7184 -1.68144 PRO_97 -2.66463 0.43099 2.01581 -0.16922 0.00014 0.11667 0.91702 -0.88709 -0.01033 -0.07515 -1.34007 0.19898 0 0 -0.37883 0 0 0.03544 0.00524 0.01027 0.87353 0 -1.13415 0 -2.4119 -0.5081 0.77802 -4.19735 THR_98 -3.64499 0.50145 1.99069 -0.11281 0.05318 0.07398 0.44066 -1.21784 -0.01642 -0.09577 -0.82152 -0.6561 0 0 0 0 0 0.00714 0.00411 0.01815 0.04156 0 -0.40931 2.43381 -1.0874 -0.54295 0.34464 -2.69574 PHE_99 -8.06 0.90409 3.3468 -0.75569 0.06763 0.08906 2.20753 -2.43338 -0 -0 -1.60325 -0.48057 0 0 0 0 0 0.00625 0.07466 0.02397 0 2.44884 -0.26279 0 1.0402 -0.01856 0.36175 -3.04346 LYS_100 -3.62286 0.3246 4.14996 -0.35554 0.0775 0.22308 1.4178 -1.65907 -0.01678 -0.08719 -2.2496 -0.35068 0 0 0 -0.64295 0 0.03002 -0.08985 0.05171 1.51492 0 -0.09856 0 -1.5107 0.0977 0.53983 -2.25667 GLY_101 -2.21754 0.25111 1.97659 -6e-05 0 0 0.1627 -1.02839 -0.01642 -0.09577 0.12966 -0.39869 0 0 0 0 0 0.00932 -0.15709 0 0 0 -1.44516 0 0.83697 -0.61977 0.49292 -2.11962 GLN_102 -5.49196 0.87419 5.89203 -0.66688 0.17612 0.68834 3.0605 -2.75892 -0.0337 -0.23253 -3.29245 -0.71764 0 0 0 0 0 0.02079 -0.00137 0.01859 0 2.45791 0.07583 0 -0.18838 -0.55371 0.91341 0.24018 PRO_103 -3.58081 0.53471 2.19322 -0.12676 0.00085 0.09406 0.88456 -1.09312 -0.01921 -0.10631 -0.93447 0.24166 0 0 0 0 0 0.00689 0.22363 0.02416 0.19446 0 -1.13329 0 -2.4119 -0.45852 1.06524 -4.40093 SER_104 -4.62441 0.78088 3.17983 -0.0319 0 0.02074 1.05471 -1.5442 -0 -0 -1.51224 -0.16488 0 0 -0.37883 0 0 0.03444 0.01541 0.19011 0.47869 0 -0.06787 1.84862 -0.77834 -0.63843 0.59855 -1.53912 LYS_105 -5.38673 0.73679 4.55936 -0.34095 0.06305 0.22015 1.73185 -2.2083 -0.05655 -0.20967 -1.45649 -0.34508 0 0 0 0 0 0.00936 0.01563 0.08329 1.93652 0 0.11938 0 -1.5107 -0.23576 1.1025 -1.17234 PRO_106 -4.21379 0.76555 1.58725 -0.13749 0.00132 0.09728 0.09908 -0.74134 -0 -0 -0.16987 0.24129 0 0 0 0 0 0.03624 0.17351 0.01765 0.30053 0 -1.12083 0 -2.4119 -0.29794 1.10307 -4.67041 PHE_107 -5.42175 0.70649 1.22751 -0.45833 0.02588 0.15883 0.61744 -1.36788 -1e-05 -0.00021 -1.23233 0.08843 0 0 -0.4104 0 0 0.01915 -0.0161 0.02317 0 2.60374 -0.06174 0 1.0402 -0.55865 0.83567 -2.18091 VAL_108 -1.71139 0.15586 1.08383 -0.26968 0.15632 0.05626 0.35653 -0.7406 -0 -0 -0.02487 -0.33906 0 0 0 0 0 0.00826 -0.07142 0.00164 0.22105 0 -0.76026 0 1.9342 -0.44224 0.56703 0.18143 GLY_109 -1.12265 0.13881 0.76504 -0.00033 0 0 0.2453 -0.51803 -0 -0 -0.06243 -0.17441 0 0 0 0 0 0.00429 -0.12692 0 0 0 -0.85553 0 0.83697 -0.17498 0.06431 -0.98055 VAL_110 -1.53913 0.16003 0.67005 -0.26867 0.16305 0.05656 1e-05 -0.57029 -0 -0 0.05868 -0.2981 0 0 0 0 0 0.00626 -0.0417 0.00016 0.28117 0 -0.75917 0 1.9342 -0.17049 0.05006 -0.26731 LEU_111 -1.33819 0.09925 0.74605 -0.46873 0.20471 0.09217 0.00862 -0.49818 -0 -0 -0.24637 0.12162 0 0 0 0 0 0.00973 -0.00117 0.02443 0.56671 0 -0.3433 0 0.18072 -0.34409 0.12349 -1.06255 SER_112 -1.05578 0.04017 1.27484 -0.02824 0 0.06666 0.25571 -0.60946 -0 -0 0.01149 -0.18647 0 0 0 0 0 0.02887 0.00046 0.00349 0.06922 0 -0.50834 0.60051 -0.77834 -0.28535 0.11298 -0.98757 ALA_113 -0.81782 0.03626 0.9373 -0.02457 0 0 0.30685 -0.48372 -0 -0 0.12527 -0.21251 0 0 0 0 0 0.01348 -0.03059 0 0 0 -0.10847 0 1.8394 -0.58752 0.06854 1.0619 GLY_114 -0.9665 0.10638 0.92354 -0.00032 0 0 0.26637 -0.51028 -0.00894 -0.03538 0.1297 -0.17179 0 0 0 0 0 0.00573 -0.12585 0 0 0 -0.93821 0 0.83697 -0.4204 0.0507 -0.85827 ILE_115 -1.28257 0.14793 0.9318 -0.46397 0.33615 0.09814 0 -0.53132 -2e-05 -8e-05 0.12648 -0.00503 0 0 0 0 0 0.04717 -0.02976 0.00242 0.35634 0 -0.76182 0 0.73287 -0.17588 0.12616 -0.34501 ASN:CtermProteinFull_116 -0.90315 0.06203 0.77886 -0.19326 0.00774 0.35936 0 -0.43754 -0.00896 -0.03546 -0.07321 -0.29651 0 0 0 0 0 0.55255 0 0.00455 0 2.07819 0 0 -0.93687 -0.20143 0.20598 0.96287 VRT_117 0 0 0 0 0 0 0 -0 -0 -0 0 0 0 0 0 0 0 4.86548 0 0 0 0 0 0 0 0 0 4.86548 #END_POSE_ENERGIES_TABLE model01_0001.pdb ENDMDL REMARK ID 96494 DOMAINID 91535 MODEL 3 2021-07-17_00000178_2_11 MODEL 3 REMARK Rerank model04.pdb to model03.pdb score: 228.062 tmscore: 0.92997 6wbjA_201 prob: 99.85 ident: 25.69 ATOM 1 N GLN A 1 -9.384 2.439 -4.797 1.00 0.780 N ATOM 2 CA GLN A 1 -8.905 2.665 -6.163 1.00 0.460 C ATOM 3 C GLN A 1 -7.379 2.707 -6.230 1.00 0.280 C ATOM 4 O GLN A 1 -6.751 1.774 -6.726 1.00 0.330 O ATOM 5 CB GLN A 1 -9.503 3.948 -6.766 1.00 0.770 C ATOM 6 CG GLN A 1 -11.008 3.882 -7.018 1.00 0.770 C ATOM 7 CD GLN A 1 -11.380 2.826 -8.018 1.00 0.770 C ATOM 8 OE1 GLN A 1 -10.890 2.819 -9.148 1.00 0.770 O ATOM 9 NE2 GLN A 1 -12.230 1.910 -7.599 1.00 0.770 N ATOM 10 1H GLN A 1 -10.346 2.768 -4.666 1.00 0.940 H ATOM 11 2H GLN A 1 -9.359 1.445 -4.616 1.00 0.940 H ATOM 12 3H GLN A 1 -8.768 2.900 -4.139 1.00 0.940 H ATOM 13 HA GLN A 1 -9.231 1.825 -6.777 1.00 0.550 H ATOM 14 1HB GLN A 1 -9.322 4.787 -6.099 1.00 0.930 H ATOM 15 2HB GLN A 1 -9.011 4.169 -7.715 1.00 0.930 H ATOM 16 1HG GLN A 1 -11.518 3.639 -6.104 1.00 0.930 H ATOM 17 2HG GLN A 1 -11.354 4.845 -7.394 1.00 0.930 H ATOM 18 1HE2 GLN A 1 -12.520 1.163 -8.205 1.00 0.930 H ATOM 19 2HE2 GLN A 1 -12.600 1.948 -6.660 1.00 0.930 H ATOM 20 N GLU A 2 -6.778 3.802 -5.768 1.00 0.250 N ATOM 21 CA GLU A 2 -5.327 3.942 -5.811 1.00 0.200 C ATOM 22 C GLU A 2 -4.611 2.834 -4.996 1.00 0.130 C ATOM 23 O GLU A 2 -4.938 2.680 -3.813 1.00 0.120 O ATOM 24 CB GLU A 2 -4.942 5.314 -5.251 1.00 0.300 C ATOM 25 CG GLU A 2 -3.469 5.644 -5.322 1.00 0.300 C ATOM 26 CD GLU A 2 -3.146 6.978 -4.748 1.00 0.300 C ATOM 27 OE1 GLU A 2 -4.040 7.636 -4.278 1.00 0.300 O ATOM 28 OE2 GLU A 2 -1.999 7.342 -4.773 1.00 0.300 O ATOM 29 H GLU A 2 -7.319 4.561 -5.380 1.00 0.300 H ATOM 30 HA GLU A 2 -5.038 3.930 -6.851 1.00 0.240 H ATOM 31 1HB GLU A 2 -5.477 6.087 -5.801 1.00 0.360 H ATOM 32 2HB GLU A 2 -5.251 5.385 -4.218 1.00 0.360 H ATOM 33 1HG GLU A 2 -2.913 4.900 -4.784 1.00 0.360 H ATOM 34 2HG GLU A 2 -3.150 5.617 -6.361 1.00 0.360 H ATOM 35 N PRO A 3 -3.603 2.109 -5.575 1.00 0.140 N ATOM 36 CA PRO A 3 -2.803 1.028 -4.969 1.00 0.130 C ATOM 37 C PRO A 3 -2.208 1.385 -3.619 1.00 0.120 C ATOM 38 O PRO A 3 -2.049 0.531 -2.744 1.00 0.110 O ATOM 39 CB PRO A 3 -1.693 0.820 -6.006 1.00 0.200 C ATOM 40 CG PRO A 3 -2.334 1.178 -7.317 1.00 0.200 C ATOM 41 CD PRO A 3 -3.256 2.340 -7.007 1.00 0.200 C ATOM 42 HA PRO A 3 -3.432 0.128 -4.884 1.00 0.160 H ATOM 43 1HB PRO A 3 -0.824 1.451 -5.766 1.00 0.230 H ATOM 44 2HB PRO A 3 -1.346 -0.224 -5.977 1.00 0.230 H ATOM 45 1HG PRO A 3 -1.562 1.436 -8.060 1.00 0.230 H ATOM 46 2HG PRO A 3 -2.879 0.309 -7.718 1.00 0.230 H ATOM 47 1HD PRO A 3 -2.749 3.304 -7.156 1.00 0.230 H ATOM 48 2HD PRO A 3 -4.142 2.207 -7.654 1.00 0.230 H ATOM 49 N TYR A 4 -1.890 2.658 -3.435 1.00 0.150 N ATOM 50 CA TYR A 4 -1.340 3.165 -2.194 1.00 0.160 C ATOM 51 C TYR A 4 -2.081 2.621 -0.973 1.00 0.170 C ATOM 52 O TYR A 4 -1.473 2.334 0.060 1.00 0.280 O ATOM 53 CB TYR A 4 -1.378 4.690 -2.180 1.00 0.220 C ATOM 54 CG TYR A 4 -0.757 5.292 -0.949 1.00 0.220 C ATOM 55 CD1 TYR A 4 0.617 5.477 -0.890 1.00 0.220 C ATOM 56 CD2 TYR A 4 -1.544 5.645 0.122 1.00 0.220 C ATOM 57 CE1 TYR A 4 1.188 6.019 0.239 1.00 0.220 C ATOM 58 CE2 TYR A 4 -0.982 6.183 1.249 1.00 0.220 C ATOM 59 CZ TYR A 4 0.385 6.371 1.312 1.00 0.220 C ATOM 60 OH TYR A 4 0.957 6.909 2.444 1.00 0.220 O ATOM 61 H TYR A 4 -1.990 3.325 -4.188 1.00 0.180 H ATOM 62 HA TYR A 4 -0.309 2.842 -2.123 1.00 0.190 H ATOM 63 1HB TYR A 4 -0.858 5.082 -3.055 1.00 0.260 H ATOM 64 2HB TYR A 4 -2.413 5.030 -2.239 1.00 0.260 H ATOM 65 HD1 TYR A 4 1.242 5.196 -1.738 1.00 0.260 H ATOM 66 HD2 TYR A 4 -2.607 5.493 0.073 1.00 0.260 H ATOM 67 HE1 TYR A 4 2.267 6.169 0.290 1.00 0.260 H ATOM 68 HE2 TYR A 4 -1.613 6.457 2.094 1.00 0.260 H ATOM 69 HH TYR A 4 1.912 6.958 2.330 1.00 0.260 H ATOM 70 N PHE A 5 -3.414 2.523 -1.076 1.00 0.120 N ATOM 71 CA PHE A 5 -4.250 2.152 0.050 1.00 0.120 C ATOM 72 C PHE A 5 -4.613 0.664 0.108 1.00 0.110 C ATOM 73 O PHE A 5 -5.449 0.275 0.925 1.00 0.120 O ATOM 74 CB PHE A 5 -5.545 2.956 -0.033 1.00 0.170 C ATOM 75 CG PHE A 5 -5.343 4.447 0.054 1.00 0.170 C ATOM 76 CD1 PHE A 5 -5.244 5.191 -1.116 1.00 0.170 C ATOM 77 CD2 PHE A 5 -5.267 5.112 1.272 1.00 0.170 C ATOM 78 CE1 PHE A 5 -5.065 6.556 -1.081 1.00 0.170 C ATOM 79 CE2 PHE A 5 -5.092 6.490 1.307 1.00 0.170 C ATOM 80 CZ PHE A 5 -4.990 7.209 0.128 1.00 0.170 C ATOM 81 H PHE A 5 -3.881 2.721 -1.968 1.00 0.140 H ATOM 82 HA PHE A 5 -3.719 2.413 0.965 1.00 0.140 H ATOM 83 1HB PHE A 5 -6.038 2.735 -0.982 1.00 0.200 H ATOM 84 2HB PHE A 5 -6.217 2.655 0.767 1.00 0.200 H ATOM 85 HD1 PHE A 5 -5.304 4.677 -2.073 1.00 0.200 H ATOM 86 HD2 PHE A 5 -5.353 4.548 2.205 1.00 0.200 H ATOM 87 HE1 PHE A 5 -4.982 7.119 -2.020 1.00 0.200 H ATOM 88 HE2 PHE A 5 -5.034 7.007 2.254 1.00 0.200 H ATOM 89 HZ PHE A 5 -4.850 8.289 0.154 1.00 0.200 H ATOM 90 N THR A 6 -4.013 -0.174 -0.751 1.00 0.110 N ATOM 91 CA THR A 6 -4.291 -1.607 -0.725 1.00 0.110 C ATOM 92 C THR A 6 -2.980 -2.260 -0.387 1.00 0.120 C ATOM 93 O THR A 6 -2.905 -3.308 0.285 1.00 0.120 O ATOM 94 CB THR A 6 -4.766 -2.126 -2.095 1.00 0.150 C ATOM 95 OG1 THR A 6 -3.732 -1.936 -3.064 1.00 0.150 O ATOM 96 CG2 THR A 6 -5.992 -1.363 -2.532 1.00 0.150 C ATOM 97 H THR A 6 -3.318 0.163 -1.421 1.00 0.130 H ATOM 98 HA THR A 6 -5.023 -1.840 0.047 1.00 0.130 H ATOM 99 HB THR A 6 -4.984 -3.167 -2.027 1.00 0.180 H ATOM 100 HG1 THR A 6 -3.943 -2.437 -3.859 1.00 0.180 H ATOM 101 1HG2 THR A 6 -6.323 -1.730 -3.502 1.00 0.180 H ATOM 102 2HG2 THR A 6 -6.783 -1.504 -1.797 1.00 0.180 H ATOM 103 3HG2 THR A 6 -5.753 -0.300 -2.613 1.00 0.180 H ATOM 104 N TRP A 7 -1.938 -1.513 -0.710 1.00 0.140 N ATOM 105 CA TRP A 7 -0.579 -1.943 -0.531 1.00 0.170 C ATOM 106 C TRP A 7 -0.230 -2.455 0.850 1.00 0.150 C ATOM 107 O TRP A 7 0.418 -3.496 0.947 1.00 0.190 O ATOM 108 CB TRP A 7 0.397 -0.859 -0.932 1.00 0.230 C ATOM 109 CG TRP A 7 1.752 -1.310 -0.785 1.00 0.230 C ATOM 110 CD1 TRP A 7 2.667 -0.942 0.145 1.00 0.230 C ATOM 111 CD2 TRP A 7 2.378 -2.284 -1.613 1.00 0.230 C ATOM 112 NE1 TRP A 7 3.829 -1.607 -0.066 1.00 0.230 N ATOM 113 CE2 TRP A 7 3.663 -2.444 -1.142 1.00 0.230 C ATOM 114 CE3 TRP A 7 1.947 -3.031 -2.711 1.00 0.230 C ATOM 115 CZ2 TRP A 7 4.530 -3.322 -1.721 1.00 0.230 C ATOM 116 CZ3 TRP A 7 2.811 -3.913 -3.284 1.00 0.230 C ATOM 117 CH2 TRP A 7 4.058 -4.060 -2.808 1.00 0.230 C ATOM 118 H TRP A 7 -2.122 -0.665 -1.265 1.00 0.170 H ATOM 119 HA TRP A 7 -0.417 -2.760 -1.217 1.00 0.200 H ATOM 120 1HB TRP A 7 0.230 -0.607 -1.975 1.00 0.270 H ATOM 121 2HB TRP A 7 0.265 0.045 -0.362 1.00 0.270 H ATOM 122 HD1 TRP A 7 2.498 -0.223 0.933 1.00 0.270 H ATOM 123 HE1 TRP A 7 4.661 -1.500 0.500 1.00 0.270 H ATOM 124 HE3 TRP A 7 0.940 -2.921 -3.103 1.00 0.270 H ATOM 125 HZ2 TRP A 7 5.534 -3.448 -1.346 1.00 0.270 H ATOM 126 HZ3 TRP A 7 2.468 -4.499 -4.136 1.00 0.270 H ATOM 127 HH2 TRP A 7 4.686 -4.774 -3.296 1.00 0.270 H ATOM 128 N PRO A 8 -0.603 -1.797 1.971 1.00 0.140 N ATOM 129 CA PRO A 8 -0.217 -2.250 3.285 1.00 0.160 C ATOM 130 C PRO A 8 -0.548 -3.737 3.503 1.00 0.170 C ATOM 131 O PRO A 8 0.212 -4.451 4.170 1.00 0.220 O ATOM 132 CB PRO A 8 -1.075 -1.349 4.188 1.00 0.240 C ATOM 133 CG PRO A 8 -1.299 -0.085 3.380 1.00 0.240 C ATOM 134 CD PRO A 8 -1.465 -0.570 1.979 1.00 0.240 C ATOM 135 HA PRO A 8 0.849 -2.068 3.414 1.00 0.190 H ATOM 136 1HB PRO A 8 -2.008 -1.862 4.473 1.00 0.290 H ATOM 137 2HB PRO A 8 -0.527 -1.128 5.109 1.00 0.290 H ATOM 138 1HG PRO A 8 -2.206 0.428 3.745 1.00 0.290 H ATOM 139 2HG PRO A 8 -0.498 0.620 3.474 1.00 0.290 H ATOM 140 1HD PRO A 8 -2.520 -0.815 1.841 1.00 0.290 H ATOM 141 2HD PRO A 8 -1.128 0.194 1.292 1.00 0.290 H ATOM 142 N LEU A 9 -1.669 -4.209 2.928 1.00 0.140 N ATOM 143 CA LEU A 9 -2.072 -5.597 3.068 1.00 0.140 C ATOM 144 C LEU A 9 -1.227 -6.530 2.235 1.00 0.150 C ATOM 145 O LEU A 9 -0.855 -7.623 2.655 1.00 0.200 O ATOM 146 CB LEU A 9 -3.497 -5.794 2.621 1.00 0.200 C ATOM 147 CG LEU A 9 -4.017 -7.213 2.752 1.00 0.200 C ATOM 148 CD1 LEU A 9 -4.074 -7.667 4.171 1.00 0.200 C ATOM 149 CD2 LEU A 9 -5.244 -7.274 2.128 1.00 0.200 C ATOM 150 H LEU A 9 -2.267 -3.619 2.344 1.00 0.170 H ATOM 151 HA LEU A 9 -1.962 -5.858 4.116 1.00 0.170 H ATOM 152 1HB LEU A 9 -4.136 -5.142 3.211 1.00 0.240 H ATOM 153 2HB LEU A 9 -3.577 -5.495 1.574 1.00 0.240 H ATOM 154 HG LEU A 9 -3.354 -7.884 2.235 1.00 0.240 H ATOM 155 1HD1 LEU A 9 -4.454 -8.677 4.176 1.00 0.240 H ATOM 156 2HD1 LEU A 9 -3.089 -7.654 4.615 1.00 0.240 H ATOM 157 3HD1 LEU A 9 -4.742 -7.029 4.744 1.00 0.240 H ATOM 158 1HD2 LEU A 9 -5.586 -8.278 2.155 1.00 0.240 H ATOM 159 2HD2 LEU A 9 -5.958 -6.609 2.608 1.00 0.240 H ATOM 160 3HD2 LEU A 9 -5.062 -6.970 1.116 1.00 0.240 H ATOM 161 N ILE A 10 -0.983 -6.109 1.011 1.00 0.110 N ATOM 162 CA ILE A 10 -0.264 -6.901 0.026 1.00 0.110 C ATOM 163 C ILE A 10 1.151 -7.160 0.560 1.00 0.120 C ATOM 164 O ILE A 10 1.647 -8.302 0.617 1.00 0.150 O ATOM 165 CB ILE A 10 -0.246 -6.083 -1.285 1.00 0.150 C ATOM 166 CG1 ILE A 10 -1.715 -5.980 -1.807 1.00 0.150 C ATOM 167 CG2 ILE A 10 0.656 -6.711 -2.327 1.00 0.150 C ATOM 168 CD1 ILE A 10 -1.943 -4.957 -2.897 1.00 0.150 C ATOM 169 H ILE A 10 -1.354 -5.184 0.764 1.00 0.130 H ATOM 170 HA ILE A 10 -0.768 -7.844 -0.130 1.00 0.130 H ATOM 171 HB ILE A 10 0.110 -5.082 -1.069 1.00 0.180 H ATOM 172 1HG1 ILE A 10 -2.019 -6.953 -2.168 1.00 0.180 H ATOM 173 2HG1 ILE A 10 -2.364 -5.713 -0.976 1.00 0.180 H ATOM 174 1HG2 ILE A 10 0.656 -6.118 -3.230 1.00 0.180 H ATOM 175 2HG2 ILE A 10 1.678 -6.781 -1.956 1.00 0.180 H ATOM 176 3HG2 ILE A 10 0.275 -7.686 -2.552 1.00 0.180 H ATOM 177 1HD1 ILE A 10 -2.993 -4.959 -3.168 1.00 0.180 H ATOM 178 2HD1 ILE A 10 -1.684 -3.975 -2.548 1.00 0.180 H ATOM 179 3HD1 ILE A 10 -1.349 -5.192 -3.770 1.00 0.180 H ATOM 180 N ALA A 11 1.756 -6.070 1.009 1.00 0.130 N ATOM 181 CA ALA A 11 3.075 -6.035 1.610 1.00 0.170 C ATOM 182 C ALA A 11 3.175 -6.875 2.898 1.00 0.150 C ATOM 183 O ALA A 11 4.204 -7.508 3.166 1.00 0.210 O ATOM 184 CB ALA A 11 3.420 -4.605 1.889 1.00 0.220 C ATOM 185 H ALA A 11 1.258 -5.179 0.905 1.00 0.160 H ATOM 186 HA ALA A 11 3.782 -6.433 0.890 1.00 0.200 H ATOM 187 1HB ALA A 11 4.423 -4.531 2.294 1.00 0.270 H ATOM 188 2HB ALA A 11 3.360 -4.062 0.983 1.00 0.270 H ATOM 189 3HB ALA A 11 2.701 -4.199 2.595 1.00 0.270 H ATOM 190 N ALA A 12 2.095 -6.938 3.681 1.00 0.140 N ATOM 191 CA ALA A 12 2.084 -7.644 4.959 1.00 0.130 C ATOM 192 C ALA A 12 2.520 -9.100 4.881 1.00 0.130 C ATOM 193 O ALA A 12 3.148 -9.599 5.811 1.00 0.150 O ATOM 194 CB ALA A 12 0.687 -7.637 5.547 1.00 0.190 C ATOM 195 H ALA A 12 1.290 -6.357 3.452 1.00 0.170 H ATOM 196 HA ALA A 12 2.754 -7.108 5.632 1.00 0.160 H ATOM 197 1HB ALA A 12 0.704 -8.116 6.531 1.00 0.220 H ATOM 198 2HB ALA A 12 0.347 -6.640 5.635 1.00 0.220 H ATOM 199 3HB ALA A 12 0.017 -8.179 4.892 1.00 0.220 H ATOM 200 N ASP A 13 2.221 -9.806 3.784 1.00 0.140 N ATOM 201 CA ASP A 13 2.584 -11.222 3.738 1.00 0.130 C ATOM 202 C ASP A 13 3.785 -11.486 2.844 1.00 0.130 C ATOM 203 O ASP A 13 4.044 -12.634 2.483 1.00 0.140 O ATOM 204 CB ASP A 13 1.386 -12.073 3.283 1.00 0.190 C ATOM 205 CG ASP A 13 1.510 -13.617 3.569 1.00 0.190 C ATOM 206 OD1 ASP A 13 2.096 -13.981 4.554 1.00 0.190 O ATOM 207 OD2 ASP A 13 0.940 -14.410 2.812 1.00 0.190 O ATOM 208 H ASP A 13 1.777 -9.383 2.960 1.00 0.170 H ATOM 209 HA ASP A 13 2.846 -11.543 4.747 1.00 0.160 H ATOM 210 1HB ASP A 13 0.516 -11.721 3.798 1.00 0.220 H ATOM 211 2HB ASP A 13 1.205 -11.910 2.230 1.00 0.220 H ATOM 212 N GLY A 14 4.559 -10.450 2.510 1.00 0.140 N ATOM 213 CA GLY A 14 5.733 -10.666 1.682 1.00 0.160 C ATOM 214 C GLY A 14 5.734 -9.964 0.327 1.00 0.160 C ATOM 215 O GLY A 14 6.705 -10.101 -0.415 1.00 0.220 O ATOM 216 H GLY A 14 4.360 -9.493 2.828 1.00 0.170 H ATOM 217 1HA GLY A 14 6.609 -10.339 2.241 1.00 0.190 H ATOM 218 2HA GLY A 14 5.865 -11.734 1.520 1.00 0.190 H ATOM 219 N GLY A 15 4.680 -9.228 -0.043 1.00 0.190 N ATOM 220 CA GLY A 15 4.757 -8.530 -1.318 1.00 0.190 C ATOM 221 C GLY A 15 5.758 -7.382 -1.203 1.00 0.170 C ATOM 222 O GLY A 15 6.006 -6.875 -0.105 1.00 0.220 O ATOM 223 H GLY A 15 3.821 -9.126 0.505 1.00 0.230 H ATOM 224 1HA GLY A 15 5.060 -9.214 -2.111 1.00 0.230 H ATOM 225 2HA GLY A 15 3.776 -8.136 -1.573 1.00 0.230 H ATOM 226 N TYR A 16 6.321 -6.972 -2.330 1.00 0.160 N ATOM 227 CA TYR A 16 7.257 -5.842 -2.363 1.00 0.180 C ATOM 228 C TYR A 16 7.221 -5.168 -3.720 1.00 0.200 C ATOM 229 O TYR A 16 6.732 -5.747 -4.683 1.00 0.190 O ATOM 230 CB TYR A 16 8.680 -6.272 -1.960 1.00 0.240 C ATOM 231 CG TYR A 16 9.357 -7.334 -2.827 1.00 0.240 C ATOM 232 CD1 TYR A 16 10.166 -6.990 -3.910 1.00 0.240 C ATOM 233 CD2 TYR A 16 9.175 -8.667 -2.510 1.00 0.240 C ATOM 234 CE1 TYR A 16 10.786 -7.993 -4.667 1.00 0.240 C ATOM 235 CE2 TYR A 16 9.781 -9.648 -3.251 1.00 0.240 C ATOM 236 CZ TYR A 16 10.586 -9.326 -4.325 1.00 0.240 C ATOM 237 OH TYR A 16 11.182 -10.354 -5.044 1.00 0.240 O ATOM 238 H TYR A 16 6.070 -7.470 -3.189 1.00 0.190 H ATOM 239 HA TYR A 16 6.933 -5.116 -1.625 1.00 0.220 H ATOM 240 1HB TYR A 16 9.325 -5.392 -1.956 1.00 0.290 H ATOM 241 2HB TYR A 16 8.655 -6.648 -0.936 1.00 0.290 H ATOM 242 HD1 TYR A 16 10.309 -5.952 -4.159 1.00 0.290 H ATOM 243 HD2 TYR A 16 8.546 -8.941 -1.663 1.00 0.290 H ATOM 244 HE1 TYR A 16 11.419 -7.738 -5.519 1.00 0.290 H ATOM 245 HE2 TYR A 16 9.627 -10.692 -2.987 1.00 0.290 H ATOM 246 HH TYR A 16 11.713 -9.998 -5.807 1.00 0.290 H ATOM 247 N ALA A 17 7.697 -3.928 -3.816 1.00 0.240 N ATOM 248 CA ALA A 17 7.696 -3.317 -5.138 1.00 0.250 C ATOM 249 C ALA A 17 8.915 -3.771 -5.916 1.00 0.230 C ATOM 250 O ALA A 17 8.779 -4.444 -6.938 1.00 0.220 O ATOM 251 CB ALA A 17 7.657 -1.802 -5.029 1.00 0.350 C ATOM 252 H ALA A 17 8.066 -3.447 -3.007 1.00 0.290 H ATOM 253 HA ALA A 17 6.807 -3.650 -5.675 1.00 0.300 H ATOM 254 1HB ALA A 17 7.640 -1.374 -6.032 1.00 0.420 H ATOM 255 2HB ALA A 17 6.760 -1.501 -4.487 1.00 0.420 H ATOM 256 3HB ALA A 17 8.535 -1.444 -4.501 1.00 0.420 H ATOM 257 N PHE A 18 10.104 -3.438 -5.407 1.00 0.230 N ATOM 258 CA PHE A 18 11.343 -3.842 -6.053 1.00 0.230 C ATOM 259 C PHE A 18 12.329 -4.297 -5.003 1.00 0.230 C ATOM 260 O PHE A 18 12.421 -3.698 -3.929 1.00 0.240 O ATOM 261 CB PHE A 18 11.953 -2.703 -6.862 1.00 0.320 C ATOM 262 CG PHE A 18 11.082 -2.202 -7.936 1.00 0.320 C ATOM 263 CD1 PHE A 18 10.277 -1.100 -7.721 1.00 0.320 C ATOM 264 CD2 PHE A 18 11.038 -2.825 -9.154 1.00 0.320 C ATOM 265 CE1 PHE A 18 9.450 -0.634 -8.709 1.00 0.320 C ATOM 266 CE2 PHE A 18 10.215 -2.351 -10.146 1.00 0.320 C ATOM 267 CZ PHE A 18 9.421 -1.262 -9.925 1.00 0.320 C ATOM 268 H PHE A 18 10.151 -2.897 -4.559 1.00 0.280 H ATOM 269 HA PHE A 18 11.133 -4.672 -6.719 1.00 0.280 H ATOM 270 1HB PHE A 18 12.170 -1.883 -6.210 1.00 0.390 H ATOM 271 2HB PHE A 18 12.896 -3.038 -7.306 1.00 0.390 H ATOM 272 HD1 PHE A 18 10.302 -0.604 -6.751 1.00 0.390 H ATOM 273 HD2 PHE A 18 11.669 -3.708 -9.336 1.00 0.390 H ATOM 274 HE1 PHE A 18 8.819 0.236 -8.529 1.00 0.390 H ATOM 275 HE2 PHE A 18 10.198 -2.851 -11.116 1.00 0.390 H ATOM 276 HZ PHE A 18 8.772 -0.897 -10.718 1.00 0.390 H ATOM 277 N LYS A 19 13.071 -5.348 -5.298 1.00 0.220 N ATOM 278 CA LYS A 19 14.081 -5.806 -4.348 1.00 0.250 C ATOM 279 C LYS A 19 15.112 -4.713 -4.082 1.00 0.310 C ATOM 280 O LYS A 19 15.646 -4.112 -5.014 1.00 0.360 O ATOM 281 CB LYS A 19 14.760 -7.077 -4.833 1.00 0.340 C ATOM 282 CG LYS A 19 15.771 -7.669 -3.863 1.00 0.340 C ATOM 283 CD LYS A 19 16.316 -8.957 -4.416 1.00 0.340 C ATOM 284 CE LYS A 19 17.361 -9.582 -3.520 1.00 0.340 C ATOM 285 NZ LYS A 19 17.884 -10.836 -4.114 1.00 0.340 N ATOM 286 H LYS A 19 12.907 -5.825 -6.196 1.00 0.260 H ATOM 287 HA LYS A 19 13.583 -6.030 -3.403 1.00 0.300 H ATOM 288 1HB LYS A 19 14.002 -7.837 -5.029 1.00 0.410 H ATOM 289 2HB LYS A 19 15.273 -6.881 -5.768 1.00 0.410 H ATOM 290 1HG LYS A 19 16.602 -6.973 -3.712 1.00 0.410 H ATOM 291 2HG LYS A 19 15.293 -7.859 -2.904 1.00 0.410 H ATOM 292 1HD LYS A 19 15.493 -9.668 -4.552 1.00 0.410 H ATOM 293 2HD LYS A 19 16.757 -8.767 -5.397 1.00 0.410 H ATOM 294 1HE LYS A 19 18.189 -8.882 -3.377 1.00 0.410 H ATOM 295 2HE LYS A 19 16.916 -9.808 -2.552 1.00 0.410 H ATOM 296 1HZ LYS A 19 18.578 -11.243 -3.503 1.00 0.410 H ATOM 297 2HZ LYS A 19 17.115 -11.480 -4.246 1.00 0.410 H ATOM 298 3HZ LYS A 19 18.303 -10.626 -5.011 1.00 0.410 H ATOM 299 N TYR A 20 15.426 -4.460 -2.812 1.00 0.320 N ATOM 300 CA TYR A 20 16.389 -3.406 -2.507 1.00 0.390 C ATOM 301 C TYR A 20 17.647 -3.990 -1.886 1.00 0.450 C ATOM 302 O TYR A 20 17.579 -4.747 -0.914 1.00 0.530 O ATOM 303 CB TYR A 20 15.739 -2.368 -1.592 1.00 0.520 C ATOM 304 CG TYR A 20 16.569 -1.130 -1.331 1.00 0.520 C ATOM 305 CD1 TYR A 20 16.800 -0.307 -2.374 1.00 0.520 C ATOM 306 CD2 TYR A 20 17.033 -0.784 -0.082 1.00 0.520 C ATOM 307 CE1 TYR A 20 17.479 0.846 -2.241 1.00 0.520 C ATOM 308 CE2 TYR A 20 17.737 0.410 0.068 1.00 0.520 C ATOM 309 CZ TYR A 20 17.955 1.218 -1.033 1.00 0.520 C ATOM 310 OH TYR A 20 18.651 2.414 -0.926 1.00 0.520 O ATOM 311 H TYR A 20 14.978 -4.975 -2.067 1.00 0.380 H ATOM 312 HA TYR A 20 16.686 -2.919 -3.432 1.00 0.470 H ATOM 313 1HB TYR A 20 14.795 -2.063 -2.025 1.00 0.620 H ATOM 314 2HB TYR A 20 15.515 -2.829 -0.635 1.00 0.620 H ATOM 315 HD1 TYR A 20 16.431 -0.584 -3.335 1.00 0.620 H ATOM 316 HD2 TYR A 20 16.845 -1.430 0.777 1.00 0.620 H ATOM 317 HE1 TYR A 20 17.644 1.481 -3.109 1.00 0.620 H ATOM 318 HE2 TYR A 20 18.112 0.707 1.047 1.00 0.620 H ATOM 319 HH TYR A 20 18.997 2.686 -1.822 1.00 0.620 H ATOM 320 N GLU A 21 18.795 -3.653 -2.473 1.00 0.460 N ATOM 321 CA GLU A 21 20.070 -4.171 -2.001 1.00 0.570 C ATOM 322 C GLU A 21 21.226 -3.202 -2.233 1.00 0.790 C ATOM 323 O GLU A 21 21.351 -2.595 -3.293 1.00 1.190 O ATOM 324 CB GLU A 21 20.358 -5.508 -2.694 1.00 0.750 C ATOM 325 CG GLU A 21 21.611 -6.217 -2.227 1.00 0.750 C ATOM 326 CD GLU A 21 21.810 -7.555 -2.872 1.00 0.750 C ATOM 327 OE1 GLU A 21 21.025 -7.917 -3.718 1.00 0.750 O ATOM 328 OE2 GLU A 21 22.758 -8.216 -2.527 1.00 0.750 O ATOM 329 H GLU A 21 18.760 -3.018 -3.278 1.00 0.550 H ATOM 330 HA GLU A 21 19.988 -4.348 -0.930 1.00 0.680 H ATOM 331 1HB GLU A 21 19.515 -6.183 -2.541 1.00 0.900 H ATOM 332 2HB GLU A 21 20.450 -5.343 -3.767 1.00 0.900 H ATOM 333 1HG GLU A 21 22.459 -5.603 -2.475 1.00 0.900 H ATOM 334 2HG GLU A 21 21.581 -6.332 -1.145 1.00 0.900 H ATOM 335 N ASN A 22 22.076 -3.048 -1.219 1.00 0.740 N ATOM 336 CA ASN A 22 23.277 -2.210 -1.285 1.00 1.110 C ATOM 337 C ASN A 22 23.000 -0.786 -1.765 1.00 0.910 C ATOM 338 O ASN A 22 23.782 -0.203 -2.515 1.00 0.950 O ATOM 339 CB ASN A 22 24.345 -2.870 -2.140 1.00 1.410 C ATOM 340 CG ASN A 22 24.833 -4.160 -1.539 1.00 1.410 C ATOM 341 OD1 ASN A 22 24.908 -4.298 -0.310 1.00 1.410 O ATOM 342 ND2 ASN A 22 25.171 -5.108 -2.377 1.00 1.410 N ATOM 343 H ASN A 22 21.902 -3.567 -0.368 1.00 0.890 H ATOM 344 HA ASN A 22 23.677 -2.124 -0.274 1.00 1.330 H ATOM 345 1HB ASN A 22 23.951 -3.069 -3.137 1.00 1.690 H ATOM 346 2HB ASN A 22 25.192 -2.194 -2.252 1.00 1.690 H ATOM 347 1HD2 ASN A 22 25.492 -5.992 -2.030 1.00 1.690 H ATOM 348 2HD2 ASN A 22 25.091 -4.957 -3.362 1.00 1.690 H ATOM 349 N GLY A 23 21.889 -0.222 -1.317 1.00 0.820 N ATOM 350 CA GLY A 23 21.517 1.142 -1.652 1.00 0.760 C ATOM 351 C GLY A 23 20.708 1.329 -2.947 1.00 0.670 C ATOM 352 O GLY A 23 20.165 2.421 -3.162 1.00 0.760 O ATOM 353 H GLY A 23 21.299 -0.756 -0.695 1.00 0.980 H ATOM 354 1HA GLY A 23 20.964 1.560 -0.814 1.00 0.910 H ATOM 355 2HA GLY A 23 22.427 1.733 -1.729 1.00 0.910 H ATOM 356 N LYS A 24 20.543 0.280 -3.765 1.00 0.620 N ATOM 357 CA LYS A 24 19.829 0.411 -5.042 1.00 0.570 C ATOM 358 C LYS A 24 18.639 -0.535 -5.212 1.00 0.500 C ATOM 359 O LYS A 24 18.575 -1.610 -4.610 1.00 0.490 O ATOM 360 CB LYS A 24 20.799 0.175 -6.203 1.00 0.820 C ATOM 361 CG LYS A 24 22.018 1.122 -6.264 1.00 0.820 C ATOM 362 CD LYS A 24 21.632 2.569 -6.589 1.00 0.820 C ATOM 363 CE LYS A 24 22.871 3.446 -6.744 1.00 0.820 C ATOM 364 NZ LYS A 24 22.519 4.876 -7.007 1.00 0.820 N ATOM 365 H LYS A 24 20.967 -0.623 -3.526 1.00 0.740 H ATOM 366 HA LYS A 24 19.433 1.421 -5.110 1.00 0.680 H ATOM 367 1HB LYS A 24 21.185 -0.845 -6.131 1.00 0.980 H ATOM 368 2HB LYS A 24 20.260 0.249 -7.148 1.00 0.980 H ATOM 369 1HG LYS A 24 22.534 1.100 -5.300 1.00 0.980 H ATOM 370 2HG LYS A 24 22.709 0.761 -7.022 1.00 0.980 H ATOM 371 1HD LYS A 24 21.049 2.600 -7.510 1.00 0.980 H ATOM 372 2HD LYS A 24 21.030 2.981 -5.780 1.00 0.980 H ATOM 373 1HE LYS A 24 23.460 3.389 -5.830 1.00 0.980 H ATOM 374 2HE LYS A 24 23.470 3.073 -7.576 1.00 0.980 H ATOM 375 1HZ LYS A 24 23.366 5.420 -7.102 1.00 0.980 H ATOM 376 2HZ LYS A 24 21.981 4.942 -7.861 1.00 0.980 H ATOM 377 3HZ LYS A 24 21.973 5.236 -6.236 1.00 0.980 H ATOM 378 N TYR A 25 17.680 -0.137 -6.054 1.00 0.480 N ATOM 379 CA TYR A 25 16.549 -1.019 -6.337 1.00 0.420 C ATOM 380 C TYR A 25 16.744 -1.824 -7.607 1.00 0.360 C ATOM 381 O TYR A 25 17.067 -1.294 -8.678 1.00 0.390 O ATOM 382 CB TYR A 25 15.240 -0.236 -6.478 1.00 0.610 C ATOM 383 CG TYR A 25 14.714 0.350 -5.208 1.00 0.610 C ATOM 384 CD1 TYR A 25 15.034 1.650 -4.856 1.00 0.610 C ATOM 385 CD2 TYR A 25 13.909 -0.415 -4.382 1.00 0.610 C ATOM 386 CE1 TYR A 25 14.545 2.182 -3.681 1.00 0.610 C ATOM 387 CE2 TYR A 25 13.418 0.117 -3.214 1.00 0.610 C ATOM 388 CZ TYR A 25 13.734 1.409 -2.859 1.00 0.610 C ATOM 389 OH TYR A 25 13.248 1.938 -1.687 1.00 0.610 O ATOM 390 H TYR A 25 17.749 0.760 -6.515 1.00 0.580 H ATOM 391 HA TYR A 25 16.442 -1.729 -5.519 1.00 0.500 H ATOM 392 1HB TYR A 25 15.380 0.573 -7.193 1.00 0.730 H ATOM 393 2HB TYR A 25 14.478 -0.898 -6.887 1.00 0.730 H ATOM 394 HD1 TYR A 25 15.670 2.252 -5.503 1.00 0.730 H ATOM 395 HD2 TYR A 25 13.668 -1.440 -4.649 1.00 0.730 H ATOM 396 HE1 TYR A 25 14.797 3.203 -3.400 1.00 0.730 H ATOM 397 HE2 TYR A 25 12.786 -0.492 -2.565 1.00 0.730 H ATOM 398 HH TYR A 25 13.596 2.826 -1.567 1.00 0.730 H ATOM 399 N ASP A 26 16.462 -3.110 -7.521 1.00 0.290 N ATOM 400 CA ASP A 26 16.544 -3.941 -8.697 1.00 0.250 C ATOM 401 C ASP A 26 15.239 -3.785 -9.417 1.00 0.180 C ATOM 402 O ASP A 26 14.256 -4.473 -9.139 1.00 0.180 O ATOM 403 CB ASP A 26 16.812 -5.405 -8.377 1.00 0.370 C ATOM 404 CG ASP A 26 16.967 -6.254 -9.661 1.00 0.370 C ATOM 405 OD1 ASP A 26 16.615 -5.763 -10.740 1.00 0.370 O ATOM 406 OD2 ASP A 26 17.378 -7.387 -9.561 1.00 0.370 O ATOM 407 H ASP A 26 16.205 -3.505 -6.617 1.00 0.350 H ATOM 408 HA ASP A 26 17.345 -3.578 -9.342 1.00 0.300 H ATOM 409 1HB ASP A 26 17.725 -5.485 -7.786 1.00 0.440 H ATOM 410 2HB ASP A 26 16.005 -5.794 -7.772 1.00 0.440 H ATOM 411 N ILE A 27 15.251 -2.891 -10.386 1.00 0.240 N ATOM 412 CA ILE A 27 14.069 -2.504 -11.141 1.00 0.300 C ATOM 413 C ILE A 27 13.399 -3.695 -11.863 1.00 0.300 C ATOM 414 O ILE A 27 12.259 -3.588 -12.310 1.00 0.480 O ATOM 415 CB ILE A 27 14.429 -1.383 -12.159 1.00 0.400 C ATOM 416 CG1 ILE A 27 13.160 -0.601 -12.642 1.00 0.400 C ATOM 417 CG2 ILE A 27 15.158 -1.970 -13.381 1.00 0.400 C ATOM 418 CD1 ILE A 27 12.482 0.253 -11.556 1.00 0.400 C ATOM 419 H ILE A 27 16.128 -2.377 -10.495 1.00 0.290 H ATOM 420 HA ILE A 27 13.365 -2.105 -10.429 1.00 0.360 H ATOM 421 HB ILE A 27 15.089 -0.669 -11.666 1.00 0.480 H ATOM 422 1HG1 ILE A 27 13.455 0.060 -13.453 1.00 0.480 H ATOM 423 2HG1 ILE A 27 12.426 -1.300 -13.025 1.00 0.480 H ATOM 424 1HG2 ILE A 27 15.429 -1.165 -14.063 1.00 0.480 H ATOM 425 2HG2 ILE A 27 16.060 -2.485 -13.054 1.00 0.480 H ATOM 426 3HG2 ILE A 27 14.512 -2.670 -13.903 1.00 0.480 H ATOM 427 1HD1 ILE A 27 11.624 0.766 -11.986 1.00 0.480 H ATOM 428 2HD1 ILE A 27 12.143 -0.352 -10.737 1.00 0.480 H ATOM 429 3HD1 ILE A 27 13.192 0.988 -11.180 1.00 0.480 H ATOM 430 N LYS A 28 14.122 -4.806 -12.059 1.00 0.290 N ATOM 431 CA LYS A 28 13.522 -5.951 -12.733 1.00 0.310 C ATOM 432 C LYS A 28 12.921 -6.950 -11.735 1.00 0.290 C ATOM 433 O LYS A 28 12.038 -7.750 -12.077 1.00 0.350 O ATOM 434 CB LYS A 28 14.558 -6.651 -13.617 1.00 0.430 C ATOM 435 CG LYS A 28 15.168 -5.776 -14.740 1.00 0.430 C ATOM 436 CD LYS A 28 14.123 -5.295 -15.757 1.00 0.430 C ATOM 437 CE LYS A 28 14.777 -4.530 -16.903 1.00 0.430 C ATOM 438 NZ LYS A 28 13.770 -4.031 -17.890 1.00 0.430 N ATOM 439 H LYS A 28 15.075 -4.888 -11.665 1.00 0.350 H ATOM 440 HA LYS A 28 12.705 -5.600 -13.355 1.00 0.370 H ATOM 441 1HB LYS A 28 15.382 -6.995 -12.982 1.00 0.510 H ATOM 442 2HB LYS A 28 14.110 -7.530 -14.076 1.00 0.510 H ATOM 443 1HG LYS A 28 15.646 -4.910 -14.289 1.00 0.510 H ATOM 444 2HG LYS A 28 15.932 -6.351 -15.263 1.00 0.510 H ATOM 445 1HD LYS A 28 13.575 -6.149 -16.156 1.00 0.510 H ATOM 446 2HD LYS A 28 13.418 -4.623 -15.273 1.00 0.510 H ATOM 447 1HE LYS A 28 15.322 -3.680 -16.494 1.00 0.510 H ATOM 448 2HE LYS A 28 15.479 -5.186 -17.417 1.00 0.510 H ATOM 449 1HZ LYS A 28 14.242 -3.530 -18.630 1.00 0.510 H ATOM 450 2HZ LYS A 28 13.264 -4.813 -18.286 1.00 0.510 H ATOM 451 3HZ LYS A 28 13.120 -3.412 -17.426 1.00 0.510 H ATOM 452 N ASP A 29 13.389 -6.938 -10.492 1.00 0.230 N ATOM 453 CA ASP A 29 12.920 -7.906 -9.514 1.00 0.220 C ATOM 454 C ASP A 29 11.676 -7.343 -8.846 1.00 0.200 C ATOM 455 O ASP A 29 11.752 -6.634 -7.833 1.00 0.200 O ATOM 456 CB ASP A 29 14.045 -8.231 -8.523 1.00 0.310 C ATOM 457 CG ASP A 29 13.743 -9.346 -7.502 1.00 0.310 C ATOM 458 OD1 ASP A 29 12.591 -9.617 -7.247 1.00 0.310 O ATOM 459 OD2 ASP A 29 14.689 -9.954 -7.035 1.00 0.310 O ATOM 460 H ASP A 29 14.067 -6.236 -10.188 1.00 0.280 H ATOM 461 HA ASP A 29 12.646 -8.827 -10.029 1.00 0.260 H ATOM 462 1HB ASP A 29 14.945 -8.505 -9.083 1.00 0.370 H ATOM 463 2HB ASP A 29 14.284 -7.327 -7.980 1.00 0.370 H ATOM 464 N VAL A 30 10.529 -7.641 -9.463 1.00 0.210 N ATOM 465 CA VAL A 30 9.242 -7.108 -9.032 1.00 0.210 C ATOM 466 C VAL A 30 8.487 -8.099 -8.147 1.00 0.200 C ATOM 467 O VAL A 30 8.216 -9.234 -8.535 1.00 0.290 O ATOM 468 CB VAL A 30 8.405 -6.711 -10.258 1.00 0.290 C ATOM 469 CG1 VAL A 30 7.046 -6.175 -9.832 1.00 0.290 C ATOM 470 CG2 VAL A 30 9.155 -5.668 -11.013 1.00 0.290 C ATOM 471 H VAL A 30 10.604 -8.219 -10.304 1.00 0.250 H ATOM 472 HA VAL A 30 9.432 -6.206 -8.452 1.00 0.250 H ATOM 473 HB VAL A 30 8.241 -7.584 -10.888 1.00 0.350 H ATOM 474 1HG1 VAL A 30 6.470 -5.893 -10.712 1.00 0.350 H ATOM 475 2HG1 VAL A 30 6.516 -6.921 -9.297 1.00 0.350 H ATOM 476 3HG1 VAL A 30 7.188 -5.297 -9.193 1.00 0.350 H ATOM 477 1HG2 VAL A 30 8.592 -5.361 -11.889 1.00 0.350 H ATOM 478 2HG2 VAL A 30 9.290 -4.841 -10.355 1.00 0.350 H ATOM 479 3HG2 VAL A 30 10.124 -6.044 -11.326 1.00 0.350 H ATOM 480 N GLY A 31 8.107 -7.622 -6.977 1.00 0.150 N ATOM 481 CA GLY A 31 7.465 -8.409 -5.919 1.00 0.130 C ATOM 482 C GLY A 31 5.942 -8.468 -5.930 1.00 0.180 C ATOM 483 O GLY A 31 5.335 -8.699 -4.882 1.00 0.470 O ATOM 484 H GLY A 31 8.340 -6.633 -6.812 1.00 0.180 H ATOM 485 1HA GLY A 31 7.865 -9.422 -5.952 1.00 0.160 H ATOM 486 2HA GLY A 31 7.772 -8.001 -4.970 1.00 0.160 H ATOM 487 N VAL A 32 5.330 -8.156 -7.065 1.00 0.180 N ATOM 488 CA VAL A 32 3.873 -8.101 -7.204 1.00 0.180 C ATOM 489 C VAL A 32 3.225 -9.485 -7.296 1.00 0.170 C ATOM 490 O VAL A 32 2.072 -9.659 -6.908 1.00 0.210 O ATOM 491 CB VAL A 32 3.468 -7.228 -8.418 1.00 0.250 C ATOM 492 CG1 VAL A 32 3.706 -7.957 -9.764 1.00 0.250 C ATOM 493 CG2 VAL A 32 2.001 -6.821 -8.279 1.00 0.250 C ATOM 494 H VAL A 32 5.930 -7.962 -7.855 1.00 0.220 H ATOM 495 HA VAL A 32 3.478 -7.609 -6.312 1.00 0.220 H ATOM 496 HB VAL A 32 4.097 -6.338 -8.418 1.00 0.300 H ATOM 497 1HG1 VAL A 32 3.436 -7.292 -10.582 1.00 0.300 H ATOM 498 2HG1 VAL A 32 4.743 -8.244 -9.873 1.00 0.300 H ATOM 499 3HG1 VAL A 32 3.084 -8.847 -9.830 1.00 0.300 H ATOM 500 1HG2 VAL A 32 1.725 -6.177 -9.111 1.00 0.300 H ATOM 501 2HG2 VAL A 32 1.362 -7.705 -8.284 1.00 0.300 H ATOM 502 3HG2 VAL A 32 1.861 -6.283 -7.341 1.00 0.300 H ATOM 503 N ASP A 33 3.948 -10.449 -7.879 1.00 0.170 N ATOM 504 CA ASP A 33 3.447 -11.806 -8.103 1.00 0.190 C ATOM 505 C ASP A 33 3.867 -12.769 -7.002 1.00 0.190 C ATOM 506 O ASP A 33 3.709 -13.987 -7.118 1.00 0.200 O ATOM 507 CB ASP A 33 3.957 -12.334 -9.446 1.00 0.260 C ATOM 508 CG ASP A 33 3.388 -11.594 -10.648 1.00 0.260 C ATOM 509 OD1 ASP A 33 2.204 -11.352 -10.685 1.00 0.260 O ATOM 510 OD2 ASP A 33 4.159 -11.250 -11.512 1.00 0.260 O ATOM 511 H ASP A 33 4.879 -10.226 -8.209 1.00 0.200 H ATOM 512 HA ASP A 33 2.357 -11.769 -8.128 1.00 0.230 H ATOM 513 1HB ASP A 33 5.044 -12.254 -9.472 1.00 0.310 H ATOM 514 2HB ASP A 33 3.706 -13.389 -9.539 1.00 0.310 H ATOM 515 N ASN A 34 4.431 -12.220 -5.946 1.00 0.170 N ATOM 516 CA ASN A 34 4.872 -12.975 -4.793 1.00 0.150 C ATOM 517 C ASN A 34 3.677 -13.672 -4.164 1.00 0.130 C ATOM 518 O ASN A 34 2.580 -13.114 -4.127 1.00 0.120 O ATOM 519 CB ASN A 34 5.551 -12.060 -3.791 1.00 0.220 C ATOM 520 CG ASN A 34 6.268 -12.796 -2.684 1.00 0.220 C ATOM 521 OD1 ASN A 34 5.664 -13.293 -1.712 1.00 0.220 O ATOM 522 ND2 ASN A 34 7.566 -12.901 -2.825 1.00 0.220 N ATOM 523 H ASN A 34 4.538 -11.213 -5.939 1.00 0.200 H ATOM 524 HA ASN A 34 5.576 -13.743 -5.118 1.00 0.180 H ATOM 525 1HB ASN A 34 6.270 -11.423 -4.309 1.00 0.260 H ATOM 526 2HB ASN A 34 4.809 -11.401 -3.348 1.00 0.260 H ATOM 527 1HD2 ASN A 34 8.112 -13.379 -2.133 1.00 0.260 H ATOM 528 2HD2 ASN A 34 8.014 -12.515 -3.633 1.00 0.260 H ATOM 529 N ALA A 35 3.876 -14.872 -3.622 1.00 0.120 N ATOM 530 CA ALA A 35 2.769 -15.571 -2.979 1.00 0.110 C ATOM 531 C ALA A 35 2.141 -14.714 -1.880 1.00 0.100 C ATOM 532 O ALA A 35 0.928 -14.777 -1.662 1.00 0.090 O ATOM 533 CB ALA A 35 3.244 -16.881 -2.394 1.00 0.160 C ATOM 534 H ALA A 35 4.790 -15.302 -3.672 1.00 0.140 H ATOM 535 HA ALA A 35 2.008 -15.768 -3.735 1.00 0.130 H ATOM 536 1HB ALA A 35 2.402 -17.401 -1.937 1.00 0.190 H ATOM 537 2HB ALA A 35 3.669 -17.499 -3.182 1.00 0.190 H ATOM 538 3HB ALA A 35 4.002 -16.685 -1.637 1.00 0.190 H ATOM 539 N GLY A 36 2.963 -13.924 -1.184 1.00 0.100 N ATOM 540 CA GLY A 36 2.487 -13.044 -0.142 1.00 0.100 C ATOM 541 C GLY A 36 1.529 -12.030 -0.734 1.00 0.090 C ATOM 542 O GLY A 36 0.416 -11.806 -0.239 1.00 0.090 O ATOM 543 H GLY A 36 3.961 -13.903 -1.380 1.00 0.120 H ATOM 544 1HA GLY A 36 2.013 -13.619 0.652 1.00 0.120 H ATOM 545 2HA GLY A 36 3.340 -12.524 0.270 1.00 0.120 H ATOM 546 N ALA A 37 1.977 -11.394 -1.812 1.00 0.100 N ATOM 547 CA ALA A 37 1.184 -10.392 -2.485 1.00 0.100 C ATOM 548 C ALA A 37 -0.142 -10.977 -2.948 1.00 0.110 C ATOM 549 O ALA A 37 -1.191 -10.336 -2.810 1.00 0.130 O ATOM 550 CB ALA A 37 1.949 -9.847 -3.687 1.00 0.140 C ATOM 551 H ALA A 37 2.908 -11.607 -2.143 1.00 0.120 H ATOM 552 HA ALA A 37 0.981 -9.602 -1.770 1.00 0.120 H ATOM 553 1HB ALA A 37 1.362 -9.085 -4.192 1.00 0.170 H ATOM 554 2HB ALA A 37 2.888 -9.422 -3.377 1.00 0.170 H ATOM 555 3HB ALA A 37 2.143 -10.657 -4.388 1.00 0.170 H ATOM 556 N LYS A 38 -0.107 -12.218 -3.442 1.00 0.110 N ATOM 557 CA LYS A 38 -1.314 -12.881 -3.895 1.00 0.120 C ATOM 558 C LYS A 38 -2.272 -13.125 -2.741 1.00 0.110 C ATOM 559 O LYS A 38 -3.478 -12.915 -2.893 1.00 0.110 O ATOM 560 CB LYS A 38 -0.973 -14.179 -4.619 1.00 0.160 C ATOM 561 CG LYS A 38 -0.335 -13.970 -5.996 1.00 0.160 C ATOM 562 CD LYS A 38 0.038 -15.294 -6.648 1.00 0.160 C ATOM 563 CE LYS A 38 0.586 -15.093 -8.057 1.00 0.160 C ATOM 564 NZ LYS A 38 1.051 -16.375 -8.660 1.00 0.160 N ATOM 565 H LYS A 38 0.806 -12.673 -3.543 1.00 0.130 H ATOM 566 HA LYS A 38 -1.813 -12.225 -4.606 1.00 0.140 H ATOM 567 1HB LYS A 38 -0.276 -14.752 -4.013 1.00 0.200 H ATOM 568 2HB LYS A 38 -1.874 -14.779 -4.740 1.00 0.200 H ATOM 569 1HG LYS A 38 -1.029 -13.430 -6.640 1.00 0.200 H ATOM 570 2HG LYS A 38 0.570 -13.364 -5.882 1.00 0.200 H ATOM 571 1HD LYS A 38 0.807 -15.780 -6.044 1.00 0.200 H ATOM 572 2HD LYS A 38 -0.833 -15.943 -6.691 1.00 0.200 H ATOM 573 1HE LYS A 38 -0.197 -14.674 -8.685 1.00 0.200 H ATOM 574 2HE LYS A 38 1.414 -14.396 -8.025 1.00 0.200 H ATOM 575 1HZ LYS A 38 1.403 -16.200 -9.591 1.00 0.200 H ATOM 576 2HZ LYS A 38 1.792 -16.762 -8.089 1.00 0.200 H ATOM 577 3HZ LYS A 38 0.285 -17.027 -8.708 1.00 0.200 H ATOM 578 N ALA A 39 -1.761 -13.558 -1.583 1.00 0.110 N ATOM 579 CA ALA A 39 -2.623 -13.787 -0.431 1.00 0.100 C ATOM 580 C ALA A 39 -3.319 -12.504 0.005 1.00 0.090 C ATOM 581 O ALA A 39 -4.518 -12.511 0.315 1.00 0.090 O ATOM 582 CB ALA A 39 -1.809 -14.324 0.720 1.00 0.140 C ATOM 583 H ALA A 39 -0.760 -13.791 -1.529 1.00 0.130 H ATOM 584 HA ALA A 39 -3.382 -14.514 -0.713 1.00 0.120 H ATOM 585 1HB ALA A 39 -2.461 -14.509 1.557 1.00 0.170 H ATOM 586 2HB ALA A 39 -1.323 -15.249 0.416 1.00 0.170 H ATOM 587 3HB ALA A 39 -1.043 -13.598 1.004 1.00 0.170 H ATOM 588 N GLY A 40 -2.573 -11.398 -0.010 1.00 0.090 N ATOM 589 CA GLY A 40 -3.092 -10.085 0.353 1.00 0.090 C ATOM 590 C GLY A 40 -4.205 -9.680 -0.606 1.00 0.080 C ATOM 591 O GLY A 40 -5.315 -9.318 -0.195 1.00 0.080 O ATOM 592 H GLY A 40 -1.574 -11.491 -0.240 1.00 0.110 H ATOM 593 1HA GLY A 40 -3.470 -10.113 1.373 1.00 0.110 H ATOM 594 2HA GLY A 40 -2.288 -9.360 0.325 1.00 0.110 H ATOM 595 N LEU A 41 -3.917 -9.765 -1.905 1.00 0.080 N ATOM 596 CA LEU A 41 -4.891 -9.413 -2.922 1.00 0.090 C ATOM 597 C LEU A 41 -6.120 -10.305 -2.843 1.00 0.090 C ATOM 598 O LEU A 41 -7.242 -9.825 -3.019 1.00 0.120 O ATOM 599 CB LEU A 41 -4.247 -9.547 -4.305 1.00 0.120 C ATOM 600 CG LEU A 41 -3.160 -8.506 -4.666 1.00 0.120 C ATOM 601 CD1 LEU A 41 -2.428 -8.952 -5.914 1.00 0.120 C ATOM 602 CD2 LEU A 41 -3.815 -7.148 -4.914 1.00 0.120 C ATOM 603 H LEU A 41 -2.981 -10.074 -2.192 1.00 0.100 H ATOM 604 HA LEU A 41 -5.211 -8.392 -2.749 1.00 0.110 H ATOM 605 1HB LEU A 41 -3.785 -10.532 -4.362 1.00 0.150 H ATOM 606 2HB LEU A 41 -5.031 -9.495 -5.059 1.00 0.150 H ATOM 607 HG LEU A 41 -2.443 -8.430 -3.862 1.00 0.150 H ATOM 608 1HD1 LEU A 41 -1.658 -8.220 -6.163 1.00 0.150 H ATOM 609 2HD1 LEU A 41 -1.956 -9.919 -5.731 1.00 0.150 H ATOM 610 3HD1 LEU A 41 -3.127 -9.039 -6.743 1.00 0.150 H ATOM 611 1HD2 LEU A 41 -3.047 -6.428 -5.181 1.00 0.150 H ATOM 612 2HD2 LEU A 41 -4.529 -7.231 -5.733 1.00 0.150 H ATOM 613 3HD2 LEU A 41 -4.329 -6.805 -4.027 1.00 0.150 H ATOM 614 N THR A 42 -5.918 -11.599 -2.568 1.00 0.080 N ATOM 615 CA THR A 42 -7.019 -12.542 -2.468 1.00 0.080 C ATOM 616 C THR A 42 -7.939 -12.102 -1.353 1.00 0.070 C ATOM 617 O THR A 42 -9.149 -12.036 -1.541 1.00 0.060 O ATOM 618 CB THR A 42 -6.524 -13.981 -2.205 1.00 0.110 C ATOM 619 OG1 THR A 42 -5.704 -14.416 -3.304 1.00 0.110 O ATOM 620 CG2 THR A 42 -7.723 -14.927 -2.061 1.00 0.110 C ATOM 621 H THR A 42 -4.967 -11.948 -2.465 1.00 0.100 H ATOM 622 HA THR A 42 -7.578 -12.532 -3.402 1.00 0.100 H ATOM 623 HB THR A 42 -5.935 -14.003 -1.293 1.00 0.130 H ATOM 624 HG1 THR A 42 -4.871 -13.895 -3.306 1.00 0.130 H ATOM 625 1HG2 THR A 42 -7.362 -15.935 -1.881 1.00 0.130 H ATOM 626 2HG2 THR A 42 -8.357 -14.621 -1.224 1.00 0.130 H ATOM 627 3HG2 THR A 42 -8.312 -14.909 -2.977 1.00 0.130 H ATOM 628 N PHE A 43 -7.366 -11.753 -0.200 1.00 0.080 N ATOM 629 CA PHE A 43 -8.149 -11.298 0.937 1.00 0.090 C ATOM 630 C PHE A 43 -9.027 -10.107 0.546 1.00 0.090 C ATOM 631 O PHE A 43 -10.222 -10.104 0.854 1.00 0.090 O ATOM 632 CB PHE A 43 -7.228 -10.949 2.089 1.00 0.120 C ATOM 633 CG PHE A 43 -7.891 -10.464 3.343 1.00 0.120 C ATOM 634 CD1 PHE A 43 -8.436 -11.366 4.232 1.00 0.120 C ATOM 635 CD2 PHE A 43 -7.953 -9.122 3.653 1.00 0.120 C ATOM 636 CE1 PHE A 43 -9.019 -10.934 5.398 1.00 0.120 C ATOM 637 CE2 PHE A 43 -8.520 -8.694 4.810 1.00 0.120 C ATOM 638 CZ PHE A 43 -9.056 -9.596 5.688 1.00 0.120 C ATOM 639 H PHE A 43 -6.351 -11.863 -0.097 1.00 0.100 H ATOM 640 HA PHE A 43 -8.799 -12.114 1.251 1.00 0.110 H ATOM 641 1HB PHE A 43 -6.643 -11.826 2.328 1.00 0.150 H ATOM 642 2HB PHE A 43 -6.533 -10.208 1.764 1.00 0.150 H ATOM 643 HD1 PHE A 43 -8.398 -12.434 4.002 1.00 0.150 H ATOM 644 HD2 PHE A 43 -7.550 -8.400 2.973 1.00 0.150 H ATOM 645 HE1 PHE A 43 -9.445 -11.655 6.096 1.00 0.150 H ATOM 646 HE2 PHE A 43 -8.550 -7.629 5.037 1.00 0.150 H ATOM 647 HZ PHE A 43 -9.513 -9.250 6.613 1.00 0.150 H ATOM 648 N LEU A 44 -8.456 -9.094 -0.133 1.00 0.100 N ATOM 649 CA LEU A 44 -9.268 -7.932 -0.523 1.00 0.130 C ATOM 650 C LEU A 44 -10.400 -8.356 -1.447 1.00 0.120 C ATOM 651 O LEU A 44 -11.539 -7.893 -1.308 1.00 0.150 O ATOM 652 CB LEU A 44 -8.419 -6.913 -1.291 1.00 0.170 C ATOM 653 CG LEU A 44 -7.356 -6.228 -0.502 1.00 0.170 C ATOM 654 CD1 LEU A 44 -6.433 -5.447 -1.429 1.00 0.170 C ATOM 655 CD2 LEU A 44 -7.963 -5.277 0.548 1.00 0.170 C ATOM 656 H LEU A 44 -7.449 -9.138 -0.335 1.00 0.120 H ATOM 657 HA LEU A 44 -9.706 -7.497 0.366 1.00 0.160 H ATOM 658 1HB LEU A 44 -7.934 -7.430 -2.121 1.00 0.200 H ATOM 659 2HB LEU A 44 -9.082 -6.151 -1.702 1.00 0.200 H ATOM 660 HG LEU A 44 -6.797 -6.976 -0.035 1.00 0.200 H ATOM 661 1HD1 LEU A 44 -5.640 -4.993 -0.831 1.00 0.200 H ATOM 662 2HD1 LEU A 44 -5.991 -6.121 -2.158 1.00 0.200 H ATOM 663 3HD1 LEU A 44 -6.998 -4.673 -1.945 1.00 0.200 H ATOM 664 1HD2 LEU A 44 -7.157 -4.807 1.113 1.00 0.200 H ATOM 665 2HD2 LEU A 44 -8.549 -4.506 0.045 1.00 0.200 H ATOM 666 3HD2 LEU A 44 -8.598 -5.818 1.236 1.00 0.200 H ATOM 667 N VAL A 45 -10.104 -9.258 -2.383 1.00 0.100 N ATOM 668 CA VAL A 45 -11.129 -9.728 -3.298 1.00 0.120 C ATOM 669 C VAL A 45 -12.225 -10.454 -2.539 1.00 0.090 C ATOM 670 O VAL A 45 -13.404 -10.248 -2.837 1.00 0.110 O ATOM 671 CB VAL A 45 -10.536 -10.619 -4.402 1.00 0.160 C ATOM 672 CG1 VAL A 45 -11.653 -11.273 -5.220 1.00 0.160 C ATOM 673 CG2 VAL A 45 -9.672 -9.757 -5.312 1.00 0.160 C ATOM 674 H VAL A 45 -9.133 -9.579 -2.481 1.00 0.120 H ATOM 675 HA VAL A 45 -11.572 -8.860 -3.782 1.00 0.140 H ATOM 676 HB VAL A 45 -9.933 -11.405 -3.950 1.00 0.190 H ATOM 677 1HG1 VAL A 45 -11.211 -11.891 -5.997 1.00 0.190 H ATOM 678 2HG1 VAL A 45 -12.271 -11.898 -4.578 1.00 0.190 H ATOM 679 3HG1 VAL A 45 -12.273 -10.499 -5.677 1.00 0.190 H ATOM 680 1HG2 VAL A 45 -9.237 -10.375 -6.094 1.00 0.190 H ATOM 681 2HG2 VAL A 45 -10.286 -8.978 -5.761 1.00 0.190 H ATOM 682 3HG2 VAL A 45 -8.880 -9.296 -4.738 1.00 0.190 H ATOM 683 N ASP A 46 -11.854 -11.322 -1.588 1.00 0.070 N ATOM 684 CA ASP A 46 -12.841 -12.035 -0.796 1.00 0.080 C ATOM 685 C ASP A 46 -13.711 -11.053 -0.018 1.00 0.080 C ATOM 686 O ASP A 46 -14.929 -11.217 0.025 1.00 0.080 O ATOM 687 CB ASP A 46 -12.180 -12.997 0.203 1.00 0.110 C ATOM 688 CG ASP A 46 -11.542 -14.277 -0.401 1.00 0.110 C ATOM 689 OD1 ASP A 46 -11.804 -14.618 -1.534 1.00 0.110 O ATOM 690 OD2 ASP A 46 -10.800 -14.907 0.318 1.00 0.110 O ATOM 691 H ASP A 46 -10.861 -11.499 -1.437 1.00 0.080 H ATOM 692 HA ASP A 46 -13.473 -12.612 -1.467 1.00 0.100 H ATOM 693 1HB ASP A 46 -11.398 -12.455 0.736 1.00 0.130 H ATOM 694 2HB ASP A 46 -12.915 -13.299 0.943 1.00 0.130 H ATOM 695 N LEU A 47 -13.127 -9.974 0.526 1.00 0.100 N ATOM 696 CA LEU A 47 -13.949 -9.008 1.251 1.00 0.140 C ATOM 697 C LEU A 47 -14.985 -8.410 0.317 1.00 0.150 C ATOM 698 O LEU A 47 -16.140 -8.222 0.699 1.00 0.170 O ATOM 699 CB LEU A 47 -13.112 -7.864 1.841 1.00 0.180 C ATOM 700 CG LEU A 47 -12.146 -8.194 3.004 1.00 0.180 C ATOM 701 CD1 LEU A 47 -11.322 -6.956 3.286 1.00 0.180 C ATOM 702 CD2 LEU A 47 -12.918 -8.624 4.252 1.00 0.180 C ATOM 703 H LEU A 47 -12.104 -9.885 0.498 1.00 0.120 H ATOM 704 HA LEU A 47 -14.478 -9.528 2.043 1.00 0.170 H ATOM 705 1HB LEU A 47 -12.508 -7.445 1.034 1.00 0.220 H ATOM 706 2HB LEU A 47 -13.789 -7.085 2.182 1.00 0.220 H ATOM 707 HG LEU A 47 -11.471 -8.996 2.708 1.00 0.220 H ATOM 708 1HD1 LEU A 47 -10.637 -7.151 4.082 1.00 0.220 H ATOM 709 2HD1 LEU A 47 -10.771 -6.674 2.394 1.00 0.220 H ATOM 710 3HD1 LEU A 47 -11.983 -6.147 3.578 1.00 0.220 H ATOM 711 1HD2 LEU A 47 -12.206 -8.836 5.050 1.00 0.220 H ATOM 712 2HD2 LEU A 47 -13.588 -7.824 4.567 1.00 0.220 H ATOM 713 3HD2 LEU A 47 -13.496 -9.520 4.051 1.00 0.220 H ATOM 714 N ILE A 48 -14.599 -8.134 -0.924 1.00 0.140 N ATOM 715 CA ILE A 48 -15.563 -7.607 -1.878 1.00 0.180 C ATOM 716 C ILE A 48 -16.641 -8.657 -2.198 1.00 0.170 C ATOM 717 O ILE A 48 -17.841 -8.379 -2.129 1.00 0.190 O ATOM 718 CB ILE A 48 -14.853 -7.138 -3.166 1.00 0.240 C ATOM 719 CG1 ILE A 48 -13.975 -5.908 -2.828 1.00 0.240 C ATOM 720 CG2 ILE A 48 -15.879 -6.804 -4.236 1.00 0.240 C ATOM 721 CD1 ILE A 48 -12.969 -5.494 -3.882 1.00 0.240 C ATOM 722 H ILE A 48 -13.607 -8.243 -1.172 1.00 0.170 H ATOM 723 HA ILE A 48 -16.051 -6.749 -1.433 1.00 0.220 H ATOM 724 HB ILE A 48 -14.195 -7.926 -3.523 1.00 0.280 H ATOM 725 1HG1 ILE A 48 -14.639 -5.068 -2.639 1.00 0.280 H ATOM 726 2HG1 ILE A 48 -13.426 -6.125 -1.918 1.00 0.280 H ATOM 727 1HG2 ILE A 48 -15.378 -6.491 -5.130 1.00 0.280 H ATOM 728 2HG2 ILE A 48 -16.482 -7.675 -4.474 1.00 0.280 H ATOM 729 3HG2 ILE A 48 -16.530 -6.003 -3.872 1.00 0.280 H ATOM 730 1HD1 ILE A 48 -12.416 -4.626 -3.520 1.00 0.280 H ATOM 731 2HD1 ILE A 48 -12.276 -6.318 -4.057 1.00 0.280 H ATOM 732 3HD1 ILE A 48 -13.460 -5.241 -4.800 1.00 0.280 H ATOM 733 N LYS A 49 -16.225 -9.884 -2.521 1.00 0.160 N ATOM 734 CA LYS A 49 -17.166 -10.958 -2.862 1.00 0.160 C ATOM 735 C LYS A 49 -18.135 -11.295 -1.732 1.00 0.150 C ATOM 736 O LYS A 49 -19.295 -11.634 -1.977 1.00 0.170 O ATOM 737 CB LYS A 49 -16.432 -12.223 -3.303 1.00 0.220 C ATOM 738 CG LYS A 49 -15.780 -12.137 -4.685 1.00 0.220 C ATOM 739 CD LYS A 49 -15.067 -13.440 -5.028 1.00 0.220 C ATOM 740 CE LYS A 49 -14.482 -13.419 -6.438 1.00 0.220 C ATOM 741 NZ LYS A 49 -13.725 -14.670 -6.739 1.00 0.220 N ATOM 742 H LYS A 49 -15.219 -10.065 -2.543 1.00 0.190 H ATOM 743 HA LYS A 49 -17.764 -10.615 -3.705 1.00 0.190 H ATOM 744 1HB LYS A 49 -15.650 -12.446 -2.578 1.00 0.270 H ATOM 745 2HB LYS A 49 -17.127 -13.062 -3.302 1.00 0.270 H ATOM 746 1HG LYS A 49 -16.541 -11.928 -5.435 1.00 0.270 H ATOM 747 2HG LYS A 49 -15.057 -11.319 -4.686 1.00 0.270 H ATOM 748 1HD LYS A 49 -14.257 -13.602 -4.312 1.00 0.270 H ATOM 749 2HD LYS A 49 -15.768 -14.269 -4.948 1.00 0.270 H ATOM 750 1HE LYS A 49 -15.293 -13.316 -7.157 1.00 0.270 H ATOM 751 2HE LYS A 49 -13.818 -12.570 -6.540 1.00 0.270 H ATOM 752 1HZ LYS A 49 -13.355 -14.624 -7.679 1.00 0.270 H ATOM 753 2HZ LYS A 49 -12.961 -14.771 -6.080 1.00 0.270 H ATOM 754 3HZ LYS A 49 -14.342 -15.467 -6.661 1.00 0.270 H ATOM 755 N ASN A 50 -17.676 -11.149 -0.496 1.00 0.140 N ATOM 756 CA ASN A 50 -18.455 -11.450 0.690 1.00 0.160 C ATOM 757 C ASN A 50 -19.261 -10.251 1.198 1.00 0.170 C ATOM 758 O ASN A 50 -19.851 -10.318 2.278 1.00 0.180 O ATOM 759 CB ASN A 50 -17.532 -11.947 1.779 1.00 0.220 C ATOM 760 CG ASN A 50 -16.921 -13.279 1.466 1.00 0.220 C ATOM 761 OD1 ASN A 50 -17.523 -14.131 0.800 1.00 0.220 O ATOM 762 ND2 ASN A 50 -15.718 -13.485 1.939 1.00 0.220 N ATOM 763 H ASN A 50 -16.688 -10.913 -0.375 1.00 0.170 H ATOM 764 HA ASN A 50 -19.167 -12.237 0.440 1.00 0.190 H ATOM 765 1HB ASN A 50 -16.731 -11.224 1.901 1.00 0.260 H ATOM 766 2HB ASN A 50 -18.071 -12.010 2.723 1.00 0.260 H ATOM 767 1HD2 ASN A 50 -15.253 -14.353 1.760 1.00 0.260 H ATOM 768 2HD2 ASN A 50 -15.260 -12.777 2.473 1.00 0.260 H ATOM 769 N LYS A 51 -19.299 -9.168 0.411 1.00 0.170 N ATOM 770 CA LYS A 51 -20.027 -7.939 0.707 1.00 0.180 C ATOM 771 C LYS A 51 -19.560 -7.185 1.951 1.00 0.180 C ATOM 772 O LYS A 51 -20.375 -6.609 2.675 1.00 0.210 O ATOM 773 CB LYS A 51 -21.528 -8.231 0.834 1.00 0.250 C ATOM 774 CG LYS A 51 -22.150 -8.859 -0.406 1.00 0.250 C ATOM 775 CD LYS A 51 -23.648 -9.060 -0.237 1.00 0.250 C ATOM 776 CE LYS A 51 -24.261 -9.734 -1.460 1.00 0.250 C ATOM 777 NZ LYS A 51 -25.724 -9.974 -1.290 1.00 0.250 N ATOM 778 H LYS A 51 -18.772 -9.164 -0.468 1.00 0.200 H ATOM 779 HA LYS A 51 -19.884 -7.271 -0.146 1.00 0.220 H ATOM 780 1HB LYS A 51 -21.720 -8.880 1.683 1.00 0.300 H ATOM 781 2HB LYS A 51 -22.058 -7.298 1.022 1.00 0.300 H ATOM 782 1HG LYS A 51 -21.965 -8.215 -1.265 1.00 0.300 H ATOM 783 2HG LYS A 51 -21.679 -9.825 -0.594 1.00 0.300 H ATOM 784 1HD LYS A 51 -23.830 -9.680 0.642 1.00 0.300 H ATOM 785 2HD LYS A 51 -24.128 -8.094 -0.083 1.00 0.300 H ATOM 786 1HE LYS A 51 -24.106 -9.099 -2.330 1.00 0.300 H ATOM 787 2HE LYS A 51 -23.763 -10.689 -1.626 1.00 0.300 H ATOM 788 1HZ LYS A 51 -26.091 -10.420 -2.120 1.00 0.300 H ATOM 789 2HZ LYS A 51 -25.880 -10.572 -0.491 1.00 0.300 H ATOM 790 3HZ LYS A 51 -26.198 -9.093 -1.147 1.00 0.300 H ATOM 791 N HIS A 52 -18.245 -7.127 2.173 1.00 0.160 N ATOM 792 CA HIS A 52 -17.691 -6.357 3.279 1.00 0.160 C ATOM 793 C HIS A 52 -16.955 -5.142 2.722 1.00 0.140 C ATOM 794 O HIS A 52 -16.395 -4.333 3.466 1.00 0.270 O ATOM 795 CB HIS A 52 -16.701 -7.188 4.097 1.00 0.220 C ATOM 796 CG HIS A 52 -17.285 -8.398 4.711 1.00 0.220 C ATOM 797 ND1 HIS A 52 -18.283 -8.349 5.658 1.00 0.220 N ATOM 798 CD2 HIS A 52 -16.988 -9.700 4.539 1.00 0.220 C ATOM 799 CE1 HIS A 52 -18.583 -9.581 6.029 1.00 0.220 C ATOM 800 NE2 HIS A 52 -17.806 -10.418 5.368 1.00 0.220 N ATOM 801 H HIS A 52 -17.601 -7.638 1.571 1.00 0.190 H ATOM 802 HA HIS A 52 -18.485 -6.008 3.934 1.00 0.190 H ATOM 803 1HB HIS A 52 -15.889 -7.505 3.447 1.00 0.270 H ATOM 804 2HB HIS A 52 -16.269 -6.573 4.884 1.00 0.270 H ATOM 805 HD1 HIS A 52 -18.934 -7.591 5.737 1.00 0.270 H ATOM 806 HD2 HIS A 52 -16.262 -10.207 3.912 1.00 0.270 H ATOM 807 HE1 HIS A 52 -19.359 -9.761 6.770 1.00 0.270 H ATOM 808 N MET A 53 -16.930 -5.047 1.398 1.00 0.150 N ATOM 809 CA MET A 53 -16.221 -4.005 0.682 1.00 0.100 C ATOM 810 C MET A 53 -16.862 -3.748 -0.682 1.00 0.140 C ATOM 811 O MET A 53 -17.325 -4.660 -1.362 1.00 0.340 O ATOM 812 CB MET A 53 -14.749 -4.404 0.561 1.00 0.160 C ATOM 813 CG MET A 53 -13.824 -3.398 -0.141 1.00 0.160 C ATOM 814 SD MET A 53 -12.092 -3.972 -0.202 1.00 0.160 S ATOM 815 CE MET A 53 -11.552 -3.703 1.479 1.00 0.160 C ATOM 816 H MET A 53 -17.464 -5.724 0.874 1.00 0.180 H ATOM 817 HA MET A 53 -16.287 -3.083 1.258 1.00 0.120 H ATOM 818 1HB MET A 53 -14.363 -4.571 1.558 1.00 0.190 H ATOM 819 2HB MET A 53 -14.677 -5.347 0.039 1.00 0.190 H ATOM 820 1HG MET A 53 -14.158 -3.229 -1.163 1.00 0.190 H ATOM 821 2HG MET A 53 -13.852 -2.445 0.385 1.00 0.190 H ATOM 822 1HE MET A 53 -10.516 -4.012 1.582 1.00 0.190 H ATOM 823 2HE MET A 53 -11.639 -2.644 1.724 1.00 0.190 H ATOM 824 3HE MET A 53 -12.165 -4.278 2.158 1.00 0.190 H ATOM 825 N ASN A 54 -16.916 -2.483 -1.070 1.00 0.180 N ATOM 826 CA ASN A 54 -17.437 -2.074 -2.372 1.00 0.150 C ATOM 827 C ASN A 54 -16.274 -1.769 -3.307 1.00 0.070 C ATOM 828 O ASN A 54 -15.490 -0.850 -3.046 1.00 0.100 O ATOM 829 CB ASN A 54 -18.418 -0.919 -2.259 1.00 0.220 C ATOM 830 CG ASN A 54 -19.091 -0.566 -3.594 1.00 0.220 C ATOM 831 OD1 ASN A 54 -18.508 -0.666 -4.693 1.00 0.220 O ATOM 832 ND2 ASN A 54 -20.339 -0.151 -3.506 1.00 0.220 N ATOM 833 H ASN A 54 -16.558 -1.771 -0.447 1.00 0.220 H ATOM 834 HA ASN A 54 -17.978 -2.915 -2.809 1.00 0.180 H ATOM 835 1HB ASN A 54 -19.196 -1.187 -1.543 1.00 0.270 H ATOM 836 2HB ASN A 54 -17.923 -0.044 -1.872 1.00 0.270 H ATOM 837 1HD2 ASN A 54 -20.846 0.097 -4.337 1.00 0.270 H ATOM 838 2HD2 ASN A 54 -20.785 -0.081 -2.611 1.00 0.270 H ATOM 839 N ALA A 55 -16.144 -2.556 -4.369 1.00 0.110 N ATOM 840 CA ALA A 55 -15.027 -2.472 -5.311 1.00 0.140 C ATOM 841 C ALA A 55 -14.863 -1.092 -5.944 1.00 0.170 C ATOM 842 O ALA A 55 -13.763 -0.718 -6.355 1.00 0.280 O ATOM 843 CB ALA A 55 -15.228 -3.467 -6.435 1.00 0.180 C ATOM 844 H ALA A 55 -16.863 -3.253 -4.518 1.00 0.130 H ATOM 845 HA ALA A 55 -14.115 -2.711 -4.765 1.00 0.170 H ATOM 846 1HB ALA A 55 -14.375 -3.424 -7.112 1.00 0.220 H ATOM 847 2HB ALA A 55 -15.318 -4.453 -6.035 1.00 0.220 H ATOM 848 3HB ALA A 55 -16.137 -3.212 -6.983 1.00 0.220 H ATOM 849 N ASP A 56 -15.951 -0.344 -6.054 1.00 0.170 N ATOM 850 CA ASP A 56 -15.910 0.951 -6.708 1.00 0.300 C ATOM 851 C ASP A 56 -15.620 2.102 -5.747 1.00 0.300 C ATOM 852 O ASP A 56 -15.641 3.266 -6.153 1.00 0.380 O ATOM 853 CB ASP A 56 -17.241 1.208 -7.412 1.00 0.370 C ATOM 854 CG ASP A 56 -17.518 0.252 -8.586 1.00 0.370 C ATOM 855 OD1 ASP A 56 -16.597 -0.198 -9.236 1.00 0.370 O ATOM 856 OD2 ASP A 56 -18.670 -0.027 -8.807 1.00 0.370 O ATOM 857 H ASP A 56 -16.838 -0.671 -5.664 1.00 0.200 H ATOM 858 HA ASP A 56 -15.120 0.928 -7.457 1.00 0.360 H ATOM 859 1HB ASP A 56 -18.050 1.113 -6.688 1.00 0.440 H ATOM 860 2HB ASP A 56 -17.259 2.230 -7.787 1.00 0.440 H ATOM 861 N THR A 57 -15.374 1.807 -4.474 1.00 0.220 N ATOM 862 CA THR A 57 -15.123 2.874 -3.514 1.00 0.240 C ATOM 863 C THR A 57 -13.857 3.636 -3.885 1.00 0.240 C ATOM 864 O THR A 57 -12.789 3.029 -4.069 1.00 0.340 O ATOM 865 CB THR A 57 -14.917 2.311 -2.086 1.00 0.330 C ATOM 866 OG1 THR A 57 -16.031 1.523 -1.724 1.00 0.330 O ATOM 867 CG2 THR A 57 -14.795 3.459 -1.076 1.00 0.330 C ATOM 868 H THR A 57 -15.351 0.834 -4.162 1.00 0.260 H ATOM 869 HA THR A 57 -15.966 3.562 -3.518 1.00 0.290 H ATOM 870 HB THR A 57 -14.020 1.695 -2.059 1.00 0.390 H ATOM 871 HG1 THR A 57 -15.983 0.696 -2.245 1.00 0.390 H ATOM 872 1HG2 THR A 57 -14.664 3.046 -0.079 1.00 0.390 H ATOM 873 2HG2 THR A 57 -13.942 4.080 -1.315 1.00 0.390 H ATOM 874 3HG2 THR A 57 -15.693 4.059 -1.100 1.00 0.390 H ATOM 875 N ASP A 58 -13.967 4.958 -3.966 1.00 0.210 N ATOM 876 CA ASP A 58 -12.835 5.814 -4.226 1.00 0.240 C ATOM 877 C ASP A 58 -12.465 6.569 -2.947 1.00 0.190 C ATOM 878 O ASP A 58 -13.064 6.355 -1.883 1.00 0.150 O ATOM 879 CB ASP A 58 -13.114 6.742 -5.418 1.00 0.320 C ATOM 880 CG ASP A 58 -14.244 7.709 -5.186 1.00 0.320 C ATOM 881 OD1 ASP A 58 -14.677 7.806 -4.053 1.00 0.320 O ATOM 882 OD2 ASP A 58 -14.662 8.358 -6.116 1.00 0.320 O ATOM 883 H ASP A 58 -14.873 5.393 -3.846 1.00 0.250 H ATOM 884 HA ASP A 58 -11.983 5.196 -4.490 1.00 0.290 H ATOM 885 1HB ASP A 58 -12.218 7.299 -5.677 1.00 0.390 H ATOM 886 2HB ASP A 58 -13.372 6.127 -6.285 1.00 0.390 H ATOM 887 N TYR A 59 -11.460 7.439 -3.039 1.00 0.200 N ATOM 888 CA TYR A 59 -11.007 8.185 -1.876 1.00 0.180 C ATOM 889 C TYR A 59 -12.121 9.024 -1.257 1.00 0.170 C ATOM 890 O TYR A 59 -12.358 8.950 -0.049 1.00 0.140 O ATOM 891 CB TYR A 59 -9.833 9.086 -2.249 1.00 0.260 C ATOM 892 CG TYR A 59 -9.322 9.864 -1.088 1.00 0.260 C ATOM 893 CD1 TYR A 59 -8.407 9.272 -0.236 1.00 0.260 C ATOM 894 CD2 TYR A 59 -9.779 11.152 -0.845 1.00 0.260 C ATOM 895 CE1 TYR A 59 -7.948 9.958 0.845 1.00 0.260 C ATOM 896 CE2 TYR A 59 -9.323 11.839 0.248 1.00 0.260 C ATOM 897 CZ TYR A 59 -8.413 11.249 1.092 1.00 0.260 C ATOM 898 OH TYR A 59 -7.957 11.925 2.189 1.00 0.260 O ATOM 899 H TYR A 59 -11.002 7.578 -3.926 1.00 0.240 H ATOM 900 HA TYR A 59 -10.678 7.471 -1.121 1.00 0.220 H ATOM 901 1HB TYR A 59 -9.015 8.483 -2.644 1.00 0.310 H ATOM 902 2HB TYR A 59 -10.135 9.787 -3.025 1.00 0.310 H ATOM 903 HD1 TYR A 59 -8.052 8.258 -0.427 1.00 0.310 H ATOM 904 HD2 TYR A 59 -10.507 11.616 -1.512 1.00 0.310 H ATOM 905 HE1 TYR A 59 -7.226 9.490 1.512 1.00 0.310 H ATOM 906 HE2 TYR A 59 -9.686 12.848 0.452 1.00 0.310 H ATOM 907 HH TYR A 59 -8.329 12.819 2.195 1.00 0.310 H ATOM 908 N SER A 60 -12.798 9.824 -2.094 1.00 0.190 N ATOM 909 CA SER A 60 -13.848 10.731 -1.648 1.00 0.210 C ATOM 910 C SER A 60 -15.013 10.005 -0.987 1.00 0.180 C ATOM 911 O SER A 60 -15.537 10.479 0.029 1.00 0.190 O ATOM 912 CB SER A 60 -14.356 11.539 -2.830 1.00 0.290 C ATOM 913 OG SER A 60 -13.364 12.401 -3.330 1.00 0.290 O ATOM 914 H SER A 60 -12.549 9.835 -3.072 1.00 0.230 H ATOM 915 HA SER A 60 -13.414 11.415 -0.918 1.00 0.250 H ATOM 916 1HB SER A 60 -14.678 10.852 -3.619 1.00 0.340 H ATOM 917 2HB SER A 60 -15.227 12.115 -2.526 1.00 0.340 H ATOM 918 HG SER A 60 -13.773 12.876 -4.060 1.00 0.340 H ATOM 919 N ILE A 61 -15.424 8.855 -1.531 1.00 0.220 N ATOM 920 CA ILE A 61 -16.508 8.110 -0.909 1.00 0.200 C ATOM 921 C ILE A 61 -16.087 7.629 0.455 1.00 0.150 C ATOM 922 O ILE A 61 -16.850 7.758 1.414 1.00 0.150 O ATOM 923 CB ILE A 61 -16.951 6.878 -1.727 1.00 0.290 C ATOM 924 CG1 ILE A 61 -17.619 7.323 -3.038 1.00 0.290 C ATOM 925 CG2 ILE A 61 -17.927 5.990 -0.859 1.00 0.290 C ATOM 926 CD1 ILE A 61 -17.802 6.200 -4.058 1.00 0.290 C ATOM 927 H ILE A 61 -15.003 8.517 -2.410 1.00 0.260 H ATOM 928 HA ILE A 61 -17.361 8.775 -0.791 1.00 0.240 H ATOM 929 HB ILE A 61 -16.067 6.299 -2.002 1.00 0.350 H ATOM 930 1HG1 ILE A 61 -18.595 7.743 -2.806 1.00 0.350 H ATOM 931 2HG1 ILE A 61 -17.011 8.103 -3.494 1.00 0.350 H ATOM 932 1HG2 ILE A 61 -18.233 5.116 -1.420 1.00 0.350 H ATOM 933 2HG2 ILE A 61 -17.442 5.648 0.053 1.00 0.350 H ATOM 934 3HG2 ILE A 61 -18.810 6.575 -0.591 1.00 0.350 H ATOM 935 1HD1 ILE A 61 -18.272 6.609 -4.951 1.00 0.350 H ATOM 936 2HD1 ILE A 61 -16.831 5.792 -4.327 1.00 0.350 H ATOM 937 3HD1 ILE A 61 -18.427 5.411 -3.660 1.00 0.350 H ATOM 938 N ALA A 62 -14.898 7.028 0.546 1.00 0.140 N ATOM 939 CA ALA A 62 -14.439 6.512 1.817 1.00 0.120 C ATOM 940 C ALA A 62 -14.303 7.613 2.855 1.00 0.110 C ATOM 941 O ALA A 62 -14.689 7.423 4.015 1.00 0.110 O ATOM 942 CB ALA A 62 -13.104 5.825 1.635 1.00 0.180 C ATOM 943 H ALA A 62 -14.300 6.929 -0.282 1.00 0.170 H ATOM 944 HA ALA A 62 -15.173 5.792 2.174 1.00 0.140 H ATOM 945 1HB ALA A 62 -12.769 5.415 2.584 1.00 0.210 H ATOM 946 2HB ALA A 62 -13.203 5.026 0.908 1.00 0.210 H ATOM 947 3HB ALA A 62 -12.374 6.551 1.271 1.00 0.210 H ATOM 948 N GLU A 63 -13.776 8.776 2.450 1.00 0.120 N ATOM 949 CA GLU A 63 -13.610 9.854 3.396 1.00 0.120 C ATOM 950 C GLU A 63 -14.966 10.325 3.885 1.00 0.110 C ATOM 951 O GLU A 63 -15.147 10.529 5.090 1.00 0.100 O ATOM 952 CB GLU A 63 -12.805 11.013 2.809 1.00 0.170 C ATOM 953 CG GLU A 63 -12.500 12.092 3.845 1.00 0.170 C ATOM 954 CD GLU A 63 -11.631 13.207 3.368 1.00 0.170 C ATOM 955 OE1 GLU A 63 -11.576 13.462 2.196 1.00 0.170 O ATOM 956 OE2 GLU A 63 -11.000 13.804 4.207 1.00 0.170 O ATOM 957 H GLU A 63 -13.444 8.890 1.486 1.00 0.140 H ATOM 958 HA GLU A 63 -13.060 9.473 4.254 1.00 0.140 H ATOM 959 1HB GLU A 63 -11.862 10.639 2.401 1.00 0.200 H ATOM 960 2HB GLU A 63 -13.362 11.464 1.985 1.00 0.200 H ATOM 961 1HG GLU A 63 -13.445 12.521 4.161 1.00 0.200 H ATOM 962 2HG GLU A 63 -12.040 11.627 4.717 1.00 0.200 H ATOM 963 N ALA A 64 -15.929 10.491 2.965 1.00 0.120 N ATOM 964 CA ALA A 64 -17.255 10.922 3.354 1.00 0.130 C ATOM 965 C ALA A 64 -17.902 9.918 4.289 1.00 0.120 C ATOM 966 O ALA A 64 -18.520 10.307 5.278 1.00 0.130 O ATOM 967 CB ALA A 64 -18.124 11.098 2.130 1.00 0.180 C ATOM 968 H ALA A 64 -15.729 10.336 1.971 1.00 0.140 H ATOM 969 HA ALA A 64 -17.164 11.872 3.877 1.00 0.160 H ATOM 970 1HB ALA A 64 -19.108 11.437 2.427 1.00 0.210 H ATOM 971 2HB ALA A 64 -17.666 11.831 1.465 1.00 0.210 H ATOM 972 3HB ALA A 64 -18.206 10.142 1.610 1.00 0.210 H ATOM 973 N ALA A 65 -17.747 8.620 4.003 1.00 0.120 N ATOM 974 CA ALA A 65 -18.347 7.596 4.840 1.00 0.130 C ATOM 975 C ALA A 65 -17.803 7.670 6.256 1.00 0.120 C ATOM 976 O ALA A 65 -18.530 7.516 7.251 1.00 0.130 O ATOM 977 CB ALA A 65 -18.065 6.225 4.250 1.00 0.180 C ATOM 978 H ALA A 65 -17.249 8.337 3.154 1.00 0.140 H ATOM 979 HA ALA A 65 -19.422 7.766 4.869 1.00 0.160 H ATOM 980 1HB ALA A 65 -18.528 5.455 4.858 1.00 0.210 H ATOM 981 2HB ALA A 65 -18.475 6.186 3.239 1.00 0.210 H ATOM 982 3HB ALA A 65 -16.991 6.063 4.214 1.00 0.210 H ATOM 983 N PHE A 66 -16.509 7.931 6.385 1.00 0.110 N ATOM 984 CA PHE A 66 -15.962 8.027 7.724 1.00 0.110 C ATOM 985 C PHE A 66 -16.481 9.287 8.406 1.00 0.130 C ATOM 986 O PHE A 66 -16.991 9.248 9.528 1.00 0.140 O ATOM 987 CB PHE A 66 -14.445 7.998 7.693 1.00 0.150 C ATOM 988 CG PHE A 66 -13.811 7.893 9.054 1.00 0.150 C ATOM 989 CD1 PHE A 66 -13.802 6.662 9.726 1.00 0.150 C ATOM 990 CD2 PHE A 66 -13.217 8.973 9.662 1.00 0.150 C ATOM 991 CE1 PHE A 66 -13.224 6.530 10.950 1.00 0.150 C ATOM 992 CE2 PHE A 66 -12.627 8.830 10.902 1.00 0.150 C ATOM 993 CZ PHE A 66 -12.633 7.611 11.539 1.00 0.150 C ATOM 994 H PHE A 66 -15.904 7.992 5.555 1.00 0.130 H ATOM 995 HA PHE A 66 -16.307 7.179 8.312 1.00 0.130 H ATOM 996 1HB PHE A 66 -14.122 7.158 7.093 1.00 0.180 H ATOM 997 2HB PHE A 66 -14.077 8.906 7.205 1.00 0.180 H ATOM 998 HD1 PHE A 66 -14.255 5.801 9.274 1.00 0.180 H ATOM 999 HD2 PHE A 66 -13.220 9.936 9.152 1.00 0.180 H ATOM 1000 HE1 PHE A 66 -13.233 5.560 11.457 1.00 0.180 H ATOM 1001 HE2 PHE A 66 -12.159 9.673 11.380 1.00 0.180 H ATOM 1002 HZ PHE A 66 -12.173 7.501 12.512 1.00 0.180 H ATOM 1003 N ASN A 67 -16.407 10.422 7.710 1.00 0.130 N ATOM 1004 CA ASN A 67 -16.799 11.689 8.310 1.00 0.150 C ATOM 1005 C ASN A 67 -18.279 11.772 8.672 1.00 0.160 C ATOM 1006 O ASN A 67 -18.655 12.419 9.647 1.00 0.210 O ATOM 1007 CB ASN A 67 -16.376 12.834 7.424 1.00 0.200 C ATOM 1008 CG ASN A 67 -14.893 13.006 7.475 1.00 0.200 C ATOM 1009 OD1 ASN A 67 -14.259 12.522 8.406 1.00 0.200 O ATOM 1010 ND2 ASN A 67 -14.331 13.672 6.513 1.00 0.200 N ATOM 1011 H ASN A 67 -16.024 10.409 6.760 1.00 0.160 H ATOM 1012 HA ASN A 67 -16.261 11.775 9.234 1.00 0.180 H ATOM 1013 1HB ASN A 67 -16.679 12.628 6.394 1.00 0.240 H ATOM 1014 2HB ASN A 67 -16.862 13.752 7.743 1.00 0.240 H ATOM 1015 1HD2 ASN A 67 -13.334 13.796 6.505 1.00 0.240 H ATOM 1016 2HD2 ASN A 67 -14.883 14.045 5.770 1.00 0.240 H ATOM 1017 N LYS A 68 -19.124 11.067 7.930 1.00 0.150 N ATOM 1018 CA LYS A 68 -20.554 11.040 8.194 1.00 0.170 C ATOM 1019 C LYS A 68 -20.949 9.970 9.220 1.00 0.170 C ATOM 1020 O LYS A 68 -22.126 9.857 9.568 1.00 0.190 O ATOM 1021 CB LYS A 68 -21.327 10.798 6.898 1.00 0.230 C ATOM 1022 CG LYS A 68 -21.250 11.929 5.879 1.00 0.230 C ATOM 1023 CD LYS A 68 -22.017 11.561 4.614 1.00 0.230 C ATOM 1024 CE LYS A 68 -21.976 12.675 3.578 1.00 0.230 C ATOM 1025 NZ LYS A 68 -22.708 12.298 2.332 1.00 0.230 N ATOM 1026 H LYS A 68 -18.770 10.589 7.097 1.00 0.180 H ATOM 1027 HA LYS A 68 -20.845 12.009 8.598 1.00 0.200 H ATOM 1028 1HB LYS A 68 -20.930 9.898 6.416 1.00 0.280 H ATOM 1029 2HB LYS A 68 -22.374 10.608 7.125 1.00 0.280 H ATOM 1030 1HG LYS A 68 -21.681 12.831 6.313 1.00 0.280 H ATOM 1031 2HG LYS A 68 -20.210 12.132 5.631 1.00 0.280 H ATOM 1032 1HD LYS A 68 -21.574 10.656 4.182 1.00 0.280 H ATOM 1033 2HD LYS A 68 -23.054 11.344 4.868 1.00 0.280 H ATOM 1034 1HE LYS A 68 -22.432 13.569 3.999 1.00 0.280 H ATOM 1035 2HE LYS A 68 -20.939 12.892 3.329 1.00 0.280 H ATOM 1036 1HZ LYS A 68 -22.661 13.059 1.668 1.00 0.280 H ATOM 1037 2HZ LYS A 68 -22.286 11.472 1.928 1.00 0.280 H ATOM 1038 3HZ LYS A 68 -23.675 12.103 2.554 1.00 0.280 H ATOM 1039 N GLY A 69 -19.985 9.165 9.686 1.00 0.150 N ATOM 1040 CA GLY A 69 -20.264 8.093 10.628 1.00 0.160 C ATOM 1041 C GLY A 69 -20.856 6.814 10.012 1.00 0.150 C ATOM 1042 O GLY A 69 -21.502 6.044 10.726 1.00 0.180 O ATOM 1043 H GLY A 69 -19.009 9.310 9.416 1.00 0.180 H ATOM 1044 1HA GLY A 69 -19.333 7.839 11.137 1.00 0.190 H ATOM 1045 2HA GLY A 69 -20.939 8.467 11.395 1.00 0.190 H ATOM 1046 N GLU A 70 -20.687 6.595 8.694 1.00 0.150 N ATOM 1047 CA GLU A 70 -21.237 5.410 8.035 1.00 0.150 C ATOM 1048 C GLU A 70 -20.349 4.199 8.326 1.00 0.130 C ATOM 1049 O GLU A 70 -20.831 3.073 8.467 1.00 0.130 O ATOM 1050 CB GLU A 70 -21.331 5.630 6.526 1.00 0.210 C ATOM 1051 CG GLU A 70 -22.319 6.707 6.090 1.00 0.210 C ATOM 1052 CD GLU A 70 -22.321 6.927 4.594 1.00 0.210 C ATOM 1053 OE1 GLU A 70 -21.524 6.312 3.925 1.00 0.210 O ATOM 1054 OE2 GLU A 70 -23.113 7.712 4.126 1.00 0.210 O ATOM 1055 H GLU A 70 -20.114 7.219 8.129 1.00 0.180 H ATOM 1056 HA GLU A 70 -22.234 5.216 8.432 1.00 0.180 H ATOM 1057 1HB GLU A 70 -20.367 5.903 6.159 1.00 0.250 H ATOM 1058 2HB GLU A 70 -21.613 4.697 6.040 1.00 0.250 H ATOM 1059 1HG GLU A 70 -23.318 6.420 6.411 1.00 0.250 H ATOM 1060 2HG GLU A 70 -22.060 7.640 6.591 1.00 0.250 H ATOM 1061 N THR A 71 -19.045 4.455 8.411 1.00 0.130 N ATOM 1062 CA THR A 71 -18.039 3.429 8.705 1.00 0.110 C ATOM 1063 C THR A 71 -17.322 3.701 10.007 1.00 0.120 C ATOM 1064 O THR A 71 -17.037 4.843 10.364 1.00 0.120 O ATOM 1065 CB THR A 71 -16.947 3.244 7.629 1.00 0.160 C ATOM 1066 OG1 THR A 71 -15.978 2.287 8.151 1.00 0.160 O ATOM 1067 CG2 THR A 71 -16.265 4.520 7.337 1.00 0.160 C ATOM 1068 H THR A 71 -18.765 5.423 8.252 1.00 0.160 H ATOM 1069 HA THR A 71 -18.551 2.474 8.810 1.00 0.130 H ATOM 1070 HB THR A 71 -17.391 2.851 6.717 1.00 0.190 H ATOM 1071 HG1 THR A 71 -15.170 2.238 7.563 1.00 0.190 H ATOM 1072 1HG2 THR A 71 -15.488 4.361 6.590 1.00 0.190 H ATOM 1073 2HG2 THR A 71 -16.987 5.204 6.966 1.00 0.190 H ATOM 1074 3HG2 THR A 71 -15.826 4.897 8.220 1.00 0.190 H ATOM 1075 N ALA A 72 -17.023 2.635 10.738 1.00 0.120 N ATOM 1076 CA ALA A 72 -16.262 2.759 11.975 1.00 0.120 C ATOM 1077 C ALA A 72 -14.758 2.837 11.702 1.00 0.110 C ATOM 1078 O ALA A 72 -13.965 3.070 12.615 1.00 0.120 O ATOM 1079 CB ALA A 72 -16.553 1.585 12.895 1.00 0.170 C ATOM 1080 H ALA A 72 -17.305 1.724 10.401 1.00 0.140 H ATOM 1081 HA ALA A 72 -16.564 3.684 12.467 1.00 0.140 H ATOM 1082 1HB ALA A 72 -15.997 1.706 13.824 1.00 0.200 H ATOM 1083 2HB ALA A 72 -17.619 1.547 13.112 1.00 0.200 H ATOM 1084 3HB ALA A 72 -16.248 0.661 12.407 1.00 0.200 H ATOM 1085 N MET A 73 -14.362 2.600 10.454 1.00 0.100 N ATOM 1086 CA MET A 73 -12.954 2.595 10.086 1.00 0.090 C ATOM 1087 C MET A 73 -12.687 2.994 8.641 1.00 0.080 C ATOM 1088 O MET A 73 -13.450 2.666 7.716 1.00 0.080 O ATOM 1089 CB MET A 73 -12.327 1.219 10.366 1.00 0.130 C ATOM 1090 CG MET A 73 -10.836 1.088 9.919 1.00 0.130 C ATOM 1091 SD MET A 73 -10.043 -0.450 10.372 1.00 0.130 S ATOM 1092 CE MET A 73 -8.471 -0.201 9.524 1.00 0.130 C ATOM 1093 H MET A 73 -15.072 2.435 9.745 1.00 0.120 H ATOM 1094 HA MET A 73 -12.445 3.326 10.712 1.00 0.110 H ATOM 1095 1HB MET A 73 -12.377 1.011 11.435 1.00 0.160 H ATOM 1096 2HB MET A 73 -12.903 0.448 9.854 1.00 0.160 H ATOM 1097 1HG MET A 73 -10.777 1.151 8.836 1.00 0.160 H ATOM 1098 2HG MET A 73 -10.250 1.905 10.342 1.00 0.160 H ATOM 1099 1HE MET A 73 -7.831 -1.058 9.687 1.00 0.160 H ATOM 1100 2HE MET A 73 -8.652 -0.085 8.457 1.00 0.160 H ATOM 1101 3HE MET A 73 -7.984 0.697 9.907 1.00 0.160 H ATOM 1102 N THR A 74 -11.533 3.637 8.462 1.00 0.080 N ATOM 1103 CA THR A 74 -10.997 4.004 7.166 1.00 0.080 C ATOM 1104 C THR A 74 -9.480 4.073 7.282 1.00 0.090 C ATOM 1105 O THR A 74 -8.946 4.285 8.375 1.00 0.090 O ATOM 1106 CB THR A 74 -11.535 5.355 6.672 1.00 0.110 C ATOM 1107 OG1 THR A 74 -11.128 5.547 5.317 1.00 0.110 O ATOM 1108 CG2 THR A 74 -10.961 6.507 7.523 1.00 0.110 C ATOM 1109 H THR A 74 -10.986 3.873 9.280 1.00 0.100 H ATOM 1110 HA THR A 74 -11.253 3.234 6.439 1.00 0.100 H ATOM 1111 HB THR A 74 -12.622 5.348 6.731 1.00 0.130 H ATOM 1112 HG1 THR A 74 -11.577 6.318 4.962 1.00 0.130 H ATOM 1113 1HG2 THR A 74 -11.354 7.454 7.158 1.00 0.130 H ATOM 1114 2HG2 THR A 74 -11.244 6.372 8.557 1.00 0.130 H ATOM 1115 3HG2 THR A 74 -9.876 6.532 7.455 1.00 0.130 H ATOM 1116 N ILE A 75 -8.788 3.891 6.167 1.00 0.090 N ATOM 1117 CA ILE A 75 -7.336 4.011 6.134 1.00 0.100 C ATOM 1118 C ILE A 75 -6.926 5.263 5.391 1.00 0.120 C ATOM 1119 O ILE A 75 -7.315 5.471 4.243 1.00 0.130 O ATOM 1120 CB ILE A 75 -6.678 2.764 5.507 1.00 0.140 C ATOM 1121 CG1 ILE A 75 -7.019 1.534 6.398 1.00 0.140 C ATOM 1122 CG2 ILE A 75 -5.145 2.978 5.321 1.00 0.140 C ATOM 1123 CD1 ILE A 75 -6.627 0.187 5.828 1.00 0.140 C ATOM 1124 H ILE A 75 -9.301 3.721 5.310 1.00 0.110 H ATOM 1125 HA ILE A 75 -6.971 4.100 7.156 1.00 0.120 H ATOM 1126 HB ILE A 75 -7.124 2.580 4.528 1.00 0.160 H ATOM 1127 1HG1 ILE A 75 -6.534 1.663 7.359 1.00 0.160 H ATOM 1128 2HG1 ILE A 75 -8.093 1.519 6.561 1.00 0.160 H ATOM 1129 1HG2 ILE A 75 -4.696 2.100 4.868 1.00 0.160 H ATOM 1130 2HG2 ILE A 75 -4.962 3.831 4.669 1.00 0.160 H ATOM 1131 3HG2 ILE A 75 -4.683 3.162 6.284 1.00 0.160 H ATOM 1132 1HD1 ILE A 75 -6.921 -0.597 6.526 1.00 0.160 H ATOM 1133 2HD1 ILE A 75 -7.135 0.032 4.874 1.00 0.160 H ATOM 1134 3HD1 ILE A 75 -5.554 0.137 5.673 1.00 0.160 H ATOM 1135 N ASN A 76 -6.143 6.100 6.056 1.00 0.140 N ATOM 1136 CA ASN A 76 -5.701 7.347 5.465 1.00 0.140 C ATOM 1137 C ASN A 76 -4.437 7.829 6.160 1.00 0.120 C ATOM 1138 O ASN A 76 -3.972 7.194 7.107 1.00 0.130 O ATOM 1139 CB ASN A 76 -6.825 8.363 5.589 1.00 0.200 C ATOM 1140 CG ASN A 76 -6.866 9.364 4.507 1.00 0.200 C ATOM 1141 OD1 ASN A 76 -5.813 9.777 3.984 1.00 0.200 O ATOM 1142 ND2 ASN A 76 -8.058 9.776 4.163 1.00 0.200 N ATOM 1143 H ASN A 76 -5.864 5.864 6.999 1.00 0.170 H ATOM 1144 HA ASN A 76 -5.466 7.181 4.418 1.00 0.170 H ATOM 1145 1HB ASN A 76 -7.785 7.844 5.614 1.00 0.240 H ATOM 1146 2HB ASN A 76 -6.721 8.893 6.538 1.00 0.240 H ATOM 1147 1HD2 ASN A 76 -8.156 10.476 3.445 1.00 0.240 H ATOM 1148 2HD2 ASN A 76 -8.872 9.412 4.617 1.00 0.240 H ATOM 1149 N GLY A 77 -3.898 8.962 5.720 1.00 0.120 N ATOM 1150 CA GLY A 77 -2.729 9.520 6.381 1.00 0.120 C ATOM 1151 C GLY A 77 -3.111 10.807 7.112 1.00 0.170 C ATOM 1152 O GLY A 77 -4.255 11.258 6.983 1.00 0.250 O ATOM 1153 H GLY A 77 -4.330 9.433 4.930 1.00 0.140 H ATOM 1154 1HA GLY A 77 -2.340 8.785 7.084 1.00 0.140 H ATOM 1155 2HA GLY A 77 -1.955 9.714 5.639 1.00 0.140 H ATOM 1156 N PRO A 78 -2.128 11.485 7.753 1.00 0.170 N ATOM 1157 CA PRO A 78 -2.248 12.717 8.536 1.00 0.250 C ATOM 1158 C PRO A 78 -3.009 13.824 7.836 1.00 0.250 C ATOM 1159 O PRO A 78 -3.729 14.601 8.461 1.00 0.250 O ATOM 1160 CB PRO A 78 -0.784 13.102 8.757 1.00 0.380 C ATOM 1161 CG PRO A 78 -0.053 11.784 8.772 1.00 0.380 C ATOM 1162 CD PRO A 78 -0.742 10.950 7.715 1.00 0.380 C ATOM 1163 HA PRO A 78 -2.714 12.481 9.479 1.00 0.300 H ATOM 1164 1HB PRO A 78 -0.441 13.781 7.963 1.00 0.450 H ATOM 1165 2HB PRO A 78 -0.686 13.648 9.709 1.00 0.450 H ATOM 1166 1HG PRO A 78 1.018 11.938 8.566 1.00 0.450 H ATOM 1167 2HG PRO A 78 -0.121 11.333 9.776 1.00 0.450 H ATOM 1168 1HD PRO A 78 -0.276 11.109 6.730 1.00 0.450 H ATOM 1169 2HD PRO A 78 -0.700 9.901 8.034 1.00 0.450 H ATOM 1170 N TRP A 79 -2.872 13.881 6.519 1.00 0.250 N ATOM 1171 CA TRP A 79 -3.552 14.848 5.680 1.00 0.260 C ATOM 1172 C TRP A 79 -5.037 14.981 6.002 1.00 0.250 C ATOM 1173 O TRP A 79 -5.598 16.077 5.999 1.00 0.400 O ATOM 1174 CB TRP A 79 -3.414 14.438 4.214 1.00 0.360 C ATOM 1175 CG TRP A 79 -4.100 15.363 3.265 1.00 0.360 C ATOM 1176 CD1 TRP A 79 -5.284 15.145 2.625 1.00 0.360 C ATOM 1177 CD2 TRP A 79 -3.646 16.666 2.837 1.00 0.360 C ATOM 1178 NE1 TRP A 79 -5.594 16.220 1.828 1.00 0.360 N ATOM 1179 CE2 TRP A 79 -4.604 17.159 1.947 1.00 0.360 C ATOM 1180 CE3 TRP A 79 -2.520 17.443 3.131 1.00 0.360 C ATOM 1181 CZ2 TRP A 79 -4.473 18.398 1.346 1.00 0.360 C ATOM 1182 CZ3 TRP A 79 -2.390 18.684 2.528 1.00 0.360 C ATOM 1183 CH2 TRP A 79 -3.342 19.149 1.659 1.00 0.360 C ATOM 1184 H TRP A 79 -2.240 13.248 6.052 1.00 0.300 H ATOM 1185 HA TRP A 79 -3.081 15.818 5.825 1.00 0.310 H ATOM 1186 1HB TRP A 79 -2.361 14.394 3.947 1.00 0.430 H ATOM 1187 2HB TRP A 79 -3.830 13.439 4.078 1.00 0.430 H ATOM 1188 HD1 TRP A 79 -5.893 14.246 2.731 1.00 0.430 H ATOM 1189 HE1 TRP A 79 -6.416 16.309 1.251 1.00 0.430 H ATOM 1190 HE3 TRP A 79 -1.760 17.081 3.819 1.00 0.430 H ATOM 1191 HZ2 TRP A 79 -5.218 18.786 0.652 1.00 0.430 H ATOM 1192 HZ3 TRP A 79 -1.510 19.282 2.763 1.00 0.430 H ATOM 1193 HH2 TRP A 79 -3.208 20.128 1.202 1.00 0.430 H ATOM 1194 N ALA A 80 -5.712 13.846 6.185 1.00 0.150 N ATOM 1195 CA ALA A 80 -7.156 13.851 6.351 1.00 0.160 C ATOM 1196 C ALA A 80 -7.633 14.166 7.756 1.00 0.140 C ATOM 1197 O ALA A 80 -8.842 14.287 7.975 1.00 0.140 O ATOM 1198 CB ALA A 80 -7.712 12.513 5.947 1.00 0.220 C ATOM 1199 H ALA A 80 -5.214 12.949 6.238 1.00 0.180 H ATOM 1200 HA ALA A 80 -7.557 14.612 5.682 1.00 0.190 H ATOM 1201 1HB ALA A 80 -8.803 12.528 6.013 1.00 0.260 H ATOM 1202 2HB ALA A 80 -7.410 12.315 4.923 1.00 0.260 H ATOM 1203 3HB ALA A 80 -7.311 11.744 6.607 1.00 0.260 H ATOM 1204 N TRP A 81 -6.736 14.300 8.725 1.00 0.170 N ATOM 1205 CA TRP A 81 -7.220 14.503 10.080 1.00 0.180 C ATOM 1206 C TRP A 81 -7.941 15.842 10.212 1.00 0.200 C ATOM 1207 O TRP A 81 -8.911 15.950 10.956 1.00 0.240 O ATOM 1208 CB TRP A 81 -6.074 14.344 11.076 1.00 0.250 C ATOM 1209 CG TRP A 81 -5.502 12.915 11.067 1.00 0.250 C ATOM 1210 CD1 TRP A 81 -6.075 11.799 10.514 1.00 0.250 C ATOM 1211 CD2 TRP A 81 -4.241 12.470 11.601 1.00 0.250 C ATOM 1212 NE1 TRP A 81 -5.259 10.725 10.657 1.00 0.250 N ATOM 1213 CE2 TRP A 81 -4.134 11.104 11.308 1.00 0.250 C ATOM 1214 CE3 TRP A 81 -3.198 13.107 12.271 1.00 0.250 C ATOM 1215 CZ2 TRP A 81 -3.025 10.372 11.651 1.00 0.250 C ATOM 1216 CZ3 TRP A 81 -2.082 12.361 12.620 1.00 0.250 C ATOM 1217 CH2 TRP A 81 -1.999 11.031 12.314 1.00 0.250 C ATOM 1218 H TRP A 81 -5.728 14.263 8.530 1.00 0.200 H ATOM 1219 HA TRP A 81 -7.947 13.733 10.309 1.00 0.220 H ATOM 1220 1HB TRP A 81 -5.272 15.039 10.821 1.00 0.300 H ATOM 1221 2HB TRP A 81 -6.420 14.580 12.082 1.00 0.300 H ATOM 1222 HD1 TRP A 81 -7.019 11.761 10.016 1.00 0.300 H ATOM 1223 HE1 TRP A 81 -5.452 9.792 10.319 1.00 0.300 H ATOM 1224 HE3 TRP A 81 -3.256 14.168 12.507 1.00 0.300 H ATOM 1225 HZ2 TRP A 81 -2.939 9.312 11.413 1.00 0.300 H ATOM 1226 HZ3 TRP A 81 -1.269 12.864 13.140 1.00 0.300 H ATOM 1227 HH2 TRP A 81 -1.107 10.477 12.599 1.00 0.300 H ATOM 1228 N SER A 82 -7.555 16.850 9.430 1.00 0.250 N ATOM 1229 CA SER A 82 -8.217 18.146 9.517 1.00 0.300 C ATOM 1230 C SER A 82 -9.701 18.048 9.154 1.00 0.230 C ATOM 1231 O SER A 82 -10.546 18.723 9.763 1.00 0.270 O ATOM 1232 CB SER A 82 -7.538 19.140 8.591 1.00 0.400 C ATOM 1233 OG SER A 82 -6.227 19.418 9.010 1.00 0.400 O ATOM 1234 H SER A 82 -6.768 16.744 8.801 1.00 0.300 H ATOM 1235 HA SER A 82 -8.136 18.503 10.545 1.00 0.360 H ATOM 1236 1HB SER A 82 -7.521 18.735 7.577 1.00 0.480 H ATOM 1237 2HB SER A 82 -8.118 20.063 8.563 1.00 0.480 H ATOM 1238 HG SER A 82 -5.870 20.039 8.368 1.00 0.480 H ATOM 1239 N ASN A 83 -10.025 17.218 8.157 1.00 0.190 N ATOM 1240 CA ASN A 83 -11.400 17.091 7.704 1.00 0.170 C ATOM 1241 C ASN A 83 -12.216 16.311 8.726 1.00 0.160 C ATOM 1242 O ASN A 83 -13.378 16.641 8.999 1.00 0.190 O ATOM 1243 CB ASN A 83 -11.432 16.413 6.355 1.00 0.250 C ATOM 1244 CG ASN A 83 -10.879 17.286 5.263 1.00 0.250 C ATOM 1245 OD1 ASN A 83 -10.809 18.518 5.385 1.00 0.250 O ATOM 1246 ND2 ASN A 83 -10.474 16.667 4.189 1.00 0.250 N ATOM 1247 H ASN A 83 -9.292 16.677 7.709 1.00 0.230 H ATOM 1248 HA ASN A 83 -11.838 18.086 7.619 1.00 0.200 H ATOM 1249 1HB ASN A 83 -10.848 15.487 6.397 1.00 0.300 H ATOM 1250 2HB ASN A 83 -12.455 16.139 6.104 1.00 0.300 H ATOM 1251 1HD2 ASN A 83 -10.094 17.184 3.425 1.00 0.300 H ATOM 1252 2HD2 ASN A 83 -10.557 15.650 4.123 1.00 0.300 H ATOM 1253 N ILE A 84 -11.574 15.317 9.328 1.00 0.150 N ATOM 1254 CA ILE A 84 -12.205 14.471 10.325 1.00 0.160 C ATOM 1255 C ILE A 84 -12.525 15.303 11.584 1.00 0.190 C ATOM 1256 O ILE A 84 -13.632 15.217 12.139 1.00 0.260 O ATOM 1257 CB ILE A 84 -11.287 13.279 10.642 1.00 0.220 C ATOM 1258 CG1 ILE A 84 -11.143 12.374 9.394 1.00 0.220 C ATOM 1259 CG2 ILE A 84 -11.910 12.490 11.697 1.00 0.220 C ATOM 1260 CD1 ILE A 84 -10.035 11.351 9.457 1.00 0.220 C ATOM 1261 H ILE A 84 -10.621 15.100 9.016 1.00 0.180 H ATOM 1262 HA ILE A 84 -13.141 14.097 9.926 1.00 0.190 H ATOM 1263 HB ILE A 84 -10.307 13.632 10.958 1.00 0.260 H ATOM 1264 1HG1 ILE A 84 -12.065 11.850 9.255 1.00 0.260 H ATOM 1265 2HG1 ILE A 84 -10.973 13.001 8.523 1.00 0.260 H ATOM 1266 1HG2 ILE A 84 -11.293 11.655 11.940 1.00 0.260 H ATOM 1267 2HG2 ILE A 84 -12.043 13.100 12.570 1.00 0.260 H ATOM 1268 3HG2 ILE A 84 -12.869 12.145 11.344 1.00 0.260 H ATOM 1269 1HD1 ILE A 84 -10.029 10.779 8.531 1.00 0.260 H ATOM 1270 2HD1 ILE A 84 -9.107 11.866 9.561 1.00 0.260 H ATOM 1271 3HD1 ILE A 84 -10.168 10.673 10.288 1.00 0.260 H ATOM 1272 N ASP A 85 -11.543 16.102 12.042 1.00 0.200 N ATOM 1273 CA ASP A 85 -11.731 16.968 13.203 1.00 0.260 C ATOM 1274 C ASP A 85 -12.842 17.978 12.946 1.00 0.240 C ATOM 1275 O ASP A 85 -13.643 18.271 13.837 1.00 0.360 O ATOM 1276 CB ASP A 85 -10.462 17.778 13.537 1.00 0.340 C ATOM 1277 CG ASP A 85 -9.278 17.008 14.154 1.00 0.340 C ATOM 1278 OD1 ASP A 85 -9.437 15.890 14.568 1.00 0.340 O ATOM 1279 OD2 ASP A 85 -8.222 17.584 14.230 1.00 0.340 O ATOM 1280 H ASP A 85 -10.632 16.091 11.580 1.00 0.240 H ATOM 1281 HA ASP A 85 -12.006 16.350 14.058 1.00 0.310 H ATOM 1282 1HB ASP A 85 -10.103 18.242 12.614 1.00 0.410 H ATOM 1283 2HB ASP A 85 -10.731 18.589 14.212 1.00 0.410 H ATOM 1284 N THR A 86 -12.912 18.495 11.715 1.00 0.180 N ATOM 1285 CA THR A 86 -13.926 19.468 11.362 1.00 0.190 C ATOM 1286 C THR A 86 -15.334 18.889 11.463 1.00 0.260 C ATOM 1287 O THR A 86 -16.210 19.488 12.095 1.00 0.330 O ATOM 1288 CB THR A 86 -13.696 20.023 9.937 1.00 0.260 C ATOM 1289 OG1 THR A 86 -12.421 20.688 9.878 1.00 0.260 O ATOM 1290 CG2 THR A 86 -14.793 21.026 9.575 1.00 0.260 C ATOM 1291 H THR A 86 -12.198 18.257 11.024 1.00 0.220 H ATOM 1292 HA THR A 86 -13.855 20.299 12.062 1.00 0.230 H ATOM 1293 HB THR A 86 -13.703 19.204 9.220 1.00 0.310 H ATOM 1294 HG1 THR A 86 -11.700 20.020 9.921 1.00 0.310 H ATOM 1295 1HG2 THR A 86 -14.608 21.408 8.574 1.00 0.310 H ATOM 1296 2HG2 THR A 86 -15.771 20.546 9.598 1.00 0.310 H ATOM 1297 3HG2 THR A 86 -14.778 21.849 10.287 1.00 0.310 H ATOM 1298 N SER A 87 -15.569 17.696 10.910 1.00 0.250 N ATOM 1299 CA SER A 87 -16.931 17.160 10.941 1.00 0.380 C ATOM 1300 C SER A 87 -17.317 16.375 12.199 1.00 0.410 C ATOM 1301 O SER A 87 -17.842 15.283 12.123 1.00 1.320 O ATOM 1302 CB SER A 87 -17.157 16.279 9.721 1.00 0.480 C ATOM 1303 OG SER A 87 -17.087 17.027 8.528 1.00 0.480 O ATOM 1304 H SER A 87 -14.822 17.211 10.400 1.00 0.300 H ATOM 1305 HA SER A 87 -17.612 18.005 10.864 1.00 0.460 H ATOM 1306 1HB SER A 87 -16.398 15.490 9.703 1.00 0.580 H ATOM 1307 2HB SER A 87 -18.129 15.793 9.792 1.00 0.580 H ATOM 1308 HG SER A 87 -17.318 16.424 7.820 1.00 0.580 H ATOM 1309 N LYS A 88 -17.101 16.939 13.356 1.00 0.990 N ATOM 1310 CA LYS A 88 -17.508 16.337 14.632 1.00 1.090 C ATOM 1311 C LYS A 88 -17.293 14.812 14.764 1.00 0.750 C ATOM 1312 O LYS A 88 -18.095 14.151 15.430 1.00 0.490 O ATOM 1313 CB LYS A 88 -18.989 16.634 14.881 1.00 1.490 C ATOM 1314 CG LYS A 88 -19.332 18.115 14.960 1.00 1.490 C ATOM 1315 CD LYS A 88 -20.813 18.322 15.266 1.00 1.490 C ATOM 1316 CE LYS A 88 -21.176 19.803 15.312 1.00 1.490 C ATOM 1317 NZ LYS A 88 -22.632 20.012 15.571 1.00 1.490 N ATOM 1318 H LYS A 88 -16.689 17.875 13.308 1.00 1.190 H ATOM 1319 HA LYS A 88 -16.921 16.814 15.417 1.00 1.310 H ATOM 1320 1HB LYS A 88 -19.585 16.190 14.083 1.00 1.780 H ATOM 1321 2HB LYS A 88 -19.301 16.171 15.816 1.00 1.780 H ATOM 1322 1HG LYS A 88 -18.733 18.583 15.740 1.00 1.780 H ATOM 1323 2HG LYS A 88 -19.093 18.590 14.009 1.00 1.780 H ATOM 1324 1HD LYS A 88 -21.412 17.831 14.497 1.00 1.780 H ATOM 1325 2HD LYS A 88 -21.050 17.869 16.228 1.00 1.780 H ATOM 1326 1HE LYS A 88 -20.605 20.286 16.103 1.00 1.780 H ATOM 1327 2HE LYS A 88 -20.918 20.263 14.358 1.00 1.780 H ATOM 1328 1HZ LYS A 88 -22.832 21.003 15.593 1.00 1.780 H ATOM 1329 2HZ LYS A 88 -23.174 19.578 14.836 1.00 1.780 H ATOM 1330 3HZ LYS A 88 -22.881 19.600 16.459 1.00 1.780 H ATOM 1331 N VAL A 89 -16.224 14.244 14.194 1.00 0.930 N ATOM 1332 CA VAL A 89 -16.048 12.804 14.251 1.00 0.680 C ATOM 1333 C VAL A 89 -15.252 12.439 15.471 1.00 0.430 C ATOM 1334 O VAL A 89 -14.203 13.022 15.714 1.00 0.690 O ATOM 1335 CB VAL A 89 -15.228 12.317 13.047 1.00 1.050 C ATOM 1336 CG1 VAL A 89 -15.018 10.799 13.097 1.00 1.050 C ATOM 1337 CG2 VAL A 89 -15.858 12.721 11.772 1.00 1.050 C ATOM 1338 H VAL A 89 -15.519 14.788 13.681 1.00 1.120 H ATOM 1339 HA VAL A 89 -17.024 12.321 14.276 1.00 0.820 H ATOM 1340 HB VAL A 89 -14.264 12.776 13.113 1.00 1.260 H ATOM 1341 1HG1 VAL A 89 -14.413 10.498 12.258 1.00 1.260 H ATOM 1342 2HG1 VAL A 89 -14.524 10.515 14.004 1.00 1.260 H ATOM 1343 3HG1 VAL A 89 -15.980 10.294 13.040 1.00 1.260 H ATOM 1344 1HG2 VAL A 89 -15.216 12.395 10.976 1.00 1.260 H ATOM 1345 2HG2 VAL A 89 -16.846 12.269 11.678 1.00 1.260 H ATOM 1346 3HG2 VAL A 89 -15.949 13.792 11.730 1.00 1.260 H ATOM 1347 N ASN A 90 -15.725 11.482 16.241 1.00 0.220 N ATOM 1348 CA ASN A 90 -14.959 11.006 17.381 1.00 0.410 C ATOM 1349 C ASN A 90 -14.052 9.886 16.866 1.00 0.400 C ATOM 1350 O ASN A 90 -14.558 8.845 16.450 1.00 0.580 O ATOM 1351 CB ASN A 90 -15.861 10.510 18.494 1.00 0.500 C ATOM 1352 CG ASN A 90 -15.081 10.111 19.716 1.00 0.500 C ATOM 1353 OD1 ASN A 90 -13.894 10.444 19.828 1.00 0.500 O ATOM 1354 ND2 ASN A 90 -15.717 9.416 20.628 1.00 0.500 N ATOM 1355 H ASN A 90 -16.614 11.062 16.015 1.00 0.260 H ATOM 1356 HA ASN A 90 -14.324 11.810 17.757 1.00 0.490 H ATOM 1357 1HB ASN A 90 -16.572 11.292 18.764 1.00 0.600 H ATOM 1358 2HB ASN A 90 -16.432 9.651 18.144 1.00 0.600 H ATOM 1359 1HD2 ASN A 90 -15.241 9.128 21.460 1.00 0.600 H ATOM 1360 2HD2 ASN A 90 -16.677 9.172 20.492 1.00 0.600 H ATOM 1361 N TYR A 91 -12.742 10.100 16.801 1.00 0.290 N ATOM 1362 CA TYR A 91 -11.877 9.081 16.210 1.00 0.320 C ATOM 1363 C TYR A 91 -10.524 9.061 16.885 1.00 0.230 C ATOM 1364 O TYR A 91 -10.156 9.995 17.598 1.00 0.260 O ATOM 1365 CB TYR A 91 -11.622 9.370 14.730 1.00 0.440 C ATOM 1366 CG TYR A 91 -10.680 10.529 14.514 1.00 0.440 C ATOM 1367 CD1 TYR A 91 -9.356 10.283 14.127 1.00 0.440 C ATOM 1368 CD2 TYR A 91 -11.082 11.810 14.769 1.00 0.440 C ATOM 1369 CE1 TYR A 91 -8.468 11.320 13.974 1.00 0.440 C ATOM 1370 CE2 TYR A 91 -10.192 12.848 14.627 1.00 0.440 C ATOM 1371 CZ TYR A 91 -8.890 12.611 14.228 1.00 0.440 C ATOM 1372 OH TYR A 91 -8.003 13.659 14.100 1.00 0.440 O ATOM 1373 H TYR A 91 -12.354 10.963 17.159 1.00 0.350 H ATOM 1374 HA TYR A 91 -12.337 8.101 16.336 1.00 0.380 H ATOM 1375 1HB TYR A 91 -11.175 8.492 14.274 1.00 0.520 H ATOM 1376 2HB TYR A 91 -12.542 9.570 14.222 1.00 0.520 H ATOM 1377 HD1 TYR A 91 -9.026 9.264 13.939 1.00 0.520 H ATOM 1378 HD2 TYR A 91 -12.095 12.018 15.083 1.00 0.520 H ATOM 1379 HE1 TYR A 91 -7.441 11.123 13.667 1.00 0.520 H ATOM 1380 HE2 TYR A 91 -10.523 13.862 14.831 1.00 0.520 H ATOM 1381 HH TYR A 91 -8.458 14.512 14.336 1.00 0.520 H ATOM 1382 N GLY A 92 -9.780 7.989 16.650 1.00 0.360 N ATOM 1383 CA GLY A 92 -8.416 7.912 17.124 1.00 0.270 C ATOM 1384 C GLY A 92 -7.516 7.487 15.980 1.00 0.180 C ATOM 1385 O GLY A 92 -7.985 7.222 14.870 1.00 0.170 O ATOM 1386 H GLY A 92 -10.155 7.236 16.092 1.00 0.430 H ATOM 1387 1HA GLY A 92 -8.096 8.882 17.504 1.00 0.320 H ATOM 1388 2HA GLY A 92 -8.345 7.195 17.940 1.00 0.320 H ATOM 1389 N VAL A 93 -6.234 7.359 16.274 1.00 0.160 N ATOM 1390 CA VAL A 93 -5.249 6.936 15.295 1.00 0.160 C ATOM 1391 C VAL A 93 -4.570 5.697 15.838 1.00 0.170 C ATOM 1392 O VAL A 93 -4.011 5.728 16.935 1.00 0.200 O ATOM 1393 CB VAL A 93 -4.229 8.067 15.041 1.00 0.220 C ATOM 1394 CG1 VAL A 93 -3.170 7.613 14.038 1.00 0.220 C ATOM 1395 CG2 VAL A 93 -4.977 9.324 14.519 1.00 0.220 C ATOM 1396 H VAL A 93 -5.928 7.571 17.215 1.00 0.190 H ATOM 1397 HA VAL A 93 -5.750 6.684 14.360 1.00 0.190 H ATOM 1398 HB VAL A 93 -3.718 8.305 15.973 1.00 0.270 H ATOM 1399 1HG1 VAL A 93 -2.456 8.416 13.884 1.00 0.270 H ATOM 1400 2HG1 VAL A 93 -2.642 6.736 14.418 1.00 0.270 H ATOM 1401 3HG1 VAL A 93 -3.647 7.364 13.091 1.00 0.270 H ATOM 1402 1HG2 VAL A 93 -4.266 10.129 14.350 1.00 0.270 H ATOM 1403 2HG2 VAL A 93 -5.484 9.087 13.584 1.00 0.270 H ATOM 1404 3HG2 VAL A 93 -5.712 9.652 15.248 1.00 0.270 H ATOM 1405 N THR A 94 -4.632 4.609 15.084 1.00 0.180 N ATOM 1406 CA THR A 94 -4.081 3.344 15.531 1.00 0.200 C ATOM 1407 C THR A 94 -3.180 2.698 14.493 1.00 0.160 C ATOM 1408 O THR A 94 -3.112 3.130 13.341 1.00 0.240 O ATOM 1409 CB THR A 94 -5.218 2.362 15.895 1.00 0.270 C ATOM 1410 OG1 THR A 94 -5.960 2.020 14.714 1.00 0.270 O ATOM 1411 CG2 THR A 94 -6.173 3.014 16.903 1.00 0.270 C ATOM 1412 H THR A 94 -5.098 4.652 14.188 1.00 0.220 H ATOM 1413 HA THR A 94 -3.482 3.522 16.423 1.00 0.240 H ATOM 1414 HB THR A 94 -4.797 1.457 16.330 1.00 0.330 H ATOM 1415 HG1 THR A 94 -5.444 1.406 14.168 1.00 0.330 H ATOM 1416 1HG2 THR A 94 -6.965 2.311 17.154 1.00 0.330 H ATOM 1417 2HG2 THR A 94 -5.621 3.278 17.805 1.00 0.330 H ATOM 1418 3HG2 THR A 94 -6.618 3.908 16.478 1.00 0.330 H ATOM 1419 N VAL A 95 -2.514 1.636 14.919 1.00 0.170 N ATOM 1420 CA VAL A 95 -1.653 0.827 14.075 1.00 0.180 C ATOM 1421 C VAL A 95 -2.532 -0.051 13.192 1.00 0.150 C ATOM 1422 O VAL A 95 -3.511 -0.626 13.668 1.00 0.170 O ATOM 1423 CB VAL A 95 -0.701 -0.013 14.952 1.00 0.250 C ATOM 1424 CG1 VAL A 95 0.153 -0.960 14.100 1.00 0.250 C ATOM 1425 CG2 VAL A 95 0.187 0.937 15.749 1.00 0.250 C ATOM 1426 H VAL A 95 -2.634 1.368 15.884 1.00 0.200 H ATOM 1427 HA VAL A 95 -1.059 1.484 13.438 1.00 0.220 H ATOM 1428 HB VAL A 95 -1.287 -0.627 15.634 1.00 0.300 H ATOM 1429 1HG1 VAL A 95 0.809 -1.540 14.750 1.00 0.300 H ATOM 1430 2HG1 VAL A 95 -0.486 -1.646 13.546 1.00 0.300 H ATOM 1431 3HG1 VAL A 95 0.757 -0.384 13.403 1.00 0.300 H ATOM 1432 1HG2 VAL A 95 0.858 0.365 16.390 1.00 0.300 H ATOM 1433 2HG2 VAL A 95 0.770 1.544 15.060 1.00 0.300 H ATOM 1434 3HG2 VAL A 95 -0.422 1.590 16.367 1.00 0.300 H ATOM 1435 N LEU A 96 -2.206 -0.130 11.908 1.00 0.140 N ATOM 1436 CA LEU A 96 -2.990 -0.927 10.981 1.00 0.120 C ATOM 1437 C LEU A 96 -3.006 -2.402 11.406 1.00 0.130 C ATOM 1438 O LEU A 96 -1.989 -2.902 11.894 1.00 0.140 O ATOM 1439 CB LEU A 96 -2.409 -0.796 9.568 1.00 0.180 C ATOM 1440 CG LEU A 96 -2.526 0.567 8.854 1.00 0.180 C ATOM 1441 CD1 LEU A 96 -1.756 0.488 7.519 1.00 0.180 C ATOM 1442 CD2 LEU A 96 -3.995 0.907 8.600 1.00 0.180 C ATOM 1443 H LEU A 96 -1.395 0.375 11.582 1.00 0.170 H ATOM 1444 HA LEU A 96 -3.995 -0.532 11.011 1.00 0.140 H ATOM 1445 1HB LEU A 96 -1.349 -0.980 9.665 1.00 0.210 H ATOM 1446 2HB LEU A 96 -2.831 -1.561 8.922 1.00 0.210 H ATOM 1447 HG LEU A 96 -2.075 1.346 9.468 1.00 0.210 H ATOM 1448 1HD1 LEU A 96 -1.819 1.446 7.001 1.00 0.210 H ATOM 1449 2HD1 LEU A 96 -0.706 0.250 7.708 1.00 0.210 H ATOM 1450 3HD1 LEU A 96 -2.196 -0.287 6.894 1.00 0.210 H ATOM 1451 1HD2 LEU A 96 -4.048 1.860 8.091 1.00 0.210 H ATOM 1452 2HD2 LEU A 96 -4.443 0.136 7.978 1.00 0.210 H ATOM 1453 3HD2 LEU A 96 -4.544 0.982 9.529 1.00 0.210 H ATOM 1454 N PRO A 97 -4.133 -3.119 11.190 1.00 0.120 N ATOM 1455 CA PRO A 97 -4.382 -4.507 11.558 1.00 0.130 C ATOM 1456 C PRO A 97 -3.481 -5.484 10.838 1.00 0.110 C ATOM 1457 O PRO A 97 -2.931 -5.178 9.777 1.00 0.130 O ATOM 1458 CB PRO A 97 -5.848 -4.718 11.155 1.00 0.200 C ATOM 1459 CG PRO A 97 -6.117 -3.687 10.087 1.00 0.200 C ATOM 1460 CD PRO A 97 -5.281 -2.493 10.477 1.00 0.200 C ATOM 1461 HA PRO A 97 -4.263 -4.612 12.647 1.00 0.160 H ATOM 1462 1HB PRO A 97 -5.980 -5.752 10.785 1.00 0.230 H ATOM 1463 2HB PRO A 97 -6.499 -4.607 12.032 1.00 0.230 H ATOM 1464 1HG PRO A 97 -5.832 -4.092 9.099 1.00 0.230 H ATOM 1465 2HG PRO A 97 -7.196 -3.465 10.040 1.00 0.230 H ATOM 1466 1HD PRO A 97 -4.979 -1.982 9.561 1.00 0.230 H ATOM 1467 2HD PRO A 97 -5.851 -1.840 11.161 1.00 0.230 H ATOM 1468 N THR A 98 -3.304 -6.649 11.447 1.00 0.100 N ATOM 1469 CA THR A 98 -2.476 -7.692 10.882 1.00 0.100 C ATOM 1470 C THR A 98 -3.179 -8.547 9.835 1.00 0.100 C ATOM 1471 O THR A 98 -4.408 -8.537 9.707 1.00 0.100 O ATOM 1472 CB THR A 98 -1.951 -8.625 11.999 1.00 0.140 C ATOM 1473 OG1 THR A 98 -3.058 -9.254 12.656 1.00 0.140 O ATOM 1474 CG2 THR A 98 -1.139 -7.856 13.008 1.00 0.140 C ATOM 1475 H THR A 98 -3.770 -6.849 12.322 1.00 0.120 H ATOM 1476 HA THR A 98 -1.634 -7.202 10.402 1.00 0.120 H ATOM 1477 HB THR A 98 -1.333 -9.391 11.558 1.00 0.170 H ATOM 1478 HG1 THR A 98 -2.731 -9.862 13.325 1.00 0.170 H ATOM 1479 1HG2 THR A 98 -0.778 -8.541 13.775 1.00 0.170 H ATOM 1480 2HG2 THR A 98 -0.304 -7.405 12.525 1.00 0.170 H ATOM 1481 3HG2 THR A 98 -1.751 -7.085 13.467 1.00 0.170 H ATOM 1482 N PHE A 99 -2.369 -9.306 9.107 1.00 0.090 N ATOM 1483 CA PHE A 99 -2.804 -10.274 8.115 1.00 0.090 C ATOM 1484 C PHE A 99 -1.970 -11.526 8.265 1.00 0.100 C ATOM 1485 O PHE A 99 -0.747 -11.486 8.182 1.00 0.110 O ATOM 1486 CB PHE A 99 -2.673 -9.695 6.726 1.00 0.130 C ATOM 1487 CG PHE A 99 -3.090 -10.624 5.645 1.00 0.130 C ATOM 1488 CD1 PHE A 99 -4.391 -11.095 5.557 1.00 0.130 C ATOM 1489 CD2 PHE A 99 -2.179 -11.013 4.692 1.00 0.130 C ATOM 1490 CE1 PHE A 99 -4.750 -11.939 4.547 1.00 0.130 C ATOM 1491 CE2 PHE A 99 -2.542 -11.855 3.677 1.00 0.130 C ATOM 1492 CZ PHE A 99 -3.833 -12.320 3.607 1.00 0.130 C ATOM 1493 H PHE A 99 -1.372 -9.184 9.271 1.00 0.110 H ATOM 1494 HA PHE A 99 -3.846 -10.524 8.302 1.00 0.110 H ATOM 1495 1HB PHE A 99 -3.279 -8.799 6.670 1.00 0.150 H ATOM 1496 2HB PHE A 99 -1.638 -9.407 6.551 1.00 0.150 H ATOM 1497 HD1 PHE A 99 -5.134 -10.789 6.297 1.00 0.150 H ATOM 1498 HD2 PHE A 99 -1.160 -10.636 4.757 1.00 0.150 H ATOM 1499 HE1 PHE A 99 -5.768 -12.306 4.491 1.00 0.150 H ATOM 1500 HE2 PHE A 99 -1.808 -12.154 2.928 1.00 0.150 H ATOM 1501 HZ PHE A 99 -4.130 -12.989 2.802 1.00 0.150 H ATOM 1502 N LYS A 100 -2.626 -12.636 8.586 1.00 0.100 N ATOM 1503 CA LYS A 100 -1.934 -13.889 8.884 1.00 0.130 C ATOM 1504 C LYS A 100 -0.898 -13.680 9.987 1.00 0.150 C ATOM 1505 O LYS A 100 0.184 -14.268 9.955 1.00 0.200 O ATOM 1506 CB LYS A 100 -1.222 -14.468 7.669 1.00 0.170 C ATOM 1507 CG LYS A 100 -2.071 -14.862 6.503 1.00 0.170 C ATOM 1508 CD LYS A 100 -1.154 -15.521 5.513 1.00 0.170 C ATOM 1509 CE LYS A 100 -1.814 -16.030 4.282 1.00 0.170 C ATOM 1510 NZ LYS A 100 -0.775 -16.637 3.371 1.00 0.170 N ATOM 1511 H LYS A 100 -3.636 -12.607 8.624 1.00 0.120 H ATOM 1512 HA LYS A 100 -2.664 -14.614 9.245 1.00 0.160 H ATOM 1513 1HB LYS A 100 -0.477 -13.762 7.301 1.00 0.200 H ATOM 1514 2HB LYS A 100 -0.678 -15.357 7.978 1.00 0.200 H ATOM 1515 1HG LYS A 100 -2.852 -15.549 6.816 1.00 0.200 H ATOM 1516 2HG LYS A 100 -2.525 -13.979 6.055 1.00 0.200 H ATOM 1517 1HD LYS A 100 -0.405 -14.797 5.217 1.00 0.200 H ATOM 1518 2HD LYS A 100 -0.644 -16.352 5.994 1.00 0.200 H ATOM 1519 1HE LYS A 100 -2.540 -16.791 4.550 1.00 0.200 H ATOM 1520 2HE LYS A 100 -2.320 -15.219 3.769 1.00 0.200 H ATOM 1521 1HZ LYS A 100 -1.188 -17.011 2.535 1.00 0.200 H ATOM 1522 2HZ LYS A 100 -0.075 -15.890 3.127 1.00 0.200 H ATOM 1523 3HZ LYS A 100 -0.305 -17.377 3.855 1.00 0.200 H ATOM 1524 N GLY A 101 -1.225 -12.819 10.948 1.00 0.140 N ATOM 1525 CA GLY A 101 -0.356 -12.517 12.073 1.00 0.180 C ATOM 1526 C GLY A 101 0.716 -11.463 11.777 1.00 0.160 C ATOM 1527 O GLY A 101 1.428 -11.042 12.690 1.00 0.190 O ATOM 1528 H GLY A 101 -2.138 -12.381 10.924 1.00 0.170 H ATOM 1529 1HA GLY A 101 -0.967 -12.178 12.909 1.00 0.220 H ATOM 1530 2HA GLY A 101 0.128 -13.436 12.398 1.00 0.220 H ATOM 1531 N GLN A 102 0.828 -11.007 10.531 1.00 0.130 N ATOM 1532 CA GLN A 102 1.852 -10.036 10.196 1.00 0.130 C ATOM 1533 C GLN A 102 1.298 -8.620 10.172 1.00 0.120 C ATOM 1534 O GLN A 102 0.195 -8.423 9.681 1.00 0.110 O ATOM 1535 CB GLN A 102 2.435 -10.372 8.832 1.00 0.180 C ATOM 1536 CG GLN A 102 3.048 -11.730 8.780 1.00 0.180 C ATOM 1537 CD GLN A 102 4.185 -11.812 9.724 1.00 0.180 C ATOM 1538 OE1 GLN A 102 5.046 -10.930 9.694 1.00 0.180 O ATOM 1539 NE2 GLN A 102 4.206 -12.822 10.578 1.00 0.180 N ATOM 1540 H GLN A 102 0.226 -11.364 9.785 1.00 0.160 H ATOM 1541 HA GLN A 102 2.636 -10.138 10.926 1.00 0.160 H ATOM 1542 1HB GLN A 102 1.645 -10.341 8.077 1.00 0.220 H ATOM 1543 2HB GLN A 102 3.184 -9.630 8.549 1.00 0.220 H ATOM 1544 1HG GLN A 102 2.302 -12.480 9.052 1.00 0.220 H ATOM 1545 2HG GLN A 102 3.413 -11.911 7.768 1.00 0.220 H ATOM 1546 1HE2 GLN A 102 4.953 -12.904 11.239 1.00 0.220 H ATOM 1547 2HE2 GLN A 102 3.467 -13.503 10.582 1.00 0.220 H ATOM 1548 N PRO A 103 2.020 -7.601 10.656 1.00 0.190 N ATOM 1549 CA PRO A 103 1.628 -6.201 10.605 1.00 0.220 C ATOM 1550 C PRO A 103 1.450 -5.750 9.179 1.00 0.160 C ATOM 1551 O PRO A 103 2.107 -6.284 8.288 1.00 0.170 O ATOM 1552 CB PRO A 103 2.825 -5.484 11.240 1.00 0.330 C ATOM 1553 CG PRO A 103 3.490 -6.521 12.110 1.00 0.330 C ATOM 1554 CD PRO A 103 3.284 -7.842 11.390 1.00 0.330 C ATOM 1555 HA PRO A 103 0.710 -6.029 11.177 1.00 0.260 H ATOM 1556 1HB PRO A 103 3.484 -5.089 10.442 1.00 0.400 H ATOM 1557 2HB PRO A 103 2.474 -4.611 11.815 1.00 0.400 H ATOM 1558 1HG PRO A 103 4.556 -6.269 12.243 1.00 0.400 H ATOM 1559 2HG PRO A 103 3.040 -6.514 13.115 1.00 0.400 H ATOM 1560 1HD PRO A 103 4.112 -8.079 10.697 1.00 0.400 H ATOM 1561 2HD PRO A 103 3.162 -8.591 12.189 1.00 0.400 H ATOM 1562 N SER A 104 0.566 -4.785 8.963 1.00 0.180 N ATOM 1563 CA SER A 104 0.434 -4.199 7.639 1.00 0.150 C ATOM 1564 C SER A 104 1.735 -3.469 7.356 1.00 0.160 C ATOM 1565 O SER A 104 2.368 -2.971 8.294 1.00 0.190 O ATOM 1566 CB SER A 104 -0.759 -3.287 7.538 1.00 0.220 C ATOM 1567 OG SER A 104 -1.990 -3.986 7.602 1.00 0.220 O ATOM 1568 H SER A 104 0.033 -4.402 9.736 1.00 0.220 H ATOM 1569 HA SER A 104 0.312 -4.981 6.910 1.00 0.180 H ATOM 1570 1HB SER A 104 -0.699 -2.581 8.323 1.00 0.270 H ATOM 1571 2HB SER A 104 -0.702 -2.754 6.620 1.00 0.270 H ATOM 1572 HG SER A 104 -2.111 -4.337 8.514 1.00 0.270 H ATOM 1573 N LYS A 105 2.155 -3.420 6.094 1.00 0.140 N ATOM 1574 CA LYS A 105 3.399 -2.742 5.736 1.00 0.140 C ATOM 1575 C LYS A 105 3.198 -1.675 4.642 1.00 0.130 C ATOM 1576 O LYS A 105 3.424 -1.958 3.469 1.00 0.140 O ATOM 1577 CB LYS A 105 4.422 -3.791 5.315 1.00 0.200 C ATOM 1578 CG LYS A 105 4.823 -4.725 6.442 1.00 0.200 C ATOM 1579 CD LYS A 105 5.790 -5.791 5.987 1.00 0.200 C ATOM 1580 CE LYS A 105 6.147 -6.712 7.144 1.00 0.200 C ATOM 1581 NZ LYS A 105 7.058 -7.813 6.725 1.00 0.200 N ATOM 1582 H LYS A 105 1.569 -3.843 5.366 1.00 0.170 H ATOM 1583 HA LYS A 105 3.798 -2.284 6.630 1.00 0.170 H ATOM 1584 1HB LYS A 105 3.992 -4.418 4.568 1.00 0.240 H ATOM 1585 2HB LYS A 105 5.310 -3.317 4.900 1.00 0.240 H ATOM 1586 1HG LYS A 105 5.264 -4.148 7.254 1.00 0.240 H ATOM 1587 2HG LYS A 105 3.937 -5.221 6.826 1.00 0.240 H ATOM 1588 1HD LYS A 105 5.331 -6.383 5.195 1.00 0.240 H ATOM 1589 2HD LYS A 105 6.694 -5.329 5.597 1.00 0.240 H ATOM 1590 1HE LYS A 105 6.632 -6.130 7.924 1.00 0.240 H ATOM 1591 2HE LYS A 105 5.227 -7.149 7.547 1.00 0.240 H ATOM 1592 1HZ LYS A 105 7.266 -8.399 7.521 1.00 0.240 H ATOM 1593 2HZ LYS A 105 6.605 -8.370 6.011 1.00 0.240 H ATOM 1594 3HZ LYS A 105 7.914 -7.426 6.358 1.00 0.240 H ATOM 1595 N PRO A 106 2.790 -0.441 5.004 1.00 0.120 N ATOM 1596 CA PRO A 106 2.400 0.648 4.123 1.00 0.110 C ATOM 1597 C PRO A 106 3.581 1.274 3.424 1.00 0.130 C ATOM 1598 O PRO A 106 4.721 1.114 3.863 1.00 0.160 O ATOM 1599 CB PRO A 106 1.763 1.652 5.094 1.00 0.170 C ATOM 1600 CG PRO A 106 2.479 1.425 6.389 1.00 0.170 C ATOM 1601 CD PRO A 106 2.759 -0.064 6.436 1.00 0.170 C ATOM 1602 HA PRO A 106 1.687 0.273 3.381 1.00 0.130 H ATOM 1603 1HB PRO A 106 1.905 2.680 4.708 1.00 0.200 H ATOM 1604 2HB PRO A 106 0.688 1.486 5.185 1.00 0.200 H ATOM 1605 1HG PRO A 106 3.408 2.027 6.406 1.00 0.200 H ATOM 1606 2HG PRO A 106 1.861 1.769 7.231 1.00 0.200 H ATOM 1607 1HD PRO A 106 3.748 -0.181 6.901 1.00 0.200 H ATOM 1608 2HD PRO A 106 1.964 -0.599 6.979 1.00 0.200 H ATOM 1609 N PHE A 107 3.312 2.022 2.360 1.00 0.130 N ATOM 1610 CA PHE A 107 4.375 2.783 1.738 1.00 0.160 C ATOM 1611 C PHE A 107 4.704 3.929 2.676 1.00 0.240 C ATOM 1612 O PHE A 107 3.803 4.546 3.246 1.00 0.550 O ATOM 1613 CB PHE A 107 3.955 3.396 0.398 1.00 0.210 C ATOM 1614 CG PHE A 107 3.777 2.472 -0.786 1.00 0.210 C ATOM 1615 CD1 PHE A 107 2.519 2.283 -1.340 1.00 0.210 C ATOM 1616 CD2 PHE A 107 4.858 1.813 -1.361 1.00 0.210 C ATOM 1617 CE1 PHE A 107 2.349 1.470 -2.450 1.00 0.210 C ATOM 1618 CE2 PHE A 107 4.684 0.988 -2.462 1.00 0.210 C ATOM 1619 CZ PHE A 107 3.431 0.823 -3.005 1.00 0.210 C ATOM 1620 H PHE A 107 2.367 2.093 2.007 1.00 0.160 H ATOM 1621 HA PHE A 107 5.256 2.152 1.614 1.00 0.190 H ATOM 1622 1HB PHE A 107 3.016 3.901 0.550 1.00 0.250 H ATOM 1623 2HB PHE A 107 4.681 4.160 0.120 1.00 0.250 H ATOM 1624 HD1 PHE A 107 1.662 2.788 -0.900 1.00 0.250 H ATOM 1625 HD2 PHE A 107 5.854 1.948 -0.941 1.00 0.250 H ATOM 1626 HE1 PHE A 107 1.360 1.331 -2.882 1.00 0.250 H ATOM 1627 HE2 PHE A 107 5.537 0.473 -2.902 1.00 0.250 H ATOM 1628 HZ PHE A 107 3.296 0.176 -3.870 1.00 0.250 H ATOM 1629 N VAL A 108 5.978 4.245 2.810 1.00 0.230 N ATOM 1630 CA VAL A 108 6.402 5.337 3.666 1.00 0.230 C ATOM 1631 C VAL A 108 7.110 6.415 2.857 1.00 0.290 C ATOM 1632 O VAL A 108 8.027 6.127 2.092 1.00 0.350 O ATOM 1633 CB VAL A 108 7.290 4.793 4.801 1.00 0.320 C ATOM 1634 CG1 VAL A 108 7.789 5.911 5.652 1.00 0.320 C ATOM 1635 CG2 VAL A 108 6.460 3.820 5.664 1.00 0.320 C ATOM 1636 H VAL A 108 6.674 3.706 2.313 1.00 0.280 H ATOM 1637 HA VAL A 108 5.519 5.784 4.124 1.00 0.280 H ATOM 1638 HB VAL A 108 8.150 4.279 4.377 1.00 0.390 H ATOM 1639 1HG1 VAL A 108 8.411 5.507 6.449 1.00 0.390 H ATOM 1640 2HG1 VAL A 108 8.381 6.599 5.048 1.00 0.390 H ATOM 1641 3HG1 VAL A 108 6.943 6.442 6.086 1.00 0.390 H ATOM 1642 1HG2 VAL A 108 7.077 3.429 6.471 1.00 0.390 H ATOM 1643 2HG2 VAL A 108 5.604 4.347 6.085 1.00 0.390 H ATOM 1644 3HG2 VAL A 108 6.103 2.989 5.054 1.00 0.390 H ATOM 1645 N GLY A 109 6.646 7.654 3.016 1.00 0.280 N ATOM 1646 CA GLY A 109 7.189 8.797 2.288 1.00 0.370 C ATOM 1647 C GLY A 109 8.288 9.579 3.020 1.00 0.460 C ATOM 1648 O GLY A 109 8.943 9.089 3.943 1.00 0.480 O ATOM 1649 H GLY A 109 5.885 7.788 3.668 1.00 0.340 H ATOM 1650 1HA GLY A 109 7.582 8.446 1.333 1.00 0.440 H ATOM 1651 2HA GLY A 109 6.372 9.474 2.046 1.00 0.440 H ATOM 1652 N VAL A 110 8.436 10.843 2.613 1.00 0.540 N ATOM 1653 CA VAL A 110 9.478 11.771 3.075 1.00 0.650 C ATOM 1654 C VAL A 110 9.514 12.040 4.581 1.00 0.640 C ATOM 1655 O VAL A 110 10.560 12.391 5.121 1.00 0.730 O ATOM 1656 CB VAL A 110 9.337 13.115 2.308 1.00 0.870 C ATOM 1657 CG1 VAL A 110 8.089 13.891 2.762 1.00 0.870 C ATOM 1658 CG2 VAL A 110 10.590 13.973 2.507 1.00 0.870 C ATOM 1659 H VAL A 110 7.822 11.155 1.873 1.00 0.650 H ATOM 1660 HA VAL A 110 10.440 11.337 2.797 1.00 0.780 H ATOM 1661 HB VAL A 110 9.217 12.889 1.250 1.00 1.040 H ATOM 1662 1HG1 VAL A 110 8.009 14.810 2.181 1.00 1.040 H ATOM 1663 2HG1 VAL A 110 7.197 13.292 2.608 1.00 1.040 H ATOM 1664 3HG1 VAL A 110 8.177 14.151 3.807 1.00 1.040 H ATOM 1665 1HG2 VAL A 110 10.488 14.893 1.936 1.00 1.040 H ATOM 1666 2HG2 VAL A 110 10.722 14.225 3.555 1.00 1.040 H ATOM 1667 3HG2 VAL A 110 11.465 13.426 2.157 1.00 1.040 H ATOM 1668 N LEU A 111 8.388 11.885 5.265 1.00 0.570 N ATOM 1669 CA LEU A 111 8.334 12.147 6.696 1.00 0.590 C ATOM 1670 C LEU A 111 8.658 10.907 7.527 1.00 0.600 C ATOM 1671 O LEU A 111 8.605 10.952 8.758 1.00 0.650 O ATOM 1672 CB LEU A 111 6.944 12.665 7.085 1.00 0.820 C ATOM 1673 CG LEU A 111 6.468 13.988 6.403 1.00 0.820 C ATOM 1674 CD1 LEU A 111 5.054 14.290 6.863 1.00 0.820 C ATOM 1675 CD2 LEU A 111 7.420 15.146 6.728 1.00 0.820 C ATOM 1676 H LEU A 111 7.548 11.599 4.783 1.00 0.680 H ATOM 1677 HA LEU A 111 9.084 12.895 6.937 1.00 0.710 H ATOM 1678 1HB LEU A 111 6.217 11.889 6.850 1.00 0.980 H ATOM 1679 2HB LEU A 111 6.929 12.824 8.164 1.00 0.980 H ATOM 1680 HG LEU A 111 6.435 13.847 5.331 1.00 0.980 H ATOM 1681 1HD1 LEU A 111 4.699 15.198 6.374 1.00 0.980 H ATOM 1682 2HD1 LEU A 111 4.398 13.460 6.601 1.00 0.980 H ATOM 1683 3HD1 LEU A 111 5.044 14.433 7.943 1.00 0.980 H ATOM 1684 1HD2 LEU A 111 7.061 16.053 6.241 1.00 0.980 H ATOM 1685 2HD2 LEU A 111 7.450 15.303 7.807 1.00 0.980 H ATOM 1686 3HD2 LEU A 111 8.421 14.930 6.367 1.00 0.980 H ATOM 1687 N SER A 112 9.008 9.817 6.848 1.00 0.580 N ATOM 1688 CA SER A 112 9.329 8.529 7.441 1.00 0.630 C ATOM 1689 C SER A 112 8.197 7.967 8.306 1.00 0.650 C ATOM 1690 O SER A 112 7.016 8.231 8.055 1.00 0.590 O ATOM 1691 CB SER A 112 10.604 8.654 8.261 1.00 0.860 C ATOM 1692 OG SER A 112 11.066 7.398 8.669 1.00 0.860 O ATOM 1693 H SER A 112 9.044 9.856 5.828 1.00 0.700 H ATOM 1694 HA SER A 112 9.530 7.837 6.630 1.00 0.760 H ATOM 1695 1HB SER A 112 11.367 9.151 7.664 1.00 1.030 H ATOM 1696 2HB SER A 112 10.422 9.272 9.137 1.00 1.030 H ATOM 1697 HG SER A 112 11.882 7.564 9.164 1.00 1.030 H ATOM 1698 N ALA A 113 8.557 7.134 9.283 1.00 0.820 N ATOM 1699 CA ALA A 113 7.598 6.456 10.155 1.00 0.900 C ATOM 1700 C ALA A 113 8.294 5.896 11.402 1.00 1.210 C ATOM 1701 O ALA A 113 9.508 5.658 11.393 1.00 1.400 O ATOM 1702 CB ALA A 113 6.908 5.328 9.402 1.00 1.230 C ATOM 1703 H ALA A 113 9.547 6.968 9.410 1.00 0.980 H ATOM 1704 HA ALA A 113 6.855 7.185 10.478 1.00 1.080 H ATOM 1705 1HB ALA A 113 6.187 4.842 10.056 1.00 1.470 H ATOM 1706 2HB ALA A 113 6.394 5.729 8.532 1.00 1.470 H ATOM 1707 3HB ALA A 113 7.651 4.600 9.082 1.00 1.470 H ATOM 1708 N GLY A 114 7.531 5.625 12.466 1.00 1.330 N ATOM 1709 CA GLY A 114 8.122 4.967 13.648 1.00 1.660 C ATOM 1710 C GLY A 114 8.031 3.431 13.585 1.00 1.860 C ATOM 1711 O GLY A 114 7.749 2.853 12.534 1.00 1.870 O ATOM 1712 H GLY A 114 6.547 5.851 12.455 1.00 1.600 H ATOM 1713 1HA GLY A 114 9.167 5.263 13.742 1.00 1.990 H ATOM 1714 2HA GLY A 114 7.615 5.320 14.545 1.00 1.990 H ATOM 1715 N ILE A 115 8.260 2.772 14.725 1.00 2.130 N ATOM 1716 CA ILE A 115 8.235 1.311 14.793 1.00 2.420 C ATOM 1717 C ILE A 115 7.039 0.823 15.598 1.00 2.400 C ATOM 1718 O ILE A 115 6.868 1.205 16.755 1.00 2.430 O ATOM 1719 CB ILE A 115 9.542 0.775 15.409 1.00 3.270 C ATOM 1720 CG1 ILE A 115 10.737 1.214 14.513 1.00 3.270 C ATOM 1721 CG2 ILE A 115 9.468 -0.768 15.555 1.00 3.270 C ATOM 1722 CD1 ILE A 115 12.106 0.980 15.115 1.00 3.270 C ATOM 1723 H ILE A 115 8.465 3.301 15.561 1.00 2.560 H ATOM 1724 HA ILE A 115 8.144 0.915 13.783 1.00 2.900 H ATOM 1725 HB ILE A 115 9.687 1.219 16.392 1.00 3.930 H ATOM 1726 1HG1 ILE A 115 10.677 0.678 13.567 1.00 3.930 H ATOM 1727 2HG1 ILE A 115 10.648 2.278 14.307 1.00 3.930 H ATOM 1728 1HG2 ILE A 115 10.379 -1.148 15.996 1.00 3.930 H ATOM 1729 2HG2 ILE A 115 8.632 -1.047 16.199 1.00 3.930 H ATOM 1730 3HG2 ILE A 115 9.327 -1.220 14.572 1.00 3.930 H ATOM 1731 1HD1 ILE A 115 12.868 1.327 14.416 1.00 3.930 H ATOM 1732 2HD1 ILE A 115 12.194 1.536 16.049 1.00 3.930 H ATOM 1733 3HD1 ILE A 115 12.262 -0.074 15.308 1.00 3.930 H ATOM 1734 N ASN A 116 6.223 -0.021 14.974 1.00 2.560 N ATOM 1735 CA ASN A 116 5.019 -0.554 15.594 1.00 2.650 C ATOM 1736 C ASN A 116 4.989 -2.074 15.495 1.00 3.250 C ATOM 1737 O ASN A 116 4.070 -2.717 16.004 1.00 3.310 O ATOM 1738 OXT ASN A 116 5.741 -2.623 14.692 1.00 3.970 O ATOM 1739 CB ASN A 116 3.794 0.045 14.943 1.00 3.520 C ATOM 1740 CG ASN A 116 3.681 1.525 15.172 1.00 3.520 C ATOM 1741 OD1 ASN A 116 3.339 1.982 16.272 1.00 3.520 O ATOM 1742 ND2 ASN A 116 3.959 2.295 14.148 1.00 3.520 N ATOM 1743 H ASN A 116 6.450 -0.288 14.026 1.00 3.070 H ATOM 1744 HA ASN A 116 5.023 -0.295 16.653 1.00 3.180 H ATOM 1745 1HB ASN A 116 3.817 -0.146 13.871 1.00 4.230 H ATOM 1746 2HB ASN A 116 2.914 -0.441 15.342 1.00 4.230 H ATOM 1747 1HD2 ASN A 116 3.902 3.289 14.239 1.00 4.230 H ATOM 1748 2HD2 ASN A 116 4.234 1.887 13.278 1.00 4.230 H TER # All scores below are weighted scores, not raw scores. #BEGIN_POSE_ENERGIES_TABLE model04_0001.pdb label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 coordinate_constraint omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.5 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA pose -513.312 52.7902 389.301 -35.2943 10.6172 22.8664 186.242 -218.799 -1.08492 -6.46689 -167.691 -28.4548 -54.0205 -13.237 -12.037 -6.84052 0 15.6104 -2.01794 3.90713 35.9075 86.6976 -30.3524 23.4681 -5.49113 -2.24968 54.0696 -215.873 GLN:NtermProteinFull_1 -2.66412 0.1621 2.77252 -0.66105 0.07717 0.80287 1.29972 -1.19495 -0.03187 -0.16763 -1.69319 1.22867 0 0 0 0 0 0.11831 0.01462 0.01342 0 2.4974 0 0 -0.18838 0 0.1241 2.50974 GLU_2 -3.68943 0.64382 3.45712 -0.31705 0.06008 0.41759 1.41657 -1.45663 -0.02858 -0.11742 -1.71933 -0.30627 0 0 0 0 0 0.00456 -0.08015 0.01635 0 2.75059 -0.00632 0 -2.7348 -0.22724 0.92109 -0.99543 PRO_3 -3.6614 0.70453 3.25817 -0.06846 0 0.04266 2.26454 -1.50698 -0 -0 -2.08397 0.60606 0 0 0 0 0 0.02338 -0.114 0.04223 0.21188 0 -0.51505 0 -2.4119 -0.15654 0.98947 -2.37538 TYR_4 -5.84184 0.66154 2.88381 -0.96926 0.08798 0.44909 1.32552 -1.72921 -7e-05 -0.00128 -0.57007 -0.28329 0 0 0 0 0 0.04274 0.0608 0.05524 0 2.01109 -0.0774 0.0006 1.2797 0.25395 0.2842 -0.07616 PHE_5 -6.00584 0.55764 2.2267 -0.63834 0.06573 0.37248 1.16896 -1.71625 -0 -0 -1.59122 0.09632 0 0 0 0 0 0.01224 -0.03124 0.06942 0 2.05571 -0.14802 0 1.0402 -0.10006 0.31762 -2.24793 THR_6 -5.23568 0.5441 4.08893 -0.10732 0.0634 0.05716 2.7883 -2.20957 -0 -0 -1.93083 -1.48646 0 0 0 0 0 0.02069 -0.00692 0.01584 0.33837 0 -0.57867 2.26884 -1.0874 -0.2943 0.95031 -1.8012 TRP_7 -11.208 1.73903 5.02083 -1.54059 0.25587 0.80186 3.05041 -3.73495 -0.0041 -0.0248 -2.33414 -0.24428 0 0 0 0 0 0.01736 -0.01754 0.01183 0 1.97195 -0.2582 0 1.6906 5.96489 2.22221 3.38023 PRO_8 -7.79602 1.26002 4.12084 -0.06713 0 0.04179 2.11375 -2.13672 -0 -0 -1.99524 0.6312 0 0 0 0 0 0.05093 -0.13606 0.05516 0.18461 0 -0.11481 0 -2.4119 6.01647 1.78714 1.60404 LEU_9 -7.52982 1.48835 2.91427 -0.7802 0.50877 0.31037 2.26448 -2.43392 -0.00589 -0.01752 -0.89786 0.19196 0 0 0 0 0 0.01264 -0.02088 0.17605 0.81568 0 -0.19818 0 0.18072 0.04394 0.94799 -2.02905 ILE_10 -8.75265 0.7674 3.95923 -0.48441 0.32728 0.08704 2.71837 -2.92503 -0.00041 -0.00646 -1.61224 0.21686 0 0 0 0 0 0.05836 0.03442 0.0567 0.47381 0 -0.43318 0 0.73287 0.07166 1.16758 -3.54281 ALA_11 -6.19844 0.74912 4.02038 -0.02277 0 0 2.40481 -2.9091 -0.03672 -0.15265 -2.68864 -0.34368 0 0 0 0 0 0.04869 -0.0597 0 0 0 -0.32043 0 1.8394 -0.2875 0.88652 -3.0707 ALA_12 -5.55521 0.49627 3.81915 -0.02419 0 0 2.45958 -2.55693 -0.06474 -0.41511 -0.49567 -0.35753 0 0 0 0 0 0.04095 -0.08833 0 0 0 -0.42696 0 1.8394 -0.58279 0.77338 -1.13872 ASP_13 -4.48154 0.76247 5.52066 -0.29031 0.05316 0.96047 1.8611 -2.42408 -0.08196 -0.56027 -3.7652 0.39384 0 0 0 -0.63348 0 0.00799 -0.05031 0.04655 0 3.62888 -0.38887 0 -2.3716 -0.48411 0.64463 -1.65197 GLY_14 -2.54851 0.1352 2.88002 -7e-05 0 0 1.17569 -1.5129 -0.01381 -0.09795 -1.16437 -0.32038 0 0 0 0 0 0.00448 -0.09893 0 0 0 -1.54035 0 0.83697 -0.16287 0.68931 -1.73847 GLY_15 -3.93468 0.18792 2.57376 -0.00028 0 0 1.15538 -1.76315 -0.03466 -0.15057 -0.87138 -0.21143 0 0 0 0 0 0.01999 -0.06576 0 0 0 0.35309 0 0.83697 0.13216 0.49904 -1.2736 TYR_16 -7.3935 0.91504 4.29588 -0.8759 0.04293 0.50067 1.9729 -2.90462 -0.00635 -0.09792 -1.99247 -0.34736 0 0 0 -0.60201 0 0.0319 -0.00592 0.06478 0 1.53392 -0.3518 0.00184 1.2797 -0.10321 0.44836 -3.59314 ALA_17 -3.38365 0.22332 1.61085 -0.01705 0 0 1.10158 -1.36104 -0 -0 -0.21968 -0.29277 0 0 0 0 0 0.01287 0.08145 0 0 0 0.44023 0 1.8394 0.75891 0.45004 1.24444 PHE_18 -7.22042 0.94924 1.62694 -0.61865 0.03939 0.34667 1.05945 -1.91025 -0 -0 -0.98805 0.08642 0 0 0 0 0 0.00657 -0.0103 0.01348 0 2.05961 -0.13487 0 1.0402 0.87142 0.17733 -2.60582 LYS_19 -4.85547 0.25776 5.5311 -0.38122 0.05295 0.1747 2.06585 -2.26581 -0.0557 -0.20761 -3.77511 0.17162 0 0 0 0 0 0.00763 -0.0638 0.00537 1.70419 0 0.00171 0 -1.5107 -0.33409 0.2703 -3.20635 TYR_20 -6.21428 1.06955 2.35359 -0.68324 0.07121 0.08095 0.74339 -1.93845 -0 -0 -0.9065 -0.39156 0 0 -0.30799 0 0 0.01211 -0.05456 0.27852 0 2.59614 -0.00082 0.24709 1.2797 -0.30099 0.49196 -1.57417 GLU_21 -3.52973 0.2604 4.46264 -0.27901 0.0491 0.33276 1.67192 -1.97235 -0.01364 -0.04702 -1.581 -0.24721 0 0 0 0 0 0.16868 -0.01665 0.00195 0 2.92633 -0.18243 0 -2.7348 0.21345 0.43012 -0.0865 ASN_22 -1.81396 0.18773 2.03517 -0.19319 0.04982 0.32522 0.43073 -0.87273 -0.00212 -0.00848 0.33987 -1.00876 0 0 0 0 0 0.03136 -0.0634 0.00067 0 1.86786 -1.02266 0 -0.93687 -0.2621 0.15571 -0.76013 GLY_23 -2.29956 0.49892 1.99993 -6e-05 0 0 0.25764 -1.12428 -0 -0 -0.89029 -0.37732 0 0 -0.30799 0 0 0.07404 -0.12458 0 0 0 -1.48476 0 0.83697 -0.94136 0.35664 -3.52605 LYS_24 -3.88122 0.33454 4.2344 -0.46889 0.12991 0.2577 2.18463 -2.13048 -0.00376 -0.0108 -1.87117 -0.01332 0 0 0 0 0 0.02475 -0.0039 0.00785 1.80002 0 0.01029 0 -1.5107 -0.53763 0.47347 -0.97432 TYR_25 -5.20779 0.66735 1.55031 -0.58853 0.02283 0.27381 0.73526 -1.29764 -0 -0 -0.83846 -0.14743 0 0 0 0 0 0.0067 0.01595 0.01645 0 2.12407 -0.10028 0.00496 1.2797 -0.16867 0.32117 -1.33024 ASP_26 -4.94984 0.37436 6.85996 -0.24909 0.10484 0.82836 3.52989 -2.92687 -0.03438 -0.1958 -4.06535 -1.13114 0 0 -0.60597 0 0 0.03378 -0.04495 0.00026 0 1.85994 -0.8474 0 -2.3716 -0.24314 0.59175 -3.48241 ILE_27 -3.95124 0.39776 1.96246 -0.70346 0.60367 0.2583 1.18041 -1.38019 -0 -0 -0.42235 -0.04918 0 0 0 0 0 0.04022 -0.17802 0.13097 0.9757 0 0.41618 0 0.73287 -0.16815 0.78792 0.63386 LYS_28 -3.138 0.39821 3.02556 -0.52176 0.16855 0.3433 1.31419 -1.49884 -0 -0 -1.75173 -0.02306 0 0 -0.60597 0 0 0.02838 -0.05075 0.01055 1.76349 0 -0.17364 0 -1.5107 -0.12381 0.52293 -1.82311 ASP_29 -5.27905 0.33832 6.9861 -0.23805 0.03651 0.77817 3.03453 -2.92161 -0.05041 -0.26779 -3.61902 -0.75681 0 0 0 -0.60201 0 0.01064 -0.02407 0.00909 0 2.00465 -0.81162 0 -2.3716 -0.20846 0.46205 -3.49044 VAL_30 -4.23517 0.56379 1.95003 -0.28395 0.20419 0.05869 1.76153 -1.64831 -0 -0 -0.90496 -0.11136 0 0 0 0 0 0.02548 0.06903 0.01915 0.15573 0 -0.55266 0 1.9342 -0.32829 0.56405 -0.75883 GLY_31 -4.41545 0.47079 3.43593 -6e-05 0 0 1.87378 -2.16213 -0.00616 -0.04685 -1.99915 -0.378 0 0 0 0 0 0.05839 -0.03714 0 0 0 0.21833 0 0.83697 0.05411 0.58848 -1.50817 VAL_32 -3.28978 0.39947 2.42522 -0.36731 0.22959 0.09121 1.16179 -1.5369 -0 -0 0.23641 -0.10507 0 0 0 0 0 0.02944 -0.01177 0.04764 0.88107 0 0.03854 0 1.9342 0.25965 0.49069 2.91409 ASP_33 -2.72935 0.25703 2.72575 -0.12318 0.02513 0.38231 0.44359 -1.34654 -0 -0 -0.65779 -0.37709 0 0 0 0 0 0.00705 -0.05053 0.00032 0 2.64362 -0.40076 0 -2.3716 -0.4056 0.2588 -1.71884 ASN_34 -5.88919 0.42429 5.98088 -0.22922 0.00865 0.33716 3.07715 -3.10343 -0.01986 -0.24206 -2.20994 -0.47093 0 0 -1.03585 0 0 0.01339 -0.04626 0.01308 0 2.72696 0.30835 0 -0.93687 -0.51046 0.17276 -1.63142 ALA_35 -2.98569 0.14996 3.21563 -0.02318 0 0 1.49547 -1.69909 -0.02125 -0.15643 -0.69083 -0.38548 0 0 0 0 0 0.01259 0.01385 0 0 0 -0.42654 0 1.8394 -0.38756 0.15236 0.1032 GLY_36 -4.91145 0.77354 4.70529 -5e-05 0 0 2.31614 -2.67207 -0 -0 -2.21875 -0.42102 0 0 -1.03585 0 0 0.00744 -0.05698 0 0 0 0.38334 0 0.83697 0.2077 0.16196 -1.92379 ALA_37 -6.44639 0.52643 4.50346 -0.0214 0 0 2.65394 -3.14616 -0 -0 -1.79682 -0.36652 0 0 0 0 0 0.01209 0.00469 0 0 0 -0.32452 0 1.8394 0.23674 0.20857 -2.11649 LYS_38 -5.92924 0.33979 6.72177 -0.30273 0.0279 0.13246 3.15015 -3.09434 -0 -0 -3.77524 -0.03971 0 0 0 0 0 0.01647 0.04591 0.0896 1.77312 0 0.00734 0 -1.5107 -0.41392 0.25409 -2.5073 ALA_39 -5.0938 0.23671 4.56659 -0.02175 0 0 2.79072 -2.69982 -0 -0 -2.49317 -0.35716 0 0 0 0 0 0.00545 0.03271 0 0 0 -0.23069 0 1.8394 -0.36638 0.2663 -1.52489 GLY_40 -5.45078 0.48541 4.68774 -5e-05 0 0 2.45716 -2.63267 -0.00041 -0.00646 -2.43134 -0.41302 0 0 0 0 0 0.00508 -0.0517 0 0 0 0.3338 0 0.83697 0.31606 0.15203 -1.71217 LEU_41 -6.15558 0.47064 4.92135 -0.48509 0.20691 0.11621 2.64133 -2.73204 -0 -0 -2.60139 0.22274 0 0 0 0 0 0.01415 -0.02248 0.15509 0.31484 0 -0.27768 0 0.18072 0.33732 0.14669 -2.54628 THR_42 -5.12141 0.26706 6.58544 -0.20158 0.11614 0.07291 3.18493 -3.06552 -0 -0 -3.43179 -0.11703 0 0 0 0 0 0.00231 0.02604 1e-05 0.06435 0 -0.00754 2.3021 -1.0874 -0.11789 0.22232 -0.30655 PHE_43 -7.30365 0.90054 4.23809 -0.82899 0.02788 0.2746 2.62491 -2.69153 -0 -0 -2.43916 -0.03381 0 0 0 0 0 0.00641 -0.00266 0.02257 0 1.81804 -0.43628 0 1.0402 0.06358 0.33634 -2.38292 LEU_44 -7.67494 0.76164 4.25395 -0.49442 0.25818 0.11324 2.49709 -2.77185 -0 -0 -1.92882 0.24151 0 0 0 0 0 0.04149 0.00591 0.08463 0.38659 0 -0.25821 0 0.18072 -0.13685 0.50512 -3.93501 VAL_45 -5.71976 0.41243 5.68594 -0.31704 0.22484 0.0728 3.03796 -2.88601 -0 -0 -2.55553 -0.20219 0 0 0 0 0 0.02202 -0.02245 0.00716 0.08254 0 -0.28432 0 1.9342 -0.21392 0.45538 -0.26593 ASP_46 -5.75637 0.32821 7.10068 -0.10188 0.0045 0.30457 3.03041 -3.35158 -0 -0 -2.98323 -0.36931 0 0 0 0 0 0.00699 0.0287 0.00543 0 1.68797 0.19202 0 -2.3716 -0.20816 0.44185 -2.0108 LEU_47 -8.34878 0.48247 5.57479 -0.47837 0.18632 0.10975 2.88094 -3.16213 -0.01706 -0.09689 -3.14333 0.21372 0 0 0 0 0 0.00591 0.09856 0.00135 0.33429 0 -0.27017 0 0.18072 -0.30459 0.51732 -5.23519 ILE_48 -7.55717 0.63173 5.70961 -0.49173 0.33351 0.09608 2.45845 -3.05739 -0 -0 -1.63047 0.10615 0 0 0 0 0 0.0033 -0.07071 0.02045 0.48384 0 -0.48737 0 0.73287 -0.09766 0.42661 -2.3899 LYS_49 -3.99554 0.21627 3.91427 -0.30344 0.02347 0.13411 1.70521 -1.88306 -0 -0 -1.17166 -0.03509 0 0 0 0 0 0.00447 -0.08235 0.07928 1.75008 0 -0.06801 0 -1.5107 -0.24259 0.38963 -1.07564 ASN_50 -4.5404 0.39907 4.78738 -0.19679 0.03741 0.31421 1.44207 -2.32261 -0 -0 -1.29666 -0.40909 0 0 0 0 0 0.00534 -0.06855 0.03084 0 2.01362 -0.48733 0 -0.93687 -0.64449 0.32681 -1.54602 LYS_51 -2.5946 0.23837 3.26085 -0.3381 0.07199 0.22195 1.36723 -1.55839 -0.00466 -0.02101 -1.1996 -0.38748 0 0 0 0 0 0.00258 -0.02339 0.01924 1.49938 0 -0.10638 0 -1.5107 -0.42181 0.32633 -1.1582 HIS_D_52 -3.96736 0.20635 3.11847 -0.40445 0.01029 0.5207 0.96238 -1.61834 -0.00466 -0.02101 -1.25484 -0.30053 0 0 0 0 0 0.09658 -0.0411 0.04477 0 1.66025 -0.33717 0 -0.45461 -0.19663 0.35794 -1.62297 MET_53 -5.69928 0.38736 3.30001 -0.34067 0.11792 0.07962 0.78952 -1.57829 -0.01948 -0.1036 0.00194 0.01122 0 0 0 0 0 0.01794 -0.02755 0.02933 1.31948 0 -0.10384 0 0.60916 0.16883 0.26966 -0.77072 ASN_54 -3.49325 0.31092 3.85584 -0.27906 0.08869 0.45471 2.11545 -1.77701 -0.01447 -0.12211 -2.05179 -0.82712 0 0 -0.86259 0 0 0.02488 -0.02776 0.02233 0 2.08794 -0.10984 0 -0.93687 0.29514 0.26418 -0.98178 ALA_55 -2.62033 0.22187 2.01168 -0.02481 0.00023 0 0.77519 -1.28199 -0.00242 -0.00671 0.01328 -0.37664 0 0 0 0 0 0.01167 -0.08972 0 0 0 -0.29944 0 1.8394 -0.27064 0.28866 0.18928 ASP_56 -2.65461 0.22189 3.22336 -0.12193 0.02258 0.38044 1.28266 -1.55222 -0.00329 -0.05022 -1.19158 -0.22477 0 0 -0.86259 0 0 0.0114 -0.07373 0.00685 0 2.38214 -0.34835 0 -2.3716 -0.70875 0.25352 -2.37878 THR_57 -4.36248 0.40429 3.67485 -0.17196 0.07708 0.06331 2.32241 -2.04374 -0.01447 -0.12211 -2.87049 0.24472 0 0 0 0 0 0.02654 0.10615 0.0941 0.04083 0 0.07061 2.27281 -1.0874 -0.56769 0.27628 -1.56635 ASP_58 -5.08416 0.3314 6.5781 -0.24457 0.08276 0.87512 3.06524 -2.92371 -0.02566 -0.16141 -3.23291 -1.22371 0 0 -0.56488 0 0 0.06062 -0.01314 0.00831 0 1.83424 -0.11795 0 -2.3716 0.02804 0.29836 -2.80152 TYR_59 -4.82814 0.24441 4.41161 -0.96861 0.09274 0.36226 2.00906 -2.30345 -0 -0 -1.31514 -0.26206 0 0 0 -0.70568 0 0.01659 0.00459 0.04753 0 1.77421 -0.4149 0.00773 1.2797 0.24261 0.22722 -0.0777 SER_60 -3.41446 0.12002 4.16314 -0.02389 0 0.02216 1.41302 -2.02678 -0 -0 -1.43343 -0.39022 0 0 0 0 0 0.02668 0.06301 1e-05 0.51562 0 0.29089 0.6003 -0.77834 0.02005 0.20005 -0.63215 ILE_61 -5.65022 0.31329 5.05272 -0.50149 0.4388 0.10178 3.01814 -2.81807 -0 -0 -2.85188 -0.03183 0 0 -0.56488 0 0 0.01995 -0.06816 0.03051 0.48937 0 -0.47108 0 0.73287 -0.00113 0.33482 -2.42648 ALA_62 -4.45603 0.18662 3.97123 -0.022 0 0 2.45224 -2.48573 -0.02566 -0.16141 -2.04385 -0.35332 0 0 0 0 0 0.00997 -0.03274 0 0 0 -0.22653 0 1.8394 -0.14322 0.33956 -1.15148 GLU_63 -6.00456 0.23369 7.53315 -0.33418 0.06146 0.36923 3.38556 -3.41988 -0.02998 -0.17549 -4.20107 -0.62712 0 0 0 -0.8825 0 0.0116 0.03091 0.05306 0 3.70119 -0.13001 0 -2.7348 -0.32929 0.2853 -3.20374 ALA_64 -4.76994 0.28961 5.00548 -0.02208 0 0 2.79287 -2.70764 -0 -0 -2.49167 -0.35491 0 0 0 0 0 0.00523 -0.03084 0 0 0 -0.20573 0 1.8394 -0.31192 0.27102 -0.69113 ALA_65 -5.9926 0.42425 5.19521 -0.02156 0 0 3.27397 -3.18314 -0.01963 -0.12039 -3.58314 -0.36805 0 0 0 0 0 0.00536 0.01177 0 0 0 -0.28285 0 1.8394 -0.42168 0.29517 -2.94791 PHE_66 -8.89566 0.93369 3.77692 -0.80542 0.03104 0.25341 2.30145 -2.96953 -0 -0 -1.8532 -0.04296 0 0 0 0 0 0.00304 -0.00737 0.23466 0 2.02914 -0.19152 0 1.0402 -0.19913 0.38815 -3.97312 ASN_67 -6.42659 0.58832 5.48829 -0.19458 0.09771 0.30152 2.58296 -2.84015 -0.01017 -0.0451 -1.20799 -0.27675 0 0 0 0 0 0.01575 0.02947 0.00909 0 1.47157 0.08133 0 -0.93687 -0.00565 0.42628 -0.85156 LYS_68 -3.65524 0.21927 4.004 -0.32626 0.04279 0.17885 1.27944 -1.7696 -0 -0 -1.47164 -0.15767 0 0 0 0 0 0.02273 -0.07199 0.02949 1.76153 0 -0.08671 0 -1.5107 -0.33733 0.34976 -1.49927 GLY_69 -1.93791 0.09957 2.62443 -5e-05 0 0 1.01329 -1.29737 -0 -0 -0.87253 -0.37562 0 0 0 0 0 0.01935 -0.17287 0 0 0 -1.35538 0 0.83697 -0.70131 0.35869 -1.76074 GLU_70 -3.33106 0.20131 3.47758 -0.21174 0.03224 0.3045 1.20901 -1.59836 -0 -0 -1.49303 -0.60436 0 0 0 0 0 0.0172 0.08368 0.02673 0 3.09922 -0.2658 0 -2.7348 -0.54482 0.33549 -1.997 THR_71 -4.75319 0.57173 3.30357 -0.2273 0.24391 0.10626 1.92772 -2.15656 -0.01963 -0.12039 -1.04188 -1.41854 0 0 -1.17177 0 0 0.00959 0.0029 0.26158 1.51099 0 -0.19681 2.78208 -1.0874 -0.07654 0.47344 -1.07624 ALA_72 -1.20114 0.0442 0.78792 -0.02631 0.00246 0 0.13135 -0.48573 -0 -0 0.08266 -0.42667 0 0 0 0 0 0.00896 -0.057 0 0 0 0.01437 0 1.8394 -0.24561 0.42083 0.88968 MET_73 -3.94436 0.35415 2.03619 -0.27407 0.05745 0.05901 1.18531 -1.30212 -0 -0 -1.47889 -0.02589 0 0 -1.17177 0 0 0.00429 0.05048 0.06434 2.22104 0 -0.13205 0 0.60916 -0.14406 0.29083 -1.54096 THR_74 -3.56564 0.3774 1.37042 -0.22971 0.21083 0.09115 0.2036 -0.97161 -0.00733 -0.0244 -0.00442 -1.27464 0 0 0 0 0 0.00527 -0.00662 0.03041 0.55319 0 0.03001 2.29347 -1.0874 0.15597 0.38606 -1.46402 ILE_75 -3.19697 0.20579 0.22907 -0.46463 0.31244 0.09893 0.35718 -0.68727 -0 -0 -0.01861 -0.03023 0 0 0 0 0 0.01045 -0.05258 0.03143 0.4054 0 -0.76808 0 0.73287 -0.26467 0.28206 -2.81739 ASN_76 -3.53947 0.45482 2.19253 -0.16293 0.01172 0.21887 1.16121 -1.36574 -0.00733 -0.0244 -0.82305 -0.90271 0 0 -0.99804 -0.70568 0 0.02587 0.0307 0.00902 0 1.83429 -0.20111 0 -0.93687 -0.26643 0.27565 -3.71908 GLY_77 -2.38155 0.40964 2.78763 -0.00069 0 0 1.63054 -1.40317 -0 -0 -1.1865 -0.22951 0 0 -0.99804 0 0 0.07969 -0.15024 0 0 0 -0.28441 0 0.83697 0.23475 0.68803 0.03314 PRO_78 -3.60563 0.69889 1.73818 -0.06859 0 0.04258 1.03275 -1.05299 -0.03177 -0.1621 -0.55366 0.61544 0 0 0 0 0 0.037 -0.07546 0.0077 0.18328 0 -0.47817 0 -2.4119 0.3337 0.73971 -3.01102 TRP_79 -2.12436 0.25217 2.31007 -1.23324 0.04487 0.64996 0.81038 -1.16125 -0.00415 -0.0414 0.25487 -0.32603 0 0 0 0 0 0.03435 0.13771 0.00172 0 1.91864 -0.23395 0 1.6906 0.22668 0.32193 3.52957 ALA_80 -4.903 0.46205 3.62892 -0.02768 0.00634 0 2.09416 -2.36771 -0.01981 -0.13039 -2.32039 -0.41633 0 0 0 0 0 0.02982 0.00356 0 0 0 0.01809 0 1.8394 -0.1965 0.46974 -1.82973 TRP_81 -8.32719 0.80138 4.68629 -0.73126 0.25419 0.44263 2.90388 -2.99591 -0 -0 -2.39879 -0.45809 0 0 0 0 0 0.01536 -0.01877 0.14384 0 2.74141 0.07505 0 1.6906 -0.54455 0.67816 -1.04176 SER_82 -3.07513 0.20193 4.19001 -0.0241 0 0.02213 1.62614 -1.93672 -0.03177 -0.1621 -2.02105 -0.37756 0 0 0 0 0 0.02065 -0.05832 3e-05 0.56265 0 0.26682 0.60037 -0.77834 -0.32839 0.37586 -0.92688 ASN_83 -4.71786 0.15341 5.83209 -0.17618 0.02326 0.25945 2.528 -2.67228 -0.00416 -0.04146 -2.19865 -0.26885 0 0 0 -0.8825 0 0.01498 0.00305 0.0449 0 1.50766 0.26146 0 -0.93687 -0.02155 0.14299 -1.14914 ILE_84 -9.03575 1.36672 4.16252 -0.50393 0.46786 0.09742 2.78276 -3.02418 -0 -0 -1.04624 0.10587 0 0 0 0 0 0.02479 -0.00508 0.06994 0.55276 0 -0.47574 0 0.73287 0.09895 0.46249 -3.16597 ASP_85 -3.94054 0.18862 5.48599 -0.10301 0.00275 0.30685 1.9741 -2.49642 -0 -0 -2.88428 -0.42081 0 0 0 -0.59658 0 0.06301 -0.03261 0.00351 0 1.69121 0.16628 0 -2.3716 -0.14753 0.59417 -2.51691 THR_86 -3.08212 0.22746 4.19716 -0.20206 0.12634 0.07238 2.13673 -1.88003 -0 -0 -2.54571 -0.05734 0 0 0 0 0 0.09339 -0.01301 0.00049 0.0621 0 -0.0256 2.28181 -1.0874 -0.07972 0.45612 0.68101 SER_87 -3.42741 0.38834 3.77768 -0.03197 0.03899 0.03112 1.58995 -1.84201 -1e-05 -7e-05 -0.54517 -0.12666 0 0 0 0 0 2.13885 0.11363 0.00696 0.35285 0 0.25295 0.61532 -0.77834 0.86964 0.56306 3.9877 LYS_88 -1.61454 0.17698 2.16587 -0.34629 0.088 0.22484 0.91158 -1.03178 -0 -0 -1.17731 -0.29981 0 0 0 0 0 0.78208 0.11223 0.00771 1.31618 0 -0.06094 0 -1.5107 1.13767 0.73192 1.61369 VAL_89 -5.90535 1.11134 1.80148 -0.28963 0.20738 0.06128 1.46572 -1.93223 -0.00758 -0.11781 -0.51628 0.11426 0 0 0 0 0 1.17017 0.14737 0.07692 0.13039 0 -0.49229 0 1.9342 0.11206 0.73609 -0.19251 ASN_90 -1.476 0.13312 1.0638 -0.25888 0.05484 0.47484 0.16585 -0.64848 -0.02177 -0.24714 0.29136 -0.79953 0 0 0 0 0 0.11522 -0.0706 0.01141 0 2.2928 -0.47606 0 -0.93687 -0.33702 0.58768 -0.08143 TYR_91 -6.08684 0.90223 1.88366 -1.22517 0.25141 0.69339 1.05857 -1.62816 -0.01419 -0.12933 -1.78743 -0.29976 0 0 0 -0.59658 0 0.0519 0.10026 0.31392 0 2.10641 -0.4731 5e-05 1.2797 -0.21055 0.49402 -3.31558 GLY_92 -1.51529 0.16235 0.79107 -0.00121 0 0 0.07531 -0.60857 -0 -0 -0.061 -0.30161 0 0 0 0 0 0.01192 -0.1002 0 0 0 -0.0074 0 0.83697 0.32734 0.32296 -0.06737 VAL_93 -2.53742 0.25981 -0.04454 -0.27042 0.13557 0.0574 0.00264 -0.61258 -0 -0 -0.09831 -0.37467 0 0 0 0 0 0.01191 -0.01956 0 0.19849 0 -0.73174 0 1.9342 0.25775 0.18241 -1.64907 THR_94 -1.70737 0.13319 1.24582 -0.10719 0.07467 0.07198 0.20574 -0.77224 -0 -0 -0.40951 -0.50036 0 0 0 0 0 0.01803 -0.00345 0.00382 0.11923 0 -0.64018 2.27158 -1.0874 -0.39697 0.24068 -1.23992 VAL_95 -2.59472 0.20839 0.9772 -0.266 0.14201 0.05077 0.4298 -0.75193 -0 -0 -0.24123 0.1959 0 0 0 0 0 0.01743 -0.08211 0.00582 0.11373 0 -0.32934 0 1.9342 -0.45269 0.22173 -0.42103 LEU_96 -4.28487 0.76087 1.03871 -0.45757 0.23884 0.0767 0.57144 -0.93383 -0 -0 -0.07828 0.38616 0 0 0 0 0 0.00632 0.10434 0.01714 0.48024 0 0.06125 0 0.18072 -0.44413 0.729 -1.54696 PRO_97 -2.70409 0.40113 2.04508 -0.17322 0.00025 0.11971 0.95417 -0.9057 -0.01149 -0.08025 -1.35623 0.18185 0 0 -0.39509 0 0 0.00827 0.0037 0.0039 0.84475 0 -1.12844 0 -2.4119 -0.48032 0.74872 -4.33521 THR_98 -3.66913 0.50937 1.97921 -0.11243 0.05266 0.07362 0.4331 -1.21704 -0.01626 -0.09498 -0.81742 -0.64924 0 0 0 0 0 0.00635 0.01366 0.01534 0.0416 0 -0.40848 2.43621 -1.0874 -0.53689 0.33499 -2.7132 PHE_99 -8.15734 0.98499 3.35654 -0.77661 0.07167 0.09974 2.2005 -2.44503 -0 -0 -1.6369 -0.48456 0 0 0 0 0 0.00353 0.06845 0.04832 0 2.47556 -0.25997 0 1.0402 -0.0193 0.35105 -3.07916 LYS_100 -3.664 0.32474 4.10832 -0.36077 0.08701 0.22837 1.39905 -1.65215 -0.01806 -0.09701 -2.18106 -0.35368 0 0 0 -0.63348 0 0.01229 -0.08784 0.05745 1.51314 0 -0.09915 0 -1.5107 0.09985 0.56276 -2.26493 GLY_101 -2.2226 0.2612 1.97645 -6e-05 0 0 0.16444 -1.02895 -0.01626 -0.09498 0.1289 -0.39685 0 0 0 0 0 0.00989 -0.15494 0 0 0 -1.44981 0 0.83697 -0.6148 0.55336 -2.04802 GLN_102 -5.45591 0.846 5.88381 -0.6683 0.17489 0.68812 3.05411 -2.74781 -0.03769 -0.26223 -3.25851 -0.7228 0 0 0 0 0 0.01671 0.00802 0.01545 0 2.50117 0.0921 0 -0.18838 -0.53251 0.9416 0.34784 PRO_103 -3.54835 0.52483 2.21584 -0.12731 0.0007 0.09455 0.94509 -1.10053 -0.01964 -0.11007 -1.06552 0.23763 0 0 0 0 0 0.00819 0.1225 0.02547 0.191 0 -1.13701 0 -2.4119 -0.43594 1.06829 -4.52219 SER_104 -4.6456 0.65927 3.18441 -0.03151 0 0.02038 1.13918 -1.56285 -0 -0 -1.5623 -0.15387 0 0 -0.39509 0 0 0.01672 0.02284 0.15898 0.497 0 -0.09593 1.88009 -0.77834 -0.65218 0.57513 -1.72367 LYS_105 -5.43801 0.80561 4.6139 -0.33916 0.06092 0.21348 1.79383 -2.24314 -0.05283 -0.19835 -1.37363 -0.34475 0 0 0 0 0 0.005 0.04203 0.03208 2.00329 0 0.12241 0 -1.5107 -0.18423 0.99221 -1.00004 PRO_106 -3.94778 0.55613 1.41938 -0.19764 0.00386 0.13844 0.17763 -0.74593 -0 -0 -0.20351 0.10121 0 0 0 0 0 0.0175 0.06372 0.01145 0.394 0 -0.94164 0 -2.4119 -0.02002 0.84908 -4.73601 PHE_107 -5.21929 0.62743 1.03912 -0.4976 0.02127 0.20034 0.19106 -1.19326 -0.00539 -0.02152 -0.43734 0.08803 0 0 0 0 0 0.0351 -0.01488 0.00021 0 2.51341 -0.00823 0 1.0402 -0.35932 0.47968 -1.52099 VAL_108 -2.90492 0.36226 0.52617 -0.27008 0.17546 0.05518 0.30379 -0.93313 -0 -0 0.14539 -0.23214 0 0 0 0 0 0.01896 -0.05258 0.00658 0.28745 0 -0.79319 0 1.9342 -0.46914 0.39942 -1.44031 GLY_109 -1.64514 0.12528 1.90932 -0.00022 0 0 1.01868 -1.01876 -0.00532 -0.02025 -0.71251 -0.17342 0 0 0 0 0 0.00715 -0.06024 0 0 0 -1.16742 0 0.83697 -0.1312 0.34528 -0.6918 VAL_110 -1.63394 0.24283 0.73465 -0.37537 0.33424 0.092 0.35773 -0.58568 -0 -0 0.61585 -0.17935 0 0 0 0 0 0.00367 -0.12917 0.00413 0.64792 0 0.38451 0 1.9342 -0.00749 0.47711 2.91785 LEU_111 -1.99098 0.31059 1.31342 -0.51675 0.23105 0.14979 0.33308 -0.82634 -0 -0 -0.02659 0.11023 0 0 0 0 0 0.00588 -0.07717 0.0744 0.08473 0 -0.12162 0 0.18072 -0.37845 0.34335 -0.80064 SER_112 -2.39426 0.43997 2.28465 -0.01416 0 0.02805 1.23679 -1.28811 -0 -0 -1.68897 -0.89812 0 0 -0.07632 0 0 0.02207 0.05645 0.00014 0.14003 0 0.36064 0.60082 -0.77834 0.82048 0.2412 -0.90699 ALA_113 -1.53531 0.07465 0.65382 -0.02067 0 0 0.5677 -0.61675 -0 -0 -0.44864 -0.41043 0 0 -0.07632 0 0 0.4177 0.02219 0 0 0 -0.53993 0 1.8394 1.14491 0.20033 1.27266 GLY_114 -0.95423 0.07365 0.86484 -0.00027 0 0 0.16372 -0.4864 -0.012 -0.03996 -0.08469 -0.16006 0 0 0 0 0 0.59788 -0.12034 0 0 0 -0.99201 0 0.83697 0.06858 0.131 -0.11332 ILE_115 -1.29961 0.10035 1.04509 -0.47101 0.34282 0.10329 0.00038 -0.58021 -0 -0 0.08924 -0.0092 0 0 0 0 0 0.06406 -0.0526 0.00667 0.37965 0 -0.77231 0 0.73287 -0.23271 0.14453 -0.40869 ASN:CtermProteinFull_116 -2.12864 0.1472 1.03924 -0.21206 0.01013 0.40746 0.00038 -0.76562 -0.012 -0.03996 -0.28628 -0.63408 0 0 0 0 0 0.02314 0 0.00259 0 2.29675 0 0 -0.93687 -0.2569 0.13394 -1.21161 VRT_117 0 0 0 0 0 0 0 -0 -0 -0 0 0 0 0 0 0 0 7.80522 0 0 0 0 0 0 0 0 0 7.80522 #END_POSE_ENERGIES_TABLE model04_0001.pdb ENDMDL REMARK ID 96494 DOMAINID 91535 MODEL 4 2021-07-17_00000178_2_11 MODEL 4 REMARK Rerank model02.pdb to model04.pdb score: 227.908 tmscore: 0.94006 6wbjA_201 prob: 99.85 ident: 25.69 ATOM 1 N GLN A 1 -9.056 1.021 -4.294 1.00 0.910 N ATOM 2 CA GLN A 1 -8.961 1.478 -5.682 1.00 0.550 C ATOM 3 C GLN A 1 -7.535 1.908 -6.028 1.00 0.390 C ATOM 4 O GLN A 1 -6.845 1.226 -6.783 1.00 0.370 O ATOM 5 CB GLN A 1 -9.958 2.613 -5.970 1.00 0.910 C ATOM 6 CG GLN A 1 -11.422 2.180 -5.926 1.00 0.910 C ATOM 7 CD GLN A 1 -11.747 1.150 -6.962 1.00 0.910 C ATOM 8 OE1 GLN A 1 -11.566 1.368 -8.162 1.00 0.910 O ATOM 9 NE2 GLN A 1 -12.201 -0.001 -6.506 1.00 0.910 N ATOM 10 1H GLN A 1 -10.011 1.075 -3.929 1.00 1.090 H ATOM 11 2H GLN A 1 -8.761 0.055 -4.266 1.00 1.090 H ATOM 12 3H GLN A 1 -8.430 1.562 -3.710 1.00 1.090 H ATOM 13 HA GLN A 1 -9.211 0.640 -6.332 1.00 0.660 H ATOM 14 1HB GLN A 1 -9.842 3.411 -5.234 1.00 1.100 H ATOM 15 2HB GLN A 1 -9.758 3.039 -6.952 1.00 1.100 H ATOM 16 1HG GLN A 1 -11.651 1.754 -4.966 1.00 1.100 H ATOM 17 2HG GLN A 1 -12.054 3.052 -6.105 1.00 1.100 H ATOM 18 1HE2 GLN A 1 -12.429 -0.749 -7.137 1.00 1.100 H ATOM 19 2HE2 GLN A 1 -12.317 -0.146 -5.514 1.00 1.100 H ATOM 20 N GLU A 2 -7.104 3.054 -5.505 1.00 0.390 N ATOM 21 CA GLU A 2 -5.766 3.567 -5.791 1.00 0.320 C ATOM 22 C GLU A 2 -4.633 2.605 -5.340 1.00 0.250 C ATOM 23 O GLU A 2 -4.607 2.251 -4.155 1.00 0.250 O ATOM 24 CB GLU A 2 -5.592 4.913 -5.081 1.00 0.480 C ATOM 25 CG GLU A 2 -4.274 5.614 -5.346 1.00 0.480 C ATOM 26 CD GLU A 2 -4.157 6.917 -4.635 1.00 0.480 C ATOM 27 OE1 GLU A 2 -5.075 7.283 -3.945 1.00 0.480 O ATOM 28 OE2 GLU A 2 -3.142 7.549 -4.776 1.00 0.480 O ATOM 29 H GLU A 2 -7.704 3.600 -4.903 1.00 0.470 H ATOM 30 HA GLU A 2 -5.729 3.765 -6.852 1.00 0.380 H ATOM 31 1HB GLU A 2 -6.390 5.588 -5.392 1.00 0.570 H ATOM 32 2HB GLU A 2 -5.689 4.775 -4.013 1.00 0.570 H ATOM 33 1HG GLU A 2 -3.468 4.983 -5.020 1.00 0.570 H ATOM 34 2HG GLU A 2 -4.166 5.779 -6.415 1.00 0.570 H ATOM 35 N PRO A 3 -3.658 2.244 -6.232 1.00 0.230 N ATOM 36 CA PRO A 3 -2.507 1.358 -6.001 1.00 0.210 C ATOM 37 C PRO A 3 -1.689 1.696 -4.765 1.00 0.190 C ATOM 38 O PRO A 3 -1.145 0.807 -4.107 1.00 0.210 O ATOM 39 CB PRO A 3 -1.671 1.569 -7.269 1.00 0.320 C ATOM 40 CG PRO A 3 -2.683 1.879 -8.334 1.00 0.320 C ATOM 41 CD PRO A 3 -3.741 2.712 -7.647 1.00 0.320 C ATOM 42 HA PRO A 3 -2.869 0.320 -5.944 1.00 0.250 H ATOM 43 1HB PRO A 3 -0.944 2.381 -7.117 1.00 0.380 H ATOM 44 2HB PRO A 3 -1.092 0.660 -7.490 1.00 0.380 H ATOM 45 1HG PRO A 3 -2.202 2.410 -9.172 1.00 0.380 H ATOM 46 2HG PRO A 3 -3.092 0.944 -8.747 1.00 0.380 H ATOM 47 1HD PRO A 3 -3.524 3.787 -7.737 1.00 0.380 H ATOM 48 2HD PRO A 3 -4.705 2.421 -8.104 1.00 0.380 H ATOM 49 N TYR A 4 -1.603 2.980 -4.423 1.00 0.180 N ATOM 50 CA TYR A 4 -0.869 3.411 -3.244 1.00 0.210 C ATOM 51 C TYR A 4 -1.189 2.558 -2.020 1.00 0.160 C ATOM 52 O TYR A 4 -0.320 2.299 -1.187 1.00 0.230 O ATOM 53 CB TYR A 4 -1.130 4.880 -2.894 1.00 0.280 C ATOM 54 CG TYR A 4 -0.293 5.304 -1.687 1.00 0.280 C ATOM 55 CD1 TYR A 4 1.031 5.667 -1.869 1.00 0.280 C ATOM 56 CD2 TYR A 4 -0.826 5.284 -0.407 1.00 0.280 C ATOM 57 CE1 TYR A 4 1.811 5.990 -0.779 1.00 0.280 C ATOM 58 CE2 TYR A 4 -0.037 5.606 0.684 1.00 0.280 C ATOM 59 CZ TYR A 4 1.296 5.945 0.489 1.00 0.280 C ATOM 60 OH TYR A 4 2.129 6.242 1.561 1.00 0.280 O ATOM 61 H TYR A 4 -2.016 3.703 -4.999 1.00 0.220 H ATOM 62 HA TYR A 4 0.194 3.295 -3.449 1.00 0.250 H ATOM 63 1HB TYR A 4 -0.886 5.523 -3.740 1.00 0.340 H ATOM 64 2HB TYR A 4 -2.184 5.026 -2.656 1.00 0.340 H ATOM 65 HD1 TYR A 4 1.460 5.689 -2.870 1.00 0.340 H ATOM 66 HD2 TYR A 4 -1.851 4.996 -0.262 1.00 0.340 H ATOM 67 HE1 TYR A 4 2.844 6.275 -0.909 1.00 0.340 H ATOM 68 HE2 TYR A 4 -0.454 5.572 1.689 1.00 0.340 H ATOM 69 HH TYR A 4 3.084 6.145 1.281 1.00 0.340 H ATOM 70 N PHE A 5 -2.460 2.166 -1.870 1.00 0.120 N ATOM 71 CA PHE A 5 -2.897 1.476 -0.676 1.00 0.110 C ATOM 72 C PHE A 5 -2.918 -0.051 -0.810 1.00 0.100 C ATOM 73 O PHE A 5 -3.430 -0.732 0.080 1.00 0.290 O ATOM 74 CB PHE A 5 -4.299 1.970 -0.330 1.00 0.160 C ATOM 75 CG PHE A 5 -4.350 3.453 -0.033 1.00 0.160 C ATOM 76 CD1 PHE A 5 -4.695 4.337 -1.048 1.00 0.160 C ATOM 77 CD2 PHE A 5 -4.067 3.973 1.229 1.00 0.160 C ATOM 78 CE1 PHE A 5 -4.752 5.694 -0.826 1.00 0.160 C ATOM 79 CE2 PHE A 5 -4.128 5.347 1.452 1.00 0.160 C ATOM 80 CZ PHE A 5 -4.471 6.201 0.420 1.00 0.160 C ATOM 81 H PHE A 5 -3.160 2.349 -2.599 1.00 0.140 H ATOM 82 HA PHE A 5 -2.218 1.739 0.134 1.00 0.130 H ATOM 83 1HB PHE A 5 -4.968 1.764 -1.168 1.00 0.190 H ATOM 84 2HB PHE A 5 -4.677 1.432 0.538 1.00 0.190 H ATOM 85 HD1 PHE A 5 -4.917 3.944 -2.039 1.00 0.190 H ATOM 86 HD2 PHE A 5 -3.800 3.296 2.044 1.00 0.190 H ATOM 87 HE1 PHE A 5 -5.022 6.369 -1.647 1.00 0.190 H ATOM 88 HE2 PHE A 5 -3.907 5.752 2.428 1.00 0.190 H ATOM 89 HZ PHE A 5 -4.520 7.273 0.585 1.00 0.190 H ATOM 90 N THR A 6 -2.377 -0.603 -1.910 1.00 0.140 N ATOM 91 CA THR A 6 -2.325 -2.051 -2.081 1.00 0.100 C ATOM 92 C THR A 6 -0.856 -2.366 -2.122 1.00 0.100 C ATOM 93 O THR A 6 -0.387 -3.438 -1.695 1.00 0.090 O ATOM 94 CB THR A 6 -2.970 -2.507 -3.405 1.00 0.160 C ATOM 95 OG1 THR A 6 -2.233 -1.977 -4.508 1.00 0.160 O ATOM 96 CG2 THR A 6 -4.386 -1.990 -3.477 1.00 0.160 C ATOM 97 H THR A 6 -1.945 -0.027 -2.637 1.00 0.170 H ATOM 98 HA THR A 6 -2.785 -2.558 -1.233 1.00 0.120 H ATOM 99 HB THR A 6 -2.961 -3.577 -3.462 1.00 0.190 H ATOM 100 HG1 THR A 6 -2.549 -2.376 -5.325 1.00 0.190 H ATOM 101 1HG2 THR A 6 -4.842 -2.307 -4.413 1.00 0.190 H ATOM 102 2HG2 THR A 6 -4.957 -2.386 -2.639 1.00 0.190 H ATOM 103 3HG2 THR A 6 -4.382 -0.898 -3.432 1.00 0.190 H ATOM 104 N TRP A 7 -0.121 -1.329 -2.497 1.00 0.110 N ATOM 105 CA TRP A 7 1.305 -1.405 -2.660 1.00 0.120 C ATOM 106 C TRP A 7 2.051 -2.005 -1.484 1.00 0.130 C ATOM 107 O TRP A 7 2.923 -2.844 -1.701 1.00 0.160 O ATOM 108 CB TRP A 7 1.913 -0.058 -3.019 1.00 0.160 C ATOM 109 CG TRP A 7 3.334 -0.188 -3.185 1.00 0.160 C ATOM 110 CD1 TRP A 7 4.315 0.242 -2.359 1.00 0.160 C ATOM 111 CD2 TRP A 7 3.976 -0.853 -4.269 1.00 0.160 C ATOM 112 NE1 TRP A 7 5.522 -0.091 -2.864 1.00 0.160 N ATOM 113 CE2 TRP A 7 5.332 -0.774 -4.041 1.00 0.160 C ATOM 114 CE3 TRP A 7 3.507 -1.509 -5.405 1.00 0.160 C ATOM 115 CZ2 TRP A 7 6.236 -1.328 -4.898 1.00 0.160 C ATOM 116 CZ3 TRP A 7 4.409 -2.063 -6.259 1.00 0.160 C ATOM 117 CH2 TRP A 7 5.727 -1.982 -6.018 1.00 0.160 C ATOM 118 H TRP A 7 -0.621 -0.497 -2.844 1.00 0.130 H ATOM 119 HA TRP A 7 1.491 -2.047 -3.506 1.00 0.140 H ATOM 120 1HB TRP A 7 1.485 0.291 -3.957 1.00 0.200 H ATOM 121 2HB TRP A 7 1.712 0.697 -2.281 1.00 0.200 H ATOM 122 HD1 TRP A 7 4.157 0.769 -1.438 1.00 0.200 H ATOM 123 HE1 TRP A 7 6.410 0.122 -2.421 1.00 0.200 H ATOM 124 HE3 TRP A 7 2.441 -1.582 -5.609 1.00 0.200 H ATOM 125 HZ2 TRP A 7 7.298 -1.270 -4.713 1.00 0.200 H ATOM 126 HZ3 TRP A 7 4.037 -2.579 -7.143 1.00 0.200 H ATOM 127 HH2 TRP A 7 6.383 -2.445 -6.721 1.00 0.200 H ATOM 128 N PRO A 8 1.802 -1.625 -0.213 1.00 0.130 N ATOM 129 CA PRO A 8 2.540 -2.157 0.904 1.00 0.170 C ATOM 130 C PRO A 8 2.619 -3.696 0.896 1.00 0.170 C ATOM 131 O PRO A 8 3.660 -4.252 1.274 1.00 0.220 O ATOM 132 CB PRO A 8 1.710 -1.645 2.091 1.00 0.260 C ATOM 133 CG PRO A 8 1.088 -0.366 1.604 1.00 0.260 C ATOM 134 CD PRO A 8 0.740 -0.647 0.181 1.00 0.260 C ATOM 135 HA PRO A 8 3.542 -1.719 0.893 1.00 0.200 H ATOM 136 1HB PRO A 8 0.979 -2.405 2.413 1.00 0.310 H ATOM 137 2HB PRO A 8 2.366 -1.442 2.929 1.00 0.310 H ATOM 138 1HG PRO A 8 0.197 -0.130 2.207 1.00 0.310 H ATOM 139 2HG PRO A 8 1.757 0.469 1.716 1.00 0.310 H ATOM 140 1HD PRO A 8 -0.252 -1.099 0.175 1.00 0.310 H ATOM 141 2HD PRO A 8 0.779 0.269 -0.382 1.00 0.310 H ATOM 142 N LEU A 9 1.534 -4.384 0.457 1.00 0.140 N ATOM 143 CA LEU A 9 1.521 -5.849 0.416 1.00 0.160 C ATOM 144 C LEU A 9 2.328 -6.399 -0.731 1.00 0.170 C ATOM 145 O LEU A 9 3.000 -7.423 -0.619 1.00 0.270 O ATOM 146 CB LEU A 9 0.085 -6.394 0.303 1.00 0.220 C ATOM 147 CG LEU A 9 -0.666 -6.761 1.620 1.00 0.220 C ATOM 148 CD1 LEU A 9 0.019 -7.980 2.281 1.00 0.220 C ATOM 149 CD2 LEU A 9 -0.699 -5.546 2.569 1.00 0.220 C ATOM 150 H LEU A 9 0.700 -3.910 0.103 1.00 0.170 H ATOM 151 HA LEU A 9 1.979 -6.205 1.332 1.00 0.190 H ATOM 152 1HB LEU A 9 -0.515 -5.644 -0.213 1.00 0.260 H ATOM 153 2HB LEU A 9 0.106 -7.289 -0.325 1.00 0.260 H ATOM 154 HG LEU A 9 -1.679 -7.050 1.375 1.00 0.260 H ATOM 155 1HD1 LEU A 9 -0.518 -8.257 3.187 1.00 0.260 H ATOM 156 2HD1 LEU A 9 0.016 -8.824 1.588 1.00 0.260 H ATOM 157 3HD1 LEU A 9 1.036 -7.743 2.544 1.00 0.260 H ATOM 158 1HD2 LEU A 9 -1.241 -5.812 3.478 1.00 0.260 H ATOM 159 2HD2 LEU A 9 0.316 -5.247 2.838 1.00 0.260 H ATOM 160 3HD2 LEU A 9 -1.203 -4.711 2.079 1.00 0.260 H ATOM 161 N ILE A 10 2.247 -5.708 -1.849 1.00 0.110 N ATOM 162 CA ILE A 10 2.911 -6.110 -3.081 1.00 0.110 C ATOM 163 C ILE A 10 4.426 -6.057 -2.853 1.00 0.110 C ATOM 164 O ILE A 10 5.175 -6.998 -3.168 1.00 0.170 O ATOM 165 CB ILE A 10 2.459 -5.148 -4.199 1.00 0.150 C ATOM 166 CG1 ILE A 10 0.932 -5.379 -4.442 1.00 0.150 C ATOM 167 CG2 ILE A 10 3.254 -5.367 -5.471 1.00 0.150 C ATOM 168 CD1 ILE A 10 0.241 -4.326 -5.277 1.00 0.150 C ATOM 169 H ILE A 10 1.659 -4.865 -1.830 1.00 0.130 H ATOM 170 HA ILE A 10 2.625 -7.122 -3.339 1.00 0.130 H ATOM 171 HB ILE A 10 2.599 -4.126 -3.869 1.00 0.180 H ATOM 172 1HG1 ILE A 10 0.804 -6.341 -4.915 1.00 0.180 H ATOM 173 2HG1 ILE A 10 0.425 -5.408 -3.477 1.00 0.180 H ATOM 174 1HG2 ILE A 10 2.925 -4.686 -6.240 1.00 0.180 H ATOM 175 2HG2 ILE A 10 4.314 -5.203 -5.287 1.00 0.180 H ATOM 176 3HG2 ILE A 10 3.086 -6.374 -5.799 1.00 0.180 H ATOM 177 1HD1 ILE A 10 -0.809 -4.579 -5.364 1.00 0.180 H ATOM 178 2HD1 ILE A 10 0.322 -3.365 -4.806 1.00 0.180 H ATOM 179 3HD1 ILE A 10 0.680 -4.277 -6.264 1.00 0.180 H ATOM 180 N ALA A 11 4.842 -4.930 -2.291 1.00 0.080 N ATOM 181 CA ALA A 11 6.210 -4.622 -1.925 1.00 0.100 C ATOM 182 C ALA A 11 6.796 -5.552 -0.847 1.00 0.110 C ATOM 183 O ALA A 11 7.978 -5.908 -0.894 1.00 0.110 O ATOM 184 CB ALA A 11 6.251 -3.208 -1.451 1.00 0.130 C ATOM 185 H ALA A 11 4.135 -4.211 -2.106 1.00 0.100 H ATOM 186 HA ALA A 11 6.820 -4.713 -2.819 1.00 0.120 H ATOM 187 1HB ALA A 11 7.269 -2.916 -1.227 1.00 0.160 H ATOM 188 2HB ALA A 11 5.868 -2.603 -2.212 1.00 0.160 H ATOM 189 3HB ALA A 11 5.627 -3.104 -0.567 1.00 0.160 H ATOM 190 N ALA A 12 5.969 -5.993 0.105 1.00 0.140 N ATOM 191 CA ALA A 12 6.422 -6.810 1.231 1.00 0.160 C ATOM 192 C ALA A 12 7.185 -8.067 0.835 1.00 0.160 C ATOM 193 O ALA A 12 8.157 -8.431 1.492 1.00 0.210 O ATOM 194 CB ALA A 12 5.227 -7.258 2.049 1.00 0.220 C ATOM 195 H ALA A 12 5.020 -5.620 0.135 1.00 0.170 H ATOM 196 HA ALA A 12 7.067 -6.186 1.851 1.00 0.190 H ATOM 197 1HB ALA A 12 5.574 -7.823 2.920 1.00 0.260 H ATOM 198 2HB ALA A 12 4.676 -6.410 2.365 1.00 0.260 H ATOM 199 3HB ALA A 12 4.584 -7.885 1.436 1.00 0.260 H ATOM 200 N ASP A 13 6.803 -8.720 -0.259 1.00 0.130 N ATOM 201 CA ASP A 13 7.485 -9.951 -0.642 1.00 0.140 C ATOM 202 C ASP A 13 8.451 -9.773 -1.809 1.00 0.120 C ATOM 203 O ASP A 13 8.875 -10.762 -2.407 1.00 0.130 O ATOM 204 CB ASP A 13 6.456 -11.041 -0.973 1.00 0.190 C ATOM 205 CG ASP A 13 7.005 -12.507 -0.981 1.00 0.190 C ATOM 206 OD1 ASP A 13 7.884 -12.810 -0.222 1.00 0.190 O ATOM 207 OD2 ASP A 13 6.472 -13.325 -1.724 1.00 0.190 O ATOM 208 H ASP A 13 6.026 -8.385 -0.820 1.00 0.160 H ATOM 209 HA ASP A 13 8.064 -10.299 0.214 1.00 0.170 H ATOM 210 1HB ASP A 13 5.675 -10.996 -0.237 1.00 0.230 H ATOM 211 2HB ASP A 13 5.992 -10.821 -1.928 1.00 0.230 H ATOM 212 N GLY A 14 8.848 -8.535 -2.123 1.00 0.110 N ATOM 213 CA GLY A 14 9.803 -8.337 -3.205 1.00 0.100 C ATOM 214 C GLY A 14 9.334 -7.507 -4.398 1.00 0.090 C ATOM 215 O GLY A 14 10.124 -7.291 -5.318 1.00 0.100 O ATOM 216 H GLY A 14 8.511 -7.707 -1.614 1.00 0.130 H ATOM 217 1HA GLY A 14 10.690 -7.863 -2.786 1.00 0.120 H ATOM 218 2HA GLY A 14 10.134 -9.308 -3.568 1.00 0.120 H ATOM 219 N GLY A 15 8.081 -7.042 -4.434 1.00 0.080 N ATOM 220 CA GLY A 15 7.694 -6.202 -5.555 1.00 0.090 C ATOM 221 C GLY A 15 8.418 -4.863 -5.432 1.00 0.100 C ATOM 222 O GLY A 15 8.782 -4.450 -4.330 1.00 0.110 O ATOM 223 H GLY A 15 7.372 -7.242 -3.722 1.00 0.100 H ATOM 224 1HA GLY A 15 7.949 -6.683 -6.501 1.00 0.110 H ATOM 225 2HA GLY A 15 6.618 -6.043 -5.536 1.00 0.110 H ATOM 226 N TYR A 16 8.619 -4.186 -6.553 1.00 0.130 N ATOM 227 CA TYR A 16 9.261 -2.875 -6.577 1.00 0.140 C ATOM 228 C TYR A 16 8.746 -2.099 -7.767 1.00 0.130 C ATOM 229 O TYR A 16 8.179 -2.690 -8.683 1.00 0.130 O ATOM 230 CB TYR A 16 10.795 -3.000 -6.582 1.00 0.190 C ATOM 231 CG TYR A 16 11.424 -3.743 -7.771 1.00 0.190 C ATOM 232 CD1 TYR A 16 11.831 -3.071 -8.921 1.00 0.190 C ATOM 233 CD2 TYR A 16 11.612 -5.111 -7.680 1.00 0.190 C ATOM 234 CE1 TYR A 16 12.427 -3.775 -9.978 1.00 0.190 C ATOM 235 CE2 TYR A 16 12.196 -5.805 -8.714 1.00 0.190 C ATOM 236 CZ TYR A 16 12.607 -5.151 -9.863 1.00 0.190 C ATOM 237 OH TYR A 16 13.197 -5.895 -10.880 1.00 0.190 O ATOM 238 H TYR A 16 8.307 -4.597 -7.422 1.00 0.160 H ATOM 239 HA TYR A 16 8.983 -2.335 -5.678 1.00 0.170 H ATOM 240 1HB TYR A 16 11.230 -2.000 -6.552 1.00 0.230 H ATOM 241 2HB TYR A 16 11.107 -3.510 -5.670 1.00 0.230 H ATOM 242 HD1 TYR A 16 11.685 -2.006 -8.991 1.00 0.230 H ATOM 243 HD2 TYR A 16 11.299 -5.642 -6.781 1.00 0.230 H ATOM 244 HE1 TYR A 16 12.746 -3.256 -10.883 1.00 0.230 H ATOM 245 HE2 TYR A 16 12.338 -6.880 -8.625 1.00 0.230 H ATOM 246 HH TYR A 16 13.400 -5.329 -11.676 1.00 0.230 H ATOM 247 N ALA A 17 8.895 -0.775 -7.761 1.00 0.140 N ATOM 248 CA ALA A 17 8.453 -0.051 -8.942 1.00 0.140 C ATOM 249 C ALA A 17 9.539 -0.106 -9.993 1.00 0.140 C ATOM 250 O ALA A 17 9.388 -0.792 -10.999 1.00 0.150 O ATOM 251 CB ALA A 17 8.096 1.383 -8.601 1.00 0.200 C ATOM 252 H ALA A 17 9.330 -0.303 -6.980 1.00 0.170 H ATOM 253 HA ALA A 17 7.568 -0.544 -9.343 1.00 0.170 H ATOM 254 1HB ALA A 17 7.758 1.891 -9.505 1.00 0.240 H ATOM 255 2HB ALA A 17 7.300 1.387 -7.863 1.00 0.240 H ATOM 256 3HB ALA A 17 8.962 1.900 -8.201 1.00 0.240 H ATOM 257 N PHE A 18 10.688 0.518 -9.720 1.00 0.140 N ATOM 258 CA PHE A 18 11.780 0.445 -10.679 1.00 0.150 C ATOM 259 C PHE A 18 13.075 0.172 -9.956 1.00 0.150 C ATOM 260 O PHE A 18 13.290 0.660 -8.843 1.00 0.150 O ATOM 261 CB PHE A 18 11.879 1.717 -11.509 1.00 0.210 C ATOM 262 CG PHE A 18 10.635 1.977 -12.251 1.00 0.210 C ATOM 263 CD1 PHE A 18 9.719 2.897 -11.776 1.00 0.210 C ATOM 264 CD2 PHE A 18 10.339 1.277 -13.396 1.00 0.210 C ATOM 265 CE1 PHE A 18 8.545 3.119 -12.448 1.00 0.210 C ATOM 266 CE2 PHE A 18 9.173 1.499 -14.068 1.00 0.210 C ATOM 267 CZ PHE A 18 8.275 2.419 -13.599 1.00 0.210 C ATOM 268 H PHE A 18 10.800 1.051 -8.873 1.00 0.170 H ATOM 269 HA PHE A 18 11.593 -0.384 -11.353 1.00 0.180 H ATOM 270 1HB PHE A 18 12.081 2.562 -10.878 1.00 0.250 H ATOM 271 2HB PHE A 18 12.702 1.623 -12.230 1.00 0.250 H ATOM 272 HD1 PHE A 18 9.938 3.445 -10.859 1.00 0.250 H ATOM 273 HD2 PHE A 18 11.052 0.534 -13.775 1.00 0.250 H ATOM 274 HE1 PHE A 18 7.829 3.848 -12.070 1.00 0.250 H ATOM 275 HE2 PHE A 18 8.965 0.940 -14.981 1.00 0.250 H ATOM 276 HZ PHE A 18 7.347 2.590 -14.138 1.00 0.250 H ATOM 277 N LYS A 19 13.932 -0.625 -10.569 1.00 0.150 N ATOM 278 CA LYS A 19 15.217 -0.925 -9.942 1.00 0.170 C ATOM 279 C LYS A 19 16.015 0.357 -9.715 1.00 0.200 C ATOM 280 O LYS A 19 16.166 1.176 -10.622 1.00 0.220 O ATOM 281 CB LYS A 19 15.995 -1.958 -10.761 1.00 0.230 C ATOM 282 CG LYS A 19 17.328 -2.435 -10.149 1.00 0.230 C ATOM 283 CD LYS A 19 17.934 -3.573 -11.008 1.00 0.230 C ATOM 284 CE LYS A 19 19.246 -4.140 -10.442 1.00 0.230 C ATOM 285 NZ LYS A 19 20.385 -3.179 -10.581 1.00 0.230 N ATOM 286 H LYS A 19 13.661 -1.019 -11.482 1.00 0.180 H ATOM 287 HA LYS A 19 15.020 -1.365 -8.963 1.00 0.200 H ATOM 288 1HB LYS A 19 15.371 -2.840 -10.907 1.00 0.280 H ATOM 289 2HB LYS A 19 16.211 -1.556 -11.744 1.00 0.280 H ATOM 290 1HG LYS A 19 18.029 -1.599 -10.107 1.00 0.280 H ATOM 291 2HG LYS A 19 17.154 -2.799 -9.137 1.00 0.280 H ATOM 292 1HD LYS A 19 17.209 -4.389 -11.075 1.00 0.280 H ATOM 293 2HD LYS A 19 18.113 -3.203 -12.021 1.00 0.280 H ATOM 294 1HE LYS A 19 19.107 -4.371 -9.388 1.00 0.280 H ATOM 295 2HE LYS A 19 19.493 -5.057 -10.975 1.00 0.280 H ATOM 296 1HZ LYS A 19 21.239 -3.570 -10.200 1.00 0.280 H ATOM 297 2HZ LYS A 19 20.551 -2.944 -11.553 1.00 0.280 H ATOM 298 3HZ LYS A 19 20.167 -2.334 -10.081 1.00 0.280 H ATOM 299 N TYR A 20 16.552 0.532 -8.511 1.00 0.240 N ATOM 300 CA TYR A 20 17.301 1.751 -8.228 1.00 0.310 C ATOM 301 C TYR A 20 18.766 1.431 -7.996 1.00 0.360 C ATOM 302 O TYR A 20 19.101 0.581 -7.166 1.00 0.400 O ATOM 303 CB TYR A 20 16.681 2.458 -7.028 1.00 0.410 C ATOM 304 CG TYR A 20 17.269 3.801 -6.716 1.00 0.410 C ATOM 305 CD1 TYR A 20 17.019 4.807 -7.582 1.00 0.410 C ATOM 306 CD2 TYR A 20 17.995 4.046 -5.574 1.00 0.410 C ATOM 307 CE1 TYR A 20 17.467 6.055 -7.363 1.00 0.410 C ATOM 308 CE2 TYR A 20 18.461 5.329 -5.337 1.00 0.410 C ATOM 309 CZ TYR A 20 18.191 6.330 -6.247 1.00 0.410 C ATOM 310 OH TYR A 20 18.640 7.621 -6.043 1.00 0.410 O ATOM 311 H TYR A 20 16.415 -0.162 -7.790 1.00 0.290 H ATOM 312 HA TYR A 20 17.246 2.411 -9.090 1.00 0.370 H ATOM 313 1HB TYR A 20 15.617 2.582 -7.200 1.00 0.490 H ATOM 314 2HB TYR A 20 16.792 1.830 -6.147 1.00 0.490 H ATOM 315 HD1 TYR A 20 16.452 4.601 -8.465 1.00 0.490 H ATOM 316 HD2 TYR A 20 18.194 3.243 -4.863 1.00 0.490 H ATOM 317 HE1 TYR A 20 17.250 6.843 -8.082 1.00 0.490 H ATOM 318 HE2 TYR A 20 19.036 5.548 -4.438 1.00 0.490 H ATOM 319 HH TYR A 20 18.682 8.102 -6.914 1.00 0.490 H ATOM 320 N GLU A 21 19.636 2.093 -8.758 1.00 0.430 N ATOM 321 CA GLU A 21 21.068 1.843 -8.662 1.00 0.500 C ATOM 322 C GLU A 21 21.911 3.059 -9.035 1.00 0.590 C ATOM 323 O GLU A 21 21.634 3.763 -10.004 1.00 0.560 O ATOM 324 CB GLU A 21 21.441 0.640 -9.530 1.00 0.670 C ATOM 325 CG GLU A 21 22.889 0.206 -9.424 1.00 0.670 C ATOM 326 CD GLU A 21 23.183 -1.041 -10.171 1.00 0.670 C ATOM 327 OE1 GLU A 21 22.292 -1.555 -10.824 1.00 0.670 O ATOM 328 OE2 GLU A 21 24.294 -1.495 -10.091 1.00 0.670 O ATOM 329 H GLU A 21 19.269 2.789 -9.416 1.00 0.520 H ATOM 330 HA GLU A 21 21.294 1.591 -7.626 1.00 0.600 H ATOM 331 1HB GLU A 21 20.817 -0.208 -9.254 1.00 0.810 H ATOM 332 2HB GLU A 21 21.235 0.872 -10.574 1.00 0.810 H ATOM 333 1HG GLU A 21 23.502 0.982 -9.836 1.00 0.810 H ATOM 334 2HG GLU A 21 23.157 0.079 -8.377 1.00 0.810 H ATOM 335 N ASN A 22 22.958 3.299 -8.249 1.00 0.730 N ATOM 336 CA ASN A 22 23.908 4.394 -8.455 1.00 0.840 C ATOM 337 C ASN A 22 23.205 5.751 -8.512 1.00 0.770 C ATOM 338 O ASN A 22 23.591 6.636 -9.274 1.00 0.760 O ATOM 339 CB ASN A 22 24.724 4.183 -9.719 1.00 1.130 C ATOM 340 CG ASN A 22 25.501 2.906 -9.703 1.00 1.130 C ATOM 341 OD1 ASN A 22 25.915 2.395 -8.653 1.00 1.130 O ATOM 342 ND2 ASN A 22 25.721 2.364 -10.873 1.00 1.130 N ATOM 343 H ASN A 22 23.121 2.668 -7.475 1.00 0.880 H ATOM 344 HA ASN A 22 24.591 4.422 -7.604 1.00 1.010 H ATOM 345 1HB ASN A 22 24.071 4.189 -10.592 1.00 1.360 H ATOM 346 2HB ASN A 22 25.423 5.010 -9.837 1.00 1.360 H ATOM 347 1HD2 ASN A 22 26.231 1.504 -10.940 1.00 1.360 H ATOM 348 2HD2 ASN A 22 25.371 2.803 -11.701 1.00 1.360 H ATOM 349 N GLY A 23 22.168 5.911 -7.699 1.00 0.740 N ATOM 350 CA GLY A 23 21.422 7.155 -7.615 1.00 0.710 C ATOM 351 C GLY A 23 20.283 7.331 -8.634 1.00 0.600 C ATOM 352 O GLY A 23 19.495 8.279 -8.496 1.00 0.630 O ATOM 353 H GLY A 23 21.904 5.155 -7.085 1.00 0.890 H ATOM 354 1HA GLY A 23 21.025 7.247 -6.608 1.00 0.850 H ATOM 355 2HA GLY A 23 22.121 7.981 -7.734 1.00 0.850 H ATOM 356 N LYS A 24 20.131 6.416 -9.603 1.00 0.540 N ATOM 357 CA LYS A 24 19.097 6.566 -10.637 1.00 0.480 C ATOM 358 C LYS A 24 18.119 5.395 -10.747 1.00 0.430 C ATOM 359 O LYS A 24 18.424 4.261 -10.367 1.00 0.450 O ATOM 360 CB LYS A 24 19.757 6.770 -12.005 1.00 0.700 C ATOM 361 CG LYS A 24 20.693 7.989 -12.125 1.00 0.700 C ATOM 362 CD LYS A 24 19.946 9.325 -12.040 1.00 0.700 C ATOM 363 CE LYS A 24 20.892 10.499 -12.270 1.00 0.700 C ATOM 364 NZ LYS A 24 20.198 11.816 -12.135 1.00 0.700 N ATOM 365 H LYS A 24 20.776 5.621 -9.663 1.00 0.650 H ATOM 366 HA LYS A 24 18.502 7.444 -10.397 1.00 0.580 H ATOM 367 1HB LYS A 24 20.349 5.882 -12.241 1.00 0.840 H ATOM 368 2HB LYS A 24 18.985 6.854 -12.771 1.00 0.840 H ATOM 369 1HG LYS A 24 21.438 7.945 -11.326 1.00 0.840 H ATOM 370 2HG LYS A 24 21.219 7.938 -13.076 1.00 0.840 H ATOM 371 1HD LYS A 24 19.149 9.353 -12.783 1.00 0.840 H ATOM 372 2HD LYS A 24 19.506 9.439 -11.050 1.00 0.840 H ATOM 373 1HE LYS A 24 21.700 10.449 -11.540 1.00 0.840 H ATOM 374 2HE LYS A 24 21.315 10.425 -13.271 1.00 0.840 H ATOM 375 1HZ LYS A 24 20.860 12.564 -12.293 1.00 0.840 H ATOM 376 2HZ LYS A 24 19.453 11.879 -12.816 1.00 0.840 H ATOM 377 3HZ LYS A 24 19.812 11.900 -11.204 1.00 0.840 H ATOM 378 N TYR A 25 16.924 5.671 -11.284 1.00 0.400 N ATOM 379 CA TYR A 25 15.956 4.599 -11.516 1.00 0.360 C ATOM 380 C TYR A 25 16.044 4.028 -12.919 1.00 0.320 C ATOM 381 O TYR A 25 15.923 4.729 -13.931 1.00 0.390 O ATOM 382 CB TYR A 25 14.522 5.063 -11.274 1.00 0.520 C ATOM 383 CG TYR A 25 14.199 5.308 -9.846 1.00 0.520 C ATOM 384 CD1 TYR A 25 14.326 6.574 -9.307 1.00 0.520 C ATOM 385 CD2 TYR A 25 13.783 4.251 -9.056 1.00 0.520 C ATOM 386 CE1 TYR A 25 14.033 6.784 -7.976 1.00 0.520 C ATOM 387 CE2 TYR A 25 13.487 4.458 -7.731 1.00 0.520 C ATOM 388 CZ TYR A 25 13.613 5.718 -7.187 1.00 0.520 C ATOM 389 OH TYR A 25 13.323 5.925 -5.860 1.00 0.520 O ATOM 390 H TYR A 25 16.701 6.618 -11.558 1.00 0.480 H ATOM 391 HA TYR A 25 16.167 3.782 -10.826 1.00 0.430 H ATOM 392 1HB TYR A 25 14.333 5.979 -11.833 1.00 0.620 H ATOM 393 2HB TYR A 25 13.839 4.304 -11.649 1.00 0.620 H ATOM 394 HD1 TYR A 25 14.658 7.404 -9.929 1.00 0.620 H ATOM 395 HD2 TYR A 25 13.696 3.253 -9.476 1.00 0.620 H ATOM 396 HE1 TYR A 25 14.134 7.779 -7.546 1.00 0.620 H ATOM 397 HE2 TYR A 25 13.163 3.622 -7.110 1.00 0.620 H ATOM 398 HH TYR A 25 13.492 6.844 -5.634 1.00 0.620 H ATOM 399 N ASP A 26 16.195 2.723 -12.984 1.00 0.250 N ATOM 400 CA ASP A 26 16.288 2.021 -14.240 1.00 0.250 C ATOM 401 C ASP A 26 14.860 1.773 -14.675 1.00 0.270 C ATOM 402 O ASP A 26 14.312 0.702 -14.437 1.00 0.330 O ATOM 403 CB ASP A 26 17.061 0.708 -14.055 1.00 0.350 C ATOM 404 CG ASP A 26 17.414 -0.019 -15.361 1.00 0.350 C ATOM 405 OD1 ASP A 26 17.110 0.496 -16.423 1.00 0.350 O ATOM 406 OD2 ASP A 26 17.993 -1.079 -15.290 1.00 0.350 O ATOM 407 H ASP A 26 16.268 2.195 -12.114 1.00 0.300 H ATOM 408 HA ASP A 26 16.791 2.648 -14.977 1.00 0.300 H ATOM 409 1HB ASP A 26 17.982 0.914 -13.507 1.00 0.420 H ATOM 410 2HB ASP A 26 16.472 0.040 -13.435 1.00 0.420 H ATOM 411 N ILE A 27 14.261 2.758 -15.329 1.00 0.290 N ATOM 412 CA ILE A 27 12.831 2.726 -15.632 1.00 0.370 C ATOM 413 C ILE A 27 12.404 1.493 -16.432 1.00 0.350 C ATOM 414 O ILE A 27 11.288 1.006 -16.273 1.00 0.530 O ATOM 415 CB ILE A 27 12.367 4.034 -16.304 1.00 0.490 C ATOM 416 CG1 ILE A 27 12.565 5.260 -15.301 1.00 0.490 C ATOM 417 CG2 ILE A 27 10.887 3.923 -16.742 1.00 0.490 C ATOM 418 CD1 ILE A 27 11.807 5.195 -13.947 1.00 0.490 C ATOM 419 H ILE A 27 14.820 3.599 -15.499 1.00 0.350 H ATOM 420 HA ILE A 27 12.308 2.662 -14.693 1.00 0.440 H ATOM 421 HB ILE A 27 12.982 4.232 -17.179 1.00 0.580 H ATOM 422 1HG1 ILE A 27 13.626 5.355 -15.079 1.00 0.580 H ATOM 423 2HG1 ILE A 27 12.240 6.165 -15.815 1.00 0.580 H ATOM 424 1HG2 ILE A 27 10.582 4.855 -17.212 1.00 0.580 H ATOM 425 2HG2 ILE A 27 10.758 3.117 -17.458 1.00 0.580 H ATOM 426 3HG2 ILE A 27 10.255 3.730 -15.879 1.00 0.580 H ATOM 427 1HD1 ILE A 27 12.028 6.095 -13.377 1.00 0.580 H ATOM 428 2HD1 ILE A 27 10.735 5.137 -14.114 1.00 0.580 H ATOM 429 3HD1 ILE A 27 12.121 4.342 -13.370 1.00 0.580 H ATOM 430 N LYS A 28 13.216 1.023 -17.357 1.00 0.270 N ATOM 431 CA LYS A 28 12.821 -0.173 -18.102 1.00 0.280 C ATOM 432 C LYS A 28 12.692 -1.446 -17.216 1.00 0.250 C ATOM 433 O LYS A 28 12.089 -2.434 -17.645 1.00 0.300 O ATOM 434 CB LYS A 28 13.789 -0.426 -19.263 1.00 0.390 C ATOM 435 CG LYS A 28 15.187 -0.839 -18.853 1.00 0.390 C ATOM 436 CD LYS A 28 16.100 -1.020 -20.063 1.00 0.390 C ATOM 437 CE LYS A 28 17.498 -1.483 -19.646 1.00 0.390 C ATOM 438 NZ LYS A 28 18.251 -0.429 -18.884 1.00 0.390 N ATOM 439 H LYS A 28 14.112 1.469 -17.508 1.00 0.320 H ATOM 440 HA LYS A 28 11.838 0.017 -18.534 1.00 0.340 H ATOM 441 1HB LYS A 28 13.385 -1.210 -19.904 1.00 0.470 H ATOM 442 2HB LYS A 28 13.873 0.477 -19.864 1.00 0.470 H ATOM 443 1HG LYS A 28 15.596 -0.080 -18.200 1.00 0.470 H ATOM 444 2HG LYS A 28 15.148 -1.778 -18.302 1.00 0.470 H ATOM 445 1HD LYS A 28 15.666 -1.761 -20.735 1.00 0.470 H ATOM 446 2HD LYS A 28 16.186 -0.075 -20.599 1.00 0.470 H ATOM 447 1HE LYS A 28 17.404 -2.367 -19.017 1.00 0.470 H ATOM 448 2HE LYS A 28 18.065 -1.742 -20.539 1.00 0.470 H ATOM 449 1HZ LYS A 28 19.157 -0.783 -18.630 1.00 0.470 H ATOM 450 2HZ LYS A 28 18.362 0.393 -19.451 1.00 0.470 H ATOM 451 3HZ LYS A 28 17.751 -0.166 -18.007 1.00 0.470 H ATOM 452 N ASP A 29 13.327 -1.461 -16.034 1.00 0.220 N ATOM 453 CA ASP A 29 13.307 -2.609 -15.129 1.00 0.180 C ATOM 454 C ASP A 29 12.180 -2.436 -14.115 1.00 0.160 C ATOM 455 O ASP A 29 12.351 -1.799 -13.064 1.00 0.150 O ATOM 456 CB ASP A 29 14.669 -2.769 -14.439 1.00 0.270 C ATOM 457 CG ASP A 29 14.781 -4.014 -13.540 1.00 0.270 C ATOM 458 OD1 ASP A 29 13.766 -4.594 -13.224 1.00 0.270 O ATOM 459 OD2 ASP A 29 15.877 -4.379 -13.196 1.00 0.270 O ATOM 460 H ASP A 29 13.781 -0.610 -15.701 1.00 0.260 H ATOM 461 HA ASP A 29 13.108 -3.510 -15.710 1.00 0.220 H ATOM 462 1HB ASP A 29 15.457 -2.810 -15.198 1.00 0.320 H ATOM 463 2HB ASP A 29 14.864 -1.880 -13.840 1.00 0.320 H ATOM 464 N VAL A 30 11.015 -3.013 -14.423 1.00 0.180 N ATOM 465 CA VAL A 30 9.836 -2.808 -13.594 1.00 0.160 C ATOM 466 C VAL A 30 9.534 -4.080 -12.793 1.00 0.160 C ATOM 467 O VAL A 30 9.461 -5.184 -13.335 1.00 0.250 O ATOM 468 CB VAL A 30 8.638 -2.353 -14.470 1.00 0.230 C ATOM 469 CG1 VAL A 30 8.279 -3.410 -15.522 1.00 0.230 C ATOM 470 CG2 VAL A 30 7.445 -2.004 -13.580 1.00 0.230 C ATOM 471 H VAL A 30 10.957 -3.573 -15.263 1.00 0.220 H ATOM 472 HA VAL A 30 10.051 -2.003 -12.899 1.00 0.190 H ATOM 473 HB VAL A 30 8.940 -1.462 -15.017 1.00 0.280 H ATOM 474 1HG1 VAL A 30 7.464 -3.037 -16.140 1.00 0.280 H ATOM 475 2HG1 VAL A 30 9.143 -3.605 -16.154 1.00 0.280 H ATOM 476 3HG1 VAL A 30 7.964 -4.335 -15.049 1.00 0.280 H ATOM 477 1HG2 VAL A 30 6.624 -1.648 -14.198 1.00 0.280 H ATOM 478 2HG2 VAL A 30 7.124 -2.865 -13.035 1.00 0.280 H ATOM 479 3HG2 VAL A 30 7.737 -1.217 -12.877 1.00 0.280 H ATOM 480 N GLY A 31 9.331 -3.891 -11.501 1.00 0.130 N ATOM 481 CA GLY A 31 9.138 -4.982 -10.534 1.00 0.120 C ATOM 482 C GLY A 31 7.724 -5.519 -10.358 1.00 0.190 C ATOM 483 O GLY A 31 7.487 -6.399 -9.530 1.00 0.470 O ATOM 484 H GLY A 31 9.378 -2.909 -11.193 1.00 0.160 H ATOM 485 1HA GLY A 31 9.799 -5.803 -10.808 1.00 0.140 H ATOM 486 2HA GLY A 31 9.481 -4.635 -9.570 1.00 0.140 H ATOM 487 N VAL A 32 6.788 -5.025 -11.138 1.00 0.220 N ATOM 488 CA VAL A 32 5.385 -5.406 -11.021 1.00 0.240 C ATOM 489 C VAL A 32 5.107 -6.898 -11.242 1.00 0.170 C ATOM 490 O VAL A 32 4.154 -7.432 -10.677 1.00 0.150 O ATOM 491 CB VAL A 32 4.540 -4.541 -11.989 1.00 0.330 C ATOM 492 CG1 VAL A 32 4.805 -4.921 -13.467 1.00 0.330 C ATOM 493 CG2 VAL A 32 3.058 -4.697 -11.653 1.00 0.330 C ATOM 494 H VAL A 32 7.069 -4.312 -11.793 1.00 0.260 H ATOM 495 HA VAL A 32 5.068 -5.158 -10.006 1.00 0.290 H ATOM 496 HB VAL A 32 4.838 -3.501 -11.862 1.00 0.390 H ATOM 497 1HG1 VAL A 32 4.219 -4.273 -14.115 1.00 0.390 H ATOM 498 2HG1 VAL A 32 5.857 -4.803 -13.706 1.00 0.390 H ATOM 499 3HG1 VAL A 32 4.511 -5.950 -13.658 1.00 0.390 H ATOM 500 1HG2 VAL A 32 2.470 -4.064 -12.314 1.00 0.390 H ATOM 501 2HG2 VAL A 32 2.746 -5.733 -11.787 1.00 0.390 H ATOM 502 3HG2 VAL A 32 2.885 -4.401 -10.619 1.00 0.390 H ATOM 503 N ASP A 33 5.914 -7.561 -12.076 1.00 0.190 N ATOM 504 CA ASP A 33 5.728 -8.976 -12.388 1.00 0.160 C ATOM 505 C ASP A 33 6.604 -9.902 -11.548 1.00 0.200 C ATOM 506 O ASP A 33 6.713 -11.099 -11.833 1.00 0.240 O ATOM 507 CB ASP A 33 6.023 -9.222 -13.869 1.00 0.240 C ATOM 508 CG ASP A 33 5.019 -8.562 -14.810 1.00 0.240 C ATOM 509 OD1 ASP A 33 3.838 -8.639 -14.560 1.00 0.240 O ATOM 510 OD2 ASP A 33 5.452 -7.963 -15.765 1.00 0.240 O ATOM 511 H ASP A 33 6.661 -7.062 -12.545 1.00 0.230 H ATOM 512 HA ASP A 33 4.686 -9.230 -12.193 1.00 0.190 H ATOM 513 1HB ASP A 33 7.018 -8.842 -14.103 1.00 0.280 H ATOM 514 2HB ASP A 33 6.029 -10.292 -14.066 1.00 0.280 H ATOM 515 N ASN A 34 7.251 -9.352 -10.531 1.00 0.250 N ATOM 516 CA ASN A 34 8.099 -10.119 -9.637 1.00 0.340 C ATOM 517 C ASN A 34 7.262 -11.168 -8.921 1.00 0.260 C ATOM 518 O ASN A 34 6.104 -10.913 -8.588 1.00 0.270 O ATOM 519 CB ASN A 34 8.780 -9.198 -8.633 1.00 0.440 C ATOM 520 CG ASN A 34 9.876 -9.858 -7.822 1.00 0.440 C ATOM 521 OD1 ASN A 34 9.630 -10.608 -6.858 1.00 0.440 O ATOM 522 ND2 ASN A 34 11.101 -9.603 -8.210 1.00 0.440 N ATOM 523 H ASN A 34 7.142 -8.350 -10.339 1.00 0.300 H ATOM 524 HA ASN A 34 8.858 -10.640 -10.224 1.00 0.410 H ATOM 525 1HB ASN A 34 9.213 -8.348 -9.164 1.00 0.530 H ATOM 526 2HB ASN A 34 8.034 -8.796 -7.952 1.00 0.530 H ATOM 527 1HD2 ASN A 34 11.879 -10.005 -7.722 1.00 0.530 H ATOM 528 2HD2 ASN A 34 11.262 -9.006 -8.999 1.00 0.530 H ATOM 529 N ALA A 35 7.849 -12.327 -8.623 1.00 0.240 N ATOM 530 CA ALA A 35 7.107 -13.356 -7.898 1.00 0.270 C ATOM 531 C ALA A 35 6.565 -12.811 -6.576 1.00 0.200 C ATOM 532 O ALA A 35 5.481 -13.211 -6.141 1.00 0.220 O ATOM 533 CB ALA A 35 7.996 -14.551 -7.630 1.00 0.370 C ATOM 534 H ALA A 35 8.801 -12.498 -8.914 1.00 0.290 H ATOM 535 HA ALA A 35 6.265 -13.664 -8.515 1.00 0.320 H ATOM 536 1HB ALA A 35 7.424 -15.317 -7.109 1.00 0.440 H ATOM 537 2HB ALA A 35 8.363 -14.950 -8.574 1.00 0.440 H ATOM 538 3HB ALA A 35 8.838 -14.245 -7.012 1.00 0.440 H ATOM 539 N GLY A 36 7.314 -11.911 -5.936 1.00 0.140 N ATOM 540 CA GLY A 36 6.895 -11.294 -4.699 1.00 0.120 C ATOM 541 C GLY A 36 5.617 -10.511 -4.929 1.00 0.090 C ATOM 542 O GLY A 36 4.606 -10.678 -4.233 1.00 0.100 O ATOM 543 H GLY A 36 8.211 -11.616 -6.315 1.00 0.170 H ATOM 544 1HA GLY A 36 6.764 -12.048 -3.924 1.00 0.140 H ATOM 545 2HA GLY A 36 7.674 -10.611 -4.387 1.00 0.140 H ATOM 546 N ALA A 37 5.647 -9.661 -5.951 1.00 0.080 N ATOM 547 CA ALA A 37 4.504 -8.842 -6.291 1.00 0.070 C ATOM 548 C ALA A 37 3.288 -9.715 -6.573 1.00 0.100 C ATOM 549 O ALA A 37 2.174 -9.397 -6.140 1.00 0.110 O ATOM 550 CB ALA A 37 4.823 -7.992 -7.518 1.00 0.100 C ATOM 551 H ALA A 37 6.509 -9.570 -6.472 1.00 0.100 H ATOM 552 HA ALA A 37 4.281 -8.210 -5.436 1.00 0.080 H ATOM 553 1HB ALA A 37 3.971 -7.369 -7.776 1.00 0.120 H ATOM 554 2HB ALA A 37 5.677 -7.364 -7.328 1.00 0.120 H ATOM 555 3HB ALA A 37 5.045 -8.642 -8.362 1.00 0.120 H ATOM 556 N LYS A 38 3.507 -10.848 -7.248 1.00 0.120 N ATOM 557 CA LYS A 38 2.422 -11.760 -7.549 1.00 0.150 C ATOM 558 C LYS A 38 1.843 -12.362 -6.276 1.00 0.150 C ATOM 559 O LYS A 38 0.619 -12.457 -6.149 1.00 0.150 O ATOM 560 CB LYS A 38 2.889 -12.844 -8.515 1.00 0.200 C ATOM 561 CG LYS A 38 3.129 -12.334 -9.937 1.00 0.200 C ATOM 562 CD LYS A 38 3.649 -13.435 -10.848 1.00 0.200 C ATOM 563 CE LYS A 38 3.813 -12.943 -12.282 1.00 0.200 C ATOM 564 NZ LYS A 38 4.414 -13.985 -13.160 1.00 0.200 N ATOM 565 H LYS A 38 4.456 -11.030 -7.594 1.00 0.140 H ATOM 566 HA LYS A 38 1.631 -11.195 -8.038 1.00 0.180 H ATOM 567 1HB LYS A 38 3.818 -13.272 -8.152 1.00 0.240 H ATOM 568 2HB LYS A 38 2.150 -13.643 -8.554 1.00 0.240 H ATOM 569 1HG LYS A 38 2.200 -11.936 -10.342 1.00 0.240 H ATOM 570 2HG LYS A 38 3.866 -11.525 -9.907 1.00 0.240 H ATOM 571 1HD LYS A 38 4.622 -13.768 -10.484 1.00 0.240 H ATOM 572 2HD LYS A 38 2.964 -14.280 -10.834 1.00 0.240 H ATOM 573 1HE LYS A 38 2.835 -12.672 -12.676 1.00 0.240 H ATOM 574 2HE LYS A 38 4.447 -12.064 -12.289 1.00 0.240 H ATOM 575 1HZ LYS A 38 4.504 -13.622 -14.099 1.00 0.240 H ATOM 576 2HZ LYS A 38 5.331 -14.231 -12.807 1.00 0.240 H ATOM 577 3HZ LYS A 38 3.826 -14.802 -13.171 1.00 0.240 H ATOM 578 N ALA A 39 2.696 -12.761 -5.321 1.00 0.150 N ATOM 579 CA ALA A 39 2.206 -13.319 -4.063 1.00 0.160 C ATOM 580 C ALA A 39 1.352 -12.306 -3.306 1.00 0.140 C ATOM 581 O ALA A 39 0.294 -12.654 -2.768 1.00 0.140 O ATOM 582 CB ALA A 39 3.373 -13.745 -3.192 1.00 0.220 C ATOM 583 H ALA A 39 3.708 -12.731 -5.504 1.00 0.180 H ATOM 584 HA ALA A 39 1.590 -14.186 -4.293 1.00 0.190 H ATOM 585 1HB ALA A 39 3.004 -14.178 -2.269 1.00 0.260 H ATOM 586 2HB ALA A 39 3.972 -14.478 -3.729 1.00 0.260 H ATOM 587 3HB ALA A 39 3.998 -12.878 -2.962 1.00 0.260 H ATOM 588 N GLY A 40 1.799 -11.046 -3.308 1.00 0.110 N ATOM 589 CA GLY A 40 1.103 -9.941 -2.653 1.00 0.100 C ATOM 590 C GLY A 40 -0.273 -9.750 -3.274 1.00 0.110 C ATOM 591 O GLY A 40 -1.293 -9.691 -2.574 1.00 0.130 O ATOM 592 H GLY A 40 2.706 -10.860 -3.755 1.00 0.130 H ATOM 593 1HA GLY A 40 1.010 -10.142 -1.587 1.00 0.120 H ATOM 594 2HA GLY A 40 1.692 -9.037 -2.760 1.00 0.120 H ATOM 595 N LEU A 41 -0.303 -9.649 -4.603 1.00 0.110 N ATOM 596 CA LEU A 41 -1.547 -9.475 -5.328 1.00 0.120 C ATOM 597 C LEU A 41 -2.474 -10.665 -5.142 1.00 0.150 C ATOM 598 O LEU A 41 -3.681 -10.475 -4.979 1.00 0.180 O ATOM 599 CB LEU A 41 -1.239 -9.295 -6.819 1.00 0.160 C ATOM 600 CG LEU A 41 -0.544 -7.972 -7.226 1.00 0.160 C ATOM 601 CD1 LEU A 41 -0.057 -8.078 -8.654 1.00 0.160 C ATOM 602 CD2 LEU A 41 -1.530 -6.810 -7.102 1.00 0.160 C ATOM 603 H LEU A 41 0.580 -9.687 -5.126 1.00 0.130 H ATOM 604 HA LEU A 41 -2.050 -8.597 -4.938 1.00 0.140 H ATOM 605 1HB LEU A 41 -0.583 -10.111 -7.123 1.00 0.200 H ATOM 606 2HB LEU A 41 -2.168 -9.377 -7.379 1.00 0.200 H ATOM 607 HG LEU A 41 0.311 -7.799 -6.592 1.00 0.200 H ATOM 608 1HD1 LEU A 41 0.441 -7.150 -8.937 1.00 0.200 H ATOM 609 2HD1 LEU A 41 0.653 -8.904 -8.734 1.00 0.200 H ATOM 610 3HD1 LEU A 41 -0.900 -8.256 -9.320 1.00 0.200 H ATOM 611 1HD2 LEU A 41 -1.032 -5.893 -7.404 1.00 0.200 H ATOM 612 2HD2 LEU A 41 -2.385 -6.987 -7.754 1.00 0.200 H ATOM 613 3HD2 LEU A 41 -1.874 -6.707 -6.080 1.00 0.200 H ATOM 614 N THR A 42 -1.920 -11.885 -5.131 1.00 0.140 N ATOM 615 CA THR A 42 -2.708 -13.099 -4.967 1.00 0.160 C ATOM 616 C THR A 42 -3.419 -13.041 -3.635 1.00 0.170 C ATOM 617 O THR A 42 -4.615 -13.314 -3.557 1.00 0.180 O ATOM 618 CB THR A 42 -1.832 -14.369 -5.042 1.00 0.220 C ATOM 619 OG1 THR A 42 -1.211 -14.448 -6.338 1.00 0.220 O ATOM 620 CG2 THR A 42 -2.697 -15.615 -4.817 1.00 0.220 C ATOM 621 H THR A 42 -0.918 -11.980 -5.290 1.00 0.170 H ATOM 622 HA THR A 42 -3.455 -13.144 -5.757 1.00 0.190 H ATOM 623 HB THR A 42 -1.057 -14.323 -4.281 1.00 0.260 H ATOM 624 HG1 THR A 42 -0.553 -13.725 -6.420 1.00 0.260 H ATOM 625 1HG2 THR A 42 -2.071 -16.501 -4.879 1.00 0.260 H ATOM 626 2HG2 THR A 42 -3.173 -15.582 -3.833 1.00 0.260 H ATOM 627 3HG2 THR A 42 -3.470 -15.663 -5.583 1.00 0.260 H ATOM 628 N PHE A 43 -2.688 -12.661 -2.588 1.00 0.150 N ATOM 629 CA PHE A 43 -3.245 -12.519 -1.258 1.00 0.150 C ATOM 630 C PHE A 43 -4.434 -11.577 -1.243 1.00 0.160 C ATOM 631 O PHE A 43 -5.497 -11.934 -0.723 1.00 0.160 O ATOM 632 CB PHE A 43 -2.160 -12.028 -0.317 1.00 0.210 C ATOM 633 CG PHE A 43 -2.602 -11.602 1.028 1.00 0.210 C ATOM 634 CD1 PHE A 43 -2.928 -12.509 2.009 1.00 0.210 C ATOM 635 CD2 PHE A 43 -2.662 -10.250 1.318 1.00 0.210 C ATOM 636 CE1 PHE A 43 -3.311 -12.074 3.254 1.00 0.210 C ATOM 637 CE2 PHE A 43 -3.039 -9.816 2.553 1.00 0.210 C ATOM 638 CZ PHE A 43 -3.364 -10.729 3.526 1.00 0.210 C ATOM 639 H PHE A 43 -1.683 -12.496 -2.721 1.00 0.180 H ATOM 640 HA PHE A 43 -3.581 -13.501 -0.924 1.00 0.180 H ATOM 641 1HB PHE A 43 -1.446 -12.824 -0.206 1.00 0.250 H ATOM 642 2HB PHE A 43 -1.631 -11.208 -0.767 1.00 0.250 H ATOM 643 HD1 PHE A 43 -2.881 -13.576 1.793 1.00 0.250 H ATOM 644 HD2 PHE A 43 -2.397 -9.526 0.544 1.00 0.250 H ATOM 645 HE1 PHE A 43 -3.571 -12.796 4.026 1.00 0.250 H ATOM 646 HE2 PHE A 43 -3.083 -8.748 2.770 1.00 0.250 H ATOM 647 HZ PHE A 43 -3.667 -10.385 4.514 1.00 0.250 H ATOM 648 N LEU A 44 -4.269 -10.387 -1.821 1.00 0.160 N ATOM 649 CA LEU A 44 -5.351 -9.416 -1.824 1.00 0.180 C ATOM 650 C LEU A 44 -6.565 -9.965 -2.594 1.00 0.180 C ATOM 651 O LEU A 44 -7.718 -9.794 -2.175 1.00 0.200 O ATOM 652 CB LEU A 44 -4.833 -8.113 -2.450 1.00 0.240 C ATOM 653 CG LEU A 44 -3.723 -7.336 -1.623 1.00 0.240 C ATOM 654 CD1 LEU A 44 -3.162 -6.198 -2.481 1.00 0.240 C ATOM 655 CD2 LEU A 44 -4.311 -6.782 -0.319 1.00 0.240 C ATOM 656 H LEU A 44 -3.354 -10.152 -2.227 1.00 0.190 H ATOM 657 HA LEU A 44 -5.659 -9.244 -0.801 1.00 0.220 H ATOM 658 1HB LEU A 44 -4.407 -8.356 -3.426 1.00 0.290 H ATOM 659 2HB LEU A 44 -5.678 -7.442 -2.601 1.00 0.290 H ATOM 660 HG LEU A 44 -2.902 -8.012 -1.388 1.00 0.290 H ATOM 661 1HD1 LEU A 44 -2.385 -5.662 -1.929 1.00 0.290 H ATOM 662 2HD1 LEU A 44 -2.733 -6.608 -3.396 1.00 0.290 H ATOM 663 3HD1 LEU A 44 -3.969 -5.517 -2.730 1.00 0.290 H ATOM 664 1HD2 LEU A 44 -3.538 -6.248 0.222 1.00 0.290 H ATOM 665 2HD2 LEU A 44 -5.124 -6.098 -0.556 1.00 0.290 H ATOM 666 3HD2 LEU A 44 -4.682 -7.585 0.302 1.00 0.290 H ATOM 667 N VAL A 45 -6.315 -10.657 -3.708 1.00 0.180 N ATOM 668 CA VAL A 45 -7.401 -11.245 -4.478 1.00 0.200 C ATOM 669 C VAL A 45 -8.115 -12.317 -3.658 1.00 0.190 C ATOM 670 O VAL A 45 -9.346 -12.393 -3.704 1.00 0.200 O ATOM 671 CB VAL A 45 -6.909 -11.789 -5.830 1.00 0.270 C ATOM 672 CG1 VAL A 45 -8.014 -12.579 -6.527 1.00 0.270 C ATOM 673 CG2 VAL A 45 -6.498 -10.613 -6.709 1.00 0.270 C ATOM 674 H VAL A 45 -5.348 -10.736 -4.042 1.00 0.220 H ATOM 675 HA VAL A 45 -8.121 -10.457 -4.695 1.00 0.240 H ATOM 676 HB VAL A 45 -6.057 -12.451 -5.665 1.00 0.330 H ATOM 677 1HG1 VAL A 45 -7.646 -12.950 -7.480 1.00 0.330 H ATOM 678 2HG1 VAL A 45 -8.300 -13.409 -5.916 1.00 0.330 H ATOM 679 3HG1 VAL A 45 -8.879 -11.935 -6.694 1.00 0.330 H ATOM 680 1HG2 VAL A 45 -6.136 -10.982 -7.667 1.00 0.330 H ATOM 681 2HG2 VAL A 45 -7.358 -9.963 -6.868 1.00 0.330 H ATOM 682 3HG2 VAL A 45 -5.713 -10.047 -6.225 1.00 0.330 H ATOM 683 N ASP A 46 -7.361 -13.181 -2.958 1.00 0.180 N ATOM 684 CA ASP A 46 -7.975 -14.194 -2.111 1.00 0.180 C ATOM 685 C ASP A 46 -8.814 -13.560 -1.001 1.00 0.180 C ATOM 686 O ASP A 46 -9.914 -14.033 -0.719 1.00 0.190 O ATOM 687 CB ASP A 46 -6.946 -15.173 -1.530 1.00 0.250 C ATOM 688 CG ASP A 46 -6.397 -16.246 -2.564 1.00 0.250 C ATOM 689 OD1 ASP A 46 -6.976 -16.416 -3.639 1.00 0.250 O ATOM 690 OD2 ASP A 46 -5.437 -16.900 -2.234 1.00 0.250 O ATOM 691 H ASP A 46 -6.343 -13.131 -3.031 1.00 0.220 H ATOM 692 HA ASP A 46 -8.634 -14.784 -2.724 1.00 0.220 H ATOM 693 1HB ASP A 46 -6.095 -14.598 -1.152 1.00 0.300 H ATOM 694 2HB ASP A 46 -7.384 -15.696 -0.683 1.00 0.300 H ATOM 695 N LEU A 47 -8.382 -12.424 -0.433 1.00 0.180 N ATOM 696 CA LEU A 47 -9.212 -11.784 0.589 1.00 0.190 C ATOM 697 C LEU A 47 -10.561 -11.398 -0.026 1.00 0.190 C ATOM 698 O LEU A 47 -11.616 -11.520 0.612 1.00 0.180 O ATOM 699 CB LEU A 47 -8.542 -10.521 1.157 1.00 0.260 C ATOM 700 CG LEU A 47 -7.260 -10.705 2.019 1.00 0.260 C ATOM 701 CD1 LEU A 47 -6.693 -9.335 2.314 1.00 0.260 C ATOM 702 CD2 LEU A 47 -7.571 -11.444 3.316 1.00 0.260 C ATOM 703 H LEU A 47 -7.442 -12.073 -0.656 1.00 0.220 H ATOM 704 HA LEU A 47 -9.398 -12.497 1.385 1.00 0.230 H ATOM 705 1HB LEU A 47 -8.275 -9.878 0.318 1.00 0.310 H ATOM 706 2HB LEU A 47 -9.272 -9.989 1.760 1.00 0.310 H ATOM 707 HG LEU A 47 -6.516 -11.267 1.456 1.00 0.310 H ATOM 708 1HD1 LEU A 47 -5.798 -9.431 2.898 1.00 0.310 H ATOM 709 2HD1 LEU A 47 -6.465 -8.829 1.385 1.00 0.310 H ATOM 710 3HD1 LEU A 47 -7.422 -8.759 2.874 1.00 0.310 H ATOM 711 1HD2 LEU A 47 -6.652 -11.544 3.893 1.00 0.310 H ATOM 712 2HD2 LEU A 47 -8.304 -10.883 3.894 1.00 0.310 H ATOM 713 3HD2 LEU A 47 -7.961 -12.433 3.104 1.00 0.310 H ATOM 714 N ILE A 48 -10.551 -10.949 -1.274 1.00 0.190 N ATOM 715 CA ILE A 48 -11.811 -10.634 -1.932 1.00 0.210 C ATOM 716 C ILE A 48 -12.637 -11.920 -2.170 1.00 0.210 C ATOM 717 O ILE A 48 -13.820 -11.997 -1.826 1.00 0.220 O ATOM 718 CB ILE A 48 -11.557 -9.880 -3.252 1.00 0.290 C ATOM 719 CG1 ILE A 48 -10.955 -8.489 -2.920 1.00 0.290 C ATOM 720 CG2 ILE A 48 -12.857 -9.746 -4.029 1.00 0.290 C ATOM 721 CD1 ILE A 48 -10.357 -7.738 -4.086 1.00 0.290 C ATOM 722 H ILE A 48 -9.647 -10.786 -1.735 1.00 0.230 H ATOM 723 HA ILE A 48 -12.382 -9.985 -1.282 1.00 0.250 H ATOM 724 HB ILE A 48 -10.833 -10.422 -3.848 1.00 0.340 H ATOM 725 1HG1 ILE A 48 -11.740 -7.877 -2.482 1.00 0.340 H ATOM 726 2HG1 ILE A 48 -10.169 -8.624 -2.181 1.00 0.340 H ATOM 727 1HG2 ILE A 48 -12.674 -9.231 -4.952 1.00 0.340 H ATOM 728 2HG2 ILE A 48 -13.265 -10.725 -4.262 1.00 0.340 H ATOM 729 3HG2 ILE A 48 -13.580 -9.189 -3.426 1.00 0.340 H ATOM 730 1HD1 ILE A 48 -9.963 -6.786 -3.728 1.00 0.340 H ATOM 731 2HD1 ILE A 48 -9.544 -8.328 -4.512 1.00 0.340 H ATOM 732 3HD1 ILE A 48 -11.095 -7.553 -4.842 1.00 0.340 H ATOM 733 N LYS A 49 -12.005 -12.953 -2.734 1.00 0.210 N ATOM 734 CA LYS A 49 -12.668 -14.232 -3.045 1.00 0.230 C ATOM 735 C LYS A 49 -13.292 -14.908 -1.829 1.00 0.230 C ATOM 736 O LYS A 49 -14.369 -15.501 -1.916 1.00 0.240 O ATOM 737 CB LYS A 49 -11.672 -15.203 -3.664 1.00 0.310 C ATOM 738 CG LYS A 49 -11.276 -14.923 -5.112 1.00 0.310 C ATOM 739 CD LYS A 49 -9.950 -15.633 -5.467 1.00 0.310 C ATOM 740 CE LYS A 49 -9.980 -17.146 -5.354 1.00 0.310 C ATOM 741 NZ LYS A 49 -8.627 -17.720 -5.655 1.00 0.310 N ATOM 742 H LYS A 49 -11.020 -12.829 -2.982 1.00 0.250 H ATOM 743 HA LYS A 49 -13.464 -14.033 -3.761 1.00 0.280 H ATOM 744 1HB LYS A 49 -10.783 -15.218 -3.059 1.00 0.380 H ATOM 745 2HB LYS A 49 -12.102 -16.200 -3.623 1.00 0.380 H ATOM 746 1HG LYS A 49 -12.064 -15.266 -5.783 1.00 0.380 H ATOM 747 2HG LYS A 49 -11.147 -13.848 -5.244 1.00 0.380 H ATOM 748 1HD LYS A 49 -9.690 -15.379 -6.493 1.00 0.380 H ATOM 749 2HD LYS A 49 -9.159 -15.271 -4.827 1.00 0.380 H ATOM 750 1HE LYS A 49 -10.253 -17.436 -4.343 1.00 0.380 H ATOM 751 2HE LYS A 49 -10.706 -17.554 -6.055 1.00 0.380 H ATOM 752 1HZ LYS A 49 -8.647 -18.721 -5.567 1.00 0.380 H ATOM 753 2HZ LYS A 49 -8.343 -17.469 -6.587 1.00 0.380 H ATOM 754 3HZ LYS A 49 -7.942 -17.322 -4.962 1.00 0.380 H ATOM 755 N ASN A 50 -12.628 -14.784 -0.688 1.00 0.220 N ATOM 756 CA ASN A 50 -13.050 -15.398 0.558 1.00 0.220 C ATOM 757 C ASN A 50 -13.951 -14.498 1.406 1.00 0.210 C ATOM 758 O ASN A 50 -14.235 -14.823 2.560 1.00 0.210 O ATOM 759 CB ASN A 50 -11.829 -15.814 1.348 1.00 0.310 C ATOM 760 CG ASN A 50 -11.078 -16.950 0.707 1.00 0.310 C ATOM 761 OD1 ASN A 50 -11.665 -17.844 0.084 1.00 0.310 O ATOM 762 ND2 ASN A 50 -9.776 -16.936 0.848 1.00 0.310 N ATOM 763 H ASN A 50 -11.725 -14.307 -0.713 1.00 0.260 H ATOM 764 HA ASN A 50 -13.628 -16.290 0.316 1.00 0.260 H ATOM 765 1HB ASN A 50 -11.160 -14.961 1.414 1.00 0.370 H ATOM 766 2HB ASN A 50 -12.114 -16.093 2.361 1.00 0.370 H ATOM 767 1HD2 ASN A 50 -9.221 -17.664 0.441 1.00 0.370 H ATOM 768 2HD2 ASN A 50 -9.334 -16.199 1.358 1.00 0.370 H ATOM 769 N LYS A 51 -14.415 -13.383 0.827 1.00 0.200 N ATOM 770 CA LYS A 51 -15.307 -12.422 1.464 1.00 0.200 C ATOM 771 C LYS A 51 -14.741 -11.716 2.695 1.00 0.190 C ATOM 772 O LYS A 51 -15.468 -11.453 3.654 1.00 0.200 O ATOM 773 CB LYS A 51 -16.632 -13.099 1.844 1.00 0.280 C ATOM 774 CG LYS A 51 -17.375 -13.722 0.670 1.00 0.280 C ATOM 775 CD LYS A 51 -18.706 -14.317 1.106 1.00 0.280 C ATOM 776 CE LYS A 51 -19.427 -14.984 -0.061 1.00 0.280 C ATOM 777 NZ LYS A 51 -20.714 -15.610 0.362 1.00 0.280 N ATOM 778 H LYS A 51 -14.130 -13.152 -0.132 1.00 0.240 H ATOM 779 HA LYS A 51 -15.524 -11.649 0.723 1.00 0.240 H ATOM 780 1HB LYS A 51 -16.468 -13.866 2.595 1.00 0.340 H ATOM 781 2HB LYS A 51 -17.295 -12.358 2.287 1.00 0.340 H ATOM 782 1HG LYS A 51 -17.550 -12.959 -0.088 1.00 0.340 H ATOM 783 2HG LYS A 51 -16.759 -14.508 0.229 1.00 0.340 H ATOM 784 1HD LYS A 51 -18.529 -15.059 1.887 1.00 0.340 H ATOM 785 2HD LYS A 51 -19.338 -13.530 1.514 1.00 0.340 H ATOM 786 1HE LYS A 51 -19.632 -14.237 -0.826 1.00 0.340 H ATOM 787 2HE LYS A 51 -18.781 -15.755 -0.484 1.00 0.340 H ATOM 788 1HZ LYS A 51 -21.159 -16.040 -0.437 1.00 0.340 H ATOM 789 2HZ LYS A 51 -20.534 -16.315 1.065 1.00 0.340 H ATOM 790 3HZ LYS A 51 -21.325 -14.903 0.746 1.00 0.340 H ATOM 791 N HIS A 52 -13.459 -11.350 2.651 1.00 0.170 N ATOM 792 CA HIS A 52 -12.857 -10.581 3.728 1.00 0.160 C ATOM 793 C HIS A 52 -12.680 -9.140 3.254 1.00 0.140 C ATOM 794 O HIS A 52 -12.505 -8.220 4.058 1.00 0.170 O ATOM 795 CB HIS A 52 -11.498 -11.151 4.131 1.00 0.230 C ATOM 796 CG HIS A 52 -11.560 -12.543 4.627 1.00 0.230 C ATOM 797 ND1 HIS A 52 -12.249 -12.897 5.765 1.00 0.230 N ATOM 798 CD2 HIS A 52 -10.999 -13.673 4.155 1.00 0.230 C ATOM 799 CE1 HIS A 52 -12.115 -14.197 5.960 1.00 0.230 C ATOM 800 NE2 HIS A 52 -11.356 -14.689 4.999 1.00 0.230 N ATOM 801 H HIS A 52 -12.882 -11.611 1.859 1.00 0.200 H ATOM 802 HA HIS A 52 -13.506 -10.577 4.600 1.00 0.190 H ATOM 803 1HB HIS A 52 -10.838 -11.132 3.270 1.00 0.270 H ATOM 804 2HB HIS A 52 -11.051 -10.526 4.902 1.00 0.270 H ATOM 805 HD1 HIS A 52 -13.031 -12.378 6.118 1.00 0.270 H ATOM 806 HD2 HIS A 52 -10.365 -13.874 3.298 1.00 0.270 H ATOM 807 HE1 HIS A 52 -12.592 -14.681 6.811 1.00 0.270 H ATOM 808 N MET A 53 -12.754 -8.951 1.934 1.00 0.150 N ATOM 809 CA MET A 53 -12.578 -7.654 1.303 1.00 0.200 C ATOM 810 C MET A 53 -13.591 -7.416 0.176 1.00 0.170 C ATOM 811 O MET A 53 -13.963 -8.320 -0.564 1.00 0.220 O ATOM 812 CB MET A 53 -11.143 -7.567 0.785 1.00 0.260 C ATOM 813 CG MET A 53 -10.738 -6.262 0.087 1.00 0.260 C ATOM 814 SD MET A 53 -8.999 -6.289 -0.465 1.00 0.260 S ATOM 815 CE MET A 53 -8.114 -6.080 1.074 1.00 0.260 C ATOM 816 H MET A 53 -12.864 -9.772 1.344 1.00 0.180 H ATOM 817 HA MET A 53 -12.732 -6.880 2.055 1.00 0.240 H ATOM 818 1HB MET A 53 -10.476 -7.720 1.621 1.00 0.310 H ATOM 819 2HB MET A 53 -10.968 -8.380 0.094 1.00 0.310 H ATOM 820 1HG MET A 53 -11.364 -6.094 -0.789 1.00 0.310 H ATOM 821 2HG MET A 53 -10.874 -5.421 0.766 1.00 0.310 H ATOM 822 1HE MET A 53 -7.047 -6.081 0.880 1.00 0.310 H ATOM 823 2HE MET A 53 -8.397 -5.131 1.531 1.00 0.310 H ATOM 824 3HE MET A 53 -8.352 -6.888 1.749 1.00 0.310 H ATOM 825 N ASN A 54 -14.075 -6.184 0.078 1.00 0.180 N ATOM 826 CA ASN A 54 -14.980 -5.772 -0.992 1.00 0.160 C ATOM 827 C ASN A 54 -14.169 -5.110 -2.098 1.00 0.160 C ATOM 828 O ASN A 54 -13.550 -4.064 -1.873 1.00 0.160 O ATOM 829 CB ASN A 54 -16.106 -4.887 -0.487 1.00 0.230 C ATOM 830 CG ASN A 54 -17.144 -4.555 -1.572 1.00 0.230 C ATOM 831 OD1 ASN A 54 -16.841 -4.387 -2.773 1.00 0.230 O ATOM 832 ND2 ASN A 54 -18.389 -4.462 -1.153 1.00 0.230 N ATOM 833 H ASN A 54 -13.772 -5.491 0.751 1.00 0.220 H ATOM 834 HA ASN A 54 -15.436 -6.665 -1.425 1.00 0.190 H ATOM 835 1HB ASN A 54 -16.617 -5.397 0.331 1.00 0.280 H ATOM 836 2HB ASN A 54 -15.710 -3.969 -0.087 1.00 0.280 H ATOM 837 1HD2 ASN A 54 -19.124 -4.248 -1.804 1.00 0.280 H ATOM 838 2HD2 ASN A 54 -18.607 -4.602 -0.185 1.00 0.280 H ATOM 839 N ALA A 55 -14.148 -5.724 -3.273 1.00 0.200 N ATOM 840 CA ALA A 55 -13.333 -5.275 -4.403 1.00 0.230 C ATOM 841 C ALA A 55 -13.597 -3.831 -4.824 1.00 0.230 C ATOM 842 O ALA A 55 -12.718 -3.172 -5.382 1.00 0.280 O ATOM 843 CB ALA A 55 -13.603 -6.153 -5.607 1.00 0.310 C ATOM 844 H ALA A 55 -14.712 -6.558 -3.375 1.00 0.240 H ATOM 845 HA ALA A 55 -12.288 -5.361 -4.109 1.00 0.280 H ATOM 846 1HB ALA A 55 -12.965 -5.840 -6.433 1.00 0.370 H ATOM 847 2HB ALA A 55 -13.400 -7.171 -5.363 1.00 0.370 H ATOM 848 3HB ALA A 55 -14.649 -6.050 -5.898 1.00 0.370 H ATOM 849 N ASP A 56 -14.808 -3.343 -4.590 1.00 0.210 N ATOM 850 CA ASP A 56 -15.177 -2.005 -5.023 1.00 0.240 C ATOM 851 C ASP A 56 -14.913 -0.935 -3.965 1.00 0.210 C ATOM 852 O ASP A 56 -15.258 0.234 -4.162 1.00 0.260 O ATOM 853 CB ASP A 56 -16.659 -1.985 -5.395 1.00 0.320 C ATOM 854 CG ASP A 56 -17.003 -2.844 -6.628 1.00 0.320 C ATOM 855 OD1 ASP A 56 -16.185 -2.998 -7.511 1.00 0.320 O ATOM 856 OD2 ASP A 56 -18.096 -3.351 -6.656 1.00 0.320 O ATOM 857 H ASP A 56 -15.498 -3.904 -4.087 1.00 0.250 H ATOM 858 HA ASP A 56 -14.593 -1.760 -5.908 1.00 0.290 H ATOM 859 1HB ASP A 56 -17.243 -2.346 -4.548 1.00 0.390 H ATOM 860 2HB ASP A 56 -16.968 -0.960 -5.590 1.00 0.390 H ATOM 861 N THR A 57 -14.320 -1.314 -2.835 1.00 0.160 N ATOM 862 CA THR A 57 -14.085 -0.341 -1.780 1.00 0.140 C ATOM 863 C THR A 57 -13.195 0.781 -2.285 1.00 0.130 C ATOM 864 O THR A 57 -12.107 0.534 -2.831 1.00 0.120 O ATOM 865 CB THR A 57 -13.383 -0.976 -0.555 1.00 0.200 C ATOM 866 OG1 THR A 57 -14.145 -2.072 -0.086 1.00 0.200 O ATOM 867 CG2 THR A 57 -13.268 0.054 0.582 1.00 0.200 C ATOM 868 H THR A 57 -14.026 -2.283 -2.700 1.00 0.190 H ATOM 869 HA THR A 57 -15.041 0.082 -1.470 1.00 0.170 H ATOM 870 HB THR A 57 -12.391 -1.326 -0.839 1.00 0.240 H ATOM 871 HG1 THR A 57 -14.037 -2.803 -0.726 1.00 0.240 H ATOM 872 1HG2 THR A 57 -12.785 -0.411 1.437 1.00 0.240 H ATOM 873 2HG2 THR A 57 -12.676 0.903 0.264 1.00 0.240 H ATOM 874 3HG2 THR A 57 -14.255 0.392 0.868 1.00 0.240 H ATOM 875 N ASP A 58 -13.657 2.006 -2.080 1.00 0.180 N ATOM 876 CA ASP A 58 -12.922 3.195 -2.439 1.00 0.190 C ATOM 877 C ASP A 58 -12.421 3.863 -1.165 1.00 0.150 C ATOM 878 O ASP A 58 -12.726 3.411 -0.054 1.00 0.150 O ATOM 879 CB ASP A 58 -13.812 4.118 -3.286 1.00 0.260 C ATOM 880 CG ASP A 58 -13.035 5.079 -4.209 1.00 0.260 C ATOM 881 OD1 ASP A 58 -11.899 5.388 -3.897 1.00 0.260 O ATOM 882 OD2 ASP A 58 -13.577 5.483 -5.200 1.00 0.260 O ATOM 883 H ASP A 58 -14.566 2.095 -1.659 1.00 0.220 H ATOM 884 HA ASP A 58 -12.055 2.915 -3.032 1.00 0.230 H ATOM 885 1HB ASP A 58 -14.467 3.499 -3.907 1.00 0.310 H ATOM 886 2HB ASP A 58 -14.454 4.705 -2.629 1.00 0.310 H ATOM 887 N TYR A 59 -11.716 4.968 -1.317 1.00 0.180 N ATOM 888 CA TYR A 59 -11.163 5.693 -0.190 1.00 0.200 C ATOM 889 C TYR A 59 -12.244 6.162 0.775 1.00 0.190 C ATOM 890 O TYR A 59 -12.162 5.896 1.976 1.00 0.200 O ATOM 891 CB TYR A 59 -10.355 6.888 -0.688 1.00 0.270 C ATOM 892 CG TYR A 59 -9.719 7.655 0.412 1.00 0.270 C ATOM 893 CD1 TYR A 59 -8.489 7.234 0.900 1.00 0.270 C ATOM 894 CD2 TYR A 59 -10.357 8.753 0.964 1.00 0.270 C ATOM 895 CE1 TYR A 59 -7.904 7.911 1.926 1.00 0.270 C ATOM 896 CE2 TYR A 59 -9.773 9.425 1.999 1.00 0.270 C ATOM 897 CZ TYR A 59 -8.553 9.012 2.480 1.00 0.270 C ATOM 898 OH TYR A 59 -7.976 9.674 3.522 1.00 0.270 O ATOM 899 H TYR A 59 -11.529 5.282 -2.269 1.00 0.220 H ATOM 900 HA TYR A 59 -10.501 5.021 0.357 1.00 0.240 H ATOM 901 1HB TYR A 59 -9.572 6.543 -1.364 1.00 0.330 H ATOM 902 2HB TYR A 59 -11.001 7.560 -1.251 1.00 0.330 H ATOM 903 HD1 TYR A 59 -7.992 6.364 0.467 1.00 0.330 H ATOM 904 HD2 TYR A 59 -11.326 9.077 0.586 1.00 0.330 H ATOM 905 HE1 TYR A 59 -6.937 7.582 2.311 1.00 0.330 H ATOM 906 HE2 TYR A 59 -10.277 10.285 2.448 1.00 0.330 H ATOM 907 HH TYR A 59 -8.557 10.402 3.797 1.00 0.330 H ATOM 908 N SER A 60 -13.260 6.867 0.249 1.00 0.180 N ATOM 909 CA SER A 60 -14.323 7.419 1.085 1.00 0.200 C ATOM 910 C SER A 60 -15.152 6.354 1.787 1.00 0.200 C ATOM 911 O SER A 60 -15.626 6.564 2.909 1.00 0.240 O ATOM 912 CB SER A 60 -15.233 8.274 0.232 1.00 0.270 C ATOM 913 OG SER A 60 -15.897 7.488 -0.726 1.00 0.270 O ATOM 914 H SER A 60 -13.284 7.046 -0.746 1.00 0.220 H ATOM 915 HA SER A 60 -13.859 8.049 1.847 1.00 0.240 H ATOM 916 1HB SER A 60 -15.964 8.773 0.867 1.00 0.330 H ATOM 917 2HB SER A 60 -14.648 9.045 -0.266 1.00 0.330 H ATOM 918 HG SER A 60 -16.499 8.085 -1.186 1.00 0.330 H ATOM 919 N ILE A 61 -15.273 5.188 1.165 1.00 0.190 N ATOM 920 CA ILE A 61 -16.012 4.093 1.761 1.00 0.190 C ATOM 921 C ILE A 61 -15.248 3.573 2.953 1.00 0.170 C ATOM 922 O ILE A 61 -15.816 3.387 4.033 1.00 0.180 O ATOM 923 CB ILE A 61 -16.253 2.946 0.757 1.00 0.270 C ATOM 924 CG1 ILE A 61 -17.204 3.441 -0.361 1.00 0.270 C ATOM 925 CG2 ILE A 61 -16.832 1.709 1.493 1.00 0.270 C ATOM 926 CD1 ILE A 61 -17.311 2.526 -1.582 1.00 0.270 C ATOM 927 H ILE A 61 -14.884 5.107 0.236 1.00 0.230 H ATOM 928 HA ILE A 61 -16.975 4.467 2.106 1.00 0.230 H ATOM 929 HB ILE A 61 -15.309 2.677 0.292 1.00 0.320 H ATOM 930 1HG1 ILE A 61 -18.199 3.555 0.067 1.00 0.320 H ATOM 931 2HG1 ILE A 61 -16.864 4.421 -0.700 1.00 0.320 H ATOM 932 1HG2 ILE A 61 -16.992 0.898 0.792 1.00 0.320 H ATOM 933 2HG2 ILE A 61 -16.144 1.363 2.263 1.00 0.320 H ATOM 934 3HG2 ILE A 61 -17.782 1.976 1.960 1.00 0.320 H ATOM 935 1HD1 ILE A 61 -18.007 2.972 -2.294 1.00 0.320 H ATOM 936 2HD1 ILE A 61 -16.357 2.415 -2.060 1.00 0.320 H ATOM 937 3HD1 ILE A 61 -17.682 1.548 -1.295 1.00 0.320 H ATOM 938 N ALA A 62 -13.956 3.309 2.749 1.00 0.140 N ATOM 939 CA ALA A 62 -13.126 2.801 3.817 1.00 0.130 C ATOM 940 C ALA A 62 -13.039 3.786 4.970 1.00 0.140 C ATOM 941 O ALA A 62 -13.100 3.383 6.138 1.00 0.130 O ATOM 942 CB ALA A 62 -11.736 2.516 3.290 1.00 0.190 C ATOM 943 H ALA A 62 -13.542 3.466 1.824 1.00 0.170 H ATOM 944 HA ALA A 62 -13.572 1.879 4.185 1.00 0.160 H ATOM 945 1HB ALA A 62 -11.117 2.113 4.087 1.00 0.220 H ATOM 946 2HB ALA A 62 -11.797 1.800 2.479 1.00 0.220 H ATOM 947 3HB ALA A 62 -11.298 3.445 2.918 1.00 0.220 H ATOM 948 N GLU A 63 -12.916 5.083 4.655 1.00 0.170 N ATOM 949 CA GLU A 63 -12.812 6.074 5.701 1.00 0.200 C ATOM 950 C GLU A 63 -14.087 6.105 6.518 1.00 0.200 C ATOM 951 O GLU A 63 -14.026 6.126 7.752 1.00 0.200 O ATOM 952 CB GLU A 63 -12.500 7.464 5.141 1.00 0.270 C ATOM 953 CG GLU A 63 -12.251 8.492 6.241 1.00 0.270 C ATOM 954 CD GLU A 63 -11.870 9.858 5.772 1.00 0.270 C ATOM 955 OE1 GLU A 63 -12.101 10.192 4.640 1.00 0.270 O ATOM 956 OE2 GLU A 63 -11.320 10.570 6.576 1.00 0.270 O ATOM 957 H GLU A 63 -12.845 5.373 3.674 1.00 0.200 H ATOM 958 HA GLU A 63 -11.995 5.790 6.362 1.00 0.240 H ATOM 959 1HB GLU A 63 -11.619 7.414 4.496 1.00 0.320 H ATOM 960 2HB GLU A 63 -13.336 7.805 4.528 1.00 0.320 H ATOM 961 1HG GLU A 63 -13.164 8.585 6.817 1.00 0.320 H ATOM 962 2HG GLU A 63 -11.476 8.115 6.910 1.00 0.320 H ATOM 963 N ALA A 64 -15.248 6.098 5.846 1.00 0.220 N ATOM 964 CA ALA A 64 -16.507 6.114 6.560 1.00 0.240 C ATOM 965 C ALA A 64 -16.653 4.886 7.435 1.00 0.210 C ATOM 966 O ALA A 64 -17.089 4.995 8.580 1.00 0.220 O ATOM 967 CB ALA A 64 -17.658 6.171 5.580 1.00 0.330 C ATOM 968 H ALA A 64 -15.260 6.109 4.821 1.00 0.260 H ATOM 969 HA ALA A 64 -16.526 6.996 7.195 1.00 0.290 H ATOM 970 1HB ALA A 64 -18.595 6.200 6.121 1.00 0.390 H ATOM 971 2HB ALA A 64 -17.560 7.062 4.960 1.00 0.390 H ATOM 972 3HB ALA A 64 -17.628 5.284 4.943 1.00 0.390 H ATOM 973 N ALA A 65 -16.264 3.713 6.922 1.00 0.180 N ATOM 974 CA ALA A 65 -16.381 2.488 7.691 1.00 0.170 C ATOM 975 C ALA A 65 -15.549 2.559 8.962 1.00 0.140 C ATOM 976 O ALA A 65 -15.960 2.115 10.045 1.00 0.160 O ATOM 977 CB ALA A 65 -15.929 1.309 6.847 1.00 0.240 C ATOM 978 H ALA A 65 -15.929 3.660 5.953 1.00 0.220 H ATOM 979 HA ALA A 65 -17.427 2.359 7.966 1.00 0.200 H ATOM 980 1HB ALA A 65 -16.035 0.385 7.406 1.00 0.290 H ATOM 981 2HB ALA A 65 -16.546 1.262 5.948 1.00 0.290 H ATOM 982 3HB ALA A 65 -14.887 1.445 6.567 1.00 0.290 H ATOM 983 N PHE A 66 -14.362 3.145 8.866 1.00 0.120 N ATOM 984 CA PHE A 66 -13.547 3.242 10.061 1.00 0.110 C ATOM 985 C PHE A 66 -14.173 4.240 11.030 1.00 0.120 C ATOM 986 O PHE A 66 -14.372 3.948 12.211 1.00 0.120 O ATOM 987 CB PHE A 66 -12.119 3.626 9.711 1.00 0.160 C ATOM 988 CG PHE A 66 -11.163 3.536 10.872 1.00 0.160 C ATOM 989 CD1 PHE A 66 -10.704 2.283 11.301 1.00 0.160 C ATOM 990 CD2 PHE A 66 -10.705 4.655 11.524 1.00 0.160 C ATOM 991 CE1 PHE A 66 -9.829 2.166 12.334 1.00 0.160 C ATOM 992 CE2 PHE A 66 -9.810 4.528 12.567 1.00 0.160 C ATOM 993 CZ PHE A 66 -9.379 3.286 12.968 1.00 0.160 C ATOM 994 H PHE A 66 -14.009 3.453 7.950 1.00 0.140 H ATOM 995 HA PHE A 66 -13.528 2.276 10.559 1.00 0.130 H ATOM 996 1HB PHE A 66 -11.767 2.979 8.918 1.00 0.190 H ATOM 997 2HB PHE A 66 -12.105 4.650 9.325 1.00 0.190 H ATOM 998 HD1 PHE A 66 -11.041 1.391 10.810 1.00 0.190 H ATOM 999 HD2 PHE A 66 -11.056 5.635 11.204 1.00 0.190 H ATOM 1000 HE1 PHE A 66 -9.489 1.177 12.654 1.00 0.190 H ATOM 1001 HE2 PHE A 66 -9.448 5.400 13.078 1.00 0.190 H ATOM 1002 HZ PHE A 66 -8.680 3.190 13.788 1.00 0.190 H ATOM 1003 N ASN A 67 -14.547 5.416 10.526 1.00 0.130 N ATOM 1004 CA ASN A 67 -15.080 6.466 11.381 1.00 0.130 C ATOM 1005 C ASN A 67 -16.393 6.098 12.066 1.00 0.120 C ATOM 1006 O ASN A 67 -16.654 6.516 13.194 1.00 0.140 O ATOM 1007 CB ASN A 67 -15.192 7.752 10.605 1.00 0.180 C ATOM 1008 CG ASN A 67 -13.832 8.328 10.370 1.00 0.180 C ATOM 1009 OD1 ASN A 67 -12.883 7.949 11.054 1.00 0.180 O ATOM 1010 ND2 ASN A 67 -13.711 9.221 9.439 1.00 0.180 N ATOM 1011 H ASN A 67 -14.412 5.602 9.527 1.00 0.160 H ATOM 1012 HA ASN A 67 -14.369 6.629 12.164 1.00 0.160 H ATOM 1013 1HB ASN A 67 -15.669 7.556 9.642 1.00 0.220 H ATOM 1014 2HB ASN A 67 -15.806 8.467 11.146 1.00 0.220 H ATOM 1015 1HD2 ASN A 67 -12.811 9.622 9.243 1.00 0.220 H ATOM 1016 2HD2 ASN A 67 -14.507 9.500 8.903 1.00 0.220 H ATOM 1017 N LYS A 68 -17.199 5.270 11.415 1.00 0.130 N ATOM 1018 CA LYS A 68 -18.468 4.819 11.966 1.00 0.140 C ATOM 1019 C LYS A 68 -18.329 3.579 12.855 1.00 0.150 C ATOM 1020 O LYS A 68 -19.321 3.112 13.419 1.00 0.250 O ATOM 1021 CB LYS A 68 -19.451 4.514 10.836 1.00 0.190 C ATOM 1022 CG LYS A 68 -19.901 5.724 10.026 1.00 0.190 C ATOM 1023 CD LYS A 68 -20.841 5.294 8.903 1.00 0.190 C ATOM 1024 CE LYS A 68 -21.320 6.479 8.078 1.00 0.190 C ATOM 1025 NZ LYS A 68 -22.219 6.050 6.964 1.00 0.190 N ATOM 1026 H LYS A 68 -16.956 4.997 10.458 1.00 0.160 H ATOM 1027 HA LYS A 68 -18.876 5.622 12.578 1.00 0.170 H ATOM 1028 1HB LYS A 68 -18.979 3.814 10.139 1.00 0.230 H ATOM 1029 2HB LYS A 68 -20.334 4.022 11.240 1.00 0.230 H ATOM 1030 1HG LYS A 68 -20.418 6.423 10.683 1.00 0.230 H ATOM 1031 2HG LYS A 68 -19.033 6.226 9.603 1.00 0.230 H ATOM 1032 1HD LYS A 68 -20.313 4.593 8.247 1.00 0.230 H ATOM 1033 2HD LYS A 68 -21.703 4.781 9.327 1.00 0.230 H ATOM 1034 1HE LYS A 68 -21.861 7.168 8.723 1.00 0.230 H ATOM 1035 2HE LYS A 68 -20.456 6.993 7.657 1.00 0.230 H ATOM 1036 1HZ LYS A 68 -22.517 6.859 6.437 1.00 0.230 H ATOM 1037 2HZ LYS A 68 -21.721 5.415 6.353 1.00 0.230 H ATOM 1038 3HZ LYS A 68 -23.028 5.578 7.345 1.00 0.230 H ATOM 1039 N GLY A 69 -17.118 3.017 12.963 1.00 0.130 N ATOM 1040 CA GLY A 69 -16.895 1.810 13.744 1.00 0.130 C ATOM 1041 C GLY A 69 -17.308 0.498 13.055 1.00 0.140 C ATOM 1042 O GLY A 69 -17.559 -0.493 13.745 1.00 0.170 O ATOM 1043 H GLY A 69 -16.301 3.452 12.525 1.00 0.160 H ATOM 1044 1HA GLY A 69 -15.834 1.758 13.993 1.00 0.160 H ATOM 1045 2HA GLY A 69 -17.427 1.901 14.689 1.00 0.160 H ATOM 1046 N GLU A 70 -17.420 0.481 11.714 1.00 0.140 N ATOM 1047 CA GLU A 70 -17.824 -0.723 10.987 1.00 0.150 C ATOM 1048 C GLU A 70 -16.637 -1.681 10.876 1.00 0.160 C ATOM 1049 O GLU A 70 -16.799 -2.903 10.892 1.00 0.330 O ATOM 1050 CB GLU A 70 -18.332 -0.365 9.592 1.00 0.210 C ATOM 1051 CG GLU A 70 -19.620 0.452 9.564 1.00 0.210 C ATOM 1052 CD GLU A 70 -20.040 0.831 8.163 1.00 0.210 C ATOM 1053 OE1 GLU A 70 -19.311 0.526 7.247 1.00 0.210 O ATOM 1054 OE2 GLU A 70 -21.080 1.427 8.011 1.00 0.210 O ATOM 1055 H GLU A 70 -17.164 1.296 11.158 1.00 0.170 H ATOM 1056 HA GLU A 70 -18.621 -1.219 11.541 1.00 0.180 H ATOM 1057 1HB GLU A 70 -17.579 0.197 9.087 1.00 0.250 H ATOM 1058 2HB GLU A 70 -18.498 -1.277 9.020 1.00 0.250 H ATOM 1059 1HG GLU A 70 -20.414 -0.126 10.032 1.00 0.250 H ATOM 1060 2HG GLU A 70 -19.470 1.356 10.153 1.00 0.250 H ATOM 1061 N THR A 71 -15.444 -1.099 10.762 1.00 0.170 N ATOM 1062 CA THR A 71 -14.186 -1.845 10.674 1.00 0.140 C ATOM 1063 C THR A 71 -13.266 -1.538 11.834 1.00 0.140 C ATOM 1064 O THR A 71 -13.184 -0.408 12.315 1.00 0.140 O ATOM 1065 CB THR A 71 -13.369 -1.608 9.386 1.00 0.210 C ATOM 1066 OG1 THR A 71 -12.107 -2.321 9.530 1.00 0.210 O ATOM 1067 CG2 THR A 71 -13.101 -0.169 9.186 1.00 0.210 C ATOM 1068 H THR A 71 -15.440 -0.080 10.725 1.00 0.200 H ATOM 1069 HA THR A 71 -14.418 -2.909 10.716 1.00 0.170 H ATOM 1070 HB THR A 71 -13.912 -1.999 8.528 1.00 0.250 H ATOM 1071 HG1 THR A 71 -11.475 -2.085 8.792 1.00 0.250 H ATOM 1072 1HG2 THR A 71 -12.509 -0.025 8.282 1.00 0.250 H ATOM 1073 2HG2 THR A 71 -14.031 0.333 9.090 1.00 0.250 H ATOM 1074 3HG2 THR A 71 -12.568 0.208 10.014 1.00 0.250 H ATOM 1075 N ALA A 72 -12.555 -2.558 12.299 1.00 0.140 N ATOM 1076 CA ALA A 72 -11.571 -2.372 13.359 1.00 0.140 C ATOM 1077 C ALA A 72 -10.238 -1.863 12.803 1.00 0.120 C ATOM 1078 O ALA A 72 -9.327 -1.531 13.562 1.00 0.140 O ATOM 1079 CB ALA A 72 -11.348 -3.676 14.108 1.00 0.200 C ATOM 1080 H ALA A 72 -12.684 -3.468 11.876 1.00 0.170 H ATOM 1081 HA ALA A 72 -11.955 -1.624 14.051 1.00 0.170 H ATOM 1082 1HB ALA A 72 -10.629 -3.513 14.911 1.00 0.240 H ATOM 1083 2HB ALA A 72 -12.291 -4.022 14.528 1.00 0.240 H ATOM 1084 3HB ALA A 72 -10.959 -4.425 13.420 1.00 0.240 H ATOM 1085 N MET A 73 -10.109 -1.844 11.479 1.00 0.100 N ATOM 1086 CA MET A 73 -8.870 -1.431 10.837 1.00 0.080 C ATOM 1087 C MET A 73 -9.059 -0.815 9.457 1.00 0.060 C ATOM 1088 O MET A 73 -9.921 -1.230 8.663 1.00 0.060 O ATOM 1089 CB MET A 73 -7.889 -2.613 10.745 1.00 0.120 C ATOM 1090 CG MET A 73 -6.560 -2.290 9.989 1.00 0.120 C ATOM 1091 SD MET A 73 -5.345 -3.604 10.002 1.00 0.120 S ATOM 1092 CE MET A 73 -4.129 -2.855 8.902 1.00 0.120 C ATOM 1093 H MET A 73 -10.909 -2.113 10.911 1.00 0.120 H ATOM 1094 HA MET A 73 -8.411 -0.667 11.462 1.00 0.100 H ATOM 1095 1HB MET A 73 -7.630 -2.945 11.751 1.00 0.140 H ATOM 1096 2HB MET A 73 -8.374 -3.447 10.239 1.00 0.140 H ATOM 1097 1HG MET A 73 -6.780 -2.092 8.942 1.00 0.140 H ATOM 1098 2HG MET A 73 -6.098 -1.400 10.416 1.00 0.140 H ATOM 1099 1HE MET A 73 -3.289 -3.526 8.780 1.00 0.140 H ATOM 1100 2HE MET A 73 -4.586 -2.673 7.933 1.00 0.140 H ATOM 1101 3HE MET A 73 -3.784 -1.908 9.322 1.00 0.140 H ATOM 1102 N THR A 74 -8.166 0.128 9.159 1.00 0.060 N ATOM 1103 CA THR A 74 -8.056 0.766 7.861 1.00 0.070 C ATOM 1104 C THR A 74 -6.609 1.197 7.669 1.00 0.080 C ATOM 1105 O THR A 74 -5.884 1.405 8.646 1.00 0.100 O ATOM 1106 CB THR A 74 -8.976 1.988 7.725 1.00 0.090 C ATOM 1107 OG1 THR A 74 -8.960 2.427 6.367 1.00 0.090 O ATOM 1108 CG2 THR A 74 -8.475 3.145 8.619 1.00 0.090 C ATOM 1109 H THR A 74 -7.511 0.409 9.877 1.00 0.070 H ATOM 1110 HA THR A 74 -8.308 0.046 7.083 1.00 0.080 H ATOM 1111 HB THR A 74 -9.988 1.705 8.008 1.00 0.110 H ATOM 1112 HG1 THR A 74 -9.638 3.096 6.245 1.00 0.110 H ATOM 1113 1HG2 THR A 74 -9.141 3.999 8.507 1.00 0.110 H ATOM 1114 2HG2 THR A 74 -8.464 2.828 9.653 1.00 0.110 H ATOM 1115 3HG2 THR A 74 -7.471 3.446 8.331 1.00 0.110 H ATOM 1116 N ILE A 75 -6.186 1.324 6.421 1.00 0.080 N ATOM 1117 CA ILE A 75 -4.844 1.799 6.115 1.00 0.100 C ATOM 1118 C ILE A 75 -4.918 3.187 5.518 1.00 0.130 C ATOM 1119 O ILE A 75 -5.604 3.401 4.520 1.00 0.160 O ATOM 1120 CB ILE A 75 -4.107 0.838 5.156 1.00 0.130 C ATOM 1121 CG1 ILE A 75 -3.986 -0.547 5.854 1.00 0.130 C ATOM 1122 CG2 ILE A 75 -2.725 1.426 4.736 1.00 0.130 C ATOM 1123 CD1 ILE A 75 -3.433 -1.674 4.992 1.00 0.130 C ATOM 1124 H ILE A 75 -6.841 1.137 5.671 1.00 0.100 H ATOM 1125 HA ILE A 75 -4.273 1.862 7.039 1.00 0.120 H ATOM 1126 HB ILE A 75 -4.711 0.694 4.260 1.00 0.160 H ATOM 1127 1HG1 ILE A 75 -3.374 -0.434 6.730 1.00 0.160 H ATOM 1128 2HG1 ILE A 75 -4.978 -0.849 6.177 1.00 0.160 H ATOM 1129 1HG2 ILE A 75 -2.221 0.750 4.054 1.00 0.160 H ATOM 1130 2HG2 ILE A 75 -2.862 2.382 4.234 1.00 0.160 H ATOM 1131 3HG2 ILE A 75 -2.106 1.573 5.617 1.00 0.160 H ATOM 1132 1HD1 ILE A 75 -3.410 -2.594 5.576 1.00 0.160 H ATOM 1133 2HD1 ILE A 75 -4.075 -1.815 4.120 1.00 0.160 H ATOM 1134 3HD1 ILE A 75 -2.426 -1.442 4.662 1.00 0.160 H ATOM 1135 N ASN A 76 -4.222 4.129 6.136 1.00 0.160 N ATOM 1136 CA ASN A 76 -4.246 5.493 5.655 1.00 0.180 C ATOM 1137 C ASN A 76 -3.007 6.233 6.134 1.00 0.170 C ATOM 1138 O ASN A 76 -2.189 5.665 6.860 1.00 0.190 O ATOM 1139 CB ASN A 76 -5.524 6.157 6.143 1.00 0.240 C ATOM 1140 CG ASN A 76 -6.038 7.186 5.230 1.00 0.240 C ATOM 1141 OD1 ASN A 76 -5.246 7.848 4.550 1.00 0.240 O ATOM 1142 ND2 ASN A 76 -7.331 7.357 5.202 1.00 0.240 N ATOM 1143 H ASN A 76 -3.680 3.887 6.956 1.00 0.190 H ATOM 1144 HA ASN A 76 -4.234 5.484 4.571 1.00 0.220 H ATOM 1145 1HB ASN A 76 -6.299 5.403 6.289 1.00 0.290 H ATOM 1146 2HB ASN A 76 -5.337 6.622 7.113 1.00 0.290 H ATOM 1147 1HD2 ASN A 76 -7.709 8.070 4.605 1.00 0.290 H ATOM 1148 2HD2 ASN A 76 -7.931 6.799 5.774 1.00 0.290 H ATOM 1149 N GLY A 77 -2.876 7.497 5.763 1.00 0.190 N ATOM 1150 CA GLY A 77 -1.747 8.270 6.237 1.00 0.180 C ATOM 1151 C GLY A 77 -2.195 9.298 7.268 1.00 0.190 C ATOM 1152 O GLY A 77 -3.395 9.442 7.515 1.00 0.230 O ATOM 1153 H GLY A 77 -3.586 7.900 5.158 1.00 0.230 H ATOM 1154 1HA GLY A 77 -1.028 7.584 6.677 1.00 0.220 H ATOM 1155 2HA GLY A 77 -1.261 8.753 5.402 1.00 0.220 H ATOM 1156 N PRO A 78 -1.251 10.096 7.800 1.00 0.210 N ATOM 1157 CA PRO A 78 -1.426 11.116 8.825 1.00 0.290 C ATOM 1158 C PRO A 78 -2.528 12.124 8.577 1.00 0.310 C ATOM 1159 O PRO A 78 -3.182 12.595 9.509 1.00 0.360 O ATOM 1160 CB PRO A 78 -0.063 11.812 8.818 1.00 0.430 C ATOM 1161 CG PRO A 78 0.903 10.742 8.391 1.00 0.430 C ATOM 1162 CD PRO A 78 0.158 9.949 7.349 1.00 0.430 C ATOM 1163 HA PRO A 78 -1.583 10.620 9.772 1.00 0.350 H ATOM 1164 1HB PRO A 78 -0.082 12.676 8.138 1.00 0.520 H ATOM 1165 2HB PRO A 78 0.156 12.202 9.823 1.00 0.520 H ATOM 1166 1HG PRO A 78 1.830 11.196 8.004 1.00 0.520 H ATOM 1167 2HG PRO A 78 1.189 10.131 9.262 1.00 0.520 H ATOM 1168 1HD PRO A 78 0.303 10.386 6.348 1.00 0.520 H ATOM 1169 2HD PRO A 78 0.510 8.914 7.410 1.00 0.520 H ATOM 1170 N TRP A 79 -2.780 12.443 7.317 1.00 0.330 N ATOM 1171 CA TRP A 79 -3.802 13.417 6.991 1.00 0.390 C ATOM 1172 C TRP A 79 -5.210 13.002 7.402 1.00 0.370 C ATOM 1173 O TRP A 79 -6.095 13.846 7.540 1.00 0.480 O ATOM 1174 CB TRP A 79 -3.794 13.660 5.482 1.00 0.520 C ATOM 1175 CG TRP A 79 -4.090 12.408 4.687 1.00 0.520 C ATOM 1176 CD1 TRP A 79 -5.323 11.912 4.390 1.00 0.520 C ATOM 1177 CD2 TRP A 79 -3.138 11.501 4.071 1.00 0.520 C ATOM 1178 NE1 TRP A 79 -5.212 10.768 3.660 1.00 0.520 N ATOM 1179 CE2 TRP A 79 -3.883 10.498 3.446 1.00 0.520 C ATOM 1180 CE3 TRP A 79 -1.734 11.463 3.995 1.00 0.520 C ATOM 1181 CZ2 TRP A 79 -3.283 9.458 2.754 1.00 0.520 C ATOM 1182 CZ3 TRP A 79 -1.132 10.422 3.289 1.00 0.520 C ATOM 1183 CH2 TRP A 79 -1.890 9.442 2.686 1.00 0.520 C ATOM 1184 H TRP A 79 -2.244 12.059 6.553 1.00 0.400 H ATOM 1185 HA TRP A 79 -3.556 14.348 7.501 1.00 0.470 H ATOM 1186 1HB TRP A 79 -4.543 14.411 5.230 1.00 0.630 H ATOM 1187 2HB TRP A 79 -2.825 14.044 5.178 1.00 0.630 H ATOM 1188 HD1 TRP A 79 -6.266 12.358 4.700 1.00 0.630 H ATOM 1189 HE1 TRP A 79 -6.017 10.219 3.341 1.00 0.630 H ATOM 1190 HE3 TRP A 79 -1.126 12.232 4.467 1.00 0.630 H ATOM 1191 HZ2 TRP A 79 -3.869 8.681 2.274 1.00 0.630 H ATOM 1192 HZ3 TRP A 79 -0.043 10.399 3.227 1.00 0.630 H ATOM 1193 HH2 TRP A 79 -1.388 8.638 2.142 1.00 0.630 H ATOM 1194 N ALA A 80 -5.434 11.703 7.592 1.00 0.250 N ATOM 1195 CA ALA A 80 -6.753 11.200 7.930 1.00 0.210 C ATOM 1196 C ALA A 80 -7.052 11.259 9.413 1.00 0.200 C ATOM 1197 O ALA A 80 -8.199 11.061 9.831 1.00 0.210 O ATOM 1198 CB ALA A 80 -6.876 9.775 7.456 1.00 0.310 C ATOM 1199 H ALA A 80 -4.659 11.035 7.502 1.00 0.300 H ATOM 1200 HA ALA A 80 -7.488 11.813 7.411 1.00 0.250 H ATOM 1201 1HB ALA A 80 -7.876 9.398 7.665 1.00 0.370 H ATOM 1202 2HB ALA A 80 -6.690 9.761 6.387 1.00 0.370 H ATOM 1203 3HB ALA A 80 -6.133 9.162 7.969 1.00 0.370 H ATOM 1204 N TRP A 81 -6.046 11.545 10.228 1.00 0.250 N ATOM 1205 CA TRP A 81 -6.256 11.490 11.660 1.00 0.290 C ATOM 1206 C TRP A 81 -7.213 12.572 12.139 1.00 0.290 C ATOM 1207 O TRP A 81 -7.924 12.378 13.128 1.00 0.290 O ATOM 1208 CB TRP A 81 -4.905 11.545 12.367 1.00 0.390 C ATOM 1209 CG TRP A 81 -4.042 10.310 12.045 1.00 0.390 C ATOM 1210 CD1 TRP A 81 -4.467 9.119 11.518 1.00 0.390 C ATOM 1211 CD2 TRP A 81 -2.616 10.176 12.191 1.00 0.390 C ATOM 1212 NE1 TRP A 81 -3.415 8.284 11.324 1.00 0.390 N ATOM 1213 CE2 TRP A 81 -2.277 8.903 11.718 1.00 0.390 C ATOM 1214 CE3 TRP A 81 -1.607 11.021 12.654 1.00 0.390 C ATOM 1215 CZ2 TRP A 81 -0.977 8.460 11.685 1.00 0.390 C ATOM 1216 CZ3 TRP A 81 -0.296 10.567 12.625 1.00 0.390 C ATOM 1217 CH2 TRP A 81 0.008 9.321 12.150 1.00 0.390 C ATOM 1218 H TRP A 81 -5.117 11.783 9.857 1.00 0.300 H ATOM 1219 HA TRP A 81 -6.713 10.538 11.906 1.00 0.350 H ATOM 1220 1HB TRP A 81 -4.365 12.434 12.036 1.00 0.470 H ATOM 1221 2HB TRP A 81 -5.047 11.621 13.437 1.00 0.470 H ATOM 1222 HD1 TRP A 81 -5.472 8.867 11.269 1.00 0.470 H ATOM 1223 HE1 TRP A 81 -3.469 7.352 10.932 1.00 0.470 H ATOM 1224 HE3 TRP A 81 -1.844 12.018 13.022 1.00 0.470 H ATOM 1225 HZ2 TRP A 81 -0.715 7.474 11.307 1.00 0.470 H ATOM 1226 HZ3 TRP A 81 0.487 11.232 12.985 1.00 0.470 H ATOM 1227 HH2 TRP A 81 1.047 8.998 12.136 1.00 0.470 H ATOM 1228 N SER A 82 -7.285 13.703 11.433 1.00 0.310 N ATOM 1229 CA SER A 82 -8.175 14.779 11.834 1.00 0.310 C ATOM 1230 C SER A 82 -9.639 14.348 11.804 1.00 0.290 C ATOM 1231 O SER A 82 -10.411 14.699 12.708 1.00 0.300 O ATOM 1232 CB SER A 82 -7.990 15.967 10.905 1.00 0.430 C ATOM 1233 OG SER A 82 -6.707 16.525 11.035 1.00 0.430 O ATOM 1234 H SER A 82 -6.685 13.855 10.630 1.00 0.370 H ATOM 1235 HA SER A 82 -7.922 15.076 12.853 1.00 0.370 H ATOM 1236 1HB SER A 82 -8.146 15.645 9.873 1.00 0.520 H ATOM 1237 2HB SER A 82 -8.743 16.721 11.128 1.00 0.520 H ATOM 1238 HG SER A 82 -6.677 17.263 10.419 1.00 0.520 H ATOM 1239 N ASN A 83 -10.022 13.580 10.777 1.00 0.290 N ATOM 1240 CA ASN A 83 -11.403 13.146 10.627 1.00 0.280 C ATOM 1241 C ASN A 83 -11.726 12.049 11.629 1.00 0.250 C ATOM 1242 O ASN A 83 -12.839 11.990 12.172 1.00 0.260 O ATOM 1243 CB ASN A 83 -11.648 12.672 9.214 1.00 0.400 C ATOM 1244 CG ASN A 83 -11.646 13.798 8.213 1.00 0.400 C ATOM 1245 OD1 ASN A 83 -11.815 14.981 8.549 1.00 0.400 O ATOM 1246 ND2 ASN A 83 -11.463 13.450 6.969 1.00 0.400 N ATOM 1247 H ASN A 83 -9.337 13.311 10.078 1.00 0.350 H ATOM 1248 HA ASN A 83 -12.059 13.991 10.835 1.00 0.340 H ATOM 1249 1HB ASN A 83 -10.869 11.952 8.932 1.00 0.480 H ATOM 1250 2HB ASN A 83 -12.602 12.151 9.159 1.00 0.480 H ATOM 1251 1HD2 ASN A 83 -11.455 14.141 6.250 1.00 0.480 H ATOM 1252 2HD2 ASN A 83 -11.340 12.464 6.727 1.00 0.480 H ATOM 1253 N ILE A 84 -10.738 11.201 11.891 1.00 0.240 N ATOM 1254 CA ILE A 84 -10.895 10.090 12.813 1.00 0.220 C ATOM 1255 C ILE A 84 -11.112 10.626 14.240 1.00 0.230 C ATOM 1256 O ILE A 84 -12.002 10.165 14.970 1.00 0.240 O ATOM 1257 CB ILE A 84 -9.674 9.166 12.719 1.00 0.320 C ATOM 1258 CG1 ILE A 84 -9.631 8.502 11.317 1.00 0.320 C ATOM 1259 CG2 ILE A 84 -9.808 8.113 13.728 1.00 0.320 C ATOM 1260 CD1 ILE A 84 -8.334 7.816 10.960 1.00 0.320 C ATOM 1261 H ILE A 84 -9.857 11.303 11.373 1.00 0.290 H ATOM 1262 HA ILE A 84 -11.777 9.526 12.533 1.00 0.260 H ATOM 1263 HB ILE A 84 -8.764 9.734 12.882 1.00 0.380 H ATOM 1264 1HG1 ILE A 84 -10.415 7.772 11.271 1.00 0.380 H ATOM 1265 2HG1 ILE A 84 -9.831 9.260 10.563 1.00 0.380 H ATOM 1266 1HG2 ILE A 84 -8.965 7.459 13.683 1.00 0.380 H ATOM 1267 2HG2 ILE A 84 -9.863 8.556 14.705 1.00 0.380 H ATOM 1268 3HG2 ILE A 84 -10.716 7.557 13.529 1.00 0.380 H ATOM 1269 1HD1 ILE A 84 -8.422 7.391 9.960 1.00 0.380 H ATOM 1270 2HD1 ILE A 84 -7.556 8.545 10.965 1.00 0.380 H ATOM 1271 3HD1 ILE A 84 -8.100 7.025 11.659 1.00 0.380 H ATOM 1272 N ASP A 85 -10.288 11.606 14.635 1.00 0.250 N ATOM 1273 CA ASP A 85 -10.402 12.246 15.940 1.00 0.270 C ATOM 1274 C ASP A 85 -11.751 12.983 16.059 1.00 0.280 C ATOM 1275 O ASP A 85 -12.474 12.822 17.046 1.00 0.350 O ATOM 1276 CB ASP A 85 -9.228 13.216 16.128 1.00 0.370 C ATOM 1277 CG ASP A 85 -9.107 13.838 17.524 1.00 0.370 C ATOM 1278 OD1 ASP A 85 -8.835 13.124 18.463 1.00 0.370 O ATOM 1279 OD2 ASP A 85 -9.279 15.031 17.626 1.00 0.370 O ATOM 1280 H ASP A 85 -9.526 11.903 14.018 1.00 0.300 H ATOM 1281 HA ASP A 85 -10.351 11.477 16.710 1.00 0.320 H ATOM 1282 1HB ASP A 85 -8.298 12.687 15.902 1.00 0.440 H ATOM 1283 2HB ASP A 85 -9.314 14.022 15.395 1.00 0.440 H ATOM 1284 N THR A 86 -12.155 13.693 14.996 1.00 0.250 N ATOM 1285 CA THR A 86 -13.419 14.433 14.949 1.00 0.270 C ATOM 1286 C THR A 86 -14.606 13.501 15.177 1.00 0.320 C ATOM 1287 O THR A 86 -15.570 13.843 15.867 1.00 0.370 O ATOM 1288 CB THR A 86 -13.586 15.173 13.600 1.00 0.370 C ATOM 1289 OG1 THR A 86 -12.528 16.133 13.442 1.00 0.370 O ATOM 1290 CG2 THR A 86 -14.925 15.900 13.544 1.00 0.370 C ATOM 1291 H THR A 86 -11.529 13.801 14.199 1.00 0.300 H ATOM 1292 HA THR A 86 -13.411 15.175 15.746 1.00 0.320 H ATOM 1293 HB THR A 86 -13.536 14.455 12.787 1.00 0.440 H ATOM 1294 HG1 THR A 86 -11.673 15.667 13.332 1.00 0.440 H ATOM 1295 1HG2 THR A 86 -15.009 16.413 12.588 1.00 0.440 H ATOM 1296 2HG2 THR A 86 -15.746 15.194 13.641 1.00 0.440 H ATOM 1297 3HG2 THR A 86 -14.975 16.627 14.353 1.00 0.440 H ATOM 1298 N SER A 87 -14.510 12.307 14.606 1.00 0.300 N ATOM 1299 CA SER A 87 -15.531 11.273 14.651 1.00 0.370 C ATOM 1300 C SER A 87 -15.584 10.521 15.995 1.00 0.380 C ATOM 1301 O SER A 87 -16.426 9.647 16.182 1.00 1.030 O ATOM 1302 CB SER A 87 -15.286 10.299 13.513 1.00 0.490 C ATOM 1303 OG SER A 87 -15.422 10.936 12.267 1.00 0.490 O ATOM 1304 H SER A 87 -13.693 12.133 14.016 1.00 0.360 H ATOM 1305 HA SER A 87 -16.497 11.751 14.494 1.00 0.440 H ATOM 1306 1HB SER A 87 -14.283 9.898 13.591 1.00 0.590 H ATOM 1307 2HB SER A 87 -15.984 9.463 13.583 1.00 0.590 H ATOM 1308 HG SER A 87 -14.582 11.430 12.134 1.00 0.590 H ATOM 1309 N LYS A 88 -14.680 10.842 16.923 1.00 0.740 N ATOM 1310 CA LYS A 88 -14.592 10.228 18.246 1.00 0.830 C ATOM 1311 C LYS A 88 -14.323 8.737 18.198 1.00 0.560 C ATOM 1312 O LYS A 88 -14.880 7.965 18.984 1.00 0.410 O ATOM 1313 CB LYS A 88 -15.865 10.499 19.054 1.00 1.130 C ATOM 1314 CG LYS A 88 -16.160 11.975 19.267 1.00 1.130 C ATOM 1315 CD LYS A 88 -17.402 12.178 20.119 1.00 1.130 C ATOM 1316 CE LYS A 88 -17.727 13.657 20.280 1.00 1.130 C ATOM 1317 NZ LYS A 88 -18.968 13.871 21.081 1.00 1.130 N ATOM 1318 H LYS A 88 -14.001 11.578 16.721 1.00 0.890 H ATOM 1319 HA LYS A 88 -13.752 10.692 18.766 1.00 1.000 H ATOM 1320 1HB LYS A 88 -16.726 10.043 18.575 1.00 1.350 H ATOM 1321 2HB LYS A 88 -15.766 10.042 20.037 1.00 1.350 H ATOM 1322 1HG LYS A 88 -15.306 12.446 19.751 1.00 1.350 H ATOM 1323 2HG LYS A 88 -16.310 12.454 18.297 1.00 1.350 H ATOM 1324 1HD LYS A 88 -18.247 11.677 19.644 1.00 1.350 H ATOM 1325 2HD LYS A 88 -17.245 11.736 21.102 1.00 1.350 H ATOM 1326 1HE LYS A 88 -16.895 14.152 20.778 1.00 1.350 H ATOM 1327 2HE LYS A 88 -17.862 14.101 19.293 1.00 1.350 H ATOM 1328 1HZ LYS A 88 -19.149 14.862 21.164 1.00 1.350 H ATOM 1329 2HZ LYS A 88 -19.750 13.425 20.621 1.00 1.350 H ATOM 1330 3HZ LYS A 88 -18.850 13.474 22.002 1.00 1.350 H ATOM 1331 N VAL A 89 -13.435 8.347 17.299 1.00 0.660 N ATOM 1332 CA VAL A 89 -13.032 6.967 17.160 1.00 0.460 C ATOM 1333 C VAL A 89 -11.910 6.689 18.138 1.00 0.260 C ATOM 1334 O VAL A 89 -10.983 7.487 18.261 1.00 0.410 O ATOM 1335 CB VAL A 89 -12.490 6.717 15.755 1.00 0.720 C ATOM 1336 CG1 VAL A 89 -12.021 5.274 15.581 1.00 0.720 C ATOM 1337 CG2 VAL A 89 -13.504 7.068 14.747 1.00 0.720 C ATOM 1338 H VAL A 89 -13.016 9.048 16.678 1.00 0.790 H ATOM 1339 HA VAL A 89 -13.882 6.316 17.368 1.00 0.550 H ATOM 1340 HB VAL A 89 -11.637 7.347 15.626 1.00 0.870 H ATOM 1341 1HG1 VAL A 89 -11.622 5.153 14.586 1.00 0.870 H ATOM 1342 2HG1 VAL A 89 -11.262 5.029 16.298 1.00 0.870 H ATOM 1343 3HG1 VAL A 89 -12.864 4.598 15.712 1.00 0.870 H ATOM 1344 1HG2 VAL A 89 -13.055 6.924 13.783 1.00 0.870 H ATOM 1345 2HG2 VAL A 89 -14.387 6.434 14.855 1.00 0.870 H ATOM 1346 3HG2 VAL A 89 -13.791 8.099 14.864 1.00 0.870 H ATOM 1347 N ASN A 90 -11.994 5.591 18.865 1.00 0.160 N ATOM 1348 CA ASN A 90 -10.904 5.231 19.753 1.00 0.250 C ATOM 1349 C ASN A 90 -9.913 4.432 18.910 1.00 0.230 C ATOM 1350 O ASN A 90 -10.184 3.279 18.575 1.00 0.500 O ATOM 1351 CB ASN A 90 -11.394 4.422 20.939 1.00 0.310 C ATOM 1352 CG ASN A 90 -10.294 4.135 21.926 1.00 0.310 C ATOM 1353 OD1 ASN A 90 -9.214 4.732 21.843 1.00 0.310 O ATOM 1354 ND2 ASN A 90 -10.547 3.244 22.857 1.00 0.310 N ATOM 1355 H ASN A 90 -12.797 4.988 18.767 1.00 0.190 H ATOM 1356 HA ASN A 90 -10.401 6.132 20.105 1.00 0.300 H ATOM 1357 1HB ASN A 90 -12.191 4.966 21.446 1.00 0.380 H ATOM 1358 2HB ASN A 90 -11.810 3.477 20.591 1.00 0.380 H ATOM 1359 1HD2 ASN A 90 -9.850 3.018 23.539 1.00 0.380 H ATOM 1360 2HD2 ASN A 90 -11.437 2.788 22.884 1.00 0.380 H ATOM 1361 N TYR A 91 -8.804 5.042 18.509 1.00 0.260 N ATOM 1362 CA TYR A 91 -7.896 4.367 17.590 1.00 0.300 C ATOM 1363 C TYR A 91 -6.464 4.639 17.970 1.00 0.270 C ATOM 1364 O TYR A 91 -6.172 5.571 18.721 1.00 0.280 O ATOM 1365 CB TYR A 91 -8.071 4.882 16.156 1.00 0.400 C ATOM 1366 CG TYR A 91 -7.475 6.270 15.909 1.00 0.400 C ATOM 1367 CD1 TYR A 91 -6.260 6.377 15.225 1.00 0.400 C ATOM 1368 CD2 TYR A 91 -8.070 7.406 16.399 1.00 0.400 C ATOM 1369 CE1 TYR A 91 -5.673 7.598 15.015 1.00 0.400 C ATOM 1370 CE2 TYR A 91 -7.470 8.644 16.190 1.00 0.400 C ATOM 1371 CZ TYR A 91 -6.278 8.734 15.500 1.00 0.400 C ATOM 1372 OH TYR A 91 -5.685 9.956 15.303 1.00 0.400 O ATOM 1373 H TYR A 91 -8.611 5.984 18.824 1.00 0.310 H ATOM 1374 HA TYR A 91 -8.066 3.291 17.634 1.00 0.360 H ATOM 1375 1HB TYR A 91 -7.579 4.192 15.479 1.00 0.480 H ATOM 1376 2HB TYR A 91 -9.106 4.906 15.892 1.00 0.480 H ATOM 1377 HD1 TYR A 91 -5.777 5.484 14.847 1.00 0.480 H ATOM 1378 HD2 TYR A 91 -9.001 7.343 16.942 1.00 0.480 H ATOM 1379 HE1 TYR A 91 -4.729 7.664 14.475 1.00 0.480 H ATOM 1380 HE2 TYR A 91 -7.944 9.547 16.576 1.00 0.480 H ATOM 1381 HH TYR A 91 -4.842 9.836 14.852 1.00 0.480 H ATOM 1382 N GLY A 92 -5.566 3.817 17.451 1.00 0.410 N ATOM 1383 CA GLY A 92 -4.153 4.063 17.622 1.00 0.360 C ATOM 1384 C GLY A 92 -3.479 4.018 16.267 1.00 0.250 C ATOM 1385 O GLY A 92 -4.120 3.752 15.247 1.00 0.210 O ATOM 1386 H GLY A 92 -5.870 3.040 16.883 1.00 0.490 H ATOM 1387 1HA GLY A 92 -3.995 5.038 18.083 1.00 0.430 H ATOM 1388 2HA GLY A 92 -3.721 3.311 18.281 1.00 0.430 H ATOM 1389 N VAL A 93 -2.171 4.203 16.269 1.00 0.260 N ATOM 1390 CA VAL A 93 -1.380 4.171 15.054 1.00 0.210 C ATOM 1391 C VAL A 93 -0.290 3.133 15.227 1.00 0.190 C ATOM 1392 O VAL A 93 0.464 3.180 16.198 1.00 0.210 O ATOM 1393 CB VAL A 93 -0.769 5.563 14.779 1.00 0.310 C ATOM 1394 CG1 VAL A 93 0.097 5.526 13.519 1.00 0.310 C ATOM 1395 CG2 VAL A 93 -1.906 6.601 14.632 1.00 0.310 C ATOM 1396 H VAL A 93 -1.709 4.388 17.149 1.00 0.310 H ATOM 1397 HA VAL A 93 -2.014 3.883 14.215 1.00 0.250 H ATOM 1398 HB VAL A 93 -0.124 5.841 15.611 1.00 0.380 H ATOM 1399 1HG1 VAL A 93 0.529 6.508 13.353 1.00 0.380 H ATOM 1400 2HG1 VAL A 93 0.905 4.801 13.636 1.00 0.380 H ATOM 1401 3HG1 VAL A 93 -0.516 5.247 12.662 1.00 0.380 H ATOM 1402 1HG2 VAL A 93 -1.482 7.585 14.452 1.00 0.380 H ATOM 1403 2HG2 VAL A 93 -2.548 6.323 13.796 1.00 0.380 H ATOM 1404 3HG2 VAL A 93 -2.500 6.635 15.541 1.00 0.380 H ATOM 1405 N THR A 94 -0.210 2.184 14.308 1.00 0.200 N ATOM 1406 CA THR A 94 0.805 1.151 14.432 1.00 0.240 C ATOM 1407 C THR A 94 1.485 0.806 13.126 1.00 0.200 C ATOM 1408 O THR A 94 1.259 1.445 12.095 1.00 0.250 O ATOM 1409 CB THR A 94 0.231 -0.123 15.069 1.00 0.320 C ATOM 1410 OG1 THR A 94 1.321 -1.000 15.387 1.00 0.320 O ATOM 1411 CG2 THR A 94 -0.755 -0.818 14.121 1.00 0.320 C ATOM 1412 H THR A 94 -0.847 2.187 13.526 1.00 0.240 H ATOM 1413 HA THR A 94 1.581 1.519 15.102 1.00 0.290 H ATOM 1414 HB THR A 94 -0.285 0.145 15.991 1.00 0.380 H ATOM 1415 HG1 THR A 94 0.999 -1.711 15.958 1.00 0.380 H ATOM 1416 1HG2 THR A 94 -1.145 -1.712 14.604 1.00 0.380 H ATOM 1417 2HG2 THR A 94 -1.577 -0.140 13.898 1.00 0.380 H ATOM 1418 3HG2 THR A 94 -0.268 -1.105 13.192 1.00 0.380 H ATOM 1419 N VAL A 95 2.328 -0.207 13.201 1.00 0.210 N ATOM 1420 CA VAL A 95 3.095 -0.724 12.084 1.00 0.230 C ATOM 1421 C VAL A 95 2.237 -1.700 11.291 1.00 0.220 C ATOM 1422 O VAL A 95 1.624 -2.600 11.860 1.00 0.250 O ATOM 1423 CB VAL A 95 4.381 -1.401 12.602 1.00 0.310 C ATOM 1424 CG1 VAL A 95 5.170 -2.036 11.456 1.00 0.310 C ATOM 1425 CG2 VAL A 95 5.230 -0.354 13.321 1.00 0.310 C ATOM 1426 H VAL A 95 2.395 -0.660 14.110 1.00 0.250 H ATOM 1427 HA VAL A 95 3.372 0.107 11.434 1.00 0.280 H ATOM 1428 HB VAL A 95 4.111 -2.196 13.297 1.00 0.380 H ATOM 1429 1HG1 VAL A 95 6.066 -2.508 11.854 1.00 0.380 H ATOM 1430 2HG1 VAL A 95 4.566 -2.793 10.958 1.00 0.380 H ATOM 1431 3HG1 VAL A 95 5.455 -1.269 10.738 1.00 0.380 H ATOM 1432 1HG2 VAL A 95 6.135 -0.821 13.708 1.00 0.380 H ATOM 1433 2HG2 VAL A 95 5.498 0.436 12.621 1.00 0.380 H ATOM 1434 3HG2 VAL A 95 4.665 0.074 14.147 1.00 0.380 H ATOM 1435 N LEU A 96 2.202 -1.538 9.978 1.00 0.210 N ATOM 1436 CA LEU A 96 1.392 -2.417 9.155 1.00 0.210 C ATOM 1437 C LEU A 96 1.856 -3.870 9.287 1.00 0.210 C ATOM 1438 O LEU A 96 3.059 -4.118 9.403 1.00 0.220 O ATOM 1439 CB LEU A 96 1.450 -1.969 7.693 1.00 0.290 C ATOM 1440 CG LEU A 96 0.785 -0.633 7.328 1.00 0.290 C ATOM 1441 CD1 LEU A 96 1.059 -0.365 5.856 1.00 0.290 C ATOM 1442 CD2 LEU A 96 -0.716 -0.683 7.599 1.00 0.290 C ATOM 1443 H LEU A 96 2.731 -0.785 9.562 1.00 0.250 H ATOM 1444 HA LEU A 96 0.383 -2.337 9.527 1.00 0.250 H ATOM 1445 1HB LEU A 96 2.499 -1.837 7.463 1.00 0.350 H ATOM 1446 2HB LEU A 96 1.061 -2.747 7.041 1.00 0.350 H ATOM 1447 HG LEU A 96 1.230 0.172 7.912 1.00 0.350 H ATOM 1448 1HD1 LEU A 96 0.616 0.589 5.565 1.00 0.350 H ATOM 1449 2HD1 LEU A 96 2.131 -0.332 5.704 1.00 0.350 H ATOM 1450 3HD1 LEU A 96 0.627 -1.162 5.249 1.00 0.350 H ATOM 1451 1HD2 LEU A 96 -1.153 0.269 7.319 1.00 0.350 H ATOM 1452 2HD2 LEU A 96 -1.162 -1.479 7.008 1.00 0.350 H ATOM 1453 3HD2 LEU A 96 -0.921 -0.855 8.647 1.00 0.350 H ATOM 1454 N PRO A 97 0.920 -4.844 9.225 1.00 0.220 N ATOM 1455 CA PRO A 97 1.129 -6.274 9.392 1.00 0.220 C ATOM 1456 C PRO A 97 2.029 -6.871 8.340 1.00 0.210 C ATOM 1457 O PRO A 97 2.178 -6.327 7.244 1.00 0.240 O ATOM 1458 CB PRO A 97 -0.291 -6.851 9.290 1.00 0.330 C ATOM 1459 CG PRO A 97 -1.086 -5.822 8.527 1.00 0.330 C ATOM 1460 CD PRO A 97 -0.499 -4.496 8.938 1.00 0.330 C ATOM 1461 HA PRO A 97 1.546 -6.455 10.394 1.00 0.260 H ATOM 1462 1HB PRO A 97 -0.251 -7.827 8.768 1.00 0.400 H ATOM 1463 2HB PRO A 97 -0.691 -7.044 10.294 1.00 0.400 H ATOM 1464 1HG PRO A 97 -0.985 -6.005 7.442 1.00 0.400 H ATOM 1465 2HG PRO A 97 -2.158 -5.913 8.768 1.00 0.400 H ATOM 1466 1HD PRO A 97 -0.607 -3.813 8.098 1.00 0.400 H ATOM 1467 2HD PRO A 97 -0.999 -4.128 9.851 1.00 0.400 H ATOM 1468 N THR A 98 2.661 -7.978 8.703 1.00 0.210 N ATOM 1469 CA THR A 98 3.561 -8.672 7.813 1.00 0.200 C ATOM 1470 C THR A 98 2.851 -9.558 6.805 1.00 0.190 C ATOM 1471 O THR A 98 1.663 -9.872 6.938 1.00 0.200 O ATOM 1472 CB THR A 98 4.554 -9.545 8.618 1.00 0.280 C ATOM 1473 OG1 THR A 98 3.829 -10.532 9.362 1.00 0.280 O ATOM 1474 CG2 THR A 98 5.370 -8.702 9.564 1.00 0.280 C ATOM 1475 H THR A 98 2.506 -8.382 9.616 1.00 0.250 H ATOM 1476 HA THR A 98 4.114 -7.917 7.263 1.00 0.240 H ATOM 1477 HB THR A 98 5.218 -10.051 7.933 1.00 0.340 H ATOM 1478 HG1 THR A 98 4.448 -11.097 9.834 1.00 0.340 H ATOM 1479 1HG2 THR A 98 6.061 -9.344 10.110 1.00 0.340 H ATOM 1480 2HG2 THR A 98 5.927 -7.981 9.010 1.00 0.340 H ATOM 1481 3HG2 THR A 98 4.716 -8.193 10.266 1.00 0.340 H ATOM 1482 N PHE A 99 3.612 -9.971 5.806 1.00 0.180 N ATOM 1483 CA PHE A 99 3.182 -10.885 4.771 1.00 0.170 C ATOM 1484 C PHE A 99 4.297 -11.875 4.521 1.00 0.180 C ATOM 1485 O PHE A 99 5.419 -11.497 4.196 1.00 0.180 O ATOM 1486 CB PHE A 99 2.830 -10.111 3.515 1.00 0.240 C ATOM 1487 CG PHE A 99 2.379 -10.962 2.406 1.00 0.240 C ATOM 1488 CD1 PHE A 99 1.222 -11.700 2.507 1.00 0.240 C ATOM 1489 CD2 PHE A 99 3.117 -11.030 1.248 1.00 0.240 C ATOM 1490 CE1 PHE A 99 0.827 -12.497 1.483 1.00 0.240 C ATOM 1491 CE2 PHE A 99 2.715 -11.826 0.211 1.00 0.240 C ATOM 1492 CZ PHE A 99 1.566 -12.565 0.332 1.00 0.240 C ATOM 1493 H PHE A 99 4.562 -9.607 5.779 1.00 0.220 H ATOM 1494 HA PHE A 99 2.304 -11.426 5.121 1.00 0.200 H ATOM 1495 1HB PHE A 99 2.048 -9.407 3.754 1.00 0.290 H ATOM 1496 2HB PHE A 99 3.696 -9.547 3.187 1.00 0.290 H ATOM 1497 HD1 PHE A 99 0.622 -11.650 3.418 1.00 0.290 H ATOM 1498 HD2 PHE A 99 4.030 -10.444 1.170 1.00 0.290 H ATOM 1499 HE1 PHE A 99 -0.079 -13.082 1.585 1.00 0.290 H ATOM 1500 HE2 PHE A 99 3.309 -11.876 -0.703 1.00 0.290 H ATOM 1501 HZ PHE A 99 1.239 -13.206 -0.486 1.00 0.290 H ATOM 1502 N LYS A 100 4.017 -13.152 4.766 1.00 0.190 N ATOM 1503 CA LYS A 100 5.030 -14.197 4.663 1.00 0.220 C ATOM 1504 C LYS A 100 6.257 -13.853 5.519 1.00 0.250 C ATOM 1505 O LYS A 100 7.398 -14.117 5.136 1.00 0.290 O ATOM 1506 CB LYS A 100 5.428 -14.417 3.204 1.00 0.300 C ATOM 1507 CG LYS A 100 4.297 -14.930 2.309 1.00 0.300 C ATOM 1508 CD LYS A 100 4.698 -14.912 0.834 1.00 0.300 C ATOM 1509 CE LYS A 100 5.825 -15.911 0.522 1.00 0.300 C ATOM 1510 NZ LYS A 100 6.094 -16.014 -0.938 1.00 0.300 N ATOM 1511 H LYS A 100 3.072 -13.400 5.026 1.00 0.230 H ATOM 1512 HA LYS A 100 4.609 -15.127 5.048 1.00 0.260 H ATOM 1513 1HB LYS A 100 5.814 -13.493 2.769 1.00 0.360 H ATOM 1514 2HB LYS A 100 6.233 -15.144 3.180 1.00 0.360 H ATOM 1515 1HG LYS A 100 4.030 -15.943 2.600 1.00 0.360 H ATOM 1516 2HG LYS A 100 3.424 -14.291 2.436 1.00 0.360 H ATOM 1517 1HD LYS A 100 3.832 -15.144 0.219 1.00 0.360 H ATOM 1518 2HD LYS A 100 5.039 -13.912 0.574 1.00 0.360 H ATOM 1519 1HE LYS A 100 6.737 -15.562 0.998 1.00 0.360 H ATOM 1520 2HE LYS A 100 5.571 -16.895 0.912 1.00 0.360 H ATOM 1521 1HZ LYS A 100 6.857 -16.645 -1.102 1.00 0.360 H ATOM 1522 2HZ LYS A 100 5.278 -16.349 -1.414 1.00 0.360 H ATOM 1523 3HZ LYS A 100 6.346 -15.065 -1.289 1.00 0.360 H ATOM 1524 N GLY A 101 6.002 -13.249 6.684 1.00 0.250 N ATOM 1525 CA GLY A 101 7.031 -12.867 7.641 1.00 0.290 C ATOM 1526 C GLY A 101 7.704 -11.522 7.347 1.00 0.250 C ATOM 1527 O GLY A 101 8.491 -11.039 8.162 1.00 0.270 O ATOM 1528 H GLY A 101 5.038 -13.078 6.940 1.00 0.300 H ATOM 1529 1HA GLY A 101 6.588 -12.832 8.636 1.00 0.350 H ATOM 1530 2HA GLY A 101 7.791 -13.646 7.669 1.00 0.350 H ATOM 1531 N GLN A 102 7.392 -10.896 6.214 1.00 0.220 N ATOM 1532 CA GLN A 102 8.035 -9.644 5.872 1.00 0.200 C ATOM 1533 C GLN A 102 7.156 -8.447 6.201 1.00 0.190 C ATOM 1534 O GLN A 102 5.954 -8.515 5.983 1.00 0.220 O ATOM 1535 CB GLN A 102 8.357 -9.638 4.386 1.00 0.290 C ATOM 1536 CG GLN A 102 9.257 -10.757 3.981 1.00 0.290 C ATOM 1537 CD GLN A 102 10.564 -10.642 4.668 1.00 0.290 C ATOM 1538 OE1 GLN A 102 11.162 -9.563 4.644 1.00 0.290 O ATOM 1539 NE2 GLN A 102 11.019 -11.711 5.300 1.00 0.290 N ATOM 1540 H GLN A 102 6.727 -11.305 5.553 1.00 0.260 H ATOM 1541 HA GLN A 102 8.965 -9.609 6.412 1.00 0.240 H ATOM 1542 1HB GLN A 102 7.432 -9.740 3.813 1.00 0.350 H ATOM 1543 2HB GLN A 102 8.816 -8.691 4.101 1.00 0.350 H ATOM 1544 1HG GLN A 102 8.797 -11.712 4.246 1.00 0.350 H ATOM 1545 2HG GLN A 102 9.417 -10.703 2.903 1.00 0.350 H ATOM 1546 1HE2 GLN A 102 11.892 -11.673 5.786 1.00 0.350 H ATOM 1547 2HE2 GLN A 102 10.484 -12.561 5.308 1.00 0.350 H ATOM 1548 N PRO A 103 7.696 -7.323 6.685 1.00 0.210 N ATOM 1549 CA PRO A 103 6.967 -6.093 6.949 1.00 0.220 C ATOM 1550 C PRO A 103 6.337 -5.571 5.686 1.00 0.180 C ATOM 1551 O PRO A 103 6.871 -5.802 4.604 1.00 0.220 O ATOM 1552 CB PRO A 103 8.068 -5.138 7.422 1.00 0.330 C ATOM 1553 CG PRO A 103 9.164 -6.031 7.951 1.00 0.330 C ATOM 1554 CD PRO A 103 9.122 -7.273 7.086 1.00 0.330 C ATOM 1555 HA PRO A 103 6.207 -6.245 7.722 1.00 0.260 H ATOM 1556 1HB PRO A 103 8.389 -4.499 6.579 1.00 0.400 H ATOM 1557 2HB PRO A 103 7.662 -4.462 8.191 1.00 0.400 H ATOM 1558 1HG PRO A 103 10.134 -5.510 7.893 1.00 0.400 H ATOM 1559 2HG PRO A 103 8.990 -6.256 9.014 1.00 0.400 H ATOM 1560 1HD PRO A 103 9.782 -7.198 6.203 1.00 0.400 H ATOM 1561 2HD PRO A 103 9.393 -8.103 7.756 1.00 0.400 H ATOM 1562 N SER A 104 5.211 -4.885 5.817 1.00 0.180 N ATOM 1563 CA SER A 104 4.617 -4.229 4.663 1.00 0.160 C ATOM 1564 C SER A 104 5.577 -3.124 4.251 1.00 0.160 C ATOM 1565 O SER A 104 6.219 -2.525 5.118 1.00 0.200 O ATOM 1566 CB SER A 104 3.240 -3.697 4.970 1.00 0.230 C ATOM 1567 OG SER A 104 2.291 -4.721 5.165 1.00 0.230 O ATOM 1568 H SER A 104 4.800 -4.751 6.734 1.00 0.220 H ATOM 1569 HA SER A 104 4.530 -4.932 3.853 1.00 0.190 H ATOM 1570 1HB SER A 104 3.300 -3.085 5.840 1.00 0.280 H ATOM 1571 2HB SER A 104 2.932 -3.088 4.173 1.00 0.280 H ATOM 1572 HG SER A 104 2.481 -5.174 6.013 1.00 0.280 H ATOM 1573 N LYS A 105 5.678 -2.824 2.953 1.00 0.140 N ATOM 1574 CA LYS A 105 6.600 -1.770 2.507 1.00 0.160 C ATOM 1575 C LYS A 105 5.963 -0.672 1.620 1.00 0.160 C ATOM 1576 O LYS A 105 6.101 -0.729 0.400 1.00 0.140 O ATOM 1577 CB LYS A 105 7.764 -2.441 1.780 1.00 0.220 C ATOM 1578 CG LYS A 105 8.608 -3.345 2.661 1.00 0.220 C ATOM 1579 CD LYS A 105 9.683 -4.061 1.871 1.00 0.220 C ATOM 1580 CE LYS A 105 10.486 -4.994 2.770 1.00 0.220 C ATOM 1581 NZ LYS A 105 11.527 -5.747 2.010 1.00 0.220 N ATOM 1582 H LYS A 105 5.095 -3.335 2.281 1.00 0.170 H ATOM 1583 HA LYS A 105 7.018 -1.289 3.389 1.00 0.190 H ATOM 1584 1HB LYS A 105 7.376 -3.081 1.025 1.00 0.260 H ATOM 1585 2HB LYS A 105 8.401 -1.695 1.306 1.00 0.260 H ATOM 1586 1HG LYS A 105 9.060 -2.759 3.460 1.00 0.260 H ATOM 1587 2HG LYS A 105 7.975 -4.098 3.110 1.00 0.260 H ATOM 1588 1HD LYS A 105 9.217 -4.652 1.079 1.00 0.260 H ATOM 1589 2HD LYS A 105 10.351 -3.333 1.414 1.00 0.260 H ATOM 1590 1HE LYS A 105 10.971 -4.405 3.546 1.00 0.260 H ATOM 1591 2HE LYS A 105 9.804 -5.710 3.244 1.00 0.260 H ATOM 1592 1HZ LYS A 105 12.037 -6.350 2.641 1.00 0.260 H ATOM 1593 2HZ LYS A 105 11.086 -6.314 1.294 1.00 0.260 H ATOM 1594 3HZ LYS A 105 12.165 -5.099 1.576 1.00 0.260 H ATOM 1595 N PRO A 106 5.253 0.321 2.210 1.00 0.180 N ATOM 1596 CA PRO A 106 4.537 1.423 1.568 1.00 0.160 C ATOM 1597 C PRO A 106 5.440 2.375 0.818 1.00 0.180 C ATOM 1598 O PRO A 106 6.618 2.505 1.153 1.00 0.200 O ATOM 1599 CB PRO A 106 3.925 2.191 2.746 1.00 0.240 C ATOM 1600 CG PRO A 106 3.913 1.230 3.877 1.00 0.240 C ATOM 1601 CD PRO A 106 5.134 0.370 3.681 1.00 0.240 C ATOM 1602 HA PRO A 106 3.770 1.019 0.895 1.00 0.190 H ATOM 1603 1HB PRO A 106 4.530 3.094 2.950 1.00 0.290 H ATOM 1604 2HB PRO A 106 2.918 2.548 2.476 1.00 0.290 H ATOM 1605 1HG PRO A 106 3.926 1.770 4.836 1.00 0.290 H ATOM 1606 2HG PRO A 106 2.990 0.665 3.851 1.00 0.290 H ATOM 1607 1HD PRO A 106 6.027 0.833 4.130 1.00 0.290 H ATOM 1608 2HD PRO A 106 4.903 -0.578 4.114 1.00 0.290 H ATOM 1609 N PHE A 107 4.883 3.075 -0.165 1.00 0.180 N ATOM 1610 CA PHE A 107 5.660 4.119 -0.805 1.00 0.210 C ATOM 1611 C PHE A 107 5.716 5.284 0.184 1.00 0.220 C ATOM 1612 O PHE A 107 4.724 5.590 0.865 1.00 0.200 O ATOM 1613 CB PHE A 107 5.034 4.636 -2.113 1.00 0.280 C ATOM 1614 CG PHE A 107 5.060 3.764 -3.346 1.00 0.280 C ATOM 1615 CD1 PHE A 107 3.863 3.307 -3.904 1.00 0.280 C ATOM 1616 CD2 PHE A 107 6.252 3.424 -3.973 1.00 0.280 C ATOM 1617 CE1 PHE A 107 3.870 2.545 -5.058 1.00 0.280 C ATOM 1618 CE2 PHE A 107 6.253 2.654 -5.121 1.00 0.280 C ATOM 1619 CZ PHE A 107 5.063 2.219 -5.665 1.00 0.280 C ATOM 1620 H PHE A 107 3.924 2.910 -0.437 1.00 0.220 H ATOM 1621 HA PHE A 107 6.672 3.760 -0.993 1.00 0.250 H ATOM 1622 1HB PHE A 107 4.014 4.829 -1.925 1.00 0.340 H ATOM 1623 2HB PHE A 107 5.494 5.591 -2.368 1.00 0.340 H ATOM 1624 HD1 PHE A 107 2.915 3.563 -3.432 1.00 0.340 H ATOM 1625 HD2 PHE A 107 7.196 3.774 -3.556 1.00 0.340 H ATOM 1626 HE1 PHE A 107 2.931 2.195 -5.487 1.00 0.340 H ATOM 1627 HE2 PHE A 107 7.193 2.396 -5.598 1.00 0.340 H ATOM 1628 HZ PHE A 107 5.064 1.613 -6.568 1.00 0.340 H ATOM 1629 N VAL A 108 6.857 5.954 0.256 1.00 0.250 N ATOM 1630 CA VAL A 108 6.989 7.086 1.157 1.00 0.250 C ATOM 1631 C VAL A 108 7.315 8.358 0.394 1.00 0.290 C ATOM 1632 O VAL A 108 8.276 8.406 -0.374 1.00 0.350 O ATOM 1633 CB VAL A 108 8.063 6.782 2.223 1.00 0.350 C ATOM 1634 CG1 VAL A 108 8.250 7.975 3.162 1.00 0.350 C ATOM 1635 CG2 VAL A 108 7.633 5.533 3.017 1.00 0.350 C ATOM 1636 H VAL A 108 7.643 5.672 -0.315 1.00 0.300 H ATOM 1637 HA VAL A 108 6.041 7.235 1.673 1.00 0.300 H ATOM 1638 HB VAL A 108 9.017 6.597 1.732 1.00 0.420 H ATOM 1639 1HG1 VAL A 108 9.014 7.737 3.900 1.00 0.420 H ATOM 1640 2HG1 VAL A 108 8.567 8.855 2.597 1.00 0.420 H ATOM 1641 3HG1 VAL A 108 7.313 8.192 3.671 1.00 0.420 H ATOM 1642 1HG2 VAL A 108 8.386 5.301 3.767 1.00 0.420 H ATOM 1643 2HG2 VAL A 108 6.678 5.724 3.504 1.00 0.420 H ATOM 1644 3HG2 VAL A 108 7.526 4.679 2.346 1.00 0.420 H ATOM 1645 N GLY A 109 6.487 9.377 0.597 1.00 0.280 N ATOM 1646 CA GLY A 109 6.667 10.653 -0.076 1.00 0.330 C ATOM 1647 C GLY A 109 7.507 11.624 0.740 1.00 0.330 C ATOM 1648 O GLY A 109 8.098 11.263 1.759 1.00 0.370 O ATOM 1649 H GLY A 109 5.719 9.245 1.241 1.00 0.340 H ATOM 1650 1HA GLY A 109 7.142 10.487 -1.043 1.00 0.400 H ATOM 1651 2HA GLY A 109 5.692 11.096 -0.276 1.00 0.400 H ATOM 1652 N VAL A 110 7.538 12.871 0.286 1.00 0.370 N ATOM 1653 CA VAL A 110 8.314 13.926 0.919 1.00 0.400 C ATOM 1654 C VAL A 110 7.452 15.143 1.197 1.00 0.410 C ATOM 1655 O VAL A 110 6.708 15.590 0.327 1.00 0.620 O ATOM 1656 CB VAL A 110 9.507 14.326 0.017 1.00 0.550 C ATOM 1657 CG1 VAL A 110 10.315 15.475 0.653 1.00 0.550 C ATOM 1658 CG2 VAL A 110 10.403 13.106 -0.204 1.00 0.550 C ATOM 1659 H VAL A 110 7.007 13.092 -0.545 1.00 0.440 H ATOM 1660 HA VAL A 110 8.701 13.554 1.868 1.00 0.480 H ATOM 1661 HB VAL A 110 9.130 14.683 -0.941 1.00 0.660 H ATOM 1662 1HG1 VAL A 110 11.142 15.738 -0.004 1.00 0.660 H ATOM 1663 2HG1 VAL A 110 9.688 16.357 0.794 1.00 0.660 H ATOM 1664 3HG1 VAL A 110 10.708 15.157 1.618 1.00 0.660 H ATOM 1665 1HG2 VAL A 110 11.239 13.380 -0.844 1.00 0.660 H ATOM 1666 2HG2 VAL A 110 10.779 12.754 0.757 1.00 0.660 H ATOM 1667 3HG2 VAL A 110 9.841 12.308 -0.680 1.00 0.660 H ATOM 1668 N LEU A 111 7.537 15.670 2.405 1.00 0.420 N ATOM 1669 CA LEU A 111 6.787 16.868 2.728 1.00 0.530 C ATOM 1670 C LEU A 111 7.727 18.055 2.729 1.00 0.440 C ATOM 1671 O LEU A 111 8.897 17.922 3.095 1.00 0.530 O ATOM 1672 CB LEU A 111 6.122 16.722 4.098 1.00 0.700 C ATOM 1673 CG LEU A 111 5.165 15.511 4.271 1.00 0.700 C ATOM 1674 CD1 LEU A 111 4.671 15.482 5.707 1.00 0.700 C ATOM 1675 CD2 LEU A 111 3.988 15.610 3.293 1.00 0.700 C ATOM 1676 H LEU A 111 8.150 15.252 3.090 1.00 0.500 H ATOM 1677 HA LEU A 111 6.036 17.047 1.963 1.00 0.640 H ATOM 1678 1HB LEU A 111 6.904 16.640 4.851 1.00 0.840 H ATOM 1679 2HB LEU A 111 5.552 17.629 4.299 1.00 0.840 H ATOM 1680 HG LEU A 111 5.710 14.586 4.082 1.00 0.840 H ATOM 1681 1HD1 LEU A 111 4.012 14.625 5.847 1.00 0.840 H ATOM 1682 2HD1 LEU A 111 5.522 15.396 6.384 1.00 0.840 H ATOM 1683 3HD1 LEU A 111 4.124 16.397 5.927 1.00 0.840 H ATOM 1684 1HD2 LEU A 111 3.330 14.753 3.436 1.00 0.840 H ATOM 1685 2HD2 LEU A 111 3.430 16.527 3.480 1.00 0.840 H ATOM 1686 3HD2 LEU A 111 4.347 15.607 2.266 1.00 0.840 H ATOM 1687 N SER A 112 7.213 19.219 2.357 1.00 0.540 N ATOM 1688 CA SER A 112 7.994 20.442 2.404 1.00 0.690 C ATOM 1689 C SER A 112 7.076 21.642 2.527 1.00 0.850 C ATOM 1690 O SER A 112 5.901 21.587 2.155 1.00 0.970 O ATOM 1691 CB SER A 112 8.858 20.575 1.164 1.00 0.910 C ATOM 1692 OG SER A 112 8.075 20.756 0.016 1.00 0.910 O ATOM 1693 H SER A 112 6.257 19.267 2.036 1.00 0.650 H ATOM 1694 HA SER A 112 8.640 20.413 3.283 1.00 0.830 H ATOM 1695 1HB SER A 112 9.533 21.421 1.283 1.00 1.090 H ATOM 1696 2HB SER A 112 9.472 19.681 1.052 1.00 1.090 H ATOM 1697 HG SER A 112 8.690 20.808 -0.717 1.00 1.090 H ATOM 1698 N ALA A 113 7.614 22.723 3.073 1.00 1.070 N ATOM 1699 CA ALA A 113 6.904 23.982 3.212 1.00 1.220 C ATOM 1700 C ALA A 113 7.902 25.080 3.526 1.00 1.570 C ATOM 1701 O ALA A 113 8.984 24.803 4.049 1.00 1.800 O ATOM 1702 CB ALA A 113 5.855 23.894 4.310 1.00 1.650 C ATOM 1703 H ALA A 113 8.576 22.681 3.381 1.00 1.280 H ATOM 1704 HA ALA A 113 6.420 24.216 2.263 1.00 1.460 H ATOM 1705 1HB ALA A 113 5.335 24.847 4.392 1.00 1.980 H ATOM 1706 2HB ALA A 113 5.135 23.111 4.072 1.00 1.980 H ATOM 1707 3HB ALA A 113 6.341 23.665 5.255 1.00 1.980 H ATOM 1708 N GLY A 114 7.527 26.321 3.258 1.00 1.730 N ATOM 1709 CA GLY A 114 8.365 27.454 3.612 1.00 2.130 C ATOM 1710 C GLY A 114 7.803 28.735 3.027 1.00 1.620 C ATOM 1711 O GLY A 114 6.761 28.726 2.369 1.00 1.390 O ATOM 1712 H GLY A 114 6.639 26.491 2.806 1.00 2.080 H ATOM 1713 1HA GLY A 114 8.426 27.540 4.697 1.00 2.560 H ATOM 1714 2HA GLY A 114 9.377 27.292 3.242 1.00 2.560 H ATOM 1715 N ILE A 115 8.491 29.841 3.278 1.00 1.960 N ATOM 1716 CA ILE A 115 8.061 31.145 2.795 1.00 1.850 C ATOM 1717 C ILE A 115 9.047 31.694 1.780 1.00 2.150 C ATOM 1718 O ILE A 115 10.244 31.782 2.058 1.00 2.660 O ATOM 1719 CB ILE A 115 7.900 32.135 3.969 1.00 2.630 C ATOM 1720 CG1 ILE A 115 6.820 31.587 4.948 1.00 2.630 C ATOM 1721 CG2 ILE A 115 7.527 33.542 3.435 1.00 2.630 C ATOM 1722 CD1 ILE A 115 6.727 32.319 6.272 1.00 2.630 C ATOM 1723 H ILE A 115 9.345 29.772 3.815 1.00 2.350 H ATOM 1724 HA ILE A 115 7.096 31.037 2.301 1.00 2.220 H ATOM 1725 HB ILE A 115 8.839 32.200 4.517 1.00 3.160 H ATOM 1726 1HG1 ILE A 115 5.850 31.633 4.456 1.00 3.160 H ATOM 1727 2HG1 ILE A 115 7.043 30.548 5.168 1.00 3.160 H ATOM 1728 1HG2 ILE A 115 7.424 34.240 4.256 1.00 3.160 H ATOM 1729 2HG2 ILE A 115 8.307 33.912 2.767 1.00 3.160 H ATOM 1730 3HG2 ILE A 115 6.585 33.487 2.889 1.00 3.160 H ATOM 1731 1HD1 ILE A 115 5.953 31.854 6.883 1.00 3.160 H ATOM 1732 2HD1 ILE A 115 7.684 32.255 6.792 1.00 3.160 H ATOM 1733 3HD1 ILE A 115 6.472 33.359 6.116 1.00 3.160 H ATOM 1734 N ASN A 116 8.532 32.062 0.614 1.00 2.500 N ATOM 1735 CA ASN A 116 9.343 32.608 -0.464 1.00 3.310 C ATOM 1736 C ASN A 116 8.498 33.515 -1.351 1.00 3.800 C ATOM 1737 O ASN A 116 8.714 34.726 -1.394 1.00 4.040 O ATOM 1738 OXT ASN A 116 7.464 33.064 -1.840 1.00 4.960 O ATOM 1739 CB ASN A 116 9.961 31.487 -1.281 1.00 3.980 C ATOM 1740 CG ASN A 116 10.944 31.973 -2.315 1.00 3.980 C ATOM 1741 OD1 ASN A 116 11.988 32.552 -1.986 1.00 3.980 O ATOM 1742 ND2 ASN A 116 10.630 31.746 -3.567 1.00 3.980 N ATOM 1743 H ASN A 116 7.537 31.943 0.477 1.00 3.000 H ATOM 1744 HA ASN A 116 10.140 33.217 -0.033 1.00 3.970 H ATOM 1745 1HB ASN A 116 10.477 30.796 -0.611 1.00 4.780 H ATOM 1746 2HB ASN A 116 9.172 30.927 -1.781 1.00 4.780 H ATOM 1747 1HD2 ASN A 116 11.239 32.047 -4.299 1.00 4.780 H ATOM 1748 2HD2 ASN A 116 9.772 31.281 -3.786 1.00 4.780 H TER # All scores below are weighted scores, not raw scores. #BEGIN_POSE_ENERGIES_TABLE model02_0001.pdb label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 coordinate_constraint omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.5 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA pose -516.237 50.9837 390.513 -35.722 10.4551 23.3703 189.739 -218.165 -1.0486 -7.07255 -179.142 -27.689 -54.715 -12.7807 -12.0017 -9.68811 0 6.86836 -2.06792 4.87117 42.2655 90.1174 -33.6547 24.9463 -5.49113 -9.14608 52.2629 -238.229 GLN:NtermProteinFull_1 -2.95209 0.15938 3.34525 -0.67266 0.08258 0.82777 1.33284 -1.36855 -0.02468 -0.15018 -1.96163 1.25108 0 0 0 0 0 0.16989 0.01879 0.01391 0 2.53684 0 0 -0.18838 0 0.1285 2.54866 GLU_2 -3.56906 0.59121 3.36375 -0.32409 0.064 0.42828 1.34349 -1.41967 -0.02042 -0.08889 -1.84972 -0.32728 0 0 0 0 0 0.0306 -0.07791 0.00819 0 2.74616 0.00194 0 -2.7348 -0.21471 0.95171 -1.0972 PRO_3 -3.54391 0.71427 3.23818 -0.0685 0 0.04275 2.27808 -1.48864 -0 -0 -2.13285 0.60346 0 0 0 0 0 0.0408 -0.10946 0.04214 0.19981 0 -0.45029 0 -2.4119 -0.14616 1.03534 -2.15689 TYR_4 -6.0331 0.69245 3.32965 -1.07185 0.18894 0.55721 1.69421 -1.91787 -0 -0 -1.4714 -0.26372 0 0 -0.42529 0 0 0.11799 0.07564 0.03183 0 2.07003 -0.0054 0.2281 1.2797 0.20307 0.57471 -0.14508 PHE_5 -6.36286 0.59546 2.17728 -0.64285 0.06456 0.37897 1.16862 -1.75938 -0 -0 -1.49699 0.10106 0 0 0 0 0 0.04552 -0.01724 0.08238 0 2.0462 -0.14833 0 1.0402 -0.14542 0.58358 -2.28924 THR_6 -5.29105 0.5343 4.16091 -0.1082 0.06966 0.0588 2.91581 -2.24775 -0 -0 -1.99992 -1.50801 0 0 0 0 0 0.0176 -0.01463 0.05159 0.31953 0 -0.58484 2.28217 -1.0874 -0.30451 0.99846 -1.73749 TRP_7 -11.6321 1.84339 5.11865 -1.56432 0.25259 0.83833 3.14279 -3.86464 -0.00757 -0.04762 -2.53124 -0.23822 0 0 0 0 0 0.01309 -0.02565 0.00283 0 1.92454 -0.28418 0 1.6906 5.95132 2.29919 2.88177 PRO_8 -8.24448 1.25315 4.03937 -0.06756 0 0.04204 2.11298 -2.14277 -0 -0 -2.00415 0.62456 0 0 0 0 0 0.05514 -0.13519 0.02608 0.15922 0 -0.20605 0 -2.4119 6.07813 1.86418 1.04275 LEU_9 -6.47327 0.45634 2.97451 -0.7212 0.37511 0.20056 1.8562 -2.15695 -0.00979 -0.03169 -1.06218 0.3189 0 0 0 0 0 0.09155 -0.04604 0.10497 2.68406 0 -0.2588 0 0.18072 0.03885 0.54864 -0.92951 ILE_10 -8.49611 0.73325 3.78415 -0.4881 0.32024 0.09058 2.72922 -2.84014 -0.00038 -0.00602 -1.74098 0.14236 0 0 0 0 0 0.02627 0.00276 0.03997 0.48328 0 -0.47177 0 0.73287 -0.01033 0.63931 -4.32957 ALA_11 -6.19427 0.79671 3.97289 -0.02309 0 0 2.30969 -2.89142 -0.03605 -0.1523 -2.58428 -0.33014 0 0 0 0 0 0.02563 -0.03039 0 0 0 -0.27106 0 1.8394 -0.26773 0.90147 -2.93494 ALA_12 -5.48494 0.42532 3.71513 -0.02347 0 0 2.42453 -2.49382 -0.073 -0.46072 -0.5385 -0.34625 0 0 0 0 0 0.02961 -0.08516 0 0 0 -0.41187 0 1.8394 -0.52606 0.74876 -1.26102 ASP_13 -4.46766 0.67246 5.55951 -0.29156 0.05318 0.9621 1.78384 -2.4161 -0.06167 -0.4696 -3.84428 0.3965 0 0 0 -0.72166 0 0.00262 -0.03371 0.01748 0 3.66142 -0.4056 0 -2.3716 -0.47008 0.52292 -1.92149 GLY_14 -2.53703 0.13532 2.84783 -7e-05 0 0 1.15156 -1.4989 -0.01176 -0.06638 -1.2961 -0.31466 0 0 0 0 0 0.00256 -0.08226 0 0 0 -1.54033 0 0.83697 -0.1559 0.70139 -1.82775 GLY_15 -3.87065 0.17063 2.49465 -0.00029 0 0 1.04092 -1.72059 -0.01613 -0.08447 -0.80479 -0.21325 0 0 0 0 0 0.01435 -0.07631 0 0 0 0.36764 0 0.83697 0.14673 0.52689 -1.1877 TYR_16 -7.37703 0.83463 4.11984 -0.89835 0.04573 0.52032 1.69212 -2.8366 -0.00333 -0.0583 -1.61326 -0.36745 0 0 0 -0.64407 0 0.06513 -0.01215 0.06266 0 1.54068 -0.34749 0.00747 1.2797 -0.10361 0.43444 -3.65892 ALA_17 -3.693 0.37817 1.574 -0.01604 0 0 1.3006 -1.44506 -0.00914 -0.07905 -0.54498 -0.27667 0 0 0 0 0 0.02042 0.12776 0 0 0 0.42296 0 1.8394 0.94876 0.53399 1.08212 PHE_18 -7.8171 0.80169 1.3638 -0.65192 0.0494 0.37677 1.27636 -1.96421 -0 -0 -0.88867 0.20303 0 0 0 0 0 0.00403 0.01213 0.04729 0 2.09095 -0.13828 0 1.0402 1.00847 0.31365 -2.8724 LYS_19 -5.10804 0.39525 6.78077 -0.38164 0.03704 0.18911 2.65615 -2.71499 -0.01067 -0.03485 -5.49015 0.45375 0 0 0 0 0 0.02219 -0.06403 0.06724 1.92197 0 0.00345 0 -1.5107 -0.38521 0.36567 -2.8077 TYR_20 -6.1069 0.95557 2.43411 -0.71981 0.05722 0.0959 0.77033 -1.9517 -0 -0 -0.92279 -0.41028 0 0 -0.3201 0 0 0.00844 -0.05213 0.19654 0 2.50371 -0.00915 0.29143 1.2797 -0.27842 0.50628 -1.67207 GLU_21 -3.87639 0.45709 5.68605 -0.27389 0.04632 0.31976 2.04621 -2.42529 -0.0201 -0.1311 -3.2557 -0.23253 0 0 0 0 0 0.01372 -0.03555 0.0293 0 2.91849 -0.18997 0 -2.7348 0.25023 0.39804 -1.01011 ASN_22 -1.93557 0.24057 2.12925 -0.19156 0.02561 0.3323 0.45382 -0.91637 -0.00943 -0.09625 0.40088 -1.00915 0 0 0 0 0 0.00779 -0.09295 0.1085 0 1.92622 -0.99184 0 -0.93687 -0.24519 0.15361 -0.64664 GLY_23 -2.32323 0.52886 1.98088 -6e-05 0 0 0.26345 -1.12394 -0 -0 -0.88168 -0.37921 0 0 -0.3201 0 0 0.01134 -0.12336 0 0 0 -1.47426 0 0.83697 -0.95646 0.31808 -3.64272 LYS_24 -3.95908 0.31251 4.30122 -0.46825 0.13077 0.25616 2.09771 -2.1638 -9e-05 -0.00022 -1.80042 -0.00325 0 0 0 0 0 0.02344 0.00245 0.00643 1.80554 0 0.01823 0 -1.5107 -0.5471 0.45454 -1.04391 TYR_25 -5.55597 0.57122 1.5192 -0.61055 0.02808 0.28527 0.7527 -1.33694 -0.00215 -0.03284 -0.83116 -0.15207 0 0 0 0 0 0.01535 -0.0564 0.02419 0 2.273 0.00312 0.00267 1.2797 -0.15017 0.30776 -1.66602 ASP_26 -4.92058 0.24289 7.43426 -0.22309 0.03554 0.7267 3.55571 -3.04192 -0.03294 -0.21579 -5.69015 -0.82837 0 0 0 -0.88442 0 0.03485 0.12668 0.08556 0 2.03048 -0.78681 0 -2.3716 -0.20014 0.48059 -4.44254 ILE_27 -4.54985 0.6046 1.96241 -0.68797 0.68633 0.16471 1.40253 -1.5565 -0 -0 -0.43027 0.12023 0 0 0 0 0 0.21491 -0.03959 0.02615 0.89708 0 -0.01049 0 0.73287 -0.16163 0.87042 0.24591 LYS_28 -2.51991 0.1963 3.87302 -0.49056 0.08477 0.34404 1.44835 -1.58338 -0.01271 -0.0445 -3.03168 0.54995 0 0 0 -0.88442 0 0.07523 -0.08556 0.01427 1.95448 0 -0.02504 0 -1.5107 -0.36444 0.82561 -1.18689 ASP_29 -5.43605 0.48193 7.05341 -0.24412 0.06618 0.80863 3.33611 -2.95407 -0.02526 -0.16088 -3.66477 -0.95588 0 0 0 -0.64407 0 0.03856 -0.02031 0.00521 0 1.90731 -0.78294 0 -2.3716 -0.41096 0.42441 -3.54916 VAL_30 -4.2637 0.36411 1.96653 -0.37183 0.30687 0.09064 1.43218 -1.59013 -0 -0 -0.50066 -0.09468 0 0 0 0 0 0.00657 0.16268 0.04003 0.99441 0 -0.69235 0 1.9342 -0.27633 0.40612 -0.08534 GLY_31 -4.45814 0.51731 3.60451 -5e-05 0 0 2.02731 -2.23134 -0.01928 -0.14107 -2.26 -0.38054 0 0 0 0 0 0.12053 -0.09329 0 0 0 0.22947 0 0.83697 -0.18722 0.59205 -1.84277 VAL_32 -3.35208 0.31421 2.28203 -0.36492 0.2592 0.08884 1.16087 -1.54114 -0.00914 -0.07905 0.17445 -0.13255 0 0 0 0 0 0.04834 -0.09014 0.00013 0.71862 0 0.23545 0 1.9342 -0.16096 0.50674 1.9931 ASP_33 -2.78042 0.29901 2.84068 -0.12402 0.02955 0.38654 0.49291 -1.40486 -0 -0 -0.71945 -0.35218 0 0 0 0 0 0.02148 -0.05051 0.00056 0 2.60688 -0.39987 0 -2.3716 -0.54049 0.26026 -1.80553 ASN_34 -5.90957 0.42571 6.16013 -0.22487 0.00768 0.32966 3.37512 -3.16815 -0.02741 -0.30211 -2.75488 -0.4674 0 0 -1.06439 0 0 0.0703 -0.04172 0.00622 0 2.81692 0.31904 0 -0.93687 -0.49123 0.17674 -1.70108 ALA_35 -3.00604 0.1508 3.22385 -0.02316 0 0 1.50575 -1.70397 -0.02102 -0.16062 -0.6535 -0.38525 0 0 0 0 0 0.01962 0.03259 0 0 0 -0.42593 0 1.8394 -0.37879 0.16691 0.18065 GLY_36 -4.91408 0.76308 4.75117 -5e-05 0 0 2.3694 -2.6905 -0 -0 -2.28481 -0.41505 0 0 -1.06439 0 0 0.00702 -0.06086 0 0 0 0.33991 0 0.83697 0.2261 0.1595 -1.9766 ALA_37 -6.41187 0.48873 4.53511 -0.02129 0 0 2.62417 -3.14166 -0 -0 -1.82005 -0.3704 0 0 0 0 0 0.01164 0.00831 0 0 0 -0.34136 0 1.8394 0.25939 0.20035 -2.13952 LYS_38 -5.9089 0.35337 6.7141 -0.30484 0.02974 0.13485 3.15554 -3.09164 -0 -0 -3.78039 -0.0347 0 0 0 0 0 0.0113 0.05797 0.06839 1.77684 0 0.01015 0 -1.5107 -0.407 0.25428 -2.47163 ALA_39 -4.99061 0.19285 4.51574 -0.0214 0 0 2.86289 -2.65735 -0 -0 -2.62086 -0.3562 0 0 0 0 0 0.00224 0.01716 0 0 0 -0.2341 0 1.8394 -0.36182 0.2679 -1.54417 GLY_40 -5.07581 0.39795 4.7578 -5e-05 0 0 2.21646 -2.5567 -0.00038 -0.00602 -2.64114 -0.415 0 0 0 0 0 0.01409 -0.04576 0 0 0 0.33398 0 0.83697 0.30707 0.14289 -1.73365 LEU_41 -6.02908 0.46174 4.98754 -0.48568 0.21103 0.11602 2.68216 -2.72067 -0 -0 -2.6201 0.22951 0 0 0 0 0 0.00895 -0.02877 0.12571 0.32681 0 -0.27933 0 0.18072 0.33658 0.15723 -2.33964 THR_42 -4.93669 0.21068 6.32933 -0.20254 0.11756 0.07358 3.07748 -2.94567 -0 -0 -3.35136 -0.12298 0 0 0 0 0 0.00442 0.0828 1e-05 0.06805 0 -0.00076 2.30119 -1.0874 -0.12097 0.22451 -0.27875 PHE_43 -7.70215 0.7508 4.14245 -0.88942 0.0422 0.26436 2.63527 -2.68531 -0 -0 -2.38037 -0.09923 0 0 0 0 0 0.01124 -0.01067 0.23687 0 1.78844 -0.51048 0 1.0402 0.10442 0.27242 -2.98895 LEU_44 -7.76176 0.42293 4.38473 -0.46609 0.20243 0.10454 2.6459 -2.74529 -0 -0 -1.78639 0.2304 0 0 0 0 0 0.01455 0.06444 0.05244 0.33263 0 -0.27547 0 0.18072 -0.1073 0.35338 -4.15322 VAL_45 -5.59858 0.46523 5.55381 -0.31702 0.21414 0.07283 3.07095 -2.81181 -0 -0 -2.59158 -0.23791 0 0 0 0 0 0.00421 0.0333 0.00391 0.10258 0 -0.28859 0 1.9342 -0.23906 0.43286 -0.19652 ASP_46 -6.2123 0.4413 8.18109 -0.10231 0.01167 0.31288 3.97062 -3.68515 -0 -0 -5.02549 -0.24534 0 0 0 -0.46614 0 0.01181 0.11424 0.08781 0 1.69194 0.11764 0 -2.3716 -0.26325 0.63769 -2.79291 LEU_47 -8.37348 0.51858 5.41725 -0.47093 0.17974 0.10593 3.07545 -3.12363 -0.00979 -0.04879 -3.45563 0.20948 0 0 0 0 0 0.00238 0.16562 0.00395 0.29834 0 -0.28036 0 0.18072 -0.36937 0.64885 -5.32568 ILE_48 -7.46034 0.65625 5.65561 -0.4913 0.33391 0.09554 2.60546 -3.02772 -0 -0 -1.52695 0.09835 0 0 0 0 0 0.00295 -0.0673 0.02351 0.50018 0 -0.49475 0 0.73287 -0.11832 0.47109 -2.01095 LYS_49 -4.68785 0.39468 5.31509 -0.46913 0.13524 0.17912 2.68373 -2.32846 -0 -0 -3.17853 0.10048 0 0 0 -0.46614 0 0.0014 -0.07581 0.63017 2.58973 0 -0.07393 0 -1.5107 -0.19917 0.54465 -0.41545 ASN_50 -4.28653 0.33126 4.53059 -0.19604 0.04268 0.31399 1.30892 -2.17954 -0 -0 -1.29358 -0.42852 0 0 0 0 0 0.00284 -0.05959 0.0076 0 2.03234 -0.53694 0 -0.93687 -0.59465 0.44139 -1.50064 LYS_51 -2.52437 0.22096 3.18296 -0.33794 0.07231 0.22183 1.28271 -1.52056 -0.00408 -0.01963 -1.25795 -0.38617 0 0 0 0 0 0.0062 0.01761 0.01932 1.50179 0 -0.10651 0 -1.5107 -0.42702 0.31902 -1.25021 HIS_D_52 -3.95058 0.20422 3.1031 -0.40317 0.00675 0.51489 0.99473 -1.61325 -0.00408 -0.01963 -0.89929 -0.29539 0 0 0 0 0 0.00677 -0.0236 0.03563 0 1.69705 -0.30856 0 -0.45461 -0.04739 0.36036 -1.09604 MET_53 -5.70534 0.36688 3.44208 -0.3519 0.13199 0.08578 1.11461 -1.64767 -0.00981 -0.04884 -0.03665 0.07667 0 0 0 0 0 0.02896 0.00954 0.02274 1.50361 0 -0.11067 0 0.60916 0.16527 0.30923 -0.04436 ASN_54 -3.50368 0.30177 3.89839 -0.28216 0.09003 0.46032 2.11359 -1.78712 -0.0107 -0.09192 -2.1138 -0.80774 0 0 -0.85364 0 0 0.025 -0.03569 0.01447 0 2.05009 -0.2071 0 -0.93687 0.09937 0.30085 -1.27653 ALA_55 -2.67193 0.23945 1.99493 -0.02481 0.00022 0 0.73764 -1.28378 -2e-05 -6e-05 0.0623 -0.37341 0 0 0 0 0 0.00325 -0.08606 0 0 0 -0.31985 0 1.8394 -0.29546 0.30283 0.12463 ASP_56 -2.70033 0.22363 3.21128 -0.12137 0.02158 0.37816 1.26864 -1.55786 -0.00426 -0.06129 -1.20665 -0.22314 0 0 -0.85364 0 0 0.00472 -0.06438 0.00767 0 2.38214 -0.35367 0 -2.3716 -0.69612 0.2686 -2.44788 THR_57 -4.37123 0.3868 3.69567 -0.17115 0.0785 0.06249 2.36103 -2.04421 -0.0107 -0.09192 -2.79495 0.23327 0 0 0 0 0 0.00938 0.01144 0.05843 0.03957 0 0.05709 2.26997 -1.0874 -0.5886 0.27313 -1.62341 ASP_58 -4.78166 0.4023 5.43628 -0.106 0.0077 0.31223 2.99363 -2.46295 -0 -0 -2.73083 -1.17585 0 0 -0.83299 0 0 0.03008 -0.01171 0.00719 0 2.42508 -0.01646 0 -2.3716 -0.00046 0.31481 -2.5612 TYR_59 -5.08378 0.32734 4.91645 -0.93982 0.0837 0.33364 3.15932 -2.50312 -0 -0 -3.41344 -0.27089 0 0 -0.83299 -1.24219 0 0.02485 0.00892 0.08949 0 1.76881 -0.40228 0 1.2797 0.27655 0.24858 -2.17116 SER_60 -3.16377 0.09177 3.56781 -0.02713 0 0.041 1.35286 -1.78611 -0 -0 -1.03404 -1.08474 0 0 0 0 0 0.009 0.03633 0.00594 0.30842 0 0.12384 0.60872 -0.77834 -0.15206 0.18717 -1.69333 ILE_61 -5.48142 0.32208 4.05585 -0.48974 0.34167 0.09769 2.6106 -2.45462 -0 -0 -0.74709 0.01603 0 0 0 0 0 0.00573 -0.04908 0.0052 0.51903 0 -0.50444 0 0.73287 -0.19214 0.24244 -0.96934 ALA_62 -4.40261 0.16559 3.89285 -0.02206 0 0 2.42997 -2.43766 -0 -0 -1.971 -0.35662 0 0 0 0 0 0.00667 -0.03641 0 0 0 -0.2275 0 1.8394 -0.12936 0.25117 -0.99758 GLU_63 -5.75631 0.23649 7.26132 -0.3338 0.06849 0.37209 3.37048 -3.30415 -0.02772 -0.18916 -3.9202 -0.61742 0 0 0 -0.88558 0 0.00754 0.02105 0.04656 0 3.52927 -0.10668 0 -2.7348 -0.3197 0.2706 -3.0116 ALA_64 -4.71273 0.27276 4.97735 -0.02204 0 0 2.74835 -2.68063 -0 -0 -2.38915 -0.35526 0 0 0 0 0 0.003 -0.0286 0 0 0 -0.20672 0 1.8394 -0.29432 0.27023 -0.57835 ALA_65 -5.93943 0.42478 5.18009 -0.02159 0 0 3.20855 -3.15394 -0.02017 -0.12585 -3.44647 -0.36564 0 0 0 0 0 0.00554 -0.0018 0 0 0 -0.28337 0 1.8394 -0.4229 0.29281 -2.83 PHE_66 -8.94614 0.94594 3.73974 -0.79652 0.02999 0.24935 2.30418 -2.96599 -0 -0 -1.86922 -0.04619 0 0 0 0 0 0.00331 -0.01391 0.26474 0 2.04537 -0.1843 0 1.0402 -0.20331 0.38755 -4.01522 ASN_67 -6.57867 0.59203 5.66526 -0.19472 0.10701 0.30185 2.6132 -2.895 -0.00674 -0.02765 -1.40314 -0.27456 0 0 0 0 0 0.0029 0.01112 0.00349 0 1.47156 0.11405 0 -0.93687 -0.00471 0.42912 -1.01047 LYS_68 -3.66322 0.20921 4.02887 -0.32697 0.04338 0.17976 1.25972 -1.77162 -0 -0 -1.45327 -0.15457 0 0 0 0 0 0.02939 -0.06882 0.02533 1.76376 0 -0.08992 0 -1.5107 -0.33464 0.36073 -1.47358 GLY_69 -1.95308 0.09844 2.63525 -5e-05 0 0 1.02063 -1.30427 -0 -0 -0.87955 -0.3762 0 0 0 0 0 0.01786 -0.17338 0 0 0 -1.34961 0 0.83697 -0.70261 0.3645 -1.7651 GLU_70 -3.35355 0.208 3.49535 -0.21298 0.03251 0.30738 1.19931 -1.60293 -0 -0 -1.51185 -0.60849 0 0 0 0 0 0.01625 0.10565 0.02454 0 3.08098 -0.27086 0 -2.7348 -0.55571 0.33533 -2.04587 THR_71 -4.73746 0.57103 3.28574 -0.22756 0.2502 0.10619 1.90792 -2.1488 -0.02017 -0.12585 -1.02113 -1.4154 0 0 -1.17465 0 0 0.01156 0.00762 0.27306 1.51748 0 -0.203 2.7769 -1.0874 -0.09378 0.45658 -1.09094 ALA_72 -1.19184 0.04375 0.78408 -0.02631 0.00248 0 0.13104 -0.48248 -0 -0 0.08204 -0.42648 0 0 0 0 0 0.00661 -0.05691 0 0 0 0.01576 0 1.8394 -0.25147 0.39935 0.86902 MET_73 -4.06475 0.36204 1.98874 -0.27384 0.05731 0.05906 1.18645 -1.30716 -0 -0 -1.47886 -0.02588 0 0 -1.17465 0 0 0.00389 0.05907 0.0659 2.22085 0 -0.13213 0 0.60916 -0.1441 0.29093 -1.69797 THR_74 -3.61482 0.37084 1.38958 -0.22945 0.20681 0.09109 0.20273 -0.98501 -0.00596 -0.0197 -0.00734 -1.2719 0 0 0 0 0 0.00618 -0.00741 0.02787 0.61645 0 0.01315 2.29282 -1.0874 0.14303 0.39037 -1.47809 ILE_75 -3.39107 0.26529 0.10463 -0.46553 0.30834 0.09922 0.34928 -0.69149 -0 -0 0.02219 -0.04523 0 0 0 0 0 0.01874 -0.05122 0.02986 0.39021 0 -0.76771 0 0.73287 -0.27227 0.29922 -3.06466 ASN_76 -4.38947 0.54585 2.44512 -0.16483 0.02116 0.22449 1.49848 -1.60493 -0.02349 -0.10737 -0.67813 -0.92924 0 0 -0.95641 -0.69082 0 0.04564 0.01738 0.01468 0 1.80296 -0.20165 0 -0.93687 -0.26241 0.28672 -4.04315 GLY_77 -3.62195 0.60649 3.10416 -0.00059 0 0 1.90658 -1.82979 -0 -0 -1.35164 -0.22636 0 0 -0.95641 0 0 0.09301 -0.09865 0 0 0 -0.23332 0 0.83697 0.15412 0.61265 -1.00474 PRO_78 -4.13254 0.73548 1.56168 -0.06997 0 0.04302 1.11946 -1.03565 -0.02832 -0.16378 -0.40186 0.61648 0 0 0 0 0 0.01344 -0.18748 0.00323 0.21662 0 -0.41542 0 -2.4119 0.19089 0.75999 -3.58663 TRP_79 -5.82624 0.57848 3.18034 -1.22846 0.12078 0.91818 1.65803 -2.12692 -0.02092 -0.12411 -0.12952 -0.71421 0 0 0 -0.55137 0 0.01769 -0.06799 0.02981 0 2.82049 -0.05987 0 1.6906 -0.16298 0.41534 0.41715 ALA_80 -5.07068 0.62026 3.58733 -0.02633 0.00193 0 2.25865 -2.42649 -0.02098 -0.16151 -2.29781 -0.40649 0 0 0 0 0 0.02352 0.04811 0 0 0 0.06436 0 1.8394 -0.43847 0.33358 -2.07161 TRP_81 -8.15356 0.77633 4.06069 -0.74008 0.25662 0.45227 2.78422 -2.76942 -0 -0 -2.53491 -0.44313 0 0 0 0 0 0.0215 -0.03138 0.11348 0 2.73885 -0.0025 0 1.6906 -0.45974 0.49091 -1.74925 SER_82 -2.98673 0.18043 4.0859 -0.02386 0 0.0218 1.6069 -1.88098 -0.032 -0.22048 -2.03182 -0.39632 0 0 0 0 0 0.01073 -0.04956 0.00064 0.50365 0 0.29315 0.60001 -0.77834 -0.26875 0.33607 -1.02957 ASN_83 -4.77847 0.15255 5.9611 -0.17474 0.02217 0.25927 2.77402 -2.70871 -0.00361 -0.04333 -3.04591 -0.27751 0 0 0 -0.88558 0 0.00964 -0.01529 0.01836 0 1.53322 0.22629 0 -0.93687 0.03087 0.11889 -1.76365 ILE_84 -9.16567 1.25381 4.27629 -0.50339 0.44275 0.09787 2.90983 -3.08734 -0 -0 -1.44241 0.0916 0 0 0 0 0 0.0208 0.01914 0.05641 0.56365 0 -0.46225 0 0.73287 0.08165 0.40362 -3.71077 ASP_85 -3.6918 0.17484 4.77023 -0.19323 0.00013 0.63047 1.78894 -2.25402 -0.00821 -0.10704 -2.29241 -0.24402 0 0 0 0 0 0.04108 0.02473 0.00323 0 3.17561 0.28737 0 -2.3716 -0.05779 0.55621 0.23271 THR_86 -3.28721 0.20962 4.45363 -0.20853 0.14885 0.07651 1.83502 -1.97415 -0.00022 -0.00689 -1.68249 -0.12712 0 0 0 0 0 0.01093 -0.06069 0.00226 0.25481 0 0.18542 2.31502 -1.0874 -0.09918 0.42378 1.38197 SER_87 -4.36704 0.3711 4.52663 -0.03558 0.00605 0.02654 1.97203 -2.14855 -0 -0 -1.64876 0.01685 0 0 0 0 0 0.21481 -0.05901 0.00631 0.98917 0 -0.29853 1.7639 -0.77834 -0.20613 0.39531 0.74676 LYS_88 -2.36115 0.22781 3.04255 -0.33797 0.06549 0.21879 1.18061 -1.41963 -0 -0 -1.48632 -0.38536 0 0 0 0 0 0.22189 -0.10036 0.01303 1.518 0 -0.12698 0 -1.5107 -0.29078 0.29966 -1.23141 VAL_89 -5.81077 0.93294 1.67902 -0.28111 0.20828 0.05645 1.19363 -1.83181 -0.00922 -0.14531 -0.66117 0.16206 0 0 0 0 0 0.09769 0.05239 0.07411 0.12088 0 -0.43673 0 1.9342 -0.36741 0.42936 -2.60253 ASN_90 -1.37957 0.13328 1.01072 -0.27124 0.0546 0.50427 0.12042 -0.6133 -0.02229 -0.26031 0.387 -0.82933 0 0 0 0 0 0.0349 -0.03 0.01185 0 2.11346 -0.58018 0 -0.93687 -0.34979 0.53469 -0.36769 TYR_91 -5.88302 0.83373 1.32305 -1.16743 0.14469 0.64959 0.5987 -1.40535 -0.01998 -0.21051 -0.25075 -0.26188 0 0 0 0 0 0.04728 0.11042 0.39554 0 2.2851 -0.42762 0.00644 1.2797 -0.22326 0.44957 -1.72596 GLY_92 -1.43124 0.18354 0.84109 -0.00118 0 0 0.08046 -0.59435 -0 -0 -0.07255 -0.2996 0 0 0 0 0 0.01504 -0.11788 0 0 0 -0.02489 0 0.83697 0.29901 0.32248 0.0369 VAL_93 -2.39983 0.2409 -0.0887 -0.26905 0.14389 0.05642 0.07295 -0.53503 -0.00745 -0.06161 0.09058 -0.34325 0 0 0 0 0 0.01254 -0.07813 5e-05 0.23203 0 -0.7568 0 1.9342 0.21566 0.1871 -1.35355 THR_94 -1.79838 0.12951 1.18513 -0.18834 0.09584 0.06717 0.36076 -0.75337 -0.00745 -0.06161 -0.84298 -1.02024 0 0 0 0 0 0.0179 -0.03193 0.00066 0.74672 0 -0.66306 2.30027 -1.0874 -0.09325 0.33608 -1.30794 VAL_95 -2.01468 0.17007 1.10783 -0.27443 0.15516 0.0544 0.57508 -0.71163 -0 -0 -0.81181 0.03456 0 0 0 0 0 0.0229 -0.07978 0.00098 0.09604 0 -0.44112 0 1.9342 -0.1642 0.30496 -0.04149 LEU_96 -4.46256 0.86071 0.95844 -0.4699 0.28863 0.07791 0.55706 -0.94412 -0 -0 -0.13109 0.39871 0 0 0 0 0 0.02248 0.1745 0.03507 0.46063 0 0.05193 0 0.18072 -0.49175 0.71812 -1.71451 PRO_97 -2.76563 0.43082 2.09469 -0.17084 0.00014 0.11788 0.94744 -0.92209 -0.00967 -0.06987 -1.37039 0.18753 0 0 -0.37339 0 0 0.03583 0.00767 0.00817 0.95021 0 -1.14404 0 -2.4119 -0.52505 0.78305 -4.19942 THR_98 -3.69259 0.50215 2.01742 -0.11263 0.0508 0.07391 0.46132 -1.23621 -0.01658 -0.09988 -0.83214 -0.62954 0 0 0 0 0 0.01189 -0.00675 0.01579 0.04441 0 -0.38757 2.43812 -1.0874 -0.58247 0.32391 -2.74404 PHE_99 -8.04593 0.83143 3.3819 -0.79852 0.07259 0.10073 2.24638 -2.44846 -0 -0 -1.56236 -0.512 0 0 0 0 0 0.00956 0.0089 0.0371 0 2.4363 -0.25965 0 1.0402 -0.03283 0.34476 -3.1499 LYS_100 -3.63165 0.25091 4.09534 -0.49435 0.20306 0.26897 1.52624 -1.61239 -0.02083 -0.11513 -2.42039 -0.28692 0 0 0 -0.72166 0 0.02229 -0.08513 0.29489 2.55335 0 -0.10686 0 -1.5107 0.09098 0.28929 -1.41069 GLY_101 -2.17979 0.25015 1.96176 -6e-05 0 0 0.15416 -1.01776 -0.01658 -0.09988 0.14213 -0.39354 0 0 0 0 0 0.00656 -0.14735 0 0 0 -1.45287 0 0.83697 -0.61136 0.25628 -2.31118 GLN_102 -5.50879 0.85167 5.89525 -0.66621 0.17153 0.6895 3.04132 -2.76056 -0.04124 -0.29476 -3.25346 -0.72286 0 0 0 0 0 0.01281 0.00909 0.02094 0 2.45702 0.08986 0 -0.18838 -0.52742 0.9305 0.20581 PRO_103 -3.60183 0.53582 2.19662 -0.12815 0.00083 0.09506 0.91181 -1.09343 -0.01978 -0.11129 -0.98241 0.23375 0 0 0 0 0 0.00717 0.14107 0.0241 0.18722 0 -1.1351 0 -2.4119 -0.44451 1.05922 -4.53574 SER_104 -4.7854 0.82534 3.25921 -0.03218 0 0.02091 1.13224 -1.59461 -0 -0 -1.52683 -0.15585 0 0 -0.37339 0 0 0.0186 0.02842 0.16983 0.48226 0 -0.07926 1.85994 -0.77834 -0.64671 0.59168 -1.58414 LYS_105 -5.46402 0.73031 4.62266 -0.34061 0.0635 0.22068 1.79966 -2.23152 -0.05653 -0.21054 -1.4276 -0.34442 0 0 0 0 0 0.01216 0.02999 0.06561 1.93343 0 0.11951 0 -1.5107 -0.2453 1.12382 -1.10993 PRO_106 -4.24844 0.74411 1.62768 -0.13771 0.00076 0.09737 0.11106 -0.75767 -0 -0 -0.19345 0.24679 0 0 0 0 0 0.03159 0.14928 0.01271 0.31735 0 -1.12572 0 -2.4119 -0.26662 1.10024 -4.70256 PHE_107 -5.28751 0.66835 1.26387 -0.46868 0.02319 0.17351 0.59699 -1.35484 -0.00696 -0.02574 -1.23035 0.0898 0 0 -0.42529 0 0 0.03339 -0.00161 0.00323 0 2.54393 -0.04994 0 1.0402 -0.52926 0.734 -2.20973 VAL_108 -1.69738 0.15781 1.07335 -0.27016 0.1604 0.05632 0.36103 -0.73589 -0 -0 -0.02317 -0.30541 0 0 0 0 0 0.00897 -0.06809 0.00027 0.22845 0 -0.76815 0 1.9342 -0.44985 0.48981 0.15253 GLY_109 -1.11539 0.13398 0.7482 -0.0003 0 0 0.2388 -0.51288 -0.00696 -0.02574 -0.04143 -0.17672 0 0 0 0 0 0.00312 -0.12383 0 0 0 -0.85852 0 0.83697 -0.18898 0.09089 -0.99878 VAL_110 -1.54137 0.17133 0.68273 -0.26387 0.15448 0.05419 0.00073 -0.57468 -0 -0 0.04291 -0.27419 0 0 0 0 0 0.05597 -0.0389 1e-05 0.33229 0 -0.75913 0 1.9342 -0.16737 0.0965 -0.09416 LEU_111 -1.3253 0.10957 0.7374 -0.46954 0.20686 0.09161 0.00753 -0.49516 -0 -0 -0.24461 0.13705 0 0 0 0 0 0.03361 0.0064 0.02221 0.5306 0 -0.36568 0 0.18072 -0.33921 0.15287 -1.02306 SER_112 -0.84007 0.06504 0.75114 -0.02978 0 0.06998 0.051 -0.38821 -0 -0 -0.12915 -0.21196 0 0 0 0 0 0.01926 -0.00369 0.00043 0.09803 0 -0.48701 0.60114 -0.77834 -0.27705 0.12911 -1.36013 ALA_113 -0.54633 0.05039 0.36814 -0.02146 0 0 0.0442 -0.22618 -0 -0 -0.02996 -0.44702 0 0 0 0 0 0.13545 0.01064 0 0 0 -0.54104 0 1.8394 -0.05863 0.0974 0.67501 GLY_114 -0.69302 0.06509 0.50798 -0.00196 0 0 0 -0.2876 -0.01018 -0.03698 -0.06884 -0.38495 0 0 0 0 0 0.01402 -0.10928 0 0 0 -1.4809 0 0.83697 0.31038 0.06445 -1.27481 ILE_115 -0.93272 0.10084 0.55432 -0.46743 0.33618 0.10018 0.00941 -0.3258 -0.01514 -0.15055 -0.04367 -0.01098 0 0 0 0 0 0.00263 -0.05759 0.00461 0.39135 0 -0.78673 0 0.73287 -0.00209 0.10212 -0.4582 ASN:CtermProteinFull_116 -0.62668 0.04197 0.48459 -0.33619 0.00532 0.91377 0.00941 -0.26896 -0.02532 -0.18753 -0.1755 -0.45131 0 0 0 0 0 0.01398 0 0.00213 0 2.64759 0 0 -0.93687 -0.24406 0.13243 0.99878 VRT_117 0 0 0 0 0 0 0 -0 -0 -0 0 0 0 0 0 0 0 3.43418 0 0 0 0 0 0 0 0 0 3.43418 #END_POSE_ENERGIES_TABLE model02_0001.pdb ENDMDL REMARK ID 96494 DOMAINID 91535 MODEL 5 2021-07-17_00000178_2_11 MODEL 5 REMARK Rerank model05.pdb score: 225.671 tmscore: 0.93498 6wbjA_201 prob: 99.85 ident: 25.69 ATOM 1 N GLN A 1 -9.746 2.084 -4.335 1.00 0.610 N ATOM 2 CA GLN A 1 -9.445 1.819 -5.744 1.00 0.300 C ATOM 3 C GLN A 1 -7.941 1.653 -5.995 1.00 0.260 C ATOM 4 O GLN A 1 -7.483 0.569 -6.354 1.00 0.290 O ATOM 5 CB GLN A 1 -10.026 2.926 -6.639 1.00 0.540 C ATOM 6 CG GLN A 1 -11.553 2.953 -6.675 1.00 0.540 C ATOM 7 CD GLN A 1 -12.131 1.706 -7.282 1.00 0.540 C ATOM 8 OE1 GLN A 1 -11.821 1.358 -8.423 1.00 0.540 O ATOM 9 NE2 GLN A 1 -12.949 1.007 -6.518 1.00 0.540 N ATOM 10 1H GLN A 1 -10.753 2.094 -4.161 1.00 0.730 H ATOM 11 2H GLN A 1 -9.313 1.375 -3.760 1.00 0.730 H ATOM 12 3H GLN A 1 -9.386 2.990 -4.078 1.00 0.730 H ATOM 13 HA GLN A 1 -9.923 0.880 -6.018 1.00 0.360 H ATOM 14 1HB GLN A 1 -9.698 3.905 -6.284 1.00 0.650 H ATOM 15 2HB GLN A 1 -9.660 2.805 -7.658 1.00 0.650 H ATOM 16 1HG GLN A 1 -11.944 3.036 -5.672 1.00 0.650 H ATOM 17 2HG GLN A 1 -11.881 3.811 -7.269 1.00 0.650 H ATOM 18 1HE2 GLN A 1 -13.364 0.156 -6.857 1.00 0.650 H ATOM 19 2HE2 GLN A 1 -13.165 1.315 -5.580 1.00 0.650 H ATOM 20 N GLU A 2 -7.178 2.733 -5.840 1.00 0.250 N ATOM 21 CA GLU A 2 -5.739 2.701 -6.091 1.00 0.240 C ATOM 22 C GLU A 2 -4.989 1.650 -5.218 1.00 0.220 C ATOM 23 O GLU A 2 -5.103 1.700 -3.987 1.00 0.220 O ATOM 24 CB GLU A 2 -5.171 4.101 -5.844 1.00 0.340 C ATOM 25 CG GLU A 2 -3.705 4.261 -6.143 1.00 0.340 C ATOM 26 CD GLU A 2 -3.226 5.654 -5.932 1.00 0.340 C ATOM 27 OE1 GLU A 2 -3.994 6.462 -5.477 1.00 0.340 O ATOM 28 OE2 GLU A 2 -2.098 5.923 -6.247 1.00 0.340 O ATOM 29 H GLU A 2 -7.588 3.611 -5.555 1.00 0.300 H ATOM 30 HA GLU A 2 -5.618 2.507 -7.145 1.00 0.290 H ATOM 31 1HB GLU A 2 -5.707 4.816 -6.470 1.00 0.410 H ATOM 32 2HB GLU A 2 -5.344 4.387 -4.819 1.00 0.410 H ATOM 33 1HG GLU A 2 -3.151 3.607 -5.489 1.00 0.410 H ATOM 34 2HG GLU A 2 -3.508 3.968 -7.169 1.00 0.410 H ATOM 35 N PRO A 3 -4.144 0.765 -5.819 1.00 0.200 N ATOM 36 CA PRO A 3 -3.350 -0.296 -5.186 1.00 0.190 C ATOM 37 C PRO A 3 -2.500 0.124 -3.996 1.00 0.180 C ATOM 38 O PRO A 3 -2.303 -0.657 -3.062 1.00 0.170 O ATOM 39 CB PRO A 3 -2.437 -0.749 -6.332 1.00 0.290 C ATOM 40 CG PRO A 3 -3.236 -0.503 -7.573 1.00 0.290 C ATOM 41 CD PRO A 3 -4.005 0.765 -7.307 1.00 0.290 C ATOM 42 HA PRO A 3 -4.031 -1.112 -4.898 1.00 0.230 H ATOM 43 1HB PRO A 3 -1.492 -0.180 -6.312 1.00 0.340 H ATOM 44 2HB PRO A 3 -2.172 -1.810 -6.205 1.00 0.340 H ATOM 45 1HG PRO A 3 -2.566 -0.418 -8.444 1.00 0.340 H ATOM 46 2HG PRO A 3 -3.899 -1.360 -7.767 1.00 0.340 H ATOM 47 1HD PRO A 3 -3.456 1.643 -7.671 1.00 0.340 H ATOM 48 2HD PRO A 3 -4.986 0.625 -7.798 1.00 0.340 H ATOM 49 N TYR A 4 -2.044 1.363 -3.975 1.00 0.190 N ATOM 50 CA TYR A 4 -1.198 1.848 -2.896 1.00 0.220 C ATOM 51 C TYR A 4 -1.885 1.856 -1.535 1.00 0.190 C ATOM 52 O TYR A 4 -1.214 1.916 -0.502 1.00 0.260 O ATOM 53 CB TYR A 4 -0.692 3.239 -3.262 1.00 0.300 C ATOM 54 CG TYR A 4 0.400 3.190 -4.306 1.00 0.300 C ATOM 55 CD1 TYR A 4 0.089 3.141 -5.658 1.00 0.300 C ATOM 56 CD2 TYR A 4 1.722 3.209 -3.909 1.00 0.300 C ATOM 57 CE1 TYR A 4 1.098 3.089 -6.592 1.00 0.300 C ATOM 58 CE2 TYR A 4 2.733 3.160 -4.844 1.00 0.300 C ATOM 59 CZ TYR A 4 2.426 3.095 -6.179 1.00 0.300 C ATOM 60 OH TYR A 4 3.434 3.045 -7.114 1.00 0.300 O ATOM 61 H TYR A 4 -2.218 1.999 -4.742 1.00 0.230 H ATOM 62 HA TYR A 4 -0.340 1.181 -2.822 1.00 0.260 H ATOM 63 1HB TYR A 4 -1.517 3.846 -3.646 1.00 0.360 H ATOM 64 2HB TYR A 4 -0.304 3.736 -2.375 1.00 0.360 H ATOM 65 HD1 TYR A 4 -0.943 3.138 -5.988 1.00 0.360 H ATOM 66 HD2 TYR A 4 1.966 3.259 -2.850 1.00 0.360 H ATOM 67 HE1 TYR A 4 0.852 3.045 -7.652 1.00 0.360 H ATOM 68 HE2 TYR A 4 3.776 3.169 -4.524 1.00 0.360 H ATOM 69 HH TYR A 4 3.052 3.001 -7.994 1.00 0.360 H ATOM 70 N PHE A 5 -3.219 1.770 -1.519 1.00 0.180 N ATOM 71 CA PHE A 5 -3.961 1.759 -0.267 1.00 0.200 C ATOM 72 C PHE A 5 -4.401 0.333 0.108 1.00 0.170 C ATOM 73 O PHE A 5 -5.113 0.136 1.093 1.00 0.180 O ATOM 74 CB PHE A 5 -5.172 2.685 -0.387 1.00 0.270 C ATOM 75 CG PHE A 5 -4.811 4.157 -0.586 1.00 0.270 C ATOM 76 CD1 PHE A 5 -4.641 4.659 -1.865 1.00 0.270 C ATOM 77 CD2 PHE A 5 -4.676 5.043 0.493 1.00 0.270 C ATOM 78 CE1 PHE A 5 -4.335 5.988 -2.079 1.00 0.270 C ATOM 79 CE2 PHE A 5 -4.372 6.384 0.273 1.00 0.270 C ATOM 80 CZ PHE A 5 -4.201 6.851 -1.014 1.00 0.270 C ATOM 81 H PHE A 5 -3.741 1.716 -2.402 1.00 0.220 H ATOM 82 HA PHE A 5 -3.313 2.138 0.524 1.00 0.240 H ATOM 83 1HB PHE A 5 -5.779 2.366 -1.237 1.00 0.330 H ATOM 84 2HB PHE A 5 -5.786 2.602 0.508 1.00 0.330 H ATOM 85 HD1 PHE A 5 -4.746 3.984 -2.711 1.00 0.330 H ATOM 86 HD2 PHE A 5 -4.819 4.678 1.518 1.00 0.330 H ATOM 87 HE1 PHE A 5 -4.202 6.358 -3.100 1.00 0.330 H ATOM 88 HE2 PHE A 5 -4.276 7.067 1.108 1.00 0.330 H ATOM 89 HZ PHE A 5 -3.966 7.899 -1.193 1.00 0.330 H ATOM 90 N THR A 6 -3.970 -0.653 -0.686 1.00 0.150 N ATOM 91 CA THR A 6 -4.250 -2.075 -0.484 1.00 0.160 C ATOM 92 C THR A 6 -2.953 -2.775 -0.170 1.00 0.170 C ATOM 93 O THR A 6 -2.887 -3.730 0.623 1.00 0.160 O ATOM 94 CB THR A 6 -4.886 -2.696 -1.752 1.00 0.220 C ATOM 95 OG1 THR A 6 -6.208 -2.179 -1.921 1.00 0.220 O ATOM 96 CG2 THR A 6 -4.881 -4.208 -1.694 1.00 0.220 C ATOM 97 H THR A 6 -3.384 -0.419 -1.484 1.00 0.180 H ATOM 98 HA THR A 6 -4.929 -2.195 0.359 1.00 0.190 H ATOM 99 HB THR A 6 -4.307 -2.395 -2.622 1.00 0.260 H ATOM 100 HG1 THR A 6 -6.156 -1.242 -2.129 1.00 0.260 H ATOM 101 1HG2 THR A 6 -5.333 -4.608 -2.600 1.00 0.260 H ATOM 102 2HG2 THR A 6 -3.864 -4.560 -1.630 1.00 0.260 H ATOM 103 3HG2 THR A 6 -5.424 -4.540 -0.836 1.00 0.260 H ATOM 104 N TRP A 7 -1.906 -2.212 -0.739 1.00 0.190 N ATOM 105 CA TRP A 7 -0.584 -2.750 -0.656 1.00 0.220 C ATOM 106 C TRP A 7 -0.114 -3.108 0.740 1.00 0.190 C ATOM 107 O TRP A 7 0.429 -4.196 0.915 1.00 0.230 O ATOM 108 CB TRP A 7 0.425 -1.814 -1.299 1.00 0.300 C ATOM 109 CG TRP A 7 1.728 -2.377 -1.260 1.00 0.300 C ATOM 110 CD1 TRP A 7 2.777 -2.057 -0.463 1.00 0.300 C ATOM 111 CD2 TRP A 7 2.152 -3.437 -2.085 1.00 0.300 C ATOM 112 NE1 TRP A 7 3.830 -2.844 -0.758 1.00 0.300 N ATOM 113 CE2 TRP A 7 3.458 -3.707 -1.754 1.00 0.300 C ATOM 114 CE3 TRP A 7 1.524 -4.175 -3.080 1.00 0.300 C ATOM 115 CZ2 TRP A 7 4.150 -4.683 -2.372 1.00 0.300 C ATOM 116 CZ3 TRP A 7 2.216 -5.152 -3.694 1.00 0.300 C ATOM 117 CH2 TRP A 7 3.476 -5.405 -3.358 1.00 0.300 C ATOM 118 H TRP A 7 -2.071 -1.427 -1.373 1.00 0.230 H ATOM 119 HA TRP A 7 -0.583 -3.669 -1.239 1.00 0.260 H ATOM 120 1HB TRP A 7 0.151 -1.652 -2.340 1.00 0.360 H ATOM 121 2HB TRP A 7 0.457 -0.851 -0.832 1.00 0.360 H ATOM 122 HD1 TRP A 7 2.773 -1.292 0.291 1.00 0.360 H ATOM 123 HE1 TRP A 7 4.733 -2.797 -0.296 1.00 0.360 H ATOM 124 HE3 TRP A 7 0.494 -3.977 -3.361 1.00 0.360 H ATOM 125 HZ2 TRP A 7 5.172 -4.893 -2.111 1.00 0.360 H ATOM 126 HZ3 TRP A 7 1.722 -5.733 -4.469 1.00 0.360 H ATOM 127 HH2 TRP A 7 3.949 -6.190 -3.879 1.00 0.360 H ATOM 128 N PRO A 8 -0.266 -2.260 1.786 1.00 0.150 N ATOM 129 CA PRO A 8 0.237 -2.567 3.105 1.00 0.160 C ATOM 130 C PRO A 8 -0.203 -3.963 3.590 1.00 0.170 C ATOM 131 O PRO A 8 0.571 -4.650 4.270 1.00 0.230 O ATOM 132 CB PRO A 8 -0.412 -1.460 3.952 1.00 0.240 C ATOM 133 CG PRO A 8 -0.599 -0.303 3.006 1.00 0.240 C ATOM 134 CD PRO A 8 -0.992 -0.947 1.710 1.00 0.240 C ATOM 135 HA PRO A 8 1.325 -2.487 3.089 1.00 0.190 H ATOM 136 1HB PRO A 8 -1.348 -1.817 4.409 1.00 0.290 H ATOM 137 2HB PRO A 8 0.261 -1.183 4.758 1.00 0.290 H ATOM 138 1HG PRO A 8 -1.392 0.362 3.387 1.00 0.290 H ATOM 139 2HG PRO A 8 0.286 0.302 2.930 1.00 0.290 H ATOM 140 1HD PRO A 8 -2.075 -1.083 1.734 1.00 0.290 H ATOM 141 2HD PRO A 8 -0.676 -0.313 0.892 1.00 0.290 H ATOM 142 N LEU A 9 -1.439 -4.378 3.228 1.00 0.140 N ATOM 143 CA LEU A 9 -2.000 -5.676 3.598 1.00 0.170 C ATOM 144 C LEU A 9 -1.319 -6.822 2.888 1.00 0.190 C ATOM 145 O LEU A 9 -0.998 -7.852 3.477 1.00 0.280 O ATOM 146 CB LEU A 9 -3.501 -5.687 3.291 1.00 0.230 C ATOM 147 CG LEU A 9 -4.277 -6.995 3.528 1.00 0.230 C ATOM 148 CD1 LEU A 9 -4.206 -7.461 4.984 1.00 0.230 C ATOM 149 CD2 LEU A 9 -5.705 -6.756 3.071 1.00 0.230 C ATOM 150 H LEU A 9 -2.038 -3.801 2.632 1.00 0.170 H ATOM 151 HA LEU A 9 -1.857 -5.802 4.669 1.00 0.200 H ATOM 152 1HB LEU A 9 -3.969 -4.913 3.893 1.00 0.270 H ATOM 153 2HB LEU A 9 -3.635 -5.423 2.249 1.00 0.270 H ATOM 154 HG LEU A 9 -3.847 -7.771 2.925 1.00 0.270 H ATOM 155 1HD1 LEU A 9 -4.760 -8.394 5.089 1.00 0.270 H ATOM 156 2HD1 LEU A 9 -3.171 -7.639 5.269 1.00 0.270 H ATOM 157 3HD1 LEU A 9 -4.636 -6.708 5.637 1.00 0.270 H ATOM 158 1HD2 LEU A 9 -6.277 -7.663 3.170 1.00 0.270 H ATOM 159 2HD2 LEU A 9 -6.164 -5.966 3.666 1.00 0.270 H ATOM 160 3HD2 LEU A 9 -5.682 -6.459 2.025 1.00 0.270 H ATOM 161 N ILE A 10 -1.130 -6.638 1.598 1.00 0.160 N ATOM 162 CA ILE A 10 -0.534 -7.649 0.734 1.00 0.170 C ATOM 163 C ILE A 10 0.918 -7.889 1.109 1.00 0.170 C ATOM 164 O ILE A 10 1.372 -9.034 1.291 1.00 0.220 O ATOM 165 CB ILE A 10 -0.682 -7.163 -0.726 1.00 0.230 C ATOM 166 CG1 ILE A 10 -2.065 -7.592 -1.267 1.00 0.230 C ATOM 167 CG2 ILE A 10 0.468 -7.616 -1.655 1.00 0.230 C ATOM 168 CD1 ILE A 10 -3.283 -7.231 -0.368 1.00 0.230 C ATOM 169 H ILE A 10 -1.456 -5.743 1.209 1.00 0.190 H ATOM 170 HA ILE A 10 -1.063 -8.584 0.855 1.00 0.200 H ATOM 171 HB ILE A 10 -0.687 -6.074 -0.717 1.00 0.280 H ATOM 172 1HG1 ILE A 10 -2.212 -7.112 -2.235 1.00 0.280 H ATOM 173 2HG1 ILE A 10 -2.053 -8.671 -1.409 1.00 0.280 H ATOM 174 1HG2 ILE A 10 0.289 -7.214 -2.648 1.00 0.280 H ATOM 175 2HG2 ILE A 10 1.431 -7.253 -1.307 1.00 0.280 H ATOM 176 3HG2 ILE A 10 0.496 -8.673 -1.707 1.00 0.280 H ATOM 177 1HD1 ILE A 10 -4.187 -7.556 -0.836 1.00 0.280 H ATOM 178 2HD1 ILE A 10 -3.215 -7.711 0.582 1.00 0.280 H ATOM 179 3HD1 ILE A 10 -3.327 -6.171 -0.216 1.00 0.280 H ATOM 180 N ALA A 11 1.619 -6.781 1.280 1.00 0.150 N ATOM 181 CA ALA A 11 3.010 -6.746 1.660 1.00 0.160 C ATOM 182 C ALA A 11 3.253 -7.391 3.027 1.00 0.160 C ATOM 183 O ALA A 11 4.256 -8.082 3.233 1.00 0.170 O ATOM 184 CB ALA A 11 3.460 -5.323 1.652 1.00 0.220 C ATOM 185 H ALA A 11 1.151 -5.887 1.097 1.00 0.180 H ATOM 186 HA ALA A 11 3.577 -7.299 0.918 1.00 0.190 H ATOM 187 1HB ALA A 11 4.518 -5.258 1.883 1.00 0.260 H ATOM 188 2HB ALA A 11 3.281 -4.935 0.685 1.00 0.260 H ATOM 189 3HB ALA A 11 2.882 -4.757 2.376 1.00 0.260 H ATOM 190 N ALA A 12 2.299 -7.241 3.947 1.00 0.150 N ATOM 191 CA ALA A 12 2.428 -7.754 5.304 1.00 0.150 C ATOM 192 C ALA A 12 2.743 -9.239 5.381 1.00 0.170 C ATOM 193 O ALA A 12 3.478 -9.659 6.271 1.00 0.200 O ATOM 194 CB ALA A 12 1.138 -7.543 6.069 1.00 0.210 C ATOM 195 H ALA A 12 1.516 -6.620 3.745 1.00 0.180 H ATOM 196 HA ALA A 12 3.227 -7.196 5.792 1.00 0.180 H ATOM 197 1HB ALA A 12 1.268 -7.885 7.102 1.00 0.250 H ATOM 198 2HB ALA A 12 0.886 -6.517 6.059 1.00 0.250 H ATOM 199 3HB ALA A 12 0.340 -8.105 5.596 1.00 0.250 H ATOM 200 N ASP A 13 2.227 -10.061 4.459 1.00 0.180 N ATOM 201 CA ASP A 13 2.482 -11.494 4.577 1.00 0.240 C ATOM 202 C ASP A 13 3.496 -11.998 3.563 1.00 0.220 C ATOM 203 O ASP A 13 3.616 -13.207 3.368 1.00 0.230 O ATOM 204 CB ASP A 13 1.174 -12.289 4.457 1.00 0.310 C ATOM 205 CG ASP A 13 1.245 -13.781 4.962 1.00 0.310 C ATOM 206 OD1 ASP A 13 1.967 -14.047 5.885 1.00 0.310 O ATOM 207 OD2 ASP A 13 0.500 -14.621 4.451 1.00 0.310 O ATOM 208 H ASP A 13 1.691 -9.723 3.653 1.00 0.220 H ATOM 209 HA ASP A 13 2.886 -11.687 5.570 1.00 0.290 H ATOM 210 1HB ASP A 13 0.430 -11.789 5.039 1.00 0.370 H ATOM 211 2HB ASP A 13 0.830 -12.264 3.433 1.00 0.370 H ATOM 212 N GLY A 14 4.267 -11.100 2.942 1.00 0.210 N ATOM 213 CA GLY A 14 5.269 -11.551 1.987 1.00 0.200 C ATOM 214 C GLY A 14 5.103 -11.077 0.543 1.00 0.180 C ATOM 215 O GLY A 14 5.938 -11.422 -0.294 1.00 0.180 O ATOM 216 H GLY A 14 4.188 -10.092 3.124 1.00 0.250 H ATOM 217 1HA GLY A 14 6.245 -11.224 2.344 1.00 0.240 H ATOM 218 2HA GLY A 14 5.303 -12.638 1.993 1.00 0.240 H ATOM 219 N GLY A 15 4.055 -10.315 0.208 1.00 0.170 N ATOM 220 CA GLY A 15 3.965 -9.836 -1.164 1.00 0.160 C ATOM 221 C GLY A 15 5.039 -8.772 -1.386 1.00 0.180 C ATOM 222 O GLY A 15 5.483 -8.129 -0.434 1.00 0.200 O ATOM 223 H GLY A 15 3.310 -10.046 0.858 1.00 0.200 H ATOM 224 1HA GLY A 15 4.099 -10.660 -1.867 1.00 0.190 H ATOM 225 2HA GLY A 15 2.982 -9.405 -1.334 1.00 0.190 H ATOM 226 N TYR A 16 5.446 -8.584 -2.633 1.00 0.210 N ATOM 227 CA TYR A 16 6.436 -7.573 -2.995 1.00 0.240 C ATOM 228 C TYR A 16 6.205 -7.138 -4.424 1.00 0.250 C ATOM 229 O TYR A 16 5.546 -7.850 -5.179 1.00 0.300 O ATOM 230 CB TYR A 16 7.868 -8.084 -2.764 1.00 0.320 C ATOM 231 CG TYR A 16 8.289 -9.333 -3.545 1.00 0.320 C ATOM 232 CD1 TYR A 16 8.904 -9.243 -4.789 1.00 0.320 C ATOM 233 CD2 TYR A 16 8.074 -10.577 -2.980 1.00 0.320 C ATOM 234 CE1 TYR A 16 9.306 -10.405 -5.463 1.00 0.320 C ATOM 235 CE2 TYR A 16 8.465 -11.719 -3.638 1.00 0.320 C ATOM 236 CZ TYR A 16 9.083 -11.645 -4.875 1.00 0.320 C ATOM 237 OH TYR A 16 9.470 -12.824 -5.503 1.00 0.320 O ATOM 238 H TYR A 16 5.044 -9.161 -3.359 1.00 0.250 H ATOM 239 HA TYR A 16 6.299 -6.711 -2.353 1.00 0.290 H ATOM 240 1HB TYR A 16 8.571 -7.287 -3.015 1.00 0.390 H ATOM 241 2HB TYR A 16 7.995 -8.297 -1.702 1.00 0.390 H ATOM 242 HD1 TYR A 16 9.069 -8.275 -5.228 1.00 0.390 H ATOM 243 HD2 TYR A 16 7.595 -10.653 -2.003 1.00 0.390 H ATOM 244 HE1 TYR A 16 9.789 -10.342 -6.439 1.00 0.390 H ATOM 245 HE2 TYR A 16 8.290 -12.690 -3.178 1.00 0.390 H ATOM 246 HH TYR A 16 9.886 -12.641 -6.391 1.00 0.390 H ATOM 247 N ALA A 17 6.692 -5.955 -4.805 1.00 0.270 N ATOM 248 CA ALA A 17 6.505 -5.567 -6.194 1.00 0.300 C ATOM 249 C ALA A 17 7.547 -6.255 -7.041 1.00 0.350 C ATOM 250 O ALA A 17 7.208 -7.097 -7.866 1.00 0.620 O ATOM 251 CB ALA A 17 6.577 -4.060 -6.352 1.00 0.410 C ATOM 252 H ALA A 17 7.198 -5.369 -4.155 1.00 0.320 H ATOM 253 HA ALA A 17 5.523 -5.906 -6.524 1.00 0.360 H ATOM 254 1HB ALA A 17 6.421 -3.804 -7.400 1.00 0.490 H ATOM 255 2HB ALA A 17 5.800 -3.603 -5.745 1.00 0.490 H ATOM 256 3HB ALA A 17 7.548 -3.698 -6.034 1.00 0.490 H ATOM 257 N PHE A 18 8.823 -5.948 -6.804 1.00 0.260 N ATOM 258 CA PHE A 18 9.876 -6.608 -7.555 1.00 0.260 C ATOM 259 C PHE A 18 11.009 -6.950 -6.620 1.00 0.260 C ATOM 260 O PHE A 18 11.294 -6.198 -5.685 1.00 0.360 O ATOM 261 CB PHE A 18 10.375 -5.736 -8.700 1.00 0.360 C ATOM 262 CG PHE A 18 9.279 -5.361 -9.619 1.00 0.360 C ATOM 263 CD1 PHE A 18 8.718 -4.099 -9.556 1.00 0.360 C ATOM 264 CD2 PHE A 18 8.761 -6.273 -10.506 1.00 0.360 C ATOM 265 CE1 PHE A 18 7.679 -3.759 -10.385 1.00 0.360 C ATOM 266 CE2 PHE A 18 7.726 -5.937 -11.332 1.00 0.360 C ATOM 267 CZ PHE A 18 7.184 -4.681 -11.276 1.00 0.360 C ATOM 268 H PHE A 18 9.065 -5.261 -6.109 1.00 0.310 H ATOM 269 HA PHE A 18 9.483 -7.530 -7.968 1.00 0.310 H ATOM 270 1HB PHE A 18 10.825 -4.837 -8.315 1.00 0.440 H ATOM 271 2HB PHE A 18 11.136 -6.283 -9.268 1.00 0.440 H ATOM 272 HD1 PHE A 18 9.111 -3.374 -8.843 1.00 0.440 H ATOM 273 HD2 PHE A 18 9.185 -7.283 -10.548 1.00 0.440 H ATOM 274 HE1 PHE A 18 7.245 -2.761 -10.334 1.00 0.440 H ATOM 275 HE2 PHE A 18 7.337 -6.678 -12.033 1.00 0.440 H ATOM 276 HZ PHE A 18 6.361 -4.418 -11.934 1.00 0.440 H ATOM 277 N LYS A 19 11.652 -8.077 -6.850 1.00 0.290 N ATOM 278 CA LYS A 19 12.784 -8.435 -6.004 1.00 0.280 C ATOM 279 C LYS A 19 13.903 -7.405 -6.096 1.00 0.290 C ATOM 280 O LYS A 19 14.332 -7.034 -7.190 1.00 0.300 O ATOM 281 CB LYS A 19 13.307 -9.821 -6.339 1.00 0.400 C ATOM 282 CG LYS A 19 14.453 -10.293 -5.455 1.00 0.400 C ATOM 283 CD LYS A 19 14.836 -11.699 -5.815 1.00 0.400 C ATOM 284 CE LYS A 19 16.001 -12.203 -5.004 1.00 0.400 C ATOM 285 NZ LYS A 19 16.355 -13.571 -5.408 1.00 0.400 N ATOM 286 H LYS A 19 11.326 -8.677 -7.621 1.00 0.350 H ATOM 287 HA LYS A 19 12.438 -8.452 -4.969 1.00 0.340 H ATOM 288 1HB LYS A 19 12.495 -10.544 -6.245 1.00 0.480 H ATOM 289 2HB LYS A 19 13.644 -9.848 -7.365 1.00 0.480 H ATOM 290 1HG LYS A 19 15.327 -9.651 -5.600 1.00 0.480 H ATOM 291 2HG LYS A 19 14.158 -10.250 -4.408 1.00 0.480 H ATOM 292 1HD LYS A 19 13.978 -12.359 -5.654 1.00 0.480 H ATOM 293 2HD LYS A 19 15.096 -11.739 -6.876 1.00 0.480 H ATOM 294 1HE LYS A 19 16.864 -11.551 -5.155 1.00 0.480 H ATOM 295 2HE LYS A 19 15.736 -12.201 -3.948 1.00 0.480 H ATOM 296 1HZ LYS A 19 17.138 -13.904 -4.861 1.00 0.480 H ATOM 297 2HZ LYS A 19 15.549 -14.165 -5.269 1.00 0.480 H ATOM 298 3HZ LYS A 19 16.603 -13.561 -6.391 1.00 0.480 H ATOM 299 N TYR A 20 14.414 -6.965 -4.952 1.00 0.390 N ATOM 300 CA TYR A 20 15.483 -5.979 -4.980 1.00 0.450 C ATOM 301 C TYR A 20 16.753 -6.600 -4.426 1.00 0.480 C ATOM 302 O TYR A 20 16.760 -7.134 -3.314 1.00 0.460 O ATOM 303 CB TYR A 20 15.059 -4.734 -4.204 1.00 0.610 C ATOM 304 CG TYR A 20 16.022 -3.591 -4.297 1.00 0.610 C ATOM 305 CD1 TYR A 20 16.160 -2.997 -5.498 1.00 0.610 C ATOM 306 CD2 TYR A 20 16.713 -3.106 -3.212 1.00 0.610 C ATOM 307 CE1 TYR A 20 16.967 -1.942 -5.676 1.00 0.610 C ATOM 308 CE2 TYR A 20 17.548 -2.011 -3.386 1.00 0.610 C ATOM 309 CZ TYR A 20 17.665 -1.439 -4.635 1.00 0.610 C ATOM 310 OH TYR A 20 18.486 -0.351 -4.853 1.00 0.610 O ATOM 311 H TYR A 20 14.045 -7.294 -4.071 1.00 0.470 H ATOM 312 HA TYR A 20 15.682 -5.698 -6.010 1.00 0.540 H ATOM 313 1HB TYR A 20 14.091 -4.395 -4.574 1.00 0.730 H ATOM 314 2HB TYR A 20 14.934 -4.988 -3.155 1.00 0.730 H ATOM 315 HD1 TYR A 20 15.612 -3.383 -6.331 1.00 0.730 H ATOM 316 HD2 TYR A 20 16.603 -3.570 -2.232 1.00 0.730 H ATOM 317 HE1 TYR A 20 17.056 -1.490 -6.661 1.00 0.730 H ATOM 318 HE2 TYR A 20 18.106 -1.606 -2.543 1.00 0.730 H ATOM 319 HH TYR A 20 18.731 -0.307 -5.820 1.00 0.730 H ATOM 320 N GLU A 21 17.818 -6.560 -5.225 1.00 0.580 N ATOM 321 CA GLU A 21 19.076 -7.179 -4.831 1.00 0.670 C ATOM 322 C GLU A 21 20.292 -6.447 -5.389 1.00 0.850 C ATOM 323 O GLU A 21 20.347 -6.094 -6.567 1.00 0.860 O ATOM 324 CB GLU A 21 19.090 -8.639 -5.307 1.00 0.900 C ATOM 325 CG GLU A 21 20.291 -9.449 -4.861 1.00 0.900 C ATOM 326 CD GLU A 21 20.256 -10.887 -5.314 1.00 0.900 C ATOM 327 OE1 GLU A 21 19.390 -11.247 -6.080 1.00 0.900 O ATOM 328 OE2 GLU A 21 21.101 -11.629 -4.884 1.00 0.900 O ATOM 329 H GLU A 21 17.722 -6.088 -6.130 1.00 0.700 H ATOM 330 HA GLU A 21 19.140 -7.164 -3.744 1.00 0.800 H ATOM 331 1HB GLU A 21 18.193 -9.144 -4.945 1.00 1.080 H ATOM 332 2HB GLU A 21 19.057 -8.663 -6.396 1.00 1.080 H ATOM 333 1HG GLU A 21 21.179 -8.998 -5.270 1.00 1.080 H ATOM 334 2HG GLU A 21 20.363 -9.412 -3.775 1.00 1.080 H ATOM 335 N ASN A 22 21.283 -6.222 -4.530 1.00 1.100 N ATOM 336 CA ASN A 22 22.540 -5.569 -4.901 1.00 1.360 C ATOM 337 C ASN A 22 22.317 -4.225 -5.588 1.00 1.220 C ATOM 338 O ASN A 22 23.023 -3.860 -6.527 1.00 1.300 O ATOM 339 CB ASN A 22 23.393 -6.484 -5.763 1.00 1.800 C ATOM 340 CG ASN A 22 23.825 -7.718 -5.026 1.00 1.800 C ATOM 341 OD1 ASN A 22 24.080 -7.680 -3.813 1.00 1.800 O ATOM 342 ND2 ASN A 22 23.920 -8.815 -5.732 1.00 1.800 N ATOM 343 H ASN A 22 21.170 -6.539 -3.575 1.00 1.320 H ATOM 344 HA ASN A 22 23.096 -5.363 -3.985 1.00 1.630 H ATOM 345 1HB ASN A 22 22.840 -6.777 -6.655 1.00 2.160 H ATOM 346 2HB ASN A 22 24.281 -5.947 -6.092 1.00 2.160 H ATOM 347 1HD2 ASN A 22 24.200 -9.672 -5.295 1.00 2.160 H ATOM 348 2HD2 ASN A 22 23.702 -8.803 -6.708 1.00 2.160 H ATOM 349 N GLY A 23 21.331 -3.482 -5.107 1.00 1.080 N ATOM 350 CA GLY A 23 21.024 -2.164 -5.627 1.00 1.030 C ATOM 351 C GLY A 23 20.077 -2.123 -6.834 1.00 0.920 C ATOM 352 O GLY A 23 19.618 -1.032 -7.204 1.00 1.000 O ATOM 353 H GLY A 23 20.793 -3.834 -4.329 1.00 1.300 H ATOM 354 1HA GLY A 23 20.612 -1.567 -4.818 1.00 1.240 H ATOM 355 2HA GLY A 23 21.958 -1.680 -5.905 1.00 1.240 H ATOM 356 N LYS A 24 19.719 -3.274 -7.415 1.00 0.830 N ATOM 357 CA LYS A 24 18.870 -3.276 -8.608 1.00 0.860 C ATOM 358 C LYS A 24 17.530 -3.986 -8.447 1.00 0.690 C ATOM 359 O LYS A 24 17.384 -4.920 -7.654 1.00 0.700 O ATOM 360 CB LYS A 24 19.624 -3.932 -9.767 1.00 1.190 C ATOM 361 CG LYS A 24 20.971 -3.279 -10.144 1.00 1.190 C ATOM 362 CD LYS A 24 20.809 -1.869 -10.725 1.00 1.190 C ATOM 363 CE LYS A 24 22.150 -1.310 -11.189 1.00 1.190 C ATOM 364 NZ LYS A 24 22.028 0.085 -11.710 1.00 1.190 N ATOM 365 H LYS A 24 20.083 -4.164 -7.061 1.00 1.000 H ATOM 366 HA LYS A 24 18.645 -2.244 -8.868 1.00 1.030 H ATOM 367 1HB LYS A 24 19.832 -4.972 -9.502 1.00 1.430 H ATOM 368 2HB LYS A 24 18.989 -3.945 -10.653 1.00 1.430 H ATOM 369 1HG LYS A 24 21.603 -3.225 -9.253 1.00 1.430 H ATOM 370 2HG LYS A 24 21.475 -3.907 -10.876 1.00 1.430 H ATOM 371 1HD LYS A 24 20.114 -1.890 -11.564 1.00 1.430 H ATOM 372 2HD LYS A 24 20.416 -1.201 -9.960 1.00 1.430 H ATOM 373 1HE LYS A 24 22.843 -1.315 -10.349 1.00 1.430 H ATOM 374 2HE LYS A 24 22.547 -1.948 -11.979 1.00 1.430 H ATOM 375 1HZ LYS A 24 22.938 0.415 -12.004 1.00 1.430 H ATOM 376 2HZ LYS A 24 21.396 0.099 -12.499 1.00 1.430 H ATOM 377 3HZ LYS A 24 21.671 0.687 -10.981 1.00 1.430 H ATOM 378 N TYR A 25 16.537 -3.552 -9.233 1.00 0.700 N ATOM 379 CA TYR A 25 15.242 -4.230 -9.225 1.00 0.620 C ATOM 380 C TYR A 25 15.138 -5.270 -10.316 1.00 0.520 C ATOM 381 O TYR A 25 15.218 -4.982 -11.517 1.00 0.530 O ATOM 382 CB TYR A 25 14.070 -3.262 -9.371 1.00 0.900 C ATOM 383 CG TYR A 25 13.821 -2.411 -8.179 1.00 0.900 C ATOM 384 CD1 TYR A 25 14.390 -1.155 -8.084 1.00 0.900 C ATOM 385 CD2 TYR A 25 13.016 -2.896 -7.156 1.00 0.900 C ATOM 386 CE1 TYR A 25 14.154 -0.381 -6.966 1.00 0.900 C ATOM 387 CE2 TYR A 25 12.782 -2.124 -6.044 1.00 0.900 C ATOM 388 CZ TYR A 25 13.348 -0.871 -5.944 1.00 0.900 C ATOM 389 OH TYR A 25 13.116 -0.100 -4.829 1.00 0.900 O ATOM 390 H TYR A 25 16.692 -2.768 -9.852 1.00 0.840 H ATOM 391 HA TYR A 25 15.128 -4.756 -8.276 1.00 0.740 H ATOM 392 1HB TYR A 25 14.233 -2.613 -10.231 1.00 1.080 H ATOM 393 2HB TYR A 25 13.168 -3.837 -9.563 1.00 1.080 H ATOM 394 HD1 TYR A 25 15.023 -0.778 -8.885 1.00 1.080 H ATOM 395 HD2 TYR A 25 12.577 -3.889 -7.227 1.00 1.080 H ATOM 396 HE1 TYR A 25 14.603 0.608 -6.885 1.00 1.080 H ATOM 397 HE2 TYR A 25 12.155 -2.507 -5.238 1.00 1.080 H ATOM 398 HH TYR A 25 13.608 0.721 -4.899 1.00 1.080 H ATOM 399 N ASP A 26 14.912 -6.496 -9.904 1.00 0.480 N ATOM 400 CA ASP A 26 14.804 -7.594 -10.830 1.00 0.470 C ATOM 401 C ASP A 26 13.362 -7.588 -11.287 1.00 0.470 C ATOM 402 O ASP A 26 12.537 -8.332 -10.771 1.00 0.460 O ATOM 403 CB ASP A 26 15.183 -8.914 -10.148 1.00 0.660 C ATOM 404 CG ASP A 26 15.320 -10.105 -11.106 1.00 0.660 C ATOM 405 OD1 ASP A 26 15.175 -9.916 -12.301 1.00 0.660 O ATOM 406 OD2 ASP A 26 15.586 -11.190 -10.643 1.00 0.660 O ATOM 407 H ASP A 26 14.817 -6.677 -8.903 1.00 0.580 H ATOM 408 HA ASP A 26 15.457 -7.421 -11.686 1.00 0.560 H ATOM 409 1HB ASP A 26 16.126 -8.782 -9.613 1.00 0.790 H ATOM 410 2HB ASP A 26 14.433 -9.152 -9.404 1.00 0.790 H ATOM 411 N ILE A 27 13.062 -6.754 -12.272 1.00 0.540 N ATOM 412 CA ILE A 27 11.683 -6.498 -12.685 1.00 0.600 C ATOM 413 C ILE A 27 10.933 -7.766 -13.086 1.00 0.570 C ATOM 414 O ILE A 27 9.729 -7.874 -12.875 1.00 0.690 O ATOM 415 CB ILE A 27 11.618 -5.430 -13.798 1.00 0.820 C ATOM 416 CG1 ILE A 27 12.159 -4.036 -13.251 1.00 0.820 C ATOM 417 CG2 ILE A 27 10.172 -5.282 -14.329 1.00 0.820 C ATOM 418 CD1 ILE A 27 11.407 -3.416 -12.049 1.00 0.820 C ATOM 419 H ILE A 27 13.836 -6.199 -12.648 1.00 0.650 H ATOM 420 HA ILE A 27 11.160 -6.100 -11.832 1.00 0.720 H ATOM 421 HB ILE A 27 12.267 -5.725 -14.620 1.00 0.980 H ATOM 422 1HG1 ILE A 27 13.199 -4.161 -12.959 1.00 0.980 H ATOM 423 2HG1 ILE A 27 12.117 -3.317 -14.070 1.00 0.980 H ATOM 424 1HG2 ILE A 27 10.154 -4.529 -15.113 1.00 0.980 H ATOM 425 2HG2 ILE A 27 9.817 -6.221 -14.744 1.00 0.980 H ATOM 426 3HG2 ILE A 27 9.507 -4.982 -13.526 1.00 0.980 H ATOM 427 1HD1 ILE A 27 11.877 -2.469 -11.789 1.00 0.980 H ATOM 428 2HD1 ILE A 27 10.367 -3.234 -12.303 1.00 0.980 H ATOM 429 3HD1 ILE A 27 11.453 -4.065 -11.193 1.00 0.980 H ATOM 430 N LYS A 28 11.588 -8.703 -13.742 1.00 0.530 N ATOM 431 CA LYS A 28 10.884 -9.932 -14.111 1.00 0.530 C ATOM 432 C LYS A 28 10.403 -10.764 -12.889 1.00 0.460 C ATOM 433 O LYS A 28 9.550 -11.643 -13.041 1.00 0.500 O ATOM 434 CB LYS A 28 11.754 -10.795 -15.032 1.00 0.740 C ATOM 435 CG LYS A 28 12.977 -11.403 -14.375 1.00 0.740 C ATOM 436 CD LYS A 28 13.814 -12.205 -15.371 1.00 0.740 C ATOM 437 CE LYS A 28 15.016 -12.865 -14.689 1.00 0.740 C ATOM 438 NZ LYS A 28 16.031 -11.865 -14.214 1.00 0.740 N ATOM 439 H LYS A 28 12.570 -8.575 -13.946 1.00 0.640 H ATOM 440 HA LYS A 28 9.995 -9.648 -14.674 1.00 0.640 H ATOM 441 1HB LYS A 28 11.152 -11.609 -15.436 1.00 0.890 H ATOM 442 2HB LYS A 28 12.095 -10.192 -15.872 1.00 0.890 H ATOM 443 1HG LYS A 28 13.577 -10.607 -13.955 1.00 0.890 H ATOM 444 2HG LYS A 28 12.672 -12.065 -13.566 1.00 0.890 H ATOM 445 1HD LYS A 28 13.194 -12.979 -15.823 1.00 0.890 H ATOM 446 2HD LYS A 28 14.174 -11.544 -16.159 1.00 0.890 H ATOM 447 1HE LYS A 28 14.665 -13.438 -13.832 1.00 0.890 H ATOM 448 2HE LYS A 28 15.495 -13.541 -15.395 1.00 0.890 H ATOM 449 1HZ LYS A 28 16.794 -12.347 -13.770 1.00 0.890 H ATOM 450 2HZ LYS A 28 16.380 -11.333 -14.990 1.00 0.890 H ATOM 451 3HZ LYS A 28 15.617 -11.209 -13.517 1.00 0.890 H ATOM 452 N ASP A 29 11.005 -10.555 -11.707 1.00 0.370 N ATOM 453 CA ASP A 29 10.664 -11.291 -10.492 1.00 0.310 C ATOM 454 C ASP A 29 9.603 -10.503 -9.727 1.00 0.260 C ATOM 455 O ASP A 29 9.911 -9.618 -8.916 1.00 0.240 O ATOM 456 CB ASP A 29 11.926 -11.537 -9.643 1.00 0.460 C ATOM 457 CG ASP A 29 11.706 -12.410 -8.377 1.00 0.460 C ATOM 458 OD1 ASP A 29 10.571 -12.594 -7.992 1.00 0.460 O ATOM 459 OD2 ASP A 29 12.680 -12.894 -7.830 1.00 0.460 O ATOM 460 H ASP A 29 11.676 -9.791 -11.617 1.00 0.440 H ATOM 461 HA ASP A 29 10.241 -12.256 -10.770 1.00 0.370 H ATOM 462 1HB ASP A 29 12.689 -12.013 -10.267 1.00 0.550 H ATOM 463 2HB ASP A 29 12.335 -10.575 -9.341 1.00 0.550 H ATOM 464 N VAL A 30 8.334 -10.826 -9.990 1.00 0.280 N ATOM 465 CA VAL A 30 7.227 -10.064 -9.434 1.00 0.250 C ATOM 466 C VAL A 30 6.540 -10.873 -8.329 1.00 0.180 C ATOM 467 O VAL A 30 6.186 -12.040 -8.505 1.00 0.240 O ATOM 468 CB VAL A 30 6.248 -9.648 -10.569 1.00 0.360 C ATOM 469 CG1 VAL A 30 5.660 -10.880 -11.277 1.00 0.360 C ATOM 470 CG2 VAL A 30 5.151 -8.741 -10.018 1.00 0.360 C ATOM 471 H VAL A 30 8.155 -11.600 -10.618 1.00 0.340 H ATOM 472 HA VAL A 30 7.627 -9.153 -8.997 1.00 0.300 H ATOM 473 HB VAL A 30 6.817 -9.097 -11.320 1.00 0.430 H ATOM 474 1HG1 VAL A 30 5.014 -10.550 -12.089 1.00 0.430 H ATOM 475 2HG1 VAL A 30 6.465 -11.486 -11.688 1.00 0.430 H ATOM 476 3HG1 VAL A 30 5.074 -11.480 -10.588 1.00 0.430 H ATOM 477 1HG2 VAL A 30 4.497 -8.431 -10.830 1.00 0.430 H ATOM 478 2HG2 VAL A 30 4.577 -9.259 -9.285 1.00 0.430 H ATOM 479 3HG2 VAL A 30 5.604 -7.858 -9.565 1.00 0.430 H ATOM 480 N GLY A 31 6.338 -10.214 -7.202 1.00 0.190 N ATOM 481 CA GLY A 31 5.789 -10.826 -5.982 1.00 0.230 C ATOM 482 C GLY A 31 4.270 -10.864 -5.850 1.00 0.250 C ATOM 483 O GLY A 31 3.741 -11.309 -4.831 1.00 0.460 O ATOM 484 H GLY A 31 6.646 -9.231 -7.219 1.00 0.230 H ATOM 485 1HA GLY A 31 6.181 -11.840 -5.899 1.00 0.280 H ATOM 486 2HA GLY A 31 6.183 -10.288 -5.132 1.00 0.280 H ATOM 487 N VAL A 32 3.561 -10.428 -6.869 1.00 0.140 N ATOM 488 CA VAL A 32 2.105 -10.345 -6.837 1.00 0.170 C ATOM 489 C VAL A 32 1.397 -11.686 -6.615 1.00 0.170 C ATOM 490 O VAL A 32 0.309 -11.717 -6.044 1.00 0.190 O ATOM 491 CB VAL A 32 1.603 -9.668 -8.136 1.00 0.230 C ATOM 492 CG1 VAL A 32 1.794 -10.589 -9.370 1.00 0.230 C ATOM 493 CG2 VAL A 32 0.132 -9.285 -7.980 1.00 0.230 C ATOM 494 H VAL A 32 4.072 -10.086 -7.669 1.00 0.170 H ATOM 495 HA VAL A 32 1.838 -9.690 -6.006 1.00 0.200 H ATOM 496 HB VAL A 32 2.199 -8.772 -8.304 1.00 0.270 H ATOM 497 1HG1 VAL A 32 1.459 -10.065 -10.263 1.00 0.270 H ATOM 498 2HG1 VAL A 32 2.838 -10.856 -9.486 1.00 0.270 H ATOM 499 3HG1 VAL A 32 1.205 -11.495 -9.265 1.00 0.270 H ATOM 500 1HG2 VAL A 32 -0.208 -8.781 -8.881 1.00 0.270 H ATOM 501 2HG2 VAL A 32 -0.476 -10.176 -7.822 1.00 0.270 H ATOM 502 3HG2 VAL A 32 0.018 -8.617 -7.126 1.00 0.270 H ATOM 503 N ASP A 33 1.995 -12.785 -7.086 1.00 0.170 N ATOM 504 CA ASP A 33 1.401 -14.112 -6.960 1.00 0.190 C ATOM 505 C ASP A 33 1.928 -14.891 -5.758 1.00 0.180 C ATOM 506 O ASP A 33 1.676 -16.093 -5.624 1.00 0.210 O ATOM 507 CB ASP A 33 1.669 -14.920 -8.231 1.00 0.260 C ATOM 508 CG ASP A 33 0.956 -14.374 -9.464 1.00 0.260 C ATOM 509 OD1 ASP A 33 -0.200 -14.030 -9.373 1.00 0.260 O ATOM 510 OD2 ASP A 33 1.592 -14.284 -10.487 1.00 0.260 O ATOM 511 H ASP A 33 2.873 -12.698 -7.583 1.00 0.200 H ATOM 512 HA ASP A 33 0.324 -13.991 -6.840 1.00 0.230 H ATOM 513 1HB ASP A 33 2.742 -14.929 -8.427 1.00 0.310 H ATOM 514 2HB ASP A 33 1.358 -15.952 -8.079 1.00 0.310 H ATOM 515 N ASN A 34 2.681 -14.222 -4.897 1.00 0.170 N ATOM 516 CA ASN A 34 3.230 -14.839 -3.705 1.00 0.170 C ATOM 517 C ASN A 34 2.093 -15.302 -2.810 1.00 0.160 C ATOM 518 O ASN A 34 1.066 -14.629 -2.713 1.00 0.150 O ATOM 519 CB ASN A 34 4.135 -13.864 -2.966 1.00 0.240 C ATOM 520 CG ASN A 34 4.953 -14.496 -1.855 1.00 0.240 C ATOM 521 OD1 ASN A 34 4.465 -14.774 -0.743 1.00 0.240 O ATOM 522 ND2 ASN A 34 6.206 -14.751 -2.147 1.00 0.240 N ATOM 523 H ASN A 34 2.873 -13.226 -5.048 1.00 0.200 H ATOM 524 HA ASN A 34 3.807 -15.718 -3.994 1.00 0.200 H ATOM 525 1HB ASN A 34 4.821 -13.402 -3.676 1.00 0.290 H ATOM 526 2HB ASN A 34 3.531 -13.063 -2.545 1.00 0.290 H ATOM 527 1HD2 ASN A 34 6.808 -15.170 -1.465 1.00 0.290 H ATOM 528 2HD2 ASN A 34 6.561 -14.534 -3.059 1.00 0.290 H ATOM 529 N ALA A 35 2.285 -16.413 -2.101 1.00 0.160 N ATOM 530 CA ALA A 35 1.245 -16.892 -1.195 1.00 0.150 C ATOM 531 C ALA A 35 0.862 -15.810 -0.185 1.00 0.140 C ATOM 532 O ALA A 35 -0.302 -15.722 0.215 1.00 0.130 O ATOM 533 CB ALA A 35 1.716 -18.129 -0.461 1.00 0.210 C ATOM 534 H ALA A 35 3.143 -16.936 -2.209 1.00 0.190 H ATOM 535 HA ALA A 35 0.364 -17.137 -1.787 1.00 0.180 H ATOM 536 1HB ALA A 35 0.922 -18.484 0.195 1.00 0.260 H ATOM 537 2HB ALA A 35 1.966 -18.905 -1.182 1.00 0.260 H ATOM 538 3HB ALA A 35 2.595 -17.886 0.133 1.00 0.260 H ATOM 539 N GLY A 36 1.835 -14.997 0.230 1.00 0.140 N ATOM 540 CA GLY A 36 1.597 -13.912 1.151 1.00 0.130 C ATOM 541 C GLY A 36 0.620 -12.925 0.539 1.00 0.120 C ATOM 542 O GLY A 36 -0.407 -12.560 1.127 1.00 0.120 O ATOM 543 H GLY A 36 2.789 -15.109 -0.106 1.00 0.170 H ATOM 544 1HA GLY A 36 1.228 -14.297 2.099 1.00 0.160 H ATOM 545 2HA GLY A 36 2.539 -13.411 1.324 1.00 0.160 H ATOM 546 N ALA A 37 0.930 -12.499 -0.682 1.00 0.120 N ATOM 547 CA ALA A 37 0.093 -11.555 -1.397 1.00 0.120 C ATOM 548 C ALA A 37 -1.317 -12.098 -1.556 1.00 0.120 C ATOM 549 O ALA A 37 -2.295 -11.358 -1.400 1.00 0.120 O ATOM 550 CB ALA A 37 0.687 -11.274 -2.773 1.00 0.170 C ATOM 551 H ALA A 37 1.789 -12.829 -1.100 1.00 0.140 H ATOM 552 HA ALA A 37 0.039 -10.643 -0.808 1.00 0.140 H ATOM 553 1HB ALA A 37 0.063 -10.559 -3.308 1.00 0.200 H ATOM 554 2HB ALA A 37 1.684 -10.879 -2.683 1.00 0.200 H ATOM 555 3HB ALA A 37 0.727 -12.201 -3.347 1.00 0.200 H ATOM 556 N LYS A 38 -1.431 -13.403 -1.819 1.00 0.130 N ATOM 557 CA LYS A 38 -2.733 -14.021 -1.972 1.00 0.130 C ATOM 558 C LYS A 38 -3.512 -13.984 -0.665 1.00 0.130 C ATOM 559 O LYS A 38 -4.709 -13.682 -0.674 1.00 0.130 O ATOM 560 CB LYS A 38 -2.593 -15.446 -2.496 1.00 0.180 C ATOM 561 CG LYS A 38 -2.163 -15.528 -3.963 1.00 0.180 C ATOM 562 CD LYS A 38 -1.986 -16.970 -4.414 1.00 0.180 C ATOM 563 CE LYS A 38 -1.641 -17.054 -5.895 1.00 0.180 C ATOM 564 NZ LYS A 38 -1.378 -18.455 -6.325 1.00 0.180 N ATOM 565 H LYS A 38 -0.572 -13.946 -1.961 1.00 0.160 H ATOM 566 HA LYS A 38 -3.295 -13.448 -2.709 1.00 0.160 H ATOM 567 1HB LYS A 38 -1.851 -15.972 -1.902 1.00 0.220 H ATOM 568 2HB LYS A 38 -3.539 -15.973 -2.383 1.00 0.220 H ATOM 569 1HG LYS A 38 -2.910 -15.041 -4.589 1.00 0.220 H ATOM 570 2HG LYS A 38 -1.212 -14.999 -4.087 1.00 0.220 H ATOM 571 1HD LYS A 38 -1.171 -17.422 -3.844 1.00 0.220 H ATOM 572 2HD LYS A 38 -2.898 -17.531 -4.224 1.00 0.220 H ATOM 573 1HE LYS A 38 -2.473 -16.659 -6.475 1.00 0.220 H ATOM 574 2HE LYS A 38 -0.762 -16.452 -6.093 1.00 0.220 H ATOM 575 1HZ LYS A 38 -1.157 -18.467 -7.311 1.00 0.220 H ATOM 576 2HZ LYS A 38 -0.595 -18.824 -5.800 1.00 0.220 H ATOM 577 3HZ LYS A 38 -2.194 -19.021 -6.157 1.00 0.220 H ATOM 578 N ALA A 39 -2.853 -14.278 0.463 1.00 0.130 N ATOM 579 CA ALA A 39 -3.526 -14.233 1.757 1.00 0.140 C ATOM 580 C ALA A 39 -4.036 -12.833 2.061 1.00 0.130 C ATOM 581 O ALA A 39 -5.157 -12.661 2.558 1.00 0.140 O ATOM 582 CB ALA A 39 -2.578 -14.663 2.849 1.00 0.190 C ATOM 583 H ALA A 39 -1.876 -14.594 0.407 1.00 0.160 H ATOM 584 HA ALA A 39 -4.375 -14.912 1.722 1.00 0.170 H ATOM 585 1HB ALA A 39 -3.098 -14.642 3.792 1.00 0.230 H ATOM 586 2HB ALA A 39 -2.223 -15.669 2.640 1.00 0.230 H ATOM 587 3HB ALA A 39 -1.721 -13.983 2.886 1.00 0.230 H ATOM 588 N GLY A 40 -3.220 -11.834 1.727 1.00 0.130 N ATOM 589 CA GLY A 40 -3.553 -10.434 1.922 1.00 0.130 C ATOM 590 C GLY A 40 -4.790 -10.072 1.110 1.00 0.120 C ATOM 591 O GLY A 40 -5.758 -9.510 1.635 1.00 0.160 O ATOM 592 H GLY A 40 -2.291 -12.071 1.355 1.00 0.160 H ATOM 593 1HA GLY A 40 -3.726 -10.240 2.979 1.00 0.160 H ATOM 594 2HA GLY A 40 -2.712 -9.826 1.614 1.00 0.160 H ATOM 595 N LEU A 41 -4.760 -10.393 -0.187 1.00 0.110 N ATOM 596 CA LEU A 41 -5.883 -10.106 -1.065 1.00 0.110 C ATOM 597 C LEU A 41 -7.122 -10.845 -0.624 1.00 0.120 C ATOM 598 O LEU A 41 -8.217 -10.285 -0.683 1.00 0.140 O ATOM 599 CB LEU A 41 -5.557 -10.510 -2.509 1.00 0.150 C ATOM 600 CG LEU A 41 -4.519 -9.656 -3.256 1.00 0.150 C ATOM 601 CD1 LEU A 41 -4.120 -10.364 -4.533 1.00 0.150 C ATOM 602 CD2 LEU A 41 -5.118 -8.265 -3.595 1.00 0.150 C ATOM 603 H LEU A 41 -3.924 -10.846 -0.572 1.00 0.130 H ATOM 604 HA LEU A 41 -6.099 -9.043 -1.012 1.00 0.130 H ATOM 605 1HB LEU A 41 -5.175 -11.532 -2.485 1.00 0.180 H ATOM 606 2HB LEU A 41 -6.477 -10.505 -3.086 1.00 0.180 H ATOM 607 HG LEU A 41 -3.650 -9.546 -2.649 1.00 0.180 H ATOM 608 1HD1 LEU A 41 -3.374 -9.770 -5.060 1.00 0.180 H ATOM 609 2HD1 LEU A 41 -3.693 -11.340 -4.287 1.00 0.180 H ATOM 610 3HD1 LEU A 41 -4.994 -10.498 -5.168 1.00 0.180 H ATOM 611 1HD2 LEU A 41 -4.371 -7.677 -4.128 1.00 0.180 H ATOM 612 2HD2 LEU A 41 -5.995 -8.394 -4.227 1.00 0.180 H ATOM 613 3HD2 LEU A 41 -5.406 -7.735 -2.703 1.00 0.180 H ATOM 614 N THR A 42 -6.963 -12.091 -0.170 1.00 0.100 N ATOM 615 CA THR A 42 -8.093 -12.884 0.271 1.00 0.110 C ATOM 616 C THR A 42 -8.763 -12.176 1.424 1.00 0.110 C ATOM 617 O THR A 42 -9.978 -12.011 1.419 1.00 0.130 O ATOM 618 CB THR A 42 -7.667 -14.304 0.703 1.00 0.150 C ATOM 619 OG1 THR A 42 -7.085 -14.993 -0.418 1.00 0.150 O ATOM 620 CG2 THR A 42 -8.889 -15.086 1.203 1.00 0.150 C ATOM 621 H THR A 42 -6.037 -12.516 -0.170 1.00 0.120 H ATOM 622 HA THR A 42 -8.807 -12.968 -0.547 1.00 0.130 H ATOM 623 HB THR A 42 -6.931 -14.238 1.499 1.00 0.180 H ATOM 624 HG1 THR A 42 -6.229 -14.567 -0.645 1.00 0.180 H ATOM 625 1HG2 THR A 42 -8.578 -16.084 1.499 1.00 0.180 H ATOM 626 2HG2 THR A 42 -9.342 -14.585 2.063 1.00 0.180 H ATOM 627 3HG2 THR A 42 -9.627 -15.158 0.406 1.00 0.180 H ATOM 628 N PHE A 43 -7.975 -11.710 2.396 1.00 0.120 N ATOM 629 CA PHE A 43 -8.522 -11.011 3.546 1.00 0.120 C ATOM 630 C PHE A 43 -9.352 -9.812 3.099 1.00 0.120 C ATOM 631 O PHE A 43 -10.477 -9.628 3.572 1.00 0.130 O ATOM 632 CB PHE A 43 -7.404 -10.599 4.488 1.00 0.170 C ATOM 633 CG PHE A 43 -7.840 -9.879 5.727 1.00 0.170 C ATOM 634 CD1 PHE A 43 -8.427 -10.580 6.762 1.00 0.170 C ATOM 635 CD2 PHE A 43 -7.635 -8.528 5.890 1.00 0.170 C ATOM 636 CE1 PHE A 43 -8.805 -9.941 7.916 1.00 0.170 C ATOM 637 CE2 PHE A 43 -7.999 -7.892 7.037 1.00 0.170 C ATOM 638 CZ PHE A 43 -8.589 -8.595 8.054 1.00 0.170 C ATOM 639 H PHE A 43 -6.968 -11.904 2.354 1.00 0.140 H ATOM 640 HA PHE A 43 -9.178 -11.700 4.078 1.00 0.140 H ATOM 641 1HB PHE A 43 -6.865 -11.488 4.774 1.00 0.200 H ATOM 642 2HB PHE A 43 -6.697 -9.967 3.955 1.00 0.200 H ATOM 643 HD1 PHE A 43 -8.594 -11.654 6.654 1.00 0.200 H ATOM 644 HD2 PHE A 43 -7.178 -7.965 5.106 1.00 0.200 H ATOM 645 HE1 PHE A 43 -9.272 -10.504 8.724 1.00 0.200 H ATOM 646 HE2 PHE A 43 -7.824 -6.821 7.145 1.00 0.200 H ATOM 647 HZ PHE A 43 -8.884 -8.085 8.969 1.00 0.200 H ATOM 648 N LEU A 44 -8.802 -8.989 2.199 1.00 0.130 N ATOM 649 CA LEU A 44 -9.528 -7.821 1.702 1.00 0.160 C ATOM 650 C LEU A 44 -10.863 -8.253 1.091 1.00 0.150 C ATOM 651 O LEU A 44 -11.916 -7.656 1.352 1.00 0.180 O ATOM 652 CB LEU A 44 -8.681 -7.078 0.662 1.00 0.210 C ATOM 653 CG LEU A 44 -9.209 -5.714 0.157 1.00 0.210 C ATOM 654 CD1 LEU A 44 -8.036 -4.880 -0.225 1.00 0.210 C ATOM 655 CD2 LEU A 44 -10.118 -5.879 -1.070 1.00 0.210 C ATOM 656 H LEU A 44 -7.853 -9.194 1.860 1.00 0.160 H ATOM 657 HA LEU A 44 -9.727 -7.157 2.540 1.00 0.190 H ATOM 658 1HB LEU A 44 -7.704 -6.927 1.071 1.00 0.250 H ATOM 659 2HB LEU A 44 -8.573 -7.728 -0.208 1.00 0.250 H ATOM 660 HG LEU A 44 -9.747 -5.220 0.949 1.00 0.250 H ATOM 661 1HD1 LEU A 44 -8.369 -3.902 -0.578 1.00 0.250 H ATOM 662 2HD1 LEU A 44 -7.381 -4.748 0.637 1.00 0.250 H ATOM 663 3HD1 LEU A 44 -7.503 -5.391 -1.022 1.00 0.250 H ATOM 664 1HD2 LEU A 44 -10.446 -4.894 -1.401 1.00 0.250 H ATOM 665 2HD2 LEU A 44 -9.565 -6.366 -1.872 1.00 0.250 H ATOM 666 3HD2 LEU A 44 -10.983 -6.465 -0.836 1.00 0.250 H ATOM 667 N VAL A 45 -10.819 -9.273 0.234 1.00 0.150 N ATOM 668 CA VAL A 45 -12.023 -9.751 -0.419 1.00 0.170 C ATOM 669 C VAL A 45 -13.031 -10.264 0.598 1.00 0.140 C ATOM 670 O VAL A 45 -14.229 -10.010 0.435 1.00 0.150 O ATOM 671 CB VAL A 45 -11.697 -10.816 -1.475 1.00 0.230 C ATOM 672 CG1 VAL A 45 -12.985 -11.466 -2.000 1.00 0.230 C ATOM 673 CG2 VAL A 45 -10.947 -10.141 -2.621 1.00 0.230 C ATOM 674 H VAL A 45 -9.915 -9.711 0.025 1.00 0.180 H ATOM 675 HA VAL A 45 -12.473 -8.909 -0.941 1.00 0.200 H ATOM 676 HB VAL A 45 -11.074 -11.594 -1.027 1.00 0.280 H ATOM 677 1HG1 VAL A 45 -12.729 -12.210 -2.750 1.00 0.280 H ATOM 678 2HG1 VAL A 45 -13.517 -11.953 -1.185 1.00 0.280 H ATOM 679 3HG1 VAL A 45 -13.626 -10.702 -2.445 1.00 0.280 H ATOM 680 1HG2 VAL A 45 -10.695 -10.882 -3.379 1.00 0.280 H ATOM 681 2HG2 VAL A 45 -11.577 -9.368 -3.060 1.00 0.280 H ATOM 682 3HG2 VAL A 45 -10.036 -9.686 -2.247 1.00 0.280 H ATOM 683 N ASP A 46 -12.578 -11.021 1.607 1.00 0.120 N ATOM 684 CA ASP A 46 -13.477 -11.512 2.640 1.00 0.140 C ATOM 685 C ASP A 46 -14.137 -10.340 3.363 1.00 0.140 C ATOM 686 O ASP A 46 -15.340 -10.373 3.613 1.00 0.180 O ATOM 687 CB ASP A 46 -12.740 -12.370 3.679 1.00 0.190 C ATOM 688 CG ASP A 46 -12.295 -13.783 3.209 1.00 0.190 C ATOM 689 OD1 ASP A 46 -12.751 -14.264 2.194 1.00 0.190 O ATOM 690 OD2 ASP A 46 -11.497 -14.364 3.909 1.00 0.190 O ATOM 691 H ASP A 46 -11.590 -11.267 1.643 1.00 0.140 H ATOM 692 HA ASP A 46 -14.248 -12.118 2.170 1.00 0.170 H ATOM 693 1HB ASP A 46 -11.848 -11.830 3.999 1.00 0.230 H ATOM 694 2HB ASP A 46 -13.372 -12.485 4.554 1.00 0.230 H ATOM 695 N LEU A 47 -13.394 -9.256 3.629 1.00 0.140 N ATOM 696 CA LEU A 47 -14.013 -8.109 4.290 1.00 0.170 C ATOM 697 C LEU A 47 -15.136 -7.558 3.423 1.00 0.180 C ATOM 698 O LEU A 47 -16.194 -7.187 3.935 1.00 0.200 O ATOM 699 CB LEU A 47 -12.990 -6.995 4.571 1.00 0.230 C ATOM 700 CG LEU A 47 -11.897 -7.278 5.648 1.00 0.230 C ATOM 701 CD1 LEU A 47 -10.899 -6.138 5.625 1.00 0.230 C ATOM 702 CD2 LEU A 47 -12.521 -7.413 7.036 1.00 0.230 C ATOM 703 H LEU A 47 -12.383 -9.280 3.444 1.00 0.170 H ATOM 704 HA LEU A 47 -14.452 -8.445 5.222 1.00 0.200 H ATOM 705 1HB LEU A 47 -12.473 -6.773 3.638 1.00 0.270 H ATOM 706 2HB LEU A 47 -13.531 -6.100 4.869 1.00 0.270 H ATOM 707 HG LEU A 47 -11.368 -8.198 5.404 1.00 0.270 H ATOM 708 1HD1 LEU A 47 -10.132 -6.317 6.354 1.00 0.270 H ATOM 709 2HD1 LEU A 47 -10.450 -6.069 4.636 1.00 0.270 H ATOM 710 3HD1 LEU A 47 -11.408 -5.206 5.862 1.00 0.270 H ATOM 711 1HD2 LEU A 47 -11.728 -7.601 7.761 1.00 0.270 H ATOM 712 2HD2 LEU A 47 -13.042 -6.493 7.299 1.00 0.270 H ATOM 713 3HD2 LEU A 47 -13.219 -8.241 7.060 1.00 0.270 H ATOM 714 N ILE A 48 -14.944 -7.531 2.107 1.00 0.200 N ATOM 715 CA ILE A 48 -16.021 -7.067 1.239 1.00 0.240 C ATOM 716 C ILE A 48 -17.208 -8.045 1.287 1.00 0.250 C ATOM 717 O ILE A 48 -18.358 -7.645 1.486 1.00 0.280 O ATOM 718 CB ILE A 48 -15.542 -6.899 -0.219 1.00 0.320 C ATOM 719 CG1 ILE A 48 -14.523 -5.750 -0.286 1.00 0.320 C ATOM 720 CG2 ILE A 48 -16.736 -6.619 -1.127 1.00 0.320 C ATOM 721 CD1 ILE A 48 -13.742 -5.643 -1.572 1.00 0.320 C ATOM 722 H ILE A 48 -14.018 -7.781 1.737 1.00 0.240 H ATOM 723 HA ILE A 48 -16.365 -6.104 1.597 1.00 0.290 H ATOM 724 HB ILE A 48 -15.041 -7.807 -0.543 1.00 0.380 H ATOM 725 1HG1 ILE A 48 -15.054 -4.814 -0.125 1.00 0.380 H ATOM 726 2HG1 ILE A 48 -13.810 -5.888 0.521 1.00 0.380 H ATOM 727 1HG2 ILE A 48 -16.406 -6.514 -2.141 1.00 0.380 H ATOM 728 2HG2 ILE A 48 -17.450 -7.436 -1.088 1.00 0.380 H ATOM 729 3HG2 ILE A 48 -17.228 -5.697 -0.799 1.00 0.380 H ATOM 730 1HD1 ILE A 48 -13.048 -4.805 -1.495 1.00 0.380 H ATOM 731 2HD1 ILE A 48 -13.184 -6.564 -1.729 1.00 0.380 H ATOM 732 3HD1 ILE A 48 -14.394 -5.482 -2.404 1.00 0.380 H ATOM 733 N LYS A 49 -16.937 -9.342 1.126 1.00 0.240 N ATOM 734 CA LYS A 49 -17.992 -10.362 1.127 1.00 0.270 C ATOM 735 C LYS A 49 -18.784 -10.416 2.429 1.00 0.250 C ATOM 736 O LYS A 49 -19.989 -10.676 2.424 1.00 0.260 O ATOM 737 CB LYS A 49 -17.426 -11.745 0.814 1.00 0.370 C ATOM 738 CG LYS A 49 -17.001 -11.947 -0.640 1.00 0.370 C ATOM 739 CD LYS A 49 -16.441 -13.349 -0.852 1.00 0.370 C ATOM 740 CE LYS A 49 -16.090 -13.612 -2.314 1.00 0.370 C ATOM 741 NZ LYS A 49 -15.484 -14.964 -2.501 1.00 0.370 N ATOM 742 H LYS A 49 -15.963 -9.619 0.982 1.00 0.290 H ATOM 743 HA LYS A 49 -18.695 -10.109 0.335 1.00 0.320 H ATOM 744 1HB LYS A 49 -16.555 -11.920 1.444 1.00 0.440 H ATOM 745 2HB LYS A 49 -18.167 -12.503 1.064 1.00 0.440 H ATOM 746 1HG LYS A 49 -17.859 -11.794 -1.295 1.00 0.440 H ATOM 747 2HG LYS A 49 -16.237 -11.210 -0.894 1.00 0.440 H ATOM 748 1HD LYS A 49 -15.537 -13.464 -0.246 1.00 0.440 H ATOM 749 2HD LYS A 49 -17.172 -14.086 -0.524 1.00 0.440 H ATOM 750 1HE LYS A 49 -16.995 -13.546 -2.915 1.00 0.440 H ATOM 751 2HE LYS A 49 -15.390 -12.860 -2.657 1.00 0.440 H ATOM 752 1HZ LYS A 49 -15.266 -15.105 -3.478 1.00 0.440 H ATOM 753 2HZ LYS A 49 -14.634 -15.032 -1.952 1.00 0.440 H ATOM 754 3HZ LYS A 49 -16.137 -15.673 -2.197 1.00 0.440 H ATOM 755 N ASN A 50 -18.120 -10.113 3.537 1.00 0.240 N ATOM 756 CA ASN A 50 -18.713 -10.141 4.860 1.00 0.250 C ATOM 757 C ASN A 50 -19.335 -8.801 5.264 1.00 0.260 C ATOM 758 O ASN A 50 -19.740 -8.632 6.415 1.00 0.270 O ATOM 759 CB ASN A 50 -17.662 -10.546 5.866 1.00 0.350 C ATOM 760 CG ASN A 50 -17.212 -11.964 5.694 1.00 0.350 C ATOM 761 OD1 ASN A 50 -17.981 -12.847 5.294 1.00 0.350 O ATOM 762 ND2 ASN A 50 -15.962 -12.210 5.991 1.00 0.350 N ATOM 763 H ASN A 50 -17.112 -9.959 3.464 1.00 0.290 H ATOM 764 HA ASN A 50 -19.512 -10.882 4.860 1.00 0.300 H ATOM 765 1HB ASN A 50 -16.801 -9.897 5.738 1.00 0.420 H ATOM 766 2HB ASN A 50 -18.040 -10.406 6.877 1.00 0.420 H ATOM 767 1HD2 ASN A 50 -15.597 -13.137 5.892 1.00 0.420 H ATOM 768 2HD2 ASN A 50 -15.369 -11.474 6.313 1.00 0.420 H ATOM 769 N LYS A 51 -19.427 -7.864 4.311 1.00 0.250 N ATOM 770 CA LYS A 51 -20.007 -6.537 4.489 1.00 0.270 C ATOM 771 C LYS A 51 -19.286 -5.638 5.491 1.00 0.260 C ATOM 772 O LYS A 51 -19.926 -4.873 6.216 1.00 0.290 O ATOM 773 CB LYS A 51 -21.483 -6.655 4.893 1.00 0.370 C ATOM 774 CG LYS A 51 -22.346 -7.413 3.892 1.00 0.370 C ATOM 775 CD LYS A 51 -23.806 -7.432 4.318 1.00 0.370 C ATOM 776 CE LYS A 51 -24.659 -8.233 3.341 1.00 0.370 C ATOM 777 NZ LYS A 51 -26.088 -8.294 3.768 1.00 0.370 N ATOM 778 H LYS A 51 -19.055 -8.057 3.375 1.00 0.300 H ATOM 779 HA LYS A 51 -19.962 -6.038 3.519 1.00 0.320 H ATOM 780 1HB LYS A 51 -21.576 -7.136 5.862 1.00 0.440 H ATOM 781 2HB LYS A 51 -21.906 -5.657 4.991 1.00 0.440 H ATOM 782 1HG LYS A 51 -22.258 -6.942 2.914 1.00 0.440 H ATOM 783 2HG LYS A 51 -21.984 -8.440 3.811 1.00 0.440 H ATOM 784 1HD LYS A 51 -23.886 -7.878 5.311 1.00 0.440 H ATOM 785 2HD LYS A 51 -24.181 -6.411 4.366 1.00 0.440 H ATOM 786 1HE LYS A 51 -24.604 -7.769 2.357 1.00 0.440 H ATOM 787 2HE LYS A 51 -24.266 -9.248 3.275 1.00 0.440 H ATOM 788 1HZ LYS A 51 -26.618 -8.832 3.096 1.00 0.440 H ATOM 789 2HZ LYS A 51 -26.152 -8.734 4.676 1.00 0.440 H ATOM 790 3HZ LYS A 51 -26.466 -7.359 3.821 1.00 0.440 H ATOM 791 N HIS A 52 -17.953 -5.673 5.494 1.00 0.220 N ATOM 792 CA HIS A 52 -17.170 -4.788 6.345 1.00 0.210 C ATOM 793 C HIS A 52 -16.460 -3.756 5.473 1.00 0.180 C ATOM 794 O HIS A 52 -15.745 -2.881 5.967 1.00 0.270 O ATOM 795 CB HIS A 52 -16.117 -5.564 7.137 1.00 0.300 C ATOM 796 CG HIS A 52 -16.674 -6.594 8.042 1.00 0.300 C ATOM 797 ND1 HIS A 52 -17.492 -6.290 9.106 1.00 0.300 N ATOM 798 CD2 HIS A 52 -16.504 -7.929 8.061 1.00 0.300 C ATOM 799 CE1 HIS A 52 -17.813 -7.408 9.732 1.00 0.300 C ATOM 800 NE2 HIS A 52 -17.220 -8.416 9.120 1.00 0.300 N ATOM 801 H HIS A 52 -17.454 -6.337 4.901 1.00 0.260 H ATOM 802 HA HIS A 52 -17.818 -4.262 7.041 1.00 0.250 H ATOM 803 1HB HIS A 52 -15.449 -6.062 6.438 1.00 0.360 H ATOM 804 2HB HIS A 52 -15.518 -4.872 7.726 1.00 0.360 H ATOM 805 HD1 HIS A 52 -18.064 -5.469 9.148 1.00 0.360 H ATOM 806 HD2 HIS A 52 -15.933 -8.602 7.432 1.00 0.360 H ATOM 807 HE1 HIS A 52 -18.463 -7.387 10.605 1.00 0.360 H ATOM 808 N MET A 53 -16.639 -3.893 4.163 1.00 0.210 N ATOM 809 CA MET A 53 -15.990 -3.054 3.174 1.00 0.170 C ATOM 810 C MET A 53 -16.845 -2.940 1.912 1.00 0.180 C ATOM 811 O MET A 53 -17.486 -3.893 1.478 1.00 0.250 O ATOM 812 CB MET A 53 -14.612 -3.632 2.847 1.00 0.250 C ATOM 813 CG MET A 53 -13.764 -2.822 1.846 1.00 0.250 C ATOM 814 SD MET A 53 -12.159 -3.598 1.488 1.00 0.250 S ATOM 815 CE MET A 53 -11.241 -3.416 3.000 1.00 0.250 C ATOM 816 H MET A 53 -17.289 -4.600 3.854 1.00 0.250 H ATOM 817 HA MET A 53 -15.870 -2.054 3.588 1.00 0.200 H ATOM 818 1HB MET A 53 -14.053 -3.708 3.770 1.00 0.300 H ATOM 819 2HB MET A 53 -14.722 -4.634 2.466 1.00 0.300 H ATOM 820 1HG MET A 53 -14.296 -2.715 0.903 1.00 0.300 H ATOM 821 2HG MET A 53 -13.583 -1.826 2.246 1.00 0.300 H ATOM 822 1HE MET A 53 -10.251 -3.855 2.882 1.00 0.300 H ATOM 823 2HE MET A 53 -11.141 -2.357 3.240 1.00 0.300 H ATOM 824 3HE MET A 53 -11.759 -3.920 3.805 1.00 0.300 H ATOM 825 N ASN A 54 -16.867 -1.749 1.332 1.00 0.200 N ATOM 826 CA ASN A 54 -17.566 -1.489 0.078 1.00 0.210 C ATOM 827 C ASN A 54 -16.559 -1.485 -1.066 1.00 0.200 C ATOM 828 O ASN A 54 -15.657 -0.641 -1.099 1.00 0.200 O ATOM 829 CB ASN A 54 -18.389 -0.212 0.135 1.00 0.290 C ATOM 830 CG ASN A 54 -19.248 0.007 -1.120 1.00 0.290 C ATOM 831 OD1 ASN A 54 -18.880 -0.339 -2.262 1.00 0.290 O ATOM 832 ND2 ASN A 54 -20.414 0.586 -0.913 1.00 0.290 N ATOM 833 H ASN A 54 -16.351 -0.993 1.766 1.00 0.240 H ATOM 834 HA ASN A 54 -18.256 -2.312 -0.112 1.00 0.250 H ATOM 835 1HB ASN A 54 -19.051 -0.258 1.000 1.00 0.350 H ATOM 836 2HB ASN A 54 -17.745 0.641 0.274 1.00 0.350 H ATOM 837 1HD2 ASN A 54 -21.031 0.762 -1.685 1.00 0.350 H ATOM 838 2HD2 ASN A 54 -20.686 0.853 0.014 1.00 0.350 H ATOM 839 N ALA A 55 -16.690 -2.438 -1.979 1.00 0.210 N ATOM 840 CA ALA A 55 -15.748 -2.637 -3.082 1.00 0.210 C ATOM 841 C ALA A 55 -15.564 -1.401 -3.963 1.00 0.240 C ATOM 842 O ALA A 55 -14.518 -1.230 -4.590 1.00 0.250 O ATOM 843 CB ALA A 55 -16.233 -3.763 -3.972 1.00 0.290 C ATOM 844 H ALA A 55 -17.483 -3.061 -1.890 1.00 0.250 H ATOM 845 HA ALA A 55 -14.783 -2.898 -2.648 1.00 0.250 H ATOM 846 1HB ALA A 55 -15.510 -3.932 -4.769 1.00 0.350 H ATOM 847 2HB ALA A 55 -16.348 -4.657 -3.396 1.00 0.350 H ATOM 848 3HB ALA A 55 -17.195 -3.487 -4.408 1.00 0.350 H ATOM 849 N ASP A 56 -16.582 -0.554 -4.039 1.00 0.250 N ATOM 850 CA ASP A 56 -16.532 0.610 -4.908 1.00 0.280 C ATOM 851 C ASP A 56 -15.983 1.855 -4.215 1.00 0.270 C ATOM 852 O ASP A 56 -15.966 2.940 -4.806 1.00 0.290 O ATOM 853 CB ASP A 56 -17.932 0.908 -5.441 1.00 0.380 C ATOM 854 CG ASP A 56 -18.484 -0.184 -6.377 1.00 0.380 C ATOM 855 OD1 ASP A 56 -17.727 -0.837 -7.065 1.00 0.380 O ATOM 856 OD2 ASP A 56 -19.677 -0.357 -6.374 1.00 0.380 O ATOM 857 H ASP A 56 -17.418 -0.706 -3.471 1.00 0.300 H ATOM 858 HA ASP A 56 -15.882 0.377 -5.751 1.00 0.340 H ATOM 859 1HB ASP A 56 -18.616 1.024 -4.601 1.00 0.460 H ATOM 860 2HB ASP A 56 -17.918 1.853 -5.983 1.00 0.460 H ATOM 861 N THR A 57 -15.549 1.726 -2.964 1.00 0.240 N ATOM 862 CA THR A 57 -15.043 2.884 -2.247 1.00 0.230 C ATOM 863 C THR A 57 -13.834 3.454 -2.971 1.00 0.240 C ATOM 864 O THR A 57 -12.882 2.723 -3.289 1.00 0.250 O ATOM 865 CB THR A 57 -14.593 2.523 -0.810 1.00 0.330 C ATOM 866 OG1 THR A 57 -15.666 1.916 -0.115 1.00 0.330 O ATOM 867 CG2 THR A 57 -14.182 3.796 -0.046 1.00 0.330 C ATOM 868 H THR A 57 -15.564 0.816 -2.501 1.00 0.290 H ATOM 869 HA THR A 57 -15.820 3.645 -2.205 1.00 0.280 H ATOM 870 HB THR A 57 -13.756 1.828 -0.849 1.00 0.390 H ATOM 871 HG1 THR A 57 -15.778 1.014 -0.477 1.00 0.390 H ATOM 872 1HG2 THR A 57 -13.882 3.525 0.963 1.00 0.390 H ATOM 873 2HG2 THR A 57 -13.349 4.281 -0.541 1.00 0.390 H ATOM 874 3HG2 THR A 57 -15.019 4.478 0.000 1.00 0.390 H ATOM 875 N ASP A 58 -13.879 4.759 -3.210 1.00 0.240 N ATOM 876 CA ASP A 58 -12.796 5.492 -3.825 1.00 0.240 C ATOM 877 C ASP A 58 -12.142 6.380 -2.774 1.00 0.220 C ATOM 878 O ASP A 58 -12.607 6.452 -1.630 1.00 0.200 O ATOM 879 CB ASP A 58 -13.324 6.299 -5.020 1.00 0.340 C ATOM 880 CG ASP A 58 -12.242 6.689 -6.051 1.00 0.340 C ATOM 881 OD1 ASP A 58 -11.073 6.480 -5.767 1.00 0.340 O ATOM 882 OD2 ASP A 58 -12.589 7.191 -7.087 1.00 0.340 O ATOM 883 H ASP A 58 -14.716 5.249 -2.944 1.00 0.290 H ATOM 884 HA ASP A 58 -12.049 4.790 -4.184 1.00 0.290 H ATOM 885 1HB ASP A 58 -14.090 5.708 -5.532 1.00 0.400 H ATOM 886 2HB ASP A 58 -13.806 7.208 -4.660 1.00 0.400 H ATOM 887 N TYR A 59 -11.120 7.114 -3.178 1.00 0.250 N ATOM 888 CA TYR A 59 -10.401 7.992 -2.270 1.00 0.270 C ATOM 889 C TYR A 59 -11.302 9.047 -1.634 1.00 0.260 C ATOM 890 O TYR A 59 -11.325 9.188 -0.409 1.00 0.250 O ATOM 891 CB TYR A 59 -9.251 8.677 -3.005 1.00 0.370 C ATOM 892 CG TYR A 59 -8.448 9.553 -2.114 1.00 0.370 C ATOM 893 CD1 TYR A 59 -7.437 8.984 -1.356 1.00 0.370 C ATOM 894 CD2 TYR A 59 -8.724 10.907 -2.015 1.00 0.370 C ATOM 895 CE1 TYR A 59 -6.705 9.762 -0.513 1.00 0.370 C ATOM 896 CE2 TYR A 59 -7.993 11.686 -1.160 1.00 0.370 C ATOM 897 CZ TYR A 59 -6.988 11.119 -0.412 1.00 0.370 C ATOM 898 OH TYR A 59 -6.264 11.889 0.452 1.00 0.370 O ATOM 899 H TYR A 59 -10.807 6.994 -4.144 1.00 0.300 H ATOM 900 HA TYR A 59 -9.989 7.384 -1.464 1.00 0.320 H ATOM 901 1HB TYR A 59 -8.590 7.924 -3.436 1.00 0.440 H ATOM 902 2HB TYR A 59 -9.643 9.279 -3.824 1.00 0.440 H ATOM 903 HD1 TYR A 59 -7.226 7.916 -1.433 1.00 0.440 H ATOM 904 HD2 TYR A 59 -9.525 11.353 -2.604 1.00 0.440 H ATOM 905 HE1 TYR A 59 -5.911 9.316 0.085 1.00 0.440 H ATOM 906 HE2 TYR A 59 -8.213 12.752 -1.067 1.00 0.440 H ATOM 907 HH TYR A 59 -6.586 12.804 0.411 1.00 0.440 H ATOM 908 N SER A 60 -12.042 9.798 -2.468 1.00 0.270 N ATOM 909 CA SER A 60 -12.895 10.876 -1.974 1.00 0.290 C ATOM 910 C SER A 60 -14.026 10.387 -1.081 1.00 0.280 C ATOM 911 O SER A 60 -14.431 11.084 -0.145 1.00 0.340 O ATOM 912 CB SER A 60 -13.483 11.628 -3.146 1.00 0.400 C ATOM 913 OG SER A 60 -14.349 10.803 -3.880 1.00 0.400 O ATOM 914 H SER A 60 -11.994 9.631 -3.464 1.00 0.320 H ATOM 915 HA SER A 60 -12.272 11.558 -1.393 1.00 0.350 H ATOM 916 1HB SER A 60 -14.025 12.500 -2.783 1.00 0.480 H ATOM 917 2HB SER A 60 -12.680 11.984 -3.789 1.00 0.480 H ATOM 918 HG SER A 60 -14.716 11.357 -4.579 1.00 0.480 H ATOM 919 N ILE A 61 -14.492 9.168 -1.322 1.00 0.250 N ATOM 920 CA ILE A 61 -15.546 8.592 -0.511 1.00 0.240 C ATOM 921 C ILE A 61 -15.006 8.301 0.865 1.00 0.220 C ATOM 922 O ILE A 61 -15.630 8.649 1.871 1.00 0.220 O ATOM 923 CB ILE A 61 -16.111 7.298 -1.132 1.00 0.340 C ATOM 924 CG1 ILE A 61 -16.839 7.643 -2.454 1.00 0.340 C ATOM 925 CG2 ILE A 61 -17.061 6.597 -0.123 1.00 0.340 C ATOM 926 CD1 ILE A 61 -17.200 6.446 -3.333 1.00 0.340 C ATOM 927 H ILE A 61 -14.130 8.675 -2.126 1.00 0.300 H ATOM 928 HA ILE A 61 -16.353 9.318 -0.418 1.00 0.290 H ATOM 929 HB ILE A 61 -15.288 6.630 -1.373 1.00 0.410 H ATOM 930 1HG1 ILE A 61 -17.757 8.174 -2.206 1.00 0.410 H ATOM 931 2HG1 ILE A 61 -16.205 8.313 -3.036 1.00 0.410 H ATOM 932 1HG2 ILE A 61 -17.451 5.681 -0.552 1.00 0.410 H ATOM 933 2HG2 ILE A 61 -16.530 6.345 0.793 1.00 0.410 H ATOM 934 3HG2 ILE A 61 -17.889 7.266 0.120 1.00 0.410 H ATOM 935 1HD1 ILE A 61 -17.709 6.809 -4.228 1.00 0.410 H ATOM 936 2HD1 ILE A 61 -16.318 5.914 -3.634 1.00 0.410 H ATOM 937 3HD1 ILE A 61 -17.862 5.768 -2.804 1.00 0.410 H ATOM 938 N ALA A 62 -13.853 7.633 0.912 1.00 0.210 N ATOM 939 CA ALA A 62 -13.246 7.296 2.179 1.00 0.190 C ATOM 940 C ALA A 62 -12.899 8.542 2.977 1.00 0.170 C ATOM 941 O ALA A 62 -13.113 8.582 4.195 1.00 0.150 O ATOM 942 CB ALA A 62 -11.996 6.478 1.944 1.00 0.270 C ATOM 943 H ALA A 62 -13.390 7.350 0.041 1.00 0.250 H ATOM 944 HA ALA A 62 -13.962 6.709 2.753 1.00 0.230 H ATOM 945 1HB ALA A 62 -11.551 6.206 2.898 1.00 0.330 H ATOM 946 2HB ALA A 62 -12.249 5.581 1.391 1.00 0.330 H ATOM 947 3HB ALA A 62 -11.285 7.071 1.363 1.00 0.330 H ATOM 948 N GLU A 63 -12.380 9.573 2.298 1.00 0.190 N ATOM 949 CA GLU A 63 -12.014 10.781 3.000 1.00 0.170 C ATOM 950 C GLU A 63 -13.252 11.441 3.583 1.00 0.150 C ATOM 951 O GLU A 63 -13.230 11.865 4.742 1.00 0.140 O ATOM 952 CB GLU A 63 -11.243 11.744 2.101 1.00 0.250 C ATOM 953 CG GLU A 63 -10.708 12.949 2.859 1.00 0.250 C ATOM 954 CD GLU A 63 -9.851 13.866 2.062 1.00 0.250 C ATOM 955 OE1 GLU A 63 -9.925 13.862 0.863 1.00 0.250 O ATOM 956 OE2 GLU A 63 -9.093 14.571 2.679 1.00 0.250 O ATOM 957 H GLU A 63 -12.194 9.492 1.293 1.00 0.230 H ATOM 958 HA GLU A 63 -11.360 10.509 3.827 1.00 0.200 H ATOM 959 1HB GLU A 63 -10.405 11.222 1.632 1.00 0.300 H ATOM 960 2HB GLU A 63 -11.896 12.098 1.302 1.00 0.300 H ATOM 961 1HG GLU A 63 -11.560 13.516 3.213 1.00 0.300 H ATOM 962 2HG GLU A 63 -10.152 12.605 3.731 1.00 0.300 H ATOM 963 N ALA A 64 -14.337 11.525 2.798 1.00 0.170 N ATOM 964 CA ALA A 64 -15.558 12.124 3.296 1.00 0.180 C ATOM 965 C ALA A 64 -16.101 11.349 4.483 1.00 0.160 C ATOM 966 O ALA A 64 -16.538 11.948 5.464 1.00 0.160 O ATOM 967 CB ALA A 64 -16.603 12.163 2.203 1.00 0.250 C ATOM 968 H ALA A 64 -14.309 11.193 1.829 1.00 0.200 H ATOM 969 HA ALA A 64 -15.333 13.138 3.619 1.00 0.220 H ATOM 970 1HB ALA A 64 -17.505 12.627 2.578 1.00 0.300 H ATOM 971 2HB ALA A 64 -16.217 12.732 1.357 1.00 0.300 H ATOM 972 3HB ALA A 64 -16.820 11.142 1.881 1.00 0.300 H ATOM 973 N ALA A 65 -16.062 10.013 4.418 1.00 0.160 N ATOM 974 CA ALA A 65 -16.571 9.202 5.509 1.00 0.150 C ATOM 975 C ALA A 65 -15.800 9.469 6.792 1.00 0.130 C ATOM 976 O ALA A 65 -16.364 9.549 7.896 1.00 0.130 O ATOM 977 CB ALA A 65 -16.473 7.732 5.148 1.00 0.210 C ATOM 978 H ALA A 65 -15.720 9.548 3.569 1.00 0.190 H ATOM 979 HA ALA A 65 -17.617 9.468 5.668 1.00 0.180 H ATOM 980 1HB ALA A 65 -16.874 7.123 5.951 1.00 0.260 H ATOM 981 2HB ALA A 65 -17.044 7.554 4.234 1.00 0.260 H ATOM 982 3HB ALA A 65 -15.430 7.472 4.981 1.00 0.260 H ATOM 983 N PHE A 66 -14.487 9.633 6.678 1.00 0.120 N ATOM 984 CA PHE A 66 -13.724 9.903 7.881 1.00 0.100 C ATOM 985 C PHE A 66 -14.045 11.304 8.394 1.00 0.130 C ATOM 986 O PHE A 66 -14.361 11.503 9.568 1.00 0.150 O ATOM 987 CB PHE A 66 -12.236 9.740 7.633 1.00 0.150 C ATOM 988 CG PHE A 66 -11.419 9.779 8.894 1.00 0.150 C ATOM 989 CD1 PHE A 66 -11.378 8.652 9.725 1.00 0.150 C ATOM 990 CD2 PHE A 66 -10.699 10.887 9.263 1.00 0.150 C ATOM 991 CE1 PHE A 66 -10.648 8.643 10.868 1.00 0.150 C ATOM 992 CE2 PHE A 66 -9.955 10.868 10.426 1.00 0.150 C ATOM 993 CZ PHE A 66 -9.934 9.747 11.221 1.00 0.150 C ATOM 994 H PHE A 66 -14.023 9.502 5.769 1.00 0.140 H ATOM 995 HA PHE A 66 -14.020 9.199 8.654 1.00 0.120 H ATOM 996 1HB PHE A 66 -12.062 8.797 7.130 1.00 0.180 H ATOM 997 2HB PHE A 66 -11.889 10.535 6.964 1.00 0.180 H ATOM 998 HD1 PHE A 66 -11.928 7.772 9.458 1.00 0.180 H ATOM 999 HD2 PHE A 66 -10.726 11.774 8.632 1.00 0.180 H ATOM 1000 HE1 PHE A 66 -10.636 7.753 11.503 1.00 0.180 H ATOM 1001 HE2 PHE A 66 -9.390 11.733 10.721 1.00 0.180 H ATOM 1002 HZ PHE A 66 -9.356 9.733 12.134 1.00 0.180 H ATOM 1003 N ASN A 67 -14.017 12.291 7.499 1.00 0.160 N ATOM 1004 CA ASN A 67 -14.224 13.676 7.897 1.00 0.200 C ATOM 1005 C ASN A 67 -15.610 13.957 8.470 1.00 0.190 C ATOM 1006 O ASN A 67 -15.766 14.803 9.350 1.00 0.210 O ATOM 1007 CB ASN A 67 -13.875 14.590 6.755 1.00 0.260 C ATOM 1008 CG ASN A 67 -12.386 14.634 6.580 1.00 0.260 C ATOM 1009 OD1 ASN A 67 -11.656 14.280 7.504 1.00 0.260 O ATOM 1010 ND2 ASN A 67 -11.924 15.048 5.441 1.00 0.260 N ATOM 1011 H ASN A 67 -13.800 12.080 6.521 1.00 0.190 H ATOM 1012 HA ASN A 67 -13.530 13.885 8.685 1.00 0.240 H ATOM 1013 1HB ASN A 67 -14.333 14.220 5.836 1.00 0.320 H ATOM 1014 2HB ASN A 67 -14.257 15.587 6.942 1.00 0.320 H ATOM 1015 1HD2 ASN A 67 -10.933 15.071 5.280 1.00 0.320 H ATOM 1016 2HD2 ASN A 67 -12.552 15.321 4.714 1.00 0.320 H ATOM 1017 N LYS A 68 -16.613 13.214 8.016 1.00 0.180 N ATOM 1018 CA LYS A 68 -17.976 13.357 8.504 1.00 0.190 C ATOM 1019 C LYS A 68 -18.257 12.507 9.749 1.00 0.170 C ATOM 1020 O LYS A 68 -19.365 12.553 10.287 1.00 0.190 O ATOM 1021 CB LYS A 68 -18.970 12.977 7.407 1.00 0.260 C ATOM 1022 CG LYS A 68 -18.993 13.914 6.205 1.00 0.260 C ATOM 1023 CD LYS A 68 -19.986 13.417 5.159 1.00 0.260 C ATOM 1024 CE LYS A 68 -20.045 14.337 3.949 1.00 0.260 C ATOM 1025 NZ LYS A 68 -21.003 13.834 2.918 1.00 0.260 N ATOM 1026 H LYS A 68 -16.438 12.568 7.241 1.00 0.220 H ATOM 1027 HA LYS A 68 -18.133 14.400 8.773 1.00 0.230 H ATOM 1028 1HB LYS A 68 -18.720 11.977 7.036 1.00 0.310 H ATOM 1029 2HB LYS A 68 -19.974 12.927 7.823 1.00 0.310 H ATOM 1030 1HG LYS A 68 -19.283 14.911 6.534 1.00 0.310 H ATOM 1031 2HG LYS A 68 -17.999 13.973 5.766 1.00 0.310 H ATOM 1032 1HD LYS A 68 -19.683 12.416 4.831 1.00 0.310 H ATOM 1033 2HD LYS A 68 -20.977 13.344 5.604 1.00 0.310 H ATOM 1034 1HE LYS A 68 -20.359 15.328 4.270 1.00 0.310 H ATOM 1035 2HE LYS A 68 -19.053 14.407 3.505 1.00 0.310 H ATOM 1036 1HZ LYS A 68 -21.017 14.467 2.130 1.00 0.310 H ATOM 1037 2HZ LYS A 68 -20.714 12.916 2.607 1.00 0.310 H ATOM 1038 3HZ LYS A 68 -21.929 13.774 3.319 1.00 0.310 H ATOM 1039 N GLY A 69 -17.280 11.706 10.196 1.00 0.160 N ATOM 1040 CA GLY A 69 -17.468 10.832 11.343 1.00 0.150 C ATOM 1041 C GLY A 69 -18.246 9.536 11.058 1.00 0.160 C ATOM 1042 O GLY A 69 -18.820 8.961 11.986 1.00 0.180 O ATOM 1043 H GLY A 69 -16.355 11.717 9.759 1.00 0.190 H ATOM 1044 1HA GLY A 69 -16.483 10.572 11.736 1.00 0.180 H ATOM 1045 2HA GLY A 69 -17.974 11.389 12.129 1.00 0.180 H ATOM 1046 N GLU A 70 -18.316 9.091 9.790 1.00 0.160 N ATOM 1047 CA GLU A 70 -19.056 7.877 9.442 1.00 0.170 C ATOM 1048 C GLU A 70 -18.226 6.646 9.802 1.00 0.160 C ATOM 1049 O GLU A 70 -18.760 5.613 10.214 1.00 0.170 O ATOM 1050 CB GLU A 70 -19.382 7.857 7.949 1.00 0.230 C ATOM 1051 CG GLU A 70 -20.349 8.941 7.484 1.00 0.230 C ATOM 1052 CD GLU A 70 -20.587 8.909 5.992 1.00 0.230 C ATOM 1053 OE1 GLU A 70 -19.959 8.115 5.330 1.00 0.230 O ATOM 1054 OE2 GLU A 70 -21.390 9.678 5.517 1.00 0.230 O ATOM 1055 H GLU A 70 -17.800 9.554 9.044 1.00 0.190 H ATOM 1056 HA GLU A 70 -19.983 7.853 10.012 1.00 0.200 H ATOM 1057 1HB GLU A 70 -18.473 7.969 7.397 1.00 0.280 H ATOM 1058 2HB GLU A 70 -19.807 6.889 7.684 1.00 0.280 H ATOM 1059 1HG GLU A 70 -21.298 8.814 8.001 1.00 0.280 H ATOM 1060 2HG GLU A 70 -19.942 9.912 7.764 1.00 0.280 H ATOM 1061 N THR A 71 -16.912 6.777 9.638 1.00 0.150 N ATOM 1062 CA THR A 71 -15.953 5.714 9.951 1.00 0.140 C ATOM 1063 C THR A 71 -15.028 6.110 11.077 1.00 0.140 C ATOM 1064 O THR A 71 -14.610 7.261 11.199 1.00 0.130 O ATOM 1065 CB THR A 71 -15.058 5.266 8.778 1.00 0.200 C ATOM 1066 OG1 THR A 71 -14.099 4.303 9.303 1.00 0.200 O ATOM 1067 CG2 THR A 71 -14.333 6.413 8.197 1.00 0.200 C ATOM 1068 H THR A 71 -16.591 7.673 9.271 1.00 0.180 H ATOM 1069 HA THR A 71 -16.513 4.840 10.282 1.00 0.170 H ATOM 1070 HB THR A 71 -15.665 4.791 8.010 1.00 0.240 H ATOM 1071 HG1 THR A 71 -13.400 4.088 8.622 1.00 0.240 H ATOM 1072 1HG2 THR A 71 -13.693 6.073 7.382 1.00 0.240 H ATOM 1073 2HG2 THR A 71 -15.047 7.104 7.828 1.00 0.240 H ATOM 1074 3HG2 THR A 71 -13.737 6.868 8.941 1.00 0.240 H ATOM 1075 N ALA A 72 -14.693 5.142 11.920 1.00 0.150 N ATOM 1076 CA ALA A 72 -13.740 5.378 12.998 1.00 0.160 C ATOM 1077 C ALA A 72 -12.296 5.270 12.501 1.00 0.140 C ATOM 1078 O ALA A 72 -11.354 5.563 13.239 1.00 0.150 O ATOM 1079 CB ALA A 72 -13.966 4.390 14.129 1.00 0.220 C ATOM 1080 H ALA A 72 -15.087 4.222 11.779 1.00 0.180 H ATOM 1081 HA ALA A 72 -13.893 6.391 13.370 1.00 0.190 H ATOM 1082 1HB ALA A 72 -13.263 4.597 14.935 1.00 0.260 H ATOM 1083 2HB ALA A 72 -14.985 4.489 14.501 1.00 0.260 H ATOM 1084 3HB ALA A 72 -13.809 3.378 13.762 1.00 0.260 H ATOM 1085 N MET A 73 -12.120 4.810 11.265 1.00 0.120 N ATOM 1086 CA MET A 73 -10.792 4.613 10.703 1.00 0.100 C ATOM 1087 C MET A 73 -10.733 4.759 9.190 1.00 0.090 C ATOM 1088 O MET A 73 -11.654 4.368 8.453 1.00 0.090 O ATOM 1089 CB MET A 73 -10.230 3.242 11.114 1.00 0.150 C ATOM 1090 CG MET A 73 -8.836 2.902 10.496 1.00 0.150 C ATOM 1091 SD MET A 73 -8.106 1.377 11.090 1.00 0.150 S ATOM 1092 CE MET A 73 -6.659 1.322 10.018 1.00 0.150 C ATOM 1093 H MET A 73 -12.943 4.607 10.703 1.00 0.140 H ATOM 1094 HA MET A 73 -10.139 5.379 11.119 1.00 0.120 H ATOM 1095 1HB MET A 73 -10.134 3.203 12.199 1.00 0.180 H ATOM 1096 2HB MET A 73 -10.931 2.462 10.818 1.00 0.180 H ATOM 1097 1HG MET A 73 -8.934 2.793 9.418 1.00 0.180 H ATOM 1098 2HG MET A 73 -8.134 3.712 10.695 1.00 0.180 H ATOM 1099 1HE MET A 73 -6.078 0.436 10.238 1.00 0.180 H ATOM 1100 2HE MET A 73 -6.983 1.290 8.981 1.00 0.180 H ATOM 1101 3HE MET A 73 -6.046 2.212 10.177 1.00 0.180 H ATOM 1102 N THR A 74 -9.583 5.256 8.738 1.00 0.080 N ATOM 1103 CA THR A 74 -9.242 5.364 7.333 1.00 0.090 C ATOM 1104 C THR A 74 -7.729 5.279 7.215 1.00 0.080 C ATOM 1105 O THR A 74 -7.009 5.596 8.167 1.00 0.070 O ATOM 1106 CB THR A 74 -9.735 6.679 6.710 1.00 0.120 C ATOM 1107 OG1 THR A 74 -9.549 6.620 5.296 1.00 0.120 O ATOM 1108 CG2 THR A 74 -8.922 7.874 7.258 1.00 0.120 C ATOM 1109 H THR A 74 -8.895 5.562 9.413 1.00 0.100 H ATOM 1110 HA THR A 74 -9.680 4.528 6.789 1.00 0.110 H ATOM 1111 HB THR A 74 -10.792 6.806 6.937 1.00 0.150 H ATOM 1112 HG1 THR A 74 -9.992 7.369 4.891 1.00 0.150 H ATOM 1113 1HG2 THR A 74 -9.288 8.794 6.806 1.00 0.150 H ATOM 1114 2HG2 THR A 74 -9.035 7.930 8.333 1.00 0.150 H ATOM 1115 3HG2 THR A 74 -7.867 7.764 7.020 1.00 0.150 H ATOM 1116 N ILE A 75 -7.246 4.847 6.062 1.00 0.090 N ATOM 1117 CA ILE A 75 -5.814 4.788 5.814 1.00 0.090 C ATOM 1118 C ILE A 75 -5.417 5.835 4.800 1.00 0.110 C ATOM 1119 O ILE A 75 -5.936 5.851 3.686 1.00 0.140 O ATOM 1120 CB ILE A 75 -5.389 3.385 5.330 1.00 0.130 C ATOM 1121 CG1 ILE A 75 -5.738 2.362 6.445 1.00 0.130 C ATOM 1122 CG2 ILE A 75 -3.882 3.364 4.936 1.00 0.130 C ATOM 1123 CD1 ILE A 75 -5.548 0.904 6.077 1.00 0.130 C ATOM 1124 H ILE A 75 -7.900 4.606 5.327 1.00 0.110 H ATOM 1125 HA ILE A 75 -5.287 5.002 6.742 1.00 0.110 H ATOM 1126 HB ILE A 75 -5.981 3.116 4.454 1.00 0.150 H ATOM 1127 1HG1 ILE A 75 -5.148 2.592 7.315 1.00 0.150 H ATOM 1128 2HG1 ILE A 75 -6.784 2.490 6.708 1.00 0.150 H ATOM 1129 1HG2 ILE A 75 -3.599 2.378 4.585 1.00 0.150 H ATOM 1130 2HG2 ILE A 75 -3.695 4.080 4.135 1.00 0.150 H ATOM 1131 3HG2 ILE A 75 -3.274 3.628 5.796 1.00 0.150 H ATOM 1132 1HD1 ILE A 75 -5.836 0.279 6.921 1.00 0.150 H ATOM 1133 2HD1 ILE A 75 -6.174 0.661 5.216 1.00 0.150 H ATOM 1134 3HD1 ILE A 75 -4.509 0.707 5.832 1.00 0.150 H ATOM 1135 N ASN A 76 -4.498 6.708 5.186 1.00 0.100 N ATOM 1136 CA ASN A 76 -4.069 7.770 4.300 1.00 0.130 C ATOM 1137 C ASN A 76 -2.687 8.258 4.704 1.00 0.130 C ATOM 1138 O ASN A 76 -2.122 7.774 5.688 1.00 0.130 O ATOM 1139 CB ASN A 76 -5.103 8.887 4.350 1.00 0.170 C ATOM 1140 CG ASN A 76 -5.227 9.642 3.091 1.00 0.170 C ATOM 1141 OD1 ASN A 76 -4.239 9.776 2.363 1.00 0.170 O ATOM 1142 ND2 ASN A 76 -6.397 10.152 2.822 1.00 0.170 N ATOM 1143 H ASN A 76 -4.108 6.634 6.117 1.00 0.120 H ATOM 1144 HA ASN A 76 -3.999 7.378 3.290 1.00 0.160 H ATOM 1145 1HB ASN A 76 -6.080 8.474 4.606 1.00 0.200 H ATOM 1146 2HB ASN A 76 -4.829 9.588 5.142 1.00 0.200 H ATOM 1147 1HD2 ASN A 76 -6.508 10.697 1.985 1.00 0.200 H ATOM 1148 2HD2 ASN A 76 -7.167 10.019 3.446 1.00 0.200 H ATOM 1149 N GLY A 77 -2.153 9.227 3.975 1.00 0.170 N ATOM 1150 CA GLY A 77 -0.858 9.769 4.333 1.00 0.180 C ATOM 1151 C GLY A 77 -0.989 11.180 4.898 1.00 0.180 C ATOM 1152 O GLY A 77 -2.091 11.733 4.926 1.00 0.200 O ATOM 1153 H GLY A 77 -2.677 9.577 3.178 1.00 0.200 H ATOM 1154 1HA GLY A 77 -0.409 9.110 5.072 1.00 0.220 H ATOM 1155 2HA GLY A 77 -0.213 9.763 3.464 1.00 0.220 H ATOM 1156 N PRO A 78 0.146 11.812 5.254 1.00 0.170 N ATOM 1157 CA PRO A 78 0.281 13.133 5.853 1.00 0.200 C ATOM 1158 C PRO A 78 -0.445 14.261 5.153 1.00 0.190 C ATOM 1159 O PRO A 78 -0.934 15.193 5.793 1.00 0.200 O ATOM 1160 CB PRO A 78 1.793 13.360 5.791 1.00 0.300 C ATOM 1161 CG PRO A 78 2.383 11.982 5.868 1.00 0.300 C ATOM 1162 CD PRO A 78 1.449 11.122 5.058 1.00 0.300 C ATOM 1163 HA PRO A 78 -0.038 13.073 6.883 1.00 0.240 H ATOM 1164 1HB PRO A 78 2.058 13.896 4.869 1.00 0.360 H ATOM 1165 2HB PRO A 78 2.103 14.001 6.632 1.00 0.360 H ATOM 1166 1HG PRO A 78 3.413 11.985 5.476 1.00 0.360 H ATOM 1167 2HG PRO A 78 2.445 11.663 6.920 1.00 0.360 H ATOM 1168 1HD PRO A 78 1.743 11.123 3.996 1.00 0.360 H ATOM 1169 2HD PRO A 78 1.462 10.118 5.494 1.00 0.360 H ATOM 1170 N TRP A 79 -0.565 14.180 3.837 1.00 0.220 N ATOM 1171 CA TRP A 79 -1.227 15.235 3.096 1.00 0.270 C ATOM 1172 C TRP A 79 -2.700 15.393 3.441 1.00 0.230 C ATOM 1173 O TRP A 79 -3.287 16.449 3.207 1.00 0.320 O ATOM 1174 CB TRP A 79 -1.110 14.948 1.603 1.00 0.360 C ATOM 1175 CG TRP A 79 -1.754 13.644 1.211 1.00 0.360 C ATOM 1176 CD1 TRP A 79 -3.069 13.440 0.917 1.00 0.360 C ATOM 1177 CD2 TRP A 79 -1.108 12.359 1.059 1.00 0.360 C ATOM 1178 NE1 TRP A 79 -3.290 12.132 0.610 1.00 0.360 N ATOM 1179 CE2 TRP A 79 -2.101 11.450 0.685 1.00 0.360 C ATOM 1180 CE3 TRP A 79 0.215 11.912 1.204 1.00 0.360 C ATOM 1181 CZ2 TRP A 79 -1.822 10.114 0.452 1.00 0.360 C ATOM 1182 CZ3 TRP A 79 0.496 10.575 0.963 1.00 0.360 C ATOM 1183 CH2 TRP A 79 -0.499 9.697 0.598 1.00 0.360 C ATOM 1184 H TRP A 79 -0.167 13.416 3.310 1.00 0.260 H ATOM 1185 HA TRP A 79 -0.719 16.173 3.318 1.00 0.320 H ATOM 1186 1HB TRP A 79 -1.589 15.748 1.040 1.00 0.430 H ATOM 1187 2HB TRP A 79 -0.063 14.921 1.313 1.00 0.430 H ATOM 1188 HD1 TRP A 79 -3.839 14.209 0.935 1.00 0.430 H ATOM 1189 HE1 TRP A 79 -4.211 11.752 0.369 1.00 0.430 H ATOM 1190 HE3 TRP A 79 1.010 12.598 1.490 1.00 0.430 H ATOM 1191 HZ2 TRP A 79 -2.597 9.408 0.162 1.00 0.430 H ATOM 1192 HZ3 TRP A 79 1.525 10.236 1.071 1.00 0.430 H ATOM 1193 HH2 TRP A 79 -0.247 8.652 0.417 1.00 0.430 H ATOM 1194 N ALA A 80 -3.314 14.351 3.997 1.00 0.200 N ATOM 1195 CA ALA A 80 -4.729 14.386 4.310 1.00 0.190 C ATOM 1196 C ALA A 80 -5.022 15.020 5.653 1.00 0.200 C ATOM 1197 O ALA A 80 -6.185 15.291 5.975 1.00 0.200 O ATOM 1198 CB ALA A 80 -5.282 12.983 4.289 1.00 0.270 C ATOM 1199 H ALA A 80 -2.783 13.500 4.216 1.00 0.240 H ATOM 1200 HA ALA A 80 -5.227 14.975 3.540 1.00 0.230 H ATOM 1201 1HB ALA A 80 -6.354 13.004 4.482 1.00 0.320 H ATOM 1202 2HB ALA A 80 -5.090 12.558 3.308 1.00 0.320 H ATOM 1203 3HB ALA A 80 -4.779 12.388 5.054 1.00 0.320 H ATOM 1204 N TRP A 81 -3.993 15.277 6.451 1.00 0.220 N ATOM 1205 CA TRP A 81 -4.258 15.769 7.788 1.00 0.240 C ATOM 1206 C TRP A 81 -4.851 17.172 7.753 1.00 0.190 C ATOM 1207 O TRP A 81 -5.685 17.515 8.588 1.00 0.190 O ATOM 1208 CB TRP A 81 -2.986 15.680 8.626 1.00 0.330 C ATOM 1209 CG TRP A 81 -2.523 14.223 8.804 1.00 0.330 C ATOM 1210 CD1 TRP A 81 -3.266 13.090 8.600 1.00 0.330 C ATOM 1211 CD2 TRP A 81 -1.212 13.757 9.178 1.00 0.330 C ATOM 1212 NE1 TRP A 81 -2.511 11.982 8.811 1.00 0.330 N ATOM 1213 CE2 TRP A 81 -1.257 12.358 9.156 1.00 0.330 C ATOM 1214 CE3 TRP A 81 -0.017 14.395 9.502 1.00 0.330 C ATOM 1215 CZ2 TRP A 81 -0.153 11.590 9.437 1.00 0.330 C ATOM 1216 CZ3 TRP A 81 1.094 13.615 9.790 1.00 0.330 C ATOM 1217 CH2 TRP A 81 1.026 12.250 9.755 1.00 0.330 C ATOM 1218 H TRP A 81 -3.026 15.116 6.143 1.00 0.260 H ATOM 1219 HA TRP A 81 -4.999 15.129 8.255 1.00 0.290 H ATOM 1220 1HB TRP A 81 -2.188 16.241 8.137 1.00 0.390 H ATOM 1221 2HB TRP A 81 -3.157 16.120 9.608 1.00 0.390 H ATOM 1222 HD1 TRP A 81 -4.288 13.059 8.300 1.00 0.390 H ATOM 1223 HE1 TRP A 81 -2.829 11.027 8.711 1.00 0.390 H ATOM 1224 HE3 TRP A 81 0.044 15.481 9.521 1.00 0.390 H ATOM 1225 HZ2 TRP A 81 -0.187 10.502 9.409 1.00 0.390 H ATOM 1226 HZ3 TRP A 81 2.027 14.120 10.040 1.00 0.390 H ATOM 1227 HH2 TRP A 81 1.917 11.669 9.981 1.00 0.390 H ATOM 1228 N SER A 82 -4.519 17.967 6.734 1.00 0.240 N ATOM 1229 CA SER A 82 -5.049 19.319 6.647 1.00 0.280 C ATOM 1230 C SER A 82 -6.575 19.323 6.548 1.00 0.290 C ATOM 1231 O SER A 82 -7.245 20.180 7.147 1.00 0.480 O ATOM 1232 CB SER A 82 -4.472 20.017 5.428 1.00 0.380 C ATOM 1233 OG SER A 82 -3.087 20.211 5.556 1.00 0.380 O ATOM 1234 H SER A 82 -3.849 17.664 6.038 1.00 0.290 H ATOM 1235 HA SER A 82 -4.759 19.862 7.549 1.00 0.340 H ATOM 1236 1HB SER A 82 -4.677 19.417 4.539 1.00 0.450 H ATOM 1237 2HB SER A 82 -4.968 20.977 5.294 1.00 0.450 H ATOM 1238 HG SER A 82 -2.808 20.656 4.751 1.00 0.450 H ATOM 1239 N ASN A 83 -7.130 18.372 5.790 1.00 0.200 N ATOM 1240 CA ASN A 83 -8.569 18.309 5.595 1.00 0.190 C ATOM 1241 C ASN A 83 -9.249 17.780 6.851 1.00 0.190 C ATOM 1242 O ASN A 83 -10.336 18.236 7.231 1.00 0.240 O ATOM 1243 CB ASN A 83 -8.889 17.444 4.400 1.00 0.270 C ATOM 1244 CG ASN A 83 -8.496 18.093 3.097 1.00 0.270 C ATOM 1245 OD1 ASN A 83 -8.334 19.319 2.987 1.00 0.270 O ATOM 1246 ND2 ASN A 83 -8.338 17.285 2.087 1.00 0.270 N ATOM 1247 H ASN A 83 -6.533 17.690 5.333 1.00 0.240 H ATOM 1248 HA ASN A 83 -8.944 19.316 5.415 1.00 0.230 H ATOM 1249 1HB ASN A 83 -8.358 16.489 4.491 1.00 0.320 H ATOM 1250 2HB ASN A 83 -9.954 17.219 4.379 1.00 0.320 H ATOM 1251 1HD2 ASN A 83 -8.081 17.641 1.192 1.00 0.320 H ATOM 1252 2HD2 ASN A 83 -8.494 16.283 2.207 1.00 0.320 H ATOM 1253 N ILE A 84 -8.587 16.841 7.515 1.00 0.180 N ATOM 1254 CA ILE A 84 -9.141 16.244 8.716 1.00 0.260 C ATOM 1255 C ILE A 84 -9.230 17.307 9.828 1.00 0.310 C ATOM 1256 O ILE A 84 -10.249 17.405 10.532 1.00 0.410 O ATOM 1257 CB ILE A 84 -8.307 15.035 9.152 1.00 0.330 C ATOM 1258 CG1 ILE A 84 -8.398 13.914 8.090 1.00 0.330 C ATOM 1259 CG2 ILE A 84 -8.900 14.514 10.397 1.00 0.330 C ATOM 1260 CD1 ILE A 84 -7.387 12.799 8.244 1.00 0.330 C ATOM 1261 H ILE A 84 -7.706 16.485 7.123 1.00 0.220 H ATOM 1262 HA ILE A 84 -10.147 15.906 8.501 1.00 0.310 H ATOM 1263 HB ILE A 84 -7.267 15.320 9.304 1.00 0.400 H ATOM 1264 1HG1 ILE A 84 -9.380 13.485 8.136 1.00 0.400 H ATOM 1265 2HG1 ILE A 84 -8.267 14.355 7.104 1.00 0.400 H ATOM 1266 1HG2 ILE A 84 -8.350 13.667 10.726 1.00 0.400 H ATOM 1267 2HG2 ILE A 84 -8.876 15.273 11.162 1.00 0.400 H ATOM 1268 3HG2 ILE A 84 -9.930 14.229 10.200 1.00 0.400 H ATOM 1269 1HD1 ILE A 84 -7.535 12.070 7.447 1.00 0.400 H ATOM 1270 2HD1 ILE A 84 -6.409 13.219 8.165 1.00 0.400 H ATOM 1271 3HD1 ILE A 84 -7.489 12.300 9.197 1.00 0.400 H ATOM 1272 N ASP A 85 -8.148 18.095 9.997 1.00 0.300 N ATOM 1273 CA ASP A 85 -8.131 19.165 10.994 1.00 0.340 C ATOM 1274 C ASP A 85 -9.226 20.194 10.694 1.00 0.320 C ATOM 1275 O ASP A 85 -9.942 20.629 11.597 1.00 0.470 O ATOM 1276 CB ASP A 85 -6.786 19.916 11.006 1.00 0.460 C ATOM 1277 CG ASP A 85 -5.569 19.158 11.590 1.00 0.460 C ATOM 1278 OD1 ASP A 85 -5.730 18.131 12.203 1.00 0.460 O ATOM 1279 OD2 ASP A 85 -4.483 19.656 11.433 1.00 0.460 O ATOM 1280 H ASP A 85 -7.312 17.930 9.428 1.00 0.360 H ATOM 1281 HA ASP A 85 -8.312 18.729 11.976 1.00 0.410 H ATOM 1282 1HB ASP A 85 -6.537 20.188 9.976 1.00 0.550 H ATOM 1283 2HB ASP A 85 -6.906 20.847 11.558 1.00 0.550 H ATOM 1284 N THR A 86 -9.422 20.511 9.410 1.00 0.360 N ATOM 1285 CA THR A 86 -10.424 21.474 8.948 1.00 0.410 C ATOM 1286 C THR A 86 -11.829 21.041 9.353 1.00 0.480 C ATOM 1287 O THR A 86 -12.662 21.855 9.759 1.00 0.620 O ATOM 1288 CB THR A 86 -10.344 21.668 7.415 1.00 0.550 C ATOM 1289 OG1 THR A 86 -9.049 22.191 7.058 1.00 0.550 O ATOM 1290 CG2 THR A 86 -11.418 22.641 6.938 1.00 0.550 C ATOM 1291 H THR A 86 -8.791 20.124 8.705 1.00 0.430 H ATOM 1292 HA THR A 86 -10.218 22.434 9.421 1.00 0.490 H ATOM 1293 HB THR A 86 -10.487 20.716 6.921 1.00 0.660 H ATOM 1294 HG1 THR A 86 -8.354 21.520 7.234 1.00 0.660 H ATOM 1295 1HG2 THR A 86 -11.335 22.760 5.861 1.00 0.660 H ATOM 1296 2HG2 THR A 86 -12.409 22.260 7.178 1.00 0.660 H ATOM 1297 3HG2 THR A 86 -11.275 23.604 7.424 1.00 0.660 H ATOM 1298 N SER A 87 -12.078 19.742 9.253 1.00 0.440 N ATOM 1299 CA SER A 87 -13.370 19.142 9.549 1.00 0.570 C ATOM 1300 C SER A 87 -13.643 18.962 11.053 1.00 0.600 C ATOM 1301 O SER A 87 -14.718 18.509 11.436 1.00 1.250 O ATOM 1302 CB SER A 87 -13.477 17.818 8.818 1.00 0.750 C ATOM 1303 OG SER A 87 -13.473 18.020 7.427 1.00 0.750 O ATOM 1304 H SER A 87 -11.340 19.145 8.869 1.00 0.530 H ATOM 1305 HA SER A 87 -14.139 19.803 9.151 1.00 0.680 H ATOM 1306 1HB SER A 87 -12.633 17.185 9.087 1.00 0.900 H ATOM 1307 2HB SER A 87 -14.390 17.301 9.117 1.00 0.900 H ATOM 1308 HG SER A 87 -12.540 18.148 7.186 1.00 0.900 H ATOM 1309 N LYS A 88 -12.677 19.301 11.909 1.00 0.720 N ATOM 1310 CA LYS A 88 -12.785 19.186 13.362 1.00 0.710 C ATOM 1311 C LYS A 88 -13.023 17.765 13.844 1.00 0.580 C ATOM 1312 O LYS A 88 -13.773 17.535 14.797 1.00 0.630 O ATOM 1313 CB LYS A 88 -13.894 20.104 13.890 1.00 1.000 C ATOM 1314 CG LYS A 88 -13.688 21.576 13.557 1.00 1.000 C ATOM 1315 CD LYS A 88 -14.788 22.441 14.154 1.00 1.000 C ATOM 1316 CE LYS A 88 -14.609 23.905 13.771 1.00 1.000 C ATOM 1317 NZ LYS A 88 -15.703 24.763 14.317 1.00 1.000 N ATOM 1318 H LYS A 88 -11.801 19.690 11.548 1.00 0.860 H ATOM 1319 HA LYS A 88 -11.836 19.518 13.788 1.00 0.850 H ATOM 1320 1HB LYS A 88 -14.861 19.796 13.503 1.00 1.200 H ATOM 1321 2HB LYS A 88 -13.941 20.018 14.974 1.00 1.200 H ATOM 1322 1HG LYS A 88 -12.722 21.899 13.941 1.00 1.200 H ATOM 1323 2HG LYS A 88 -13.685 21.701 12.472 1.00 1.200 H ATOM 1324 1HD LYS A 88 -15.755 22.092 13.791 1.00 1.200 H ATOM 1325 2HD LYS A 88 -14.772 22.350 15.239 1.00 1.200 H ATOM 1326 1HE LYS A 88 -13.655 24.260 14.157 1.00 1.200 H ATOM 1327 2HE LYS A 88 -14.603 23.990 12.683 1.00 1.200 H ATOM 1328 1HZ LYS A 88 -15.549 25.723 14.041 1.00 1.200 H ATOM 1329 2HZ LYS A 88 -16.593 24.449 13.954 1.00 1.200 H ATOM 1330 3HZ LYS A 88 -15.711 24.701 15.325 1.00 1.200 H ATOM 1331 N VAL A 89 -12.343 16.824 13.210 1.00 0.650 N ATOM 1332 CA VAL A 89 -12.414 15.426 13.578 1.00 0.570 C ATOM 1333 C VAL A 89 -11.427 15.200 14.700 1.00 0.410 C ATOM 1334 O VAL A 89 -10.310 15.705 14.638 1.00 0.460 O ATOM 1335 CB VAL A 89 -11.975 14.543 12.408 1.00 0.830 C ATOM 1336 CG1 VAL A 89 -11.997 13.055 12.779 1.00 0.830 C ATOM 1337 CG2 VAL A 89 -12.812 14.804 11.228 1.00 0.830 C ATOM 1338 H VAL A 89 -11.731 17.099 12.432 1.00 0.780 H ATOM 1339 HA VAL A 89 -13.424 15.180 13.905 1.00 0.680 H ATOM 1340 HB VAL A 89 -10.963 14.794 12.178 1.00 1.000 H ATOM 1341 1HG1 VAL A 89 -11.655 12.477 11.933 1.00 1.000 H ATOM 1342 2HG1 VAL A 89 -11.355 12.855 13.622 1.00 1.000 H ATOM 1343 3HG1 VAL A 89 -13.013 12.756 13.027 1.00 1.000 H ATOM 1344 1HG2 VAL A 89 -12.427 14.194 10.436 1.00 1.000 H ATOM 1345 2HG2 VAL A 89 -13.853 14.548 11.430 1.00 1.000 H ATOM 1346 3HG2 VAL A 89 -12.748 15.846 10.954 1.00 1.000 H ATOM 1347 N ASN A 90 -11.823 14.498 15.745 1.00 0.380 N ATOM 1348 CA ASN A 90 -10.866 14.185 16.794 1.00 0.340 C ATOM 1349 C ASN A 90 -10.164 12.901 16.357 1.00 0.360 C ATOM 1350 O ASN A 90 -10.759 11.827 16.416 1.00 0.800 O ATOM 1351 CB ASN A 90 -11.546 14.010 18.138 1.00 0.490 C ATOM 1352 CG ASN A 90 -10.559 13.795 19.253 1.00 0.490 C ATOM 1353 OD1 ASN A 90 -9.354 14.003 19.064 1.00 0.490 O ATOM 1354 ND2 ASN A 90 -11.043 13.393 20.405 1.00 0.490 N ATOM 1355 H ASN A 90 -12.767 14.144 15.786 1.00 0.460 H ATOM 1356 HA ASN A 90 -10.118 14.976 16.860 1.00 0.410 H ATOM 1357 1HB ASN A 90 -12.145 14.894 18.360 1.00 0.590 H ATOM 1358 2HB ASN A 90 -12.222 13.157 18.096 1.00 0.590 H ATOM 1359 1HD2 ASN A 90 -10.429 13.237 21.180 1.00 0.590 H ATOM 1360 2HD2 ASN A 90 -12.025 13.240 20.509 1.00 0.590 H ATOM 1361 N TYR A 91 -8.941 13.003 15.856 1.00 0.280 N ATOM 1362 CA TYR A 91 -8.273 11.836 15.294 1.00 0.300 C ATOM 1363 C TYR A 91 -6.843 11.784 15.759 1.00 0.230 C ATOM 1364 O TYR A 91 -6.279 12.794 16.183 1.00 0.250 O ATOM 1365 CB TYR A 91 -8.237 11.907 13.766 1.00 0.410 C ATOM 1366 CG TYR A 91 -7.241 12.921 13.234 1.00 0.410 C ATOM 1367 CD1 TYR A 91 -6.002 12.501 12.727 1.00 0.410 C ATOM 1368 CD2 TYR A 91 -7.514 14.250 13.309 1.00 0.410 C ATOM 1369 CE1 TYR A 91 -5.081 13.427 12.284 1.00 0.410 C ATOM 1370 CE2 TYR A 91 -6.598 15.173 12.875 1.00 0.410 C ATOM 1371 CZ TYR A 91 -5.388 14.776 12.363 1.00 0.410 C ATOM 1372 OH TYR A 91 -4.475 15.724 11.943 1.00 0.410 O ATOM 1373 H TYR A 91 -8.481 13.905 15.850 1.00 0.340 H ATOM 1374 HA TYR A 91 -8.778 10.930 15.626 1.00 0.360 H ATOM 1375 1HB TYR A 91 -7.954 10.935 13.377 1.00 0.490 H ATOM 1376 2HB TYR A 91 -9.211 12.149 13.378 1.00 0.490 H ATOM 1377 HD1 TYR A 91 -5.766 11.442 12.678 1.00 0.490 H ATOM 1378 HD2 TYR A 91 -8.455 14.587 13.706 1.00 0.490 H ATOM 1379 HE1 TYR A 91 -4.122 13.100 11.885 1.00 0.490 H ATOM 1380 HE2 TYR A 91 -6.838 16.230 12.942 1.00 0.490 H ATOM 1381 HH TYR A 91 -4.853 16.638 12.085 1.00 0.490 H ATOM 1382 N GLY A 92 -6.249 10.606 15.674 1.00 0.180 N ATOM 1383 CA GLY A 92 -4.837 10.483 15.951 1.00 0.180 C ATOM 1384 C GLY A 92 -4.150 9.830 14.771 1.00 0.170 C ATOM 1385 O GLY A 92 -4.794 9.458 13.786 1.00 0.230 O ATOM 1386 H GLY A 92 -6.771 9.799 15.364 1.00 0.220 H ATOM 1387 1HA GLY A 92 -4.403 11.466 16.133 1.00 0.220 H ATOM 1388 2HA GLY A 92 -4.686 9.885 16.848 1.00 0.220 H ATOM 1389 N VAL A 93 -2.851 9.636 14.904 1.00 0.190 N ATOM 1390 CA VAL A 93 -2.042 9.004 13.881 1.00 0.210 C ATOM 1391 C VAL A 93 -1.326 7.831 14.520 1.00 0.230 C ATOM 1392 O VAL A 93 -0.645 7.997 15.531 1.00 0.280 O ATOM 1393 CB VAL A 93 -1.031 10.016 13.295 1.00 0.290 C ATOM 1394 CG1 VAL A 93 -0.151 9.341 12.245 1.00 0.290 C ATOM 1395 CG2 VAL A 93 -1.800 11.213 12.676 1.00 0.290 C ATOM 1396 H VAL A 93 -2.402 9.950 15.754 1.00 0.230 H ATOM 1397 HA VAL A 93 -2.687 8.635 13.083 1.00 0.250 H ATOM 1398 HB VAL A 93 -0.378 10.371 14.091 1.00 0.340 H ATOM 1399 1HG1 VAL A 93 0.560 10.064 11.860 1.00 0.340 H ATOM 1400 2HG1 VAL A 93 0.397 8.509 12.690 1.00 0.340 H ATOM 1401 3HG1 VAL A 93 -0.773 8.971 11.431 1.00 0.340 H ATOM 1402 1HG2 VAL A 93 -1.092 11.934 12.272 1.00 0.340 H ATOM 1403 2HG2 VAL A 93 -2.449 10.856 11.877 1.00 0.340 H ATOM 1404 3HG2 VAL A 93 -2.405 11.702 13.435 1.00 0.340 H ATOM 1405 N THR A 94 -1.488 6.645 13.957 1.00 0.220 N ATOM 1406 CA THR A 94 -0.850 5.478 14.545 1.00 0.280 C ATOM 1407 C THR A 94 -0.287 4.509 13.525 1.00 0.230 C ATOM 1408 O THR A 94 -0.236 4.796 12.327 1.00 0.250 O ATOM 1409 CB THR A 94 -1.812 4.740 15.490 1.00 0.370 C ATOM 1410 OG1 THR A 94 -1.070 3.751 16.219 1.00 0.370 O ATOM 1411 CG2 THR A 94 -2.955 4.079 14.708 1.00 0.370 C ATOM 1412 H THR A 94 -2.050 6.557 13.123 1.00 0.260 H ATOM 1413 HA THR A 94 -0.010 5.822 15.149 1.00 0.340 H ATOM 1414 HB THR A 94 -2.230 5.456 16.198 1.00 0.440 H ATOM 1415 HG1 THR A 94 -1.614 3.422 16.949 1.00 0.440 H ATOM 1416 1HG2 THR A 94 -3.619 3.573 15.407 1.00 0.440 H ATOM 1417 2HG2 THR A 94 -3.511 4.845 14.171 1.00 0.440 H ATOM 1418 3HG2 THR A 94 -2.574 3.350 13.997 1.00 0.440 H ATOM 1419 N VAL A 95 0.150 3.371 14.036 1.00 0.210 N ATOM 1420 CA VAL A 95 0.744 2.294 13.266 1.00 0.200 C ATOM 1421 C VAL A 95 -0.347 1.385 12.711 1.00 0.170 C ATOM 1422 O VAL A 95 -1.236 0.950 13.441 1.00 0.170 O ATOM 1423 CB VAL A 95 1.730 1.507 14.155 1.00 0.280 C ATOM 1424 CG1 VAL A 95 2.315 0.312 13.404 1.00 0.280 C ATOM 1425 CG2 VAL A 95 2.842 2.454 14.606 1.00 0.280 C ATOM 1426 H VAL A 95 0.022 3.257 15.039 1.00 0.250 H ATOM 1427 HA VAL A 95 1.295 2.727 12.431 1.00 0.240 H ATOM 1428 HB VAL A 95 1.199 1.123 15.025 1.00 0.340 H ATOM 1429 1HG1 VAL A 95 3.001 -0.224 14.058 1.00 0.340 H ATOM 1430 2HG1 VAL A 95 1.520 -0.367 13.100 1.00 0.340 H ATOM 1431 3HG1 VAL A 95 2.852 0.659 12.523 1.00 0.340 H ATOM 1432 1HG2 VAL A 95 3.539 1.917 15.250 1.00 0.340 H ATOM 1433 2HG2 VAL A 95 3.371 2.833 13.733 1.00 0.340 H ATOM 1434 3HG2 VAL A 95 2.414 3.289 15.158 1.00 0.340 H ATOM 1435 N LEU A 96 -0.276 1.085 11.422 1.00 0.160 N ATOM 1436 CA LEU A 96 -1.281 0.238 10.807 1.00 0.140 C ATOM 1437 C LEU A 96 -1.281 -1.156 11.442 1.00 0.170 C ATOM 1438 O LEU A 96 -0.212 -1.663 11.794 1.00 0.190 O ATOM 1439 CB LEU A 96 -1.035 0.139 9.298 1.00 0.200 C ATOM 1440 CG LEU A 96 -1.250 1.410 8.457 1.00 0.200 C ATOM 1441 CD1 LEU A 96 -0.854 1.092 7.017 1.00 0.200 C ATOM 1442 CD2 LEU A 96 -2.706 1.869 8.530 1.00 0.200 C ATOM 1443 H LEU A 96 0.479 1.469 10.873 1.00 0.190 H ATOM 1444 HA LEU A 96 -2.234 0.707 10.996 1.00 0.170 H ATOM 1445 1HB LEU A 96 0.010 -0.108 9.181 1.00 0.240 H ATOM 1446 2HB LEU A 96 -1.620 -0.671 8.870 1.00 0.240 H ATOM 1447 HG LEU A 96 -0.603 2.206 8.821 1.00 0.240 H ATOM 1448 1HD1 LEU A 96 -0.977 1.980 6.395 1.00 0.240 H ATOM 1449 2HD1 LEU A 96 0.182 0.776 7.002 1.00 0.240 H ATOM 1450 3HD1 LEU A 96 -1.486 0.291 6.630 1.00 0.240 H ATOM 1451 1HD2 LEU A 96 -2.823 2.756 7.918 1.00 0.240 H ATOM 1452 2HD2 LEU A 96 -3.352 1.079 8.156 1.00 0.240 H ATOM 1453 3HD2 LEU A 96 -2.990 2.116 9.544 1.00 0.240 H ATOM 1454 N PRO A 97 -2.463 -1.805 11.555 1.00 0.170 N ATOM 1455 CA PRO A 97 -2.702 -3.100 12.177 1.00 0.210 C ATOM 1456 C PRO A 97 -1.996 -4.240 11.481 1.00 0.190 C ATOM 1457 O PRO A 97 -1.636 -4.144 10.307 1.00 0.190 O ATOM 1458 CB PRO A 97 -4.227 -3.258 12.080 1.00 0.320 C ATOM 1459 CG PRO A 97 -4.648 -2.365 10.940 1.00 0.320 C ATOM 1460 CD PRO A 97 -3.699 -1.197 10.991 1.00 0.320 C ATOM 1461 HA PRO A 97 -2.389 -3.049 13.230 1.00 0.250 H ATOM 1462 1HB PRO A 97 -4.474 -4.321 11.897 1.00 0.380 H ATOM 1463 2HB PRO A 97 -4.695 -2.983 13.035 1.00 0.380 H ATOM 1464 1HG PRO A 97 -4.577 -2.920 9.988 1.00 0.380 H ATOM 1465 2HG PRO A 97 -5.703 -2.068 11.059 1.00 0.380 H ATOM 1466 1HD PRO A 97 -3.568 -0.839 9.971 1.00 0.380 H ATOM 1467 2HD PRO A 97 -4.093 -0.420 11.668 1.00 0.380 H ATOM 1468 N THR A 98 -1.760 -5.304 12.235 1.00 0.190 N ATOM 1469 CA THR A 98 -1.092 -6.477 11.717 1.00 0.190 C ATOM 1470 C THR A 98 -2.004 -7.417 10.946 1.00 0.190 C ATOM 1471 O THR A 98 -3.234 -7.340 11.027 1.00 0.220 O ATOM 1472 CB THR A 98 -0.436 -7.272 12.871 1.00 0.270 C ATOM 1473 OG1 THR A 98 -1.450 -7.706 13.786 1.00 0.270 O ATOM 1474 CG2 THR A 98 0.574 -6.429 13.603 1.00 0.270 C ATOM 1475 H THR A 98 -2.070 -5.333 13.197 1.00 0.230 H ATOM 1476 HA THR A 98 -0.319 -6.130 11.039 1.00 0.230 H ATOM 1477 HB THR A 98 0.056 -8.143 12.466 1.00 0.320 H ATOM 1478 HG1 THR A 98 -1.049 -8.233 14.483 1.00 0.320 H ATOM 1479 1HG2 THR A 98 1.021 -7.018 14.404 1.00 0.320 H ATOM 1480 2HG2 THR A 98 1.340 -6.123 12.928 1.00 0.320 H ATOM 1481 3HG2 THR A 98 0.091 -5.552 14.023 1.00 0.320 H ATOM 1482 N PHE A 99 -1.369 -8.326 10.218 1.00 0.200 N ATOM 1483 CA PHE A 99 -2.017 -9.388 9.470 1.00 0.190 C ATOM 1484 C PHE A 99 -1.231 -10.666 9.696 1.00 0.220 C ATOM 1485 O PHE A 99 -0.035 -10.729 9.427 1.00 0.220 O ATOM 1486 CB PHE A 99 -2.092 -9.029 7.992 1.00 0.270 C ATOM 1487 CG PHE A 99 -2.747 -10.067 7.167 1.00 0.270 C ATOM 1488 CD1 PHE A 99 -4.075 -10.396 7.356 1.00 0.270 C ATOM 1489 CD2 PHE A 99 -2.033 -10.719 6.190 1.00 0.270 C ATOM 1490 CE1 PHE A 99 -4.658 -11.362 6.595 1.00 0.270 C ATOM 1491 CE2 PHE A 99 -2.622 -11.685 5.417 1.00 0.270 C ATOM 1492 CZ PHE A 99 -3.940 -12.007 5.624 1.00 0.270 C ATOM 1493 H PHE A 99 -0.352 -8.257 10.198 1.00 0.240 H ATOM 1494 HA PHE A 99 -3.026 -9.525 9.856 1.00 0.230 H ATOM 1495 1HB PHE A 99 -2.637 -8.092 7.871 1.00 0.320 H ATOM 1496 2HB PHE A 99 -1.086 -8.876 7.613 1.00 0.320 H ATOM 1497 HD1 PHE A 99 -4.659 -9.884 8.123 1.00 0.320 H ATOM 1498 HD2 PHE A 99 -0.990 -10.453 6.042 1.00 0.320 H ATOM 1499 HE1 PHE A 99 -5.698 -11.617 6.762 1.00 0.320 H ATOM 1500 HE2 PHE A 99 -2.045 -12.196 4.645 1.00 0.320 H ATOM 1501 HZ PHE A 99 -4.418 -12.774 5.016 1.00 0.320 H ATOM 1502 N LYS A 100 -1.881 -11.662 10.293 1.00 0.250 N ATOM 1503 CA LYS A 100 -1.217 -12.906 10.686 1.00 0.280 C ATOM 1504 C LYS A 100 -0.002 -12.622 11.571 1.00 0.280 C ATOM 1505 O LYS A 100 1.027 -13.291 11.468 1.00 0.320 O ATOM 1506 CB LYS A 100 -0.758 -13.729 9.491 1.00 0.380 C ATOM 1507 CG LYS A 100 -1.821 -14.242 8.569 1.00 0.380 C ATOM 1508 CD LYS A 100 -1.131 -15.128 7.576 1.00 0.380 C ATOM 1509 CE LYS A 100 -2.025 -15.777 6.577 1.00 0.380 C ATOM 1510 NZ LYS A 100 -1.194 -16.605 5.628 1.00 0.380 N ATOM 1511 H LYS A 100 -2.868 -11.550 10.479 1.00 0.300 H ATOM 1512 HA LYS A 100 -1.919 -13.504 11.268 1.00 0.340 H ATOM 1513 1HB LYS A 100 -0.060 -13.149 8.884 1.00 0.460 H ATOM 1514 2HB LYS A 100 -0.209 -14.595 9.856 1.00 0.460 H ATOM 1515 1HG LYS A 100 -2.567 -14.805 9.124 1.00 0.460 H ATOM 1516 2HG LYS A 100 -2.302 -13.411 8.055 1.00 0.460 H ATOM 1517 1HD LYS A 100 -0.407 -14.527 7.041 1.00 0.460 H ATOM 1518 2HD LYS A 100 -0.588 -15.907 8.105 1.00 0.460 H ATOM 1519 1HE LYS A 100 -2.734 -16.424 7.088 1.00 0.460 H ATOM 1520 2HE LYS A 100 -2.570 -15.021 6.022 1.00 0.460 H ATOM 1521 1HZ LYS A 100 -1.766 -17.074 4.946 1.00 0.460 H ATOM 1522 2HZ LYS A 100 -0.512 -15.965 5.149 1.00 0.460 H ATOM 1523 3HZ LYS A 100 -0.684 -17.294 6.149 1.00 0.460 H ATOM 1524 N GLY A 101 -0.121 -11.606 12.424 1.00 0.260 N ATOM 1525 CA GLY A 101 0.932 -11.211 13.347 1.00 0.260 C ATOM 1526 C GLY A 101 2.003 -10.309 12.726 1.00 0.240 C ATOM 1527 O GLY A 101 2.879 -9.817 13.439 1.00 0.240 O ATOM 1528 H GLY A 101 -1.000 -11.106 12.469 1.00 0.310 H ATOM 1529 1HA GLY A 101 0.482 -10.698 14.196 1.00 0.310 H ATOM 1530 2HA GLY A 101 1.407 -12.108 13.744 1.00 0.310 H ATOM 1531 N GLN A 102 1.933 -10.057 11.420 1.00 0.220 N ATOM 1532 CA GLN A 102 2.943 -9.240 10.782 1.00 0.220 C ATOM 1533 C GLN A 102 2.474 -7.803 10.613 1.00 0.210 C ATOM 1534 O GLN A 102 1.314 -7.590 10.284 1.00 0.210 O ATOM 1535 CB GLN A 102 3.276 -9.829 9.420 1.00 0.310 C ATOM 1536 CG GLN A 102 3.790 -11.228 9.501 1.00 0.310 C ATOM 1537 CD GLN A 102 5.058 -11.262 10.269 1.00 0.310 C ATOM 1538 OE1 GLN A 102 5.956 -10.473 9.969 1.00 0.310 O ATOM 1539 NE2 GLN A 102 5.152 -12.128 11.266 1.00 0.310 N ATOM 1540 H GLN A 102 1.196 -10.468 10.842 1.00 0.260 H ATOM 1541 HA GLN A 102 3.828 -9.299 11.391 1.00 0.260 H ATOM 1542 1HB GLN A 102 2.375 -9.844 8.800 1.00 0.370 H ATOM 1543 2HB GLN A 102 4.011 -9.208 8.909 1.00 0.370 H ATOM 1544 1HG GLN A 102 3.051 -11.862 10.000 1.00 0.370 H ATOM 1545 2HG GLN A 102 3.975 -11.592 8.489 1.00 0.370 H ATOM 1546 1HE2 GLN A 102 5.987 -12.172 11.815 1.00 0.370 H ATOM 1547 2HE2 GLN A 102 4.382 -12.733 11.488 1.00 0.370 H ATOM 1548 N PRO A 103 3.331 -6.791 10.785 1.00 0.220 N ATOM 1549 CA PRO A 103 3.018 -5.389 10.569 1.00 0.220 C ATOM 1550 C PRO A 103 2.600 -5.155 9.144 1.00 0.200 C ATOM 1551 O PRO A 103 3.047 -5.876 8.255 1.00 0.210 O ATOM 1552 CB PRO A 103 4.355 -4.693 10.845 1.00 0.330 C ATOM 1553 CG PRO A 103 5.111 -5.636 11.748 1.00 0.330 C ATOM 1554 CD PRO A 103 4.695 -7.026 11.314 1.00 0.330 C ATOM 1555 HA PRO A 103 2.239 -5.049 11.259 1.00 0.260 H ATOM 1556 1HB PRO A 103 4.871 -4.492 9.888 1.00 0.400 H ATOM 1557 2HB PRO A 103 4.170 -3.712 11.311 1.00 0.400 H ATOM 1558 1HG PRO A 103 6.195 -5.468 11.644 1.00 0.400 H ATOM 1559 2HG PRO A 103 4.860 -5.435 12.801 1.00 0.400 H ATOM 1560 1HD PRO A 103 5.359 -7.444 10.537 1.00 0.400 H ATOM 1561 2HD PRO A 103 4.683 -7.624 12.238 1.00 0.400 H ATOM 1562 N SER A 104 1.744 -4.167 8.924 1.00 0.190 N ATOM 1563 CA SER A 104 1.415 -3.790 7.560 1.00 0.180 C ATOM 1564 C SER A 104 2.690 -3.225 6.958 1.00 0.210 C ATOM 1565 O SER A 104 3.473 -2.597 7.677 1.00 0.250 O ATOM 1566 CB SER A 104 0.271 -2.808 7.506 1.00 0.260 C ATOM 1567 OG SER A 104 -0.963 -3.390 7.878 1.00 0.260 O ATOM 1568 H SER A 104 1.373 -3.626 9.698 1.00 0.230 H ATOM 1569 HA SER A 104 1.125 -4.663 7.003 1.00 0.220 H ATOM 1570 1HB SER A 104 0.498 -1.988 8.149 1.00 0.310 H ATOM 1571 2HB SER A 104 0.196 -2.433 6.523 1.00 0.310 H ATOM 1572 HG SER A 104 -0.957 -3.558 8.845 1.00 0.310 H ATOM 1573 N LYS A 105 2.915 -3.418 5.657 1.00 0.210 N ATOM 1574 CA LYS A 105 4.138 -2.894 5.033 1.00 0.240 C ATOM 1575 C LYS A 105 3.904 -2.013 3.786 1.00 0.260 C ATOM 1576 O LYS A 105 4.039 -2.501 2.667 1.00 0.260 O ATOM 1577 CB LYS A 105 5.047 -4.073 4.693 1.00 0.320 C ATOM 1578 CG LYS A 105 5.544 -4.839 5.903 1.00 0.320 C ATOM 1579 CD LYS A 105 6.364 -6.047 5.510 1.00 0.320 C ATOM 1580 CE LYS A 105 6.821 -6.814 6.742 1.00 0.320 C ATOM 1581 NZ LYS A 105 7.588 -8.043 6.385 1.00 0.320 N ATOM 1582 H LYS A 105 2.212 -3.919 5.104 1.00 0.250 H ATOM 1583 HA LYS A 105 4.669 -2.297 5.772 1.00 0.290 H ATOM 1584 1HB LYS A 105 4.497 -4.784 4.122 1.00 0.390 H ATOM 1585 2HB LYS A 105 5.898 -3.740 4.101 1.00 0.390 H ATOM 1586 1HG LYS A 105 6.134 -4.178 6.538 1.00 0.390 H ATOM 1587 2HG LYS A 105 4.695 -5.188 6.476 1.00 0.390 H ATOM 1588 1HD LYS A 105 5.756 -6.710 4.891 1.00 0.390 H ATOM 1589 2HD LYS A 105 7.231 -5.732 4.934 1.00 0.390 H ATOM 1590 1HE LYS A 105 7.452 -6.166 7.347 1.00 0.390 H ATOM 1591 2HE LYS A 105 5.941 -7.102 7.330 1.00 0.390 H ATOM 1592 1HZ LYS A 105 7.872 -8.520 7.230 1.00 0.390 H ATOM 1593 2HZ LYS A 105 7.002 -8.663 5.835 1.00 0.390 H ATOM 1594 3HZ LYS A 105 8.404 -7.792 5.850 1.00 0.390 H ATOM 1595 N PRO A 106 3.544 -0.720 3.953 1.00 0.270 N ATOM 1596 CA PRO A 106 3.228 0.261 2.919 1.00 0.280 C ATOM 1597 C PRO A 106 4.395 0.586 2.014 1.00 0.310 C ATOM 1598 O PRO A 106 5.551 0.451 2.417 1.00 0.350 O ATOM 1599 CB PRO A 106 2.883 1.524 3.720 1.00 0.420 C ATOM 1600 CG PRO A 106 2.543 1.045 5.083 1.00 0.420 C ATOM 1601 CD PRO A 106 3.422 -0.154 5.311 1.00 0.420 C ATOM 1602 HA PRO A 106 2.380 -0.097 2.325 1.00 0.340 H ATOM 1603 1HB PRO A 106 3.745 2.215 3.706 1.00 0.500 H ATOM 1604 2HB PRO A 106 2.051 2.057 3.236 1.00 0.500 H ATOM 1605 1HG PRO A 106 2.719 1.841 5.823 1.00 0.500 H ATOM 1606 2HG PRO A 106 1.487 0.809 5.125 1.00 0.500 H ATOM 1607 1HD PRO A 106 4.410 0.140 5.701 1.00 0.500 H ATOM 1608 2HD PRO A 106 2.888 -0.788 5.983 1.00 0.500 H ATOM 1609 N PHE A 107 4.092 1.049 0.802 1.00 0.340 N ATOM 1610 CA PHE A 107 5.151 1.549 -0.057 1.00 0.370 C ATOM 1611 C PHE A 107 5.555 2.886 0.539 1.00 0.260 C ATOM 1612 O PHE A 107 4.684 3.655 0.951 1.00 0.410 O ATOM 1613 CB PHE A 107 4.689 1.837 -1.497 1.00 0.510 C ATOM 1614 CG PHE A 107 4.418 0.679 -2.449 1.00 0.510 C ATOM 1615 CD1 PHE A 107 3.128 0.374 -2.865 1.00 0.510 C ATOM 1616 CD2 PHE A 107 5.461 -0.067 -2.967 1.00 0.510 C ATOM 1617 CE1 PHE A 107 2.899 -0.631 -3.783 1.00 0.510 C ATOM 1618 CE2 PHE A 107 5.227 -1.082 -3.871 1.00 0.510 C ATOM 1619 CZ PHE A 107 3.947 -1.358 -4.282 1.00 0.510 C ATOM 1620 H PHE A 107 3.130 1.102 0.499 1.00 0.410 H ATOM 1621 HA PHE A 107 6.001 0.865 -0.045 1.00 0.440 H ATOM 1622 1HB PHE A 107 3.778 2.427 -1.443 1.00 0.610 H ATOM 1623 2HB PHE A 107 5.435 2.477 -1.969 1.00 0.610 H ATOM 1624 HD1 PHE A 107 2.292 0.940 -2.477 1.00 0.610 H ATOM 1625 HD2 PHE A 107 6.482 0.156 -2.660 1.00 0.610 H ATOM 1626 HE1 PHE A 107 1.883 -0.852 -4.106 1.00 0.610 H ATOM 1627 HE2 PHE A 107 6.059 -1.658 -4.265 1.00 0.610 H ATOM 1628 HZ PHE A 107 3.761 -2.158 -4.997 1.00 0.610 H ATOM 1629 N VAL A 108 6.840 3.204 0.551 1.00 0.280 N ATOM 1630 CA VAL A 108 7.224 4.498 1.083 1.00 0.260 C ATOM 1631 C VAL A 108 7.674 5.456 0.005 1.00 0.260 C ATOM 1632 O VAL A 108 8.751 5.322 -0.581 1.00 0.340 O ATOM 1633 CB VAL A 108 8.331 4.333 2.141 1.00 0.370 C ATOM 1634 CG1 VAL A 108 8.775 5.709 2.685 1.00 0.370 C ATOM 1635 CG2 VAL A 108 7.784 3.460 3.280 1.00 0.370 C ATOM 1636 H VAL A 108 7.533 2.553 0.207 1.00 0.340 H ATOM 1637 HA VAL A 108 6.361 4.936 1.583 1.00 0.310 H ATOM 1638 HB VAL A 108 9.199 3.856 1.690 1.00 0.450 H ATOM 1639 1HG1 VAL A 108 9.554 5.566 3.432 1.00 0.450 H ATOM 1640 2HG1 VAL A 108 9.168 6.325 1.883 1.00 0.450 H ATOM 1641 3HG1 VAL A 108 7.924 6.212 3.142 1.00 0.450 H ATOM 1642 1HG2 VAL A 108 8.553 3.324 4.037 1.00 0.450 H ATOM 1643 2HG2 VAL A 108 6.917 3.947 3.725 1.00 0.450 H ATOM 1644 3HG2 VAL A 108 7.484 2.483 2.893 1.00 0.450 H ATOM 1645 N GLY A 109 6.876 6.497 -0.191 1.00 0.290 N ATOM 1646 CA GLY A 109 7.115 7.509 -1.208 1.00 0.330 C ATOM 1647 C GLY A 109 8.150 8.506 -0.722 1.00 0.280 C ATOM 1648 O GLY A 109 7.866 9.689 -0.561 1.00 0.330 O ATOM 1649 H GLY A 109 6.030 6.550 0.362 1.00 0.350 H ATOM 1650 1HA GLY A 109 7.458 7.033 -2.126 1.00 0.400 H ATOM 1651 2HA GLY A 109 6.182 8.024 -1.438 1.00 0.400 H ATOM 1652 N VAL A 110 9.361 8.019 -0.512 1.00 0.320 N ATOM 1653 CA VAL A 110 10.453 8.794 0.061 1.00 0.420 C ATOM 1654 C VAL A 110 10.786 10.043 -0.742 1.00 0.450 C ATOM 1655 O VAL A 110 11.231 11.046 -0.188 1.00 0.510 O ATOM 1656 CB VAL A 110 11.704 7.902 0.209 1.00 0.550 C ATOM 1657 CG1 VAL A 110 12.314 7.561 -1.169 1.00 0.550 C ATOM 1658 CG2 VAL A 110 12.728 8.605 1.100 1.00 0.550 C ATOM 1659 H VAL A 110 9.474 7.019 -0.701 1.00 0.380 H ATOM 1660 HA VAL A 110 10.149 9.105 1.062 1.00 0.500 H ATOM 1661 HB VAL A 110 11.402 6.960 0.669 1.00 0.660 H ATOM 1662 1HG1 VAL A 110 13.173 6.907 -1.025 1.00 0.660 H ATOM 1663 2HG1 VAL A 110 11.572 7.050 -1.781 1.00 0.660 H ATOM 1664 3HG1 VAL A 110 12.648 8.460 -1.677 1.00 0.660 H ATOM 1665 1HG2 VAL A 110 13.596 7.962 1.228 1.00 0.660 H ATOM 1666 2HG2 VAL A 110 13.046 9.543 0.648 1.00 0.660 H ATOM 1667 3HG2 VAL A 110 12.283 8.809 2.073 1.00 0.660 H ATOM 1668 N LEU A 111 10.525 10.019 -2.038 1.00 0.480 N ATOM 1669 CA LEU A 111 10.839 11.147 -2.889 1.00 0.560 C ATOM 1670 C LEU A 111 9.899 12.327 -2.655 1.00 0.560 C ATOM 1671 O LEU A 111 10.160 13.430 -3.133 1.00 0.670 O ATOM 1672 CB LEU A 111 10.771 10.712 -4.356 1.00 0.750 C ATOM 1673 CG LEU A 111 11.800 9.621 -4.811 1.00 0.750 C ATOM 1674 CD1 LEU A 111 11.491 9.234 -6.246 1.00 0.750 C ATOM 1675 CD2 LEU A 111 13.237 10.136 -4.687 1.00 0.750 C ATOM 1676 H LEU A 111 10.149 9.176 -2.448 1.00 0.580 H ATOM 1677 HA LEU A 111 11.843 11.486 -2.649 1.00 0.670 H ATOM 1678 1HB LEU A 111 9.770 10.329 -4.549 1.00 0.900 H ATOM 1679 2HB LEU A 111 10.923 11.593 -4.980 1.00 0.900 H ATOM 1680 HG LEU A 111 11.687 8.734 -4.193 1.00 0.900 H ATOM 1681 1HD1 LEU A 111 12.186 8.460 -6.573 1.00 0.900 H ATOM 1682 2HD1 LEU A 111 10.471 8.853 -6.312 1.00 0.900 H ATOM 1683 3HD1 LEU A 111 11.594 10.107 -6.890 1.00 0.900 H ATOM 1684 1HD2 LEU A 111 13.925 9.357 -5.017 1.00 0.900 H ATOM 1685 2HD2 LEU A 111 13.364 11.020 -5.314 1.00 0.900 H ATOM 1686 3HD2 LEU A 111 13.466 10.388 -3.657 1.00 0.900 H ATOM 1687 N SER A 112 8.808 12.108 -1.918 1.00 0.490 N ATOM 1688 CA SER A 112 7.871 13.175 -1.612 1.00 0.580 C ATOM 1689 C SER A 112 8.261 13.884 -0.312 1.00 0.640 C ATOM 1690 O SER A 112 7.604 14.844 0.099 1.00 0.750 O ATOM 1691 CB SER A 112 6.455 12.633 -1.491 1.00 0.780 C ATOM 1692 OG SER A 112 5.993 12.109 -2.713 1.00 0.780 O ATOM 1693 H SER A 112 8.612 11.182 -1.533 1.00 0.590 H ATOM 1694 HA SER A 112 7.897 13.903 -2.421 1.00 0.700 H ATOM 1695 1HB SER A 112 6.434 11.856 -0.728 1.00 0.930 H ATOM 1696 2HB SER A 112 5.793 13.430 -1.161 1.00 0.930 H ATOM 1697 HG SER A 112 5.097 11.808 -2.546 1.00 0.930 H ATOM 1698 N ALA A 113 9.302 13.387 0.367 1.00 0.610 N ATOM 1699 CA ALA A 113 9.743 13.960 1.630 1.00 0.730 C ATOM 1700 C ALA A 113 10.204 15.405 1.451 1.00 0.870 C ATOM 1701 O ALA A 113 10.876 15.737 0.474 1.00 0.890 O ATOM 1702 CB ALA A 113 10.870 13.121 2.206 1.00 0.970 C ATOM 1703 H ALA A 113 9.829 12.594 -0.009 1.00 0.730 H ATOM 1704 HA ALA A 113 8.900 13.955 2.320 1.00 0.880 H ATOM 1705 1HB ALA A 113 11.184 13.537 3.161 1.00 1.170 H ATOM 1706 2HB ALA A 113 10.524 12.095 2.345 1.00 1.170 H ATOM 1707 3HB ALA A 113 11.710 13.125 1.510 1.00 1.170 H ATOM 1708 N GLY A 114 9.912 16.252 2.440 1.00 1.000 N ATOM 1709 CA GLY A 114 10.329 17.654 2.403 1.00 1.150 C ATOM 1710 C GLY A 114 9.550 18.487 3.424 1.00 1.280 C ATOM 1711 O GLY A 114 8.925 17.929 4.327 1.00 1.300 O ATOM 1712 H GLY A 114 9.360 15.928 3.221 1.00 1.200 H ATOM 1713 1HA GLY A 114 11.397 17.722 2.609 1.00 1.380 H ATOM 1714 2HA GLY A 114 10.167 18.053 1.402 1.00 1.380 H ATOM 1715 N ILE A 115 9.644 19.825 3.303 1.00 1.400 N ATOM 1716 CA ILE A 115 8.989 20.801 4.192 1.00 1.550 C ATOM 1717 C ILE A 115 8.212 21.862 3.396 1.00 1.630 C ATOM 1718 O ILE A 115 8.766 22.458 2.472 1.00 1.660 O ATOM 1719 CB ILE A 115 10.029 21.506 5.100 1.00 2.110 C ATOM 1720 CG1 ILE A 115 10.768 20.441 5.974 1.00 2.110 C ATOM 1721 CG2 ILE A 115 9.335 22.580 5.984 1.00 2.110 C ATOM 1722 CD1 ILE A 115 11.962 20.964 6.750 1.00 2.110 C ATOM 1723 H ILE A 115 10.186 20.187 2.529 1.00 1.680 H ATOM 1724 HA ILE A 115 8.279 20.270 4.825 1.00 1.860 H ATOM 1725 HB ILE A 115 10.777 21.993 4.477 1.00 2.530 H ATOM 1726 1HG1 ILE A 115 10.055 20.008 6.673 1.00 2.530 H ATOM 1727 2HG1 ILE A 115 11.138 19.656 5.331 1.00 2.530 H ATOM 1728 1HG2 ILE A 115 10.063 23.083 6.605 1.00 2.530 H ATOM 1729 2HG2 ILE A 115 8.847 23.333 5.357 1.00 2.530 H ATOM 1730 3HG2 ILE A 115 8.588 22.105 6.618 1.00 2.530 H ATOM 1731 1HD1 ILE A 115 12.408 20.141 7.310 1.00 2.530 H ATOM 1732 2HD1 ILE A 115 12.698 21.370 6.056 1.00 2.530 H ATOM 1733 3HD1 ILE A 115 11.659 21.736 7.445 1.00 2.530 H ATOM 1734 N ASN A 116 6.948 22.093 3.762 1.00 1.720 N ATOM 1735 CA ASN A 116 6.115 23.099 3.104 1.00 1.880 C ATOM 1736 C ASN A 116 5.977 24.358 3.967 1.00 2.100 C ATOM 1737 O ASN A 116 6.955 25.059 4.227 1.00 2.160 O ATOM 1738 OXT ASN A 116 4.872 24.669 4.415 1.00 2.820 O ATOM 1739 CB ASN A 116 4.751 22.522 2.784 1.00 2.440 C ATOM 1740 CG ASN A 116 4.810 21.400 1.777 1.00 2.440 C ATOM 1741 OD1 ASN A 116 5.517 21.466 0.762 1.00 2.440 O ATOM 1742 ND2 ASN A 116 4.064 20.354 2.042 1.00 2.440 N ATOM 1743 H ASN A 116 6.564 21.556 4.527 1.00 2.060 H ATOM 1744 HA ASN A 116 6.597 23.396 2.172 1.00 2.260 H ATOM 1745 1HB ASN A 116 4.289 22.151 3.698 1.00 2.930 H ATOM 1746 2HB ASN A 116 4.109 23.311 2.391 1.00 2.930 H ATOM 1747 1HD2 ASN A 116 4.053 19.574 1.414 1.00 2.930 H ATOM 1748 2HD2 ASN A 116 3.501 20.336 2.869 1.00 2.930 H TER # All scores below are weighted scores, not raw scores. #BEGIN_POSE_ENERGIES_TABLE model05_0001.pdb label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 coordinate_constraint omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.5 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA pose -520.115 53.331 394.057 -35.2898 10.9267 22.5031 191.828 -221.101 -1.08737 -6.93407 -175.161 -27.6756 -58.5798 -11.9553 -10.719 -9.6961 0 8.36552 -2.73345 4.36214 42.0713 89.1211 -29.3217 24.7399 -5.49113 -8.54004 52.8298 -230.264 GLN:NtermProteinFull_1 -2.85718 0.10416 3.39294 -0.67161 0.07806 0.8139 1.27454 -1.38133 -0.01872 -0.1363 -2.00566 1.27595 0 0 0 0 0 0.13894 0.03004 0.01333 0 2.58796 0 0 -0.18838 0 0.10217 2.55281 GLU_2 -3.79694 0.68435 3.46909 -0.31488 0.05654 0.40541 1.53214 -1.45283 -0 -0 -2.05271 -0.30821 0 0 0 0 0 0.00872 -0.09533 0.00106 0 2.75485 -0.03277 0 -2.7348 -0.20133 0.92838 -1.14927 PRO_3 -3.61414 0.65878 2.98583 -0.06926 0 0.04304 2.09204 -1.3636 -0 -0 -2.35228 0.60011 0 0 0 0 0 0.01062 -0.21009 0.0486 0.23856 0 -0.58482 0 -2.4119 -0.13323 1.14776 -2.91396 TYR_4 -5.07852 0.45975 2.40869 -0.64207 0.06287 0.319 1.25117 -1.42098 -0 -0 -0.24119 -0.20253 0 0 0 0 0 0.03222 -0.08453 0.0481 0 2.9591 0.2558 1e-05 1.2797 0.02193 0.44528 1.87379 PHE_5 -5.16045 0.4454 2.55854 -0.58692 0.05681 0.32526 1.31456 -1.62607 -0 -0 -1.56204 0.03133 0 0 0 0 0 0.012 0.00551 0.00069 0 2.18741 -0.18496 0 1.0402 -0.31728 0.25059 -1.20942 THR_6 -4.86393 0.78295 3.47771 -0.21438 0.21511 0.07905 2.43919 -1.92789 -0 -0 -1.87413 -0.50261 0 0 0 0 0 0.01913 -0.02953 0.45966 0.52712 0 -0.40928 2.34695 -1.0874 -0.16882 0.5819 -0.1492 TRP_7 -11.0192 1.83658 4.71352 -1.52943 0.22595 0.77337 3.07193 -3.63864 -0.01148 -0.06794 -1.97582 -0.28661 0 0 0 0 0 0.00371 -0.01526 0.02213 0 1.88221 -0.29643 0 1.6906 6.07816 2.0944 3.55171 PRO_8 -7.85853 1.18793 4.06369 -0.06758 0 0.04198 2.0648 -2.08028 -0 -0 -1.81951 0.62841 0 0 0 0 0 0.0295 -0.12502 0.03502 0.17382 0 -0.14219 0 -2.4119 6.03747 1.96094 1.71854 LEU_9 -7.47376 0.83897 2.68714 -0.69825 0.17395 0.26957 2.31298 -2.41959 -0.00782 -0.02523 -0.92238 0.13631 0 0 0 0 0 0.02369 -0.03278 0.12142 0.78625 0 -0.20314 0 0.18072 0.05999 0.60009 -3.59187 ILE_10 -9.23925 1.04629 3.36985 -0.63872 0.69675 0.14155 2.61227 -3.05872 -0 -0 -1.7994 0.23421 0 0 0 0 0 0.09445 -0.03528 0.10169 3.30592 0 -0.47394 0 0.73287 0.01821 0.78081 -2.11044 ALA_11 -6.16339 0.85726 3.93328 -0.02238 0 0 2.41738 -2.88149 -0.03691 -0.15566 -2.69945 -0.35497 0 0 0 0 0 0.07319 -0.06748 0 0 0 -0.32496 0 1.8394 -0.32587 0.87312 -3.03893 ALA_12 -5.48943 0.513 3.83389 -0.02412 0 0 2.43642 -2.54041 -0.07763 -0.46726 -0.57155 -0.36097 0 0 0 0 0 0.03305 -0.08677 0 0 0 -0.42745 0 1.8394 -0.57329 0.78018 -1.18295 ASP_13 -4.53891 0.81661 5.61262 -0.29208 0.05754 0.97061 1.87887 -2.46122 -0.08259 -0.54788 -3.85976 0.41644 0 0 0 -0.63754 0 0.01706 -0.04739 0.04198 0 3.64002 -0.37483 0 -2.3716 -0.48639 0.67924 -1.56918 GLY_14 -2.53095 0.12978 2.85264 -7e-05 0 0 1.15061 -1.49852 -0.01074 -0.06167 -1.28312 -0.31643 0 0 0 0 0 0.00968 -0.10235 0 0 0 -1.54034 0 0.83697 -0.16222 0.70974 -1.81698 GLY_15 -3.85851 0.1701 2.47042 -0.0003 0 0 1.00701 -1.71845 -0.03413 -0.15425 -0.85003 -0.2111 0 0 0 0 0 0.01504 -0.07062 0 0 0 0.35417 0 0.83697 0.13497 0.50176 -1.40694 TYR_16 -7.35232 0.94227 4.08527 -0.90255 0.04704 0.53224 1.78958 -2.83341 -0.00277 -0.05176 -1.61188 -0.36394 0 0 0 -0.62052 0 0.07544 -0.00055 0.07079 0 1.54149 -0.28102 0.0008 1.2797 -0.0902 0.41137 -3.33494 ALA_17 -3.73749 0.40162 1.42884 -0.0169 0 0 1.13999 -1.4282 -0.00417 -0.04037 -0.32903 -0.29535 0 0 0 0 0 0.08284 0.11541 0 0 0 0.41567 0 1.8394 0.7962 0.45566 0.82412 PHE_18 -7.54366 0.8167 1.27762 -0.65224 0.04654 0.38838 1.19352 -1.89348 -0 -0 -0.81122 0.20972 0 0 0 0 0 0.01758 -0.00868 0.09762 0 2.22881 -0.14247 0 1.0402 0.85659 0.27245 -2.60601 LYS_19 -5.10602 0.25975 6.04267 -0.39422 0.05929 0.18299 2.20694 -2.41437 -0.03434 -0.13303 -4.08162 0.17625 0 0 0 0 0 0.01944 -0.07667 0.01375 1.70665 0 0.00514 0 -1.5107 -0.35701 0.33898 -3.09614 TYR_20 -6.17381 1.04664 2.37604 -0.71293 0.08139 0.09042 0.75988 -1.93791 -0 -0 -0.88807 -0.4099 0 0 -0.33366 0 0 0.00359 -0.03331 0.21195 0 2.5666 -0.01735 0.29721 1.2797 -0.24512 0.51553 -1.52311 GLU_21 -3.73872 0.28668 4.80609 -0.28122 0.04791 0.33759 1.64838 -2.07247 -0.00918 -0.02961 -1.82369 -0.25994 0 0 0 0 0 0.02051 -0.03204 0.02465 0 2.96327 -0.16803 0 -2.7348 0.2607 0.42766 -0.32626 ASN_22 -1.84195 0.19379 2.06174 -0.19184 0.04244 0.32339 0.44913 -0.88569 -0 -0 0.35127 -1.00822 0 0 0 0 0 0.02512 -0.07357 0.00167 0 1.86111 -1.01526 0 -0.93687 -0.26167 0.12319 -0.78222 GLY_23 -2.35467 0.56623 2.00427 -6e-05 0 0 0.26325 -1.14298 -0 -0 -0.85051 -0.38262 0 0 -0.33366 0 0 0.02507 -0.11039 0 0 0 -1.47663 0 0.83697 -0.95615 0.29805 -3.61383 LYS_24 -4.00358 0.34016 4.3706 -0.47997 0.13579 0.26984 2.21425 -2.19042 -0 -0 -1.9245 0.00115 0 0 0 0 0 0.04843 0.01938 0.01005 1.79763 0 0.01164 0 -1.5107 -0.54788 0.43556 -1.00257 TYR_25 -5.34232 0.59451 1.43816 -0.60087 0.02479 0.27775 0.73124 -1.28511 -0.00434 -0.06005 -0.88515 -0.1815 0 0 0 0 0 0.02923 -0.06902 0.04525 0 2.33215 0.04323 0.00334 1.2797 -0.10664 0.3201 -1.41557 ASP_26 -4.95535 0.26644 7.48809 -0.2231 0.03614 0.72717 3.55101 -3.05909 -0.03632 -0.24223 -5.65523 -0.83258 0 0 0 -0.88023 0 0.01769 0.12518 0.08335 0 2.01903 -0.77583 0 -2.3716 -0.14897 0.5122 -4.35426 ILE_27 -4.69315 0.67873 2.02032 -0.68639 0.66101 0.16273 1.46896 -1.59134 -0 -0 -0.50205 0.14925 0 0 0 0 0 0.08124 -0.04428 0.01788 0.83965 0 -0.04254 0 0.73287 -0.15572 0.80263 -0.1002 LYS_28 -2.55604 0.20366 3.91469 -0.48901 0.08412 0.33861 1.4744 -1.60357 -0.01363 -0.04827 -3.08712 0.53992 0 0 0 -0.88023 0 0.06408 -0.08897 0.0117 1.95251 0 -0.02474 0 -1.5107 -0.35817 0.73249 -1.34427 ASP_29 -5.43993 0.48624 7.12232 -0.23754 0.04583 0.77654 3.34283 -2.98102 -0.05065 -0.25988 -4.00157 -0.90288 0 0 0 -0.62052 0 0.02666 -0.00596 0.00652 0 1.88898 -0.79561 0 -2.3716 -0.4149 0.46124 -3.9249 VAL_30 -4.26012 0.35996 2.0135 -0.37233 0.31404 0.09067 1.42497 -1.60204 -0 -0 -0.55208 -0.08775 0 0 0 0 0 0.01006 0.12689 0.03391 0.98617 0 -0.69341 0 1.9342 -0.27722 0.44884 -0.10174 GLY_31 -4.43812 0.4883 3.57694 -5e-05 0 0 1.99519 -2.21751 -0.02211 -0.16035 -2.02959 -0.38017 0 0 0 0 0 0.08694 -0.09081 0 0 0 0.23671 0 0.83697 -0.1892 0.57364 -1.7332 VAL_32 -3.33754 0.3362 2.28787 -0.36377 0.24795 0.08858 1.14242 -1.53551 -0.00417 -0.04037 0.18069 -0.12429 0 0 0 0 0 0.04438 -0.09151 0.00118 0.72849 0 0.22482 0 1.9342 -0.16446 0.48331 2.03847 ASP_33 -2.80621 0.30626 2.86827 -0.12378 0.0278 0.38531 0.48517 -1.41412 -0 -0 -0.7173 -0.35829 0 0 0 0 0 0.02281 -0.05741 0.00022 0 2.60189 -0.39484 0 -2.3716 -0.54524 0.24665 -1.8444 ASN_34 -5.9063 0.44087 6.19033 -0.2261 0.00772 0.33187 3.38072 -3.17876 -0.03014 -0.31395 -2.77813 -0.4686 0 0 -1.06017 0 0 0.02957 -0.04395 0.00938 0 2.76785 0.30811 0 -0.93687 -0.5057 0.16849 -1.81376 ALA_35 -3.005 0.14522 3.2428 -0.02319 0 0 1.51141 -1.71057 -0.02124 -0.15077 -0.71871 -0.38757 0 0 0 0 0 0.01526 0.03355 0 0 0 -0.42706 0 1.8394 -0.38094 0.16298 0.12557 GLY_36 -4.9181 0.81926 4.75163 -5e-05 0 0 2.36959 -2.6856 -0 -0 -2.38677 -0.41439 0 0 -1.06017 0 0 0.01749 -0.06298 0 0 0 0.31359 0 0.83697 0.24626 0.15515 -2.01814 ALA_37 -6.41677 0.42918 4.58546 -0.02169 0 0 2.61105 -3.11807 -0 -0 -1.80101 -0.36879 0 0 0 0 0 0.01602 -0.00427 0 0 0 -0.34632 0 1.8394 0.26243 0.19056 -2.14282 LYS_38 -5.87305 0.34168 6.68903 -0.3029 0.02806 0.13257 3.14337 -3.0741 -0 -0 -3.76459 -0.03824 0 0 0 0 0 0.01483 0.06384 0.07145 1.78168 0 0.01106 0 -1.5107 -0.40913 0.22893 -2.46621 ALA_39 -5.10052 0.23415 4.59786 -0.02194 0 0 2.83925 -2.71283 -0 -0 -2.55493 -0.36037 0 0 0 0 0 0.00495 0.02734 0 0 0 -0.24583 0 1.8394 -0.36953 0.25069 -1.57231 GLY_40 -5.66735 0.56917 4.4976 -5e-05 0 0 2.52542 -2.68571 -0 -0 -2.64478 -0.41536 0 0 0 0 0 0.01194 -0.05797 0 0 0 0.29437 0 0.83697 0.31459 0.14448 -2.27668 LEU_41 -6.09335 0.50533 5.0897 -0.48219 0.17516 0.1183 2.73701 -2.79789 -0 -0 -2.60235 0.20307 0 0 0 0 0 0.02615 -0.03122 0.14439 0.30982 0 -0.28116 0 0.18072 0.35129 0.17838 -2.26885 THR_42 -5.13612 0.26644 6.61898 -0.20131 0.11396 0.07272 3.16459 -3.07655 -0 -0 -3.38059 -0.10827 0 0 0 0 0 0.00488 0.00581 0.00037 0.0614 0 -0.00614 2.30256 -1.0874 -0.11239 0.26977 -0.2273 PHE_43 -7.2104 0.75201 4.20289 -0.83447 0.02722 0.27816 2.55829 -2.67041 -0 -0 -2.40248 -0.02693 0 0 0 0 0 0.00294 0.01824 0.03908 0 1.86089 -0.44396 0 1.0402 0.07088 0.26647 -2.47138 LEU_44 -7.45992 0.69909 4.54158 -0.65262 0.41872 0.25632 2.64747 -2.79026 -0 -0 -1.82348 -0.11448 0 0 0 0 0 0.00618 -0.01432 0.11887 1.16679 0 -0.19016 0 0.18072 0.03779 0.32176 -2.64994 VAL_45 -6.02291 0.38045 5.53261 -0.31962 0.23685 0.07368 3.02044 -2.94081 -0 -0 -2.5588 -0.23906 0 0 0 0 0 0.00665 0.00024 0.00389 0.11086 0 -0.23012 0 1.9342 -0.06044 0.39284 -0.67905 ASP_46 -5.81235 0.3282 7.18304 -0.1014 0.00423 0.30246 3.05202 -3.38403 -0 -0 -3.03189 -0.37349 0 0 0 0 0 0.0051 0.04303 0.00544 0 1.68481 0.18335 0 -2.3716 -0.2301 0.49013 -2.02305 LEU_47 -8.16581 0.46195 5.66273 -0.47359 0.19587 0.1096 2.93826 -3.16599 -0.0177 -0.10287 -3.15233 0.21212 0 0 0 0 0 0.01264 0.13283 0.00137 0.31564 0 -0.27525 0 0.18072 -0.31253 0.51392 -4.92841 ILE_48 -7.83671 0.72233 5.45966 -0.49616 0.37849 0.09681 2.39415 -3.02785 -0 -0 -1.54815 0.0928 0 0 0 0 0 0.00337 -0.06995 0.00587 0.48837 0 -0.48874 0 0.73287 -0.10874 0.39807 -2.80351 LYS_49 -4.01948 0.21738 3.93699 -0.30479 0.02424 0.1352 1.72005 -1.89289 -0 -0 -1.16176 -0.03181 0 0 0 0 0 0.00394 -0.08341 0.06861 1.74631 0 -0.06938 0 -1.5107 -0.24429 0.37636 -1.08943 ASN_50 -4.53314 0.39077 4.77711 -0.19797 0.03758 0.31551 1.43285 -2.31749 -0 -0 -1.28761 -0.41281 0 0 0 0 0 0.00455 -0.0668 0.03344 0 2.01523 -0.49569 0 -0.93687 -0.64325 0.33075 -1.55385 LYS_51 -2.59253 0.23887 3.25567 -0.33798 0.07176 0.22165 1.36435 -1.55647 -0.00462 -0.02079 -1.20705 -0.38681 0 0 0 0 0 0.00241 -0.02167 0.01689 1.49815 0 -0.10635 0 -1.5107 -0.41971 0.32786 -1.16706 HIS_D_52 -3.95391 0.20097 3.10495 -0.40396 0.00977 0.52025 0.96015 -1.61232 -0.00462 -0.02079 -1.22118 -0.30054 0 0 0 0 0 0.13787 -0.04347 0.0433 0 1.65533 -0.33532 0 -0.45461 -0.18545 0.35432 -1.54926 MET_53 -5.96689 0.46244 3.36774 -0.34996 0.12228 0.0876 0.81458 -1.59973 -0.01931 -0.10725 0.08651 0.02676 0 0 0 0 0 0.02525 -0.01561 0.02837 1.3495 0 -0.12146 0 0.60916 0.14714 0.25919 -0.7937 ASN_54 -3.51547 0.31943 3.88196 -0.27981 0.0884 0.45628 2.11989 -1.78503 -0.01309 -0.11449 -2.10657 -0.8216 0 0 -0.85596 0 0 0.0235 -0.03841 0.02106 0 2.07753 -0.13701 0 -0.93687 0.25475 0.24968 -1.11184 ALA_55 -2.63122 0.2271 1.99957 -0.02474 0.00019 0 0.75604 -1.27866 -0.00161 -0.00438 0.04041 -0.37446 0 0 0 0 0 0.01483 -0.0863 0 0 0 -0.31016 0 1.8394 -0.27591 0.28141 0.17151 ASP_56 -2.6634 0.22491 3.16893 -0.12165 0.02218 0.37917 1.2717 -1.53854 -0.00229 -0.03744 -1.19551 -0.22503 0 0 -0.85596 0 0 0.00404 -0.07455 0.00694 0 2.39042 -0.35657 0 -2.3716 -0.70421 0.24122 -2.43724 THR_57 -4.37528 0.354 3.70852 -0.16922 0.07468 0.06187 2.3688 -2.05332 -0.01309 -0.11449 -2.8073 0.23441 0 0 0 0 0 0.02303 0.03558 0.06116 0.04307 0 0.05189 2.27114 -1.0874 -0.60462 0.27994 -1.65664 ASP_58 -4.72659 0.3687 5.48515 -0.10757 0.01403 0.31919 2.81203 -2.48223 -0.01643 -0.09886 -2.69945 -1.20537 0 0 -0.59736 0 0 0.02898 -0.01585 0.00622 0 2.1832 0.01061 0 -2.3716 -0.00401 0.32683 -2.77037 TYR_59 -5.14658 0.3273 4.87454 -0.95723 0.08791 0.34788 2.99351 -2.49721 -0 -0 -3.25836 -0.26722 0 0 -0.59736 -1.24009 0 0.01755 0.00904 0.09731 0 1.75016 -0.42317 2e-05 1.2797 0.2885 0.25879 -2.055 SER_60 -3.15963 0.09211 3.57969 -0.02725 0 0.04149 1.36765 -1.79251 -0 -0 -1.09421 -1.08294 0 0 0 0 0 0.01098 0.03232 0.00242 0.3088 0 0.12486 0.60422 -0.77834 -0.15047 0.1962 -1.72462 ILE_61 -5.50739 0.32943 4.07203 -0.49089 0.34594 0.09814 2.64279 -2.47014 -0 -0 -0.76061 0.00835 0 0 0 0 0 0.00543 -0.05126 0.00442 0.52036 0 -0.50388 0 0.73287 -0.19443 0.23727 -0.98157 ALA_62 -4.37418 0.15986 3.87699 -0.022 0 0 2.40496 -2.42536 -0 -0 -1.98112 -0.35833 0 0 0 0 0 0.00993 -0.03586 0 0 0 -0.23412 0 1.8394 -0.13547 0.25686 -1.01844 GLU_63 -5.79772 0.25277 7.35288 -0.33397 0.05576 0.37119 3.37041 -3.33991 -0.02885 -0.18316 -3.97501 -0.62276 0 0 0 -0.87248 0 0.01829 0.03743 0.077 0 3.65578 -0.13558 0 -2.7348 -0.34434 0.28059 -2.89646 ALA_64 -4.71248 0.27599 4.97244 -0.02215 0 0 2.74352 -2.68139 -0 -0 -2.39382 -0.35636 0 0 0 0 0 0.0071 -0.02825 0 0 0 -0.21273 0 1.8394 -0.32408 0.27534 -0.61747 ALA_65 -5.90708 0.41324 5.16455 -0.02162 0 0 3.21864 -3.14049 -0.02049 -0.12773 -3.47365 -0.36701 0 0 0 0 0 0.00615 0.00055 0 0 0 -0.27047 0 1.8394 -0.42015 0.29199 -2.81416 PHE_66 -8.96568 0.95861 3.7005 -0.82367 0.03437 0.26367 2.27498 -2.95202 -0 -0 -1.83885 -0.03837 0 0 0 0 0 0.00263 -0.00887 0.31133 0 2.04062 -0.18647 0 1.0402 -0.19132 0.387 -3.99135 ASN_67 -6.60521 0.61183 5.67999 -0.1967 0.12846 0.30489 2.61071 -2.89899 -0.0076 -0.03166 -1.46915 -0.27408 0 0 0 0 0 0.0045 0.03748 0.0007 0 1.46789 0.09325 0 -0.93687 -0.00676 0.46928 -1.01801 LYS_68 -3.65587 0.21639 4.02175 -0.32697 0.04376 0.18009 1.26313 -1.77237 -0 -0 -1.43278 -0.15764 0 0 0 0 0 0.01393 -0.07116 0.02549 1.76173 0 -0.08838 0 -1.5107 -0.33944 0.3952 -1.43383 GLY_69 -1.94927 0.09389 2.62974 -5e-05 0 0 1.01898 -1.30137 -0 -0 -0.87802 -0.3768 0 0 0 0 0 0.01646 -0.17291 0 0 0 -1.3421 0 0.83697 -0.70845 0.3566 -1.77633 GLU_70 -3.33758 0.19646 3.49753 -0.21211 0.03192 0.30457 1.20152 -1.60156 -0 -0 -1.48148 -0.60456 0 0 0 0 0 0.01487 0.07976 0.02186 0 3.10091 -0.26545 0 -2.7348 -0.54815 0.32405 -2.01225 THR_71 -4.74394 0.57263 3.28174 -0.22824 0.26101 0.10619 1.9044 -2.14875 -0.02049 -0.12773 -1.03866 -1.40895 0 0 -1.17541 0 0 0.00968 0.00759 0.25041 1.50626 0 -0.18601 2.76977 -1.0874 -0.07329 0.45569 -1.11351 ALA_72 -1.19293 0.0438 0.78863 -0.02629 0.00243 0 0.1319 -0.48437 -0 -0 0.08838 -0.42699 0 0 0 0 0 0.0088 -0.05653 0 0 0 0.01611 0 1.8394 -0.24154 0.40801 0.89883 MET_73 -4.03008 0.35008 1.98971 -0.2686 0.0529 0.06085 1.18931 -1.30315 -0 -0 -1.4706 -0.03337 0 0 -1.17541 0 0 0.0046 0.05191 0.05686 2.21601 0 -0.13205 0 0.60916 -0.1389 0.26353 -1.70724 THR_74 -3.58687 0.37015 1.38168 -0.23039 0.21045 0.09113 0.1969 -0.97581 -0.00664 -0.02183 -0.00909 -1.2688 0 0 0 0 0 0.00645 -0.0075 0.03576 0.60008 0 0.01427 2.28779 -1.0874 0.1476 0.37247 -1.47958 ILE_75 -3.29286 0.26593 0.18795 -0.47145 0.32689 0.10296 0.40891 -0.68892 -0 -0 -0.07737 -0.07322 0 0 0 0 0 0.04017 -0.05127 0.02427 0.37074 0 -0.7618 0 0.73287 -0.26202 0.29939 -2.91884 ASN_76 -4.34442 0.48683 2.44182 -0.16334 0.01922 0.222 1.44818 -1.59034 -0.02505 -0.11366 -0.71342 -0.9194 0 0 -0.95835 -0.70181 0 0.0394 0.00091 0.0134 0 1.79433 -0.2049 0 -0.93687 -0.25402 0.27393 -4.18554 GLY_77 -3.58954 0.56739 3.0761 -0.00057 0 0 1.90005 -1.81567 -0 -0 -1.34492 -0.22333 0 0 -0.95835 0 0 0.07628 -0.10377 0 0 0 -0.2673 0 0.83697 0.1728 0.60573 -1.06812 PRO_78 -4.15096 0.73414 1.56406 -0.07031 0 0.04322 1.10822 -1.0359 -0.02965 -0.16493 -0.4043 0.61624 0 0 0 0 0 0.00917 -0.18702 0.00275 0.214 0 -0.4218 0 -2.4119 0.21451 0.77019 -3.60026 TRP_79 -5.64969 0.53272 3.2513 -1.25324 0.13223 0.9397 1.66469 -2.12121 -0.02313 -0.13565 -0.07536 -0.72822 0 0 0 -0.53828 0 0.02887 -0.06557 0.03187 0 2.82318 -0.06261 0 1.6906 -0.16409 0.40772 0.68583 ALA_80 -5.08585 0.58331 3.67436 -0.02646 0.00224 0 2.26047 -2.44915 -0.02125 -0.15151 -2.35891 -0.41187 0 0 0 0 0 0.0175 0.04289 0 0 0 0.06499 0 1.8394 -0.45512 0.32108 -2.15388 TRP_81 -8.24963 0.7579 4.58933 -0.73863 0.25237 0.45309 2.81678 -2.96294 -0 -0 -2.14314 -0.44787 0 0 0 0 0 0.01859 -0.02706 0.1605 0 2.71819 0.02933 0 1.6906 -0.46001 0.54219 -1.0004 SER_82 -3.00341 0.18633 4.10517 -0.02401 0 0.02189 1.52098 -1.89365 -0.02965 -0.16493 -1.95232 -0.40869 0 0 0 0 0 0.02912 -0.05535 0.00017 0.53295 0 0.27926 0.60001 -0.77834 -0.28851 0.37077 -0.95221 ASN_83 -4.78479 0.1985 6.00106 -0.17478 0.02234 0.25754 2.68317 -2.72748 -0.00552 -0.06724 -2.66988 -0.27995 0 0 0 -0.87248 0 0.02361 -0.02211 0.02216 0 1.52292 0.2393 0 -0.93687 0.00667 0.13155 -1.43227 ILE_84 -9.04184 1.26236 4.36312 -0.5058 0.48811 0.09943 2.97401 -3.09031 -0 -0 -1.56806 0.03731 0 0 0 0 0 0.02355 -0.00191 0.08817 0.58911 0 -0.45216 0 0.73287 0.07818 0.44961 -3.47423 ASP_85 -4.23856 0.24243 5.85896 -0.10047 0.00275 0.29699 2.37291 -2.67333 -0 -0 -3.52257 -0.38096 0 0 0 -0.59719 0 0.09047 -0.02399 2e-05 0 1.70018 0.20728 0 -2.3716 -0.13753 0.62298 -2.65123 THR_86 -3.2346 0.24278 4.28569 -0.20786 0.14057 0.07605 1.79136 -1.90085 -0.0008 -0.02343 -1.68906 -0.12955 0 0 0 0 0 0.0367 -0.05481 4e-05 0.2245 0 0.13726 2.3184 -1.0874 -0.17295 0.4227 1.17475 SER_87 -4.17006 0.34395 4.26794 -0.03467 0.00639 0.02693 1.82434 -2.03227 -0 -0 -1.29872 -0.02399 0 0 0 0 0 0.22329 -0.06086 0.00113 0.94114 0 -0.29033 1.75419 -0.77834 -0.25868 0.35314 0.79453 LYS_88 -2.32385 0.21443 2.98844 -0.33733 0.06605 0.21833 1.1139 -1.3889 -0 -0 -1.34281 -0.38457 0 0 0 0 0 0.28309 -0.09385 0.0193 1.5266 0 -0.11913 0 -1.5107 -0.36689 0.30738 -1.1305 VAL_89 -5.62347 0.87089 1.61347 -0.27844 0.18736 0.05604 1.08028 -1.77348 -0.0096 -0.14816 -0.45487 0.18131 0 0 0 0 0 0.36059 0.05605 0.06594 0.1251 0 -0.41367 0 1.9342 -0.38835 0.55177 -2.00702 ASN_90 -1.39783 0.13914 1.01727 -0.27144 0.0541 0.5049 0.12051 -0.62078 -0.02228 -0.25381 0.40038 -0.82867 0 0 0 0 0 0.08105 -0.02491 0.01109 0 2.10445 -0.58578 0 -0.93687 -0.34071 0.65049 -0.19969 TYR_91 -6.16658 0.92293 1.95331 -1.22918 0.21156 0.73257 1.1032 -1.65388 -0.01481 -0.14654 -1.82758 -0.24643 0 0 0 -0.59719 0 0.02682 0.10574 0.27417 0 2.39385 -0.38742 5e-05 1.2797 -0.24294 0.48341 -3.02525 GLY_92 -1.41044 0.16068 0.83948 -0.00105 0 0 0.07252 -0.58781 -0 -0 -0.06188 -0.2858 0 0 0 0 0 0.02377 -0.12859 0 0 0 -0.0354 0 0.83697 0.24921 0.34689 0.01854 VAL_93 -2.38535 0.21931 -0.09003 -0.26781 0.13588 0.05614 0.0671 -0.53325 -0.00632 -0.0513 0.08175 -0.3548 0 0 0 0 0 0.01186 -0.07325 0.00014 0.22711 0 -0.74618 0 1.9342 0.1944 0.19925 -1.38116 THR_94 -1.77871 0.13122 1.15478 -0.18349 0.09216 0.06541 0.33355 -0.73658 -0.00633 -0.0513 -0.8669 -1.01401 0 0 0 0 0 0.00331 -0.04947 0.00066 0.62374 0 -0.61419 2.30099 -1.0874 -0.00336 0.35049 -1.3354 VAL_95 -2.00164 0.17515 1.07489 -0.27482 0.1614 0.05449 0.56169 -0.69833 -0 -0 -0.84157 0.02322 0 0 0 0 0 0.00699 -0.08223 0.00135 0.10201 0 -0.45529 0 1.9342 -0.07464 0.2832 -0.04992 LEU_96 -4.38857 0.82772 0.91814 -0.4675 0.28898 0.07744 0.53809 -0.92163 -0 -0 -0.11285 0.39633 0 0 0 0 0 0.01758 0.16086 0.03355 0.46006 0 0.03506 0 0.18072 -0.49596 0.69517 -1.7568 PRO_97 -2.69863 0.42576 2.05757 -0.16978 0.00014 0.11717 0.93356 -0.90551 -0.00901 -0.06475 -1.33287 0.19562 0 0 -0.37861 0 0 0.0308 0.01186 0.00766 0.90416 0 -1.14167 0 -2.4119 -0.5092 0.77318 -4.16446 THR_98 -3.6651 0.51834 2.01063 -0.11317 0.0527 0.0746 0.44467 -1.22955 -0.01615 -0.09287 -0.82705 -0.63264 0 0 0 0 0 0.00515 0.00791 0.01961 0.04344 0 -0.38422 2.43612 -1.0874 -0.55121 0.33996 -2.64621 PHE_99 -7.95168 0.72233 3.38537 -0.77914 0.07014 0.09196 2.20723 -2.44475 -0 -0 -1.58909 -0.49842 0 0 0 0 0 0.00904 0.06823 0.03383 0 2.46835 -0.25116 0 1.0402 -0.03805 0.34929 -3.10632 LYS_100 -3.65528 0.33163 4.14649 -0.35988 0.08742 0.22647 1.41744 -1.66457 -0.01734 -0.09076 -2.21817 -0.34353 0 0 0 -0.63754 0 0.022 -0.08959 0.06836 1.51561 0 -0.10199 0 -1.5107 0.08244 0.56562 -2.22586 GLY_101 -2.21615 0.23872 1.97221 -6e-05 0 0 0.15379 -1.02655 -0.01615 -0.09287 0.13005 -0.39856 0 0 0 0 0 0.00981 -0.15672 0 0 0 -1.44603 0 0.83697 -0.62036 0.53266 -2.09923 GLN_102 -5.51741 0.88157 5.93587 -0.66758 0.1769 0.68937 3.06974 -2.77271 -0.03287 -0.22372 -3.28359 -0.71859 0 0 0 0 0 0.01609 0.00067 0.01747 0 2.46016 0.07671 0 -0.18838 -0.54968 0.91622 0.28625 PRO_103 -3.59141 0.54409 2.22348 -0.12806 0.00083 0.09506 0.9145 -1.10007 -0.02038 -0.11695 -0.96506 0.23605 0 0 0 0 0 0.00275 0.17782 0.02541 0.18506 0 -1.13822 0 -2.4119 -0.45248 1.0735 -4.44601 SER_104 -4.61189 0.81452 3.22934 -0.03182 0 0.02071 1.10072 -1.55499 -0 -0 -1.53194 -0.15411 0 0 -0.37861 0 0 0.01061 0.02143 0.1918 0.48136 0 -0.08207 1.84587 -0.77834 -0.64732 0.63057 -1.42417 LYS_105 -5.51643 0.75755 4.6406 -0.34123 0.06186 0.21953 1.77724 -2.24846 -0.05842 -0.2149 -1.39978 -0.34063 0 0 0 0 0 0.01198 0.02031 0.05444 1.93032 0 0.11914 0 -1.5107 -0.24327 1.10811 -1.17275 PRO_106 -4.05199 0.72452 1.61477 -0.13552 0.00055 0.0959 0.12179 -0.73697 -0 -0 -0.22356 0.25518 0 0 0 0 0 0.05044 0.20213 0.01125 0.30185 0 -1.13477 0 -2.4119 -0.25752 1.04222 -4.53162 PHE_107 -5.36234 0.74357 0.32077 -0.46522 0.01141 0.16705 0.07026 -1.05146 -9e-05 -0.00023 -0.21524 0.06197 0 0 0 0 0 0.05847 -0.02184 0.02829 0 2.41568 -0.02978 0 1.0402 -0.52914 0.92451 -1.8332 VAL_108 -2.13606 0.28451 1.42131 -0.28668 0.20428 0.06978 0.77758 -0.92686 -0.00085 -0.01205 -0.83794 -0.42757 0 0 0 0 0 0.00881 -0.03335 0.00736 0.17131 0 -0.50521 0 1.9342 -0.3375 0.81381 0.18888 GLY_109 -1.85529 0.20919 2.12494 -0.00011 0 0 1.20054 -1.11183 -9e-05 -0.00023 -0.9429 -0.42633 0 0 0 0 0 0.0215 0.07756 0 0 0 0.3776 0 0.83697 0.67845 0.28645 1.47642 VAL_110 -3.17771 0.53359 2.22564 -0.3646 0.24761 0.08912 1.66453 -1.44703 -0.01536 -0.13963 -1.49194 -0.14131 0 0 0 0 0 0.02063 -0.11581 0.00053 0.6441 0 0.34602 0 1.9342 0.6661 0.25588 1.73455 LEU_111 -2.05103 0.3584 1.60489 -0.50906 0.23077 0.13826 0.56311 -0.96997 -0.00085 -0.01205 0.33341 0.17954 0 0 0 0 0 0.0255 0.01178 0.04238 0.18428 0 -0.07297 0 0.18072 -0.26184 0.24325 0.21852 SER_112 -1.77376 0.24753 2.55031 -0.02826 0.00718 0.02656 1.27472 -1.21817 -0 -0 -1.23198 -0.07919 0 0 0 0 0 0.00854 -0.06232 0.00325 0.60382 0 -0.21373 0.6005 -0.77834 -0.44497 0.15901 -0.34931 ALA_113 -1.60272 0.12312 1.74663 -0.02506 3e-05 0 1.03646 -1.03585 -0.01536 -0.13963 -0.52457 -0.22004 0 0 0 0 0 0.0192 -0.05486 0 0 0 -0.08949 0 1.8394 -0.7673 0.13144 0.42139 GLY_114 -0.78492 0.10082 0.7071 -0.00175 0 0 0.1445 -0.37728 -0 -0 0.17131 -0.36924 0 0 0 0 0 0.33017 -0.07759 0 0 0 -1.53531 0 0.83697 -0.15903 0.16134 -0.85293 ILE_115 -1.23401 0.16532 0.87374 -0.45723 0.33375 0.09595 0.00335 -0.50139 -6e-05 -0.00034 0.0267 -0.0191 0 0 0 0 0 0.13925 -0.07172 0.00093 0.34133 0 -0.58789 0 0.73287 0.17919 0.22908 0.24972 ASN:CtermProteinFull_116 -0.84903 0.06939 0.71845 -0.19911 0.01853 0.3862 0.00335 -0.40036 -6e-05 -0.00034 -0.09886 -0.27526 0 0 0 0 0 0.0844 0 0.00508 0 2.05432 0 0 -0.93687 -0.1381 0.16972 0.61147 VRT_117 0 0 0 0 0 0 0 -0 -0 -0 0 0 0 0 0 0 0 4.18276 0 0 0 0 0 0 0 0 0 4.18276 #END_POSE_ENERGIES_TABLE model05_0001.pdb ENDMDL