REMARK Name = BDB059695 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA ILE A 7 -12.598 0.106 1.715 0.00 0.00 +0.162 C ATOM 2 C ILE A 7 -12.230 -1.403 1.780 0.00 0.00 +0.234 C ATOM 3 O ILE A 7 -11.573 -1.813 2.753 0.00 0.00 -0.274 OA ATOM 4 N LEU A 8 -12.628 -2.380 0.932 0.00 0.00 -0.302 N ATOM 5 H LEU A 8 -12.338 -3.281 1.292 0.00 0.00 +0.150 HD ATOM 6 CA LEU A 8 -13.015 -2.417 -0.487 0.00 0.00 +0.159 C ATOM 7 C LEU A 8 -11.951 -1.723 -1.365 0.00 0.00 +0.234 C ATOM 8 O LEU A 8 -12.261 -0.843 -2.167 0.00 0.00 -0.274 OA ATOM 9 N LYS A 9 -10.639 -2.096 -1.295 0.00 0.00 -0.302 N ATOM 10 H LYS A 9 -10.057 -1.583 -1.951 0.00 0.00 +0.150 HD ATOM 11 CA LYS A 9 -9.961 -3.174 -0.565 0.00 0.00 +0.159 C ATOM 12 C LYS A 9 -8.441 -2.908 -0.633 0.00 0.00 +0.234 C ATOM 13 O LYS A 9 -7.946 -2.229 -1.537 0.00 0.00 -0.274 OA ATOM 14 N LYS A 10 -7.581 -3.472 0.277 0.00 0.00 -0.302 N ATOM 15 H LYS A 10 -6.666 -3.091 0.077 0.00 0.00 +0.150 HD ATOM 16 CA LYS A 10 -7.861 -3.684 1.702 0.00 0.00 +0.159 C ATOM 17 C LYS A 10 -6.655 -3.416 2.651 0.00 0.00 +0.234 C ATOM 18 O LYS A 10 -6.862 -3.028 3.802 0.00 0.00 -0.274 OA ATOM 19 N CYS A 11 -5.365 -3.691 2.314 0.00 0.00 -0.302 N ATOM 20 H CYS A 11 -4.736 -3.560 3.107 0.00 0.00 +0.150 HD ATOM 21 CA CYS A 11 -4.774 -4.467 1.212 0.00 0.00 +0.169 C ATOM 22 C CYS A 11 -3.809 -5.499 1.835 0.00 0.00 +0.235 C ATOM 23 N ARG A 12 -3.574 -6.603 1.053 0.00 0.00 -0.302 N ATOM 24 H ARG A 12 -4.244 -6.826 0.329 0.00 0.00 +0.150 HD ATOM 25 CA ARG A 12 -2.552 -7.601 1.383 0.00 0.00 +0.159 C ATOM 26 C ARG A 12 -1.135 -7.016 1.118 0.00 0.00 +0.234 C ATOM 27 N ARG A 13 -0.030 -7.645 1.615 0.00 0.00 -0.302 N ATOM 28 H ARG A 13 0.835 -7.215 1.305 0.00 0.00 +0.150 HD ATOM 29 CA ARG A 13 0.096 -8.883 2.385 0.00 0.00 +0.159 C ATOM 30 C ARG A 13 0.760 -8.733 3.777 0.00 0.00 +0.234 C ATOM 31 N ASP A 14 1.365 -7.560 4.148 0.00 0.00 -0.302 N ATOM 32 H ASP A 14 1.370 -7.553 5.166 0.00 0.00 +0.150 HD ATOM 33 CA ASP A 14 2.738 -7.196 3.732 0.00 0.00 +0.169 C ATOM 34 C ASP A 14 2.723 -6.422 2.418 0.00 0.00 +0.235 C ATOM 35 N SER A 15 2.616 -5.065 2.367 0.00 0.00 -0.301 N ATOM 36 H SER A 15 2.504 -4.808 1.391 0.00 0.00 +0.150 HD ATOM 37 CA SER A 15 1.945 -4.122 3.284 0.00 0.00 +0.184 C ATOM 38 C SER A 15 1.926 -2.720 2.618 0.00 0.00 +0.236 C ATOM 39 N ASP A 16 3.033 -2.206 1.995 0.00 0.00 -0.302 N ATOM 40 H ASP A 16 2.872 -1.260 1.655 0.00 0.00 +0.150 HD ATOM 41 CA ASP A 16 4.430 -2.676 1.991 0.00 0.00 +0.169 C ATOM 42 C ASP A 16 5.282 -1.511 2.562 0.00 0.00 +0.235 C ATOM 43 N CYS A 17 5.585 -0.490 1.693 0.00 0.00 -0.302 N ATOM 44 H CYS A 17 4.995 -0.411 0.860 0.00 0.00 +0.150 HD ATOM 45 CA CYS A 17 6.247 0.762 2.079 0.00 0.00 +0.170 C ATOM 46 CB CYS A 17 7.557 0.590 2.878 0.00 0.00 +0.112 C ATOM 47 SG CYS A 17 8.820 -0.401 1.976 0.00 0.00 -0.091 S ATOM 48 SG CYS A 29 10.571 0.507 2.528 0.00 0.00 -0.091 S ATOM 49 CB CYS A 29 10.638 1.979 1.445 0.00 0.00 +0.112 C ATOM 50 CA CYS A 29 11.355 1.725 0.107 0.00 0.00 +0.169 C ATOM 51 N CYS A 29 10.415 1.466 -1.002 0.00 0.00 -0.302 N ATOM 52 H CYS A 29 10.105 2.316 -1.475 0.00 0.00 +0.150 HD ATOM 53 C TYR A 28 10.241 0.397 -1.826 0.00 0.00 +0.234 C ATOM 54 CA TYR A 28 10.803 -0.991 -1.438 0.00 0.00 +0.163 C ATOM 55 N TYR A 28 10.104 -2.150 -2.045 0.00 0.00 -0.302 N ATOM 56 H TYR A 28 10.686 -2.976 -2.077 0.00 0.00 +0.150 HD ATOM 57 C GLY A 27 8.829 -2.580 -1.834 0.00 0.00 +0.231 C ATOM 58 CA GLY A 27 7.628 -1.632 -1.811 0.00 0.00 +0.200 C ATOM 59 N GLY A 27 6.573 -2.276 -2.607 0.00 0.00 -0.305 N ATOM 60 H GLY A 27 6.750 -3.255 -2.812 0.00 0.00 +0.149 HD ATOM 61 C ASN A 26 5.661 -1.744 -3.470 0.00 0.00 +0.234 C ATOM 62 CA ASN A 26 5.252 -0.260 -3.418 0.00 0.00 +0.168 C ATOM 63 N ASN A 26 4.887 0.058 -2.035 0.00 0.00 -0.302 N ATOM 64 H ASN A 26 5.651 0.335 -1.413 0.00 0.00 +0.150 HD ATOM 65 C GLY A 25 3.719 -0.242 -1.401 0.00 0.00 +0.231 C ATOM 66 CA GLY A 25 2.468 -0.596 -2.202 0.00 0.00 +0.200 C ATOM 67 N GLY A 25 1.668 0.619 -2.279 0.00 0.00 -0.305 N ATOM 68 H GLY A 25 1.721 1.246 -1.484 0.00 0.00 +0.149 HD ATOM 69 C ARG A 24 1.103 1.200 -3.381 0.00 0.00 +0.234 C ATOM 70 CA ARG A 24 1.047 0.398 -4.702 0.00 0.00 +0.159 C ATOM 71 N ARG A 24 0.493 -0.973 -4.620 0.00 0.00 -0.302 N ATOM 72 H ARG A 24 0.759 -1.509 -5.443 0.00 0.00 +0.150 HD ATOM 73 C CYS A 23 -0.791 -1.327 -4.307 0.00 0.00 +0.235 C ATOM 74 CA CYS A 23 -1.416 -0.851 -2.976 0.00 0.00 +0.169 C ATOM 75 N CYS A 23 -2.425 0.181 -3.206 0.00 0.00 -0.302 N ATOM 76 H CYS A 23 -2.730 0.277 -4.170 0.00 0.00 +0.150 HD ATOM 77 C ILE A 22 -2.534 1.374 -2.538 0.00 0.00 +0.234 C ATOM 78 CA ILE A 22 -2.345 1.389 -0.997 0.00 0.00 +0.162 C ATOM 79 N ILE A 22 -1.839 2.650 -0.453 0.00 0.00 -0.302 N ATOM 80 H ILE A 22 -0.836 2.701 -0.316 0.00 0.00 +0.150 HD ATOM 81 C CYS A 21 -2.508 3.861 -0.427 0.00 0.00 +0.235 C ATOM 82 CA CYS A 21 -1.638 4.989 0.189 0.00 0.00 +0.169 C ATOM 83 N CYS A 21 -1.004 4.460 1.409 0.00 0.00 -0.302 N ATOM 84 H CYS A 21 -1.448 3.638 1.808 0.00 0.00 +0.150 HD ATOM 85 C ALA A 20 -0.016 4.926 2.212 0.00 0.00 +0.234 C ATOM 86 CA ALA A 20 0.727 6.248 1.905 0.00 0.00 +0.156 C ATOM 87 N ALA A 20 1.515 6.700 3.062 0.00 0.00 -0.303 N ATOM 88 H ALA A 20 1.162 7.506 3.562 0.00 0.00 +0.149 HD ATOM 89 C GLY A 19 2.636 6.196 3.650 0.00 0.00 +0.231 C ATOM 90 CA GLY A 19 3.335 4.964 3.087 0.00 0.00 +0.200 C ATOM 91 N GLY A 19 4.446 5.399 2.241 0.00 0.00 -0.305 N ATOM 92 H GLY A 19 4.069 6.108 1.624 0.00 0.00 +0.149 HD ATOM 93 C PRO A 18 4.996 4.423 1.447 0.00 0.00 +0.234 C ATOM 94 CA PRO A 18 6.344 3.847 1.941 0.00 0.00 +0.162 C ATOM 95 N PRO A 18 6.875 2.921 0.941 0.00 0.00 -0.288 N ATOM 96 CD PRO A 18 7.476 3.678 -0.144 0.00 0.00 +0.109 C ATOM 97 CG PRO A 18 7.785 5.054 0.450 0.00 0.00 +0.021 C ATOM 98 CB PRO A 18 7.411 4.941 1.933 0.00 0.00 +0.033 C ATOM 99 O PRO A 18 4.465 4.131 0.376 0.00 0.00 -0.274 OA ATOM 100 O GLY A 19 3.131 6.832 4.588 0.00 0.00 -0.274 OA ATOM 101 CB ALA A 20 1.536 6.219 0.618 0.00 0.00 +0.038 C ATOM 102 O ALA A 20 0.282 4.233 3.190 0.00 0.00 -0.274 OA ATOM 103 CB CYS A 21 -2.394 6.318 0.338 0.00 0.00 +0.112 C ATOM 104 SG CYS A 21 -3.294 6.609 1.912 0.00 0.00 -0.091 S ATOM 105 SG CYS A 4 -4.861 5.292 1.823 0.00 0.00 -0.091 S ATOM 106 CB CYS A 4 -5.976 6.102 0.613 0.00 0.00 +0.112 C ATOM 107 CA CYS A 4 -7.092 6.931 1.256 0.00 0.00 +0.169 C ATOM 108 C CYS A 4 -8.046 6.267 2.277 0.00 0.00 +0.235 C ATOM 109 O CYS A 4 -8.529 6.964 3.182 0.00 0.00 -0.274 OA ATOM 110 N SER A 5 -8.526 5.002 2.213 0.00 0.00 -0.301 N ATOM 111 H SER A 5 -9.181 4.801 2.961 0.00 0.00 +0.150 HD ATOM 112 CA SER A 5 -8.313 3.877 1.302 0.00 0.00 +0.184 C ATOM 113 C SER A 5 -9.188 4.016 0.041 0.00 0.00 +0.236 C ATOM 114 O SER A 5 -8.764 4.693 -0.904 0.00 0.00 -0.274 OA ATOM 115 N ARG A 6 -10.449 3.534 -0.086 0.00 0.00 -0.302 N ATOM 116 H ARG A 6 -10.861 3.757 -0.992 0.00 0.00 +0.150 HD ATOM 117 CA ARG A 6 -11.352 2.837 0.834 0.00 0.00 +0.159 C ATOM 118 C ARG A 6 -12.293 1.965 -0.025 0.00 0.00 +0.234 C ATOM 119 O ARG A 6 -12.690 2.370 -1.122 0.00 0.00 -0.274 OA ATOM 120 O CYS A 21 -3.614 4.054 -0.916 0.00 0.00 -0.274 OA ATOM 121 O ILE A 22 -2.845 2.368 -3.193 0.00 0.00 -0.274 OA ATOM 122 CB CYS A 23 -1.911 -2.078 -2.183 0.00 0.00 +0.112 C ATOM 123 SG CYS A 23 -3.599 -2.647 -2.602 0.00 0.00 -0.091 S ATOM 124 SG CYS A 11 -3.811 -4.303 -1.401 0.00 0.00 -0.091 S ATOM 125 O CYS A 23 -1.400 -2.043 -5.101 0.00 0.00 -0.274 OA ATOM 126 O ARG A 24 0.702 2.357 -3.267 0.00 0.00 -0.274 OA ATOM 127 O GLY A 25 3.658 -0.135 -0.170 0.00 0.00 -0.274 OA ATOM 128 O ASN A 26 5.159 -2.502 -4.310 0.00 0.00 -0.274 OA ATOM 129 O GLY A 27 8.654 -3.805 -1.763 0.00 0.00 -0.274 OA ATOM 130 O TYR A 28 9.604 0.580 -2.864 0.00 0.00 -0.274 OA ATOM 131 C CYS A 17 6.582 1.583 0.801 0.00 0.00 +0.237 C ATOM 132 O CYS A 17 6.711 1.018 -0.293 0.00 0.00 -0.274 OA ATOM 133 O ASP A 16 5.579 -1.472 3.755 0.00 0.00 -0.274 OA ATOM 134 O SER A 15 0.947 -1.979 2.697 0.00 0.00 -0.274 OA ATOM 135 O ASP A 14 2.753 -7.011 1.330 0.00 0.00 -0.274 OA ATOM 136 O ARG A 13 0.752 -9.662 4.590 0.00 0.00 -0.274 OA ATOM 137 O ARG A 12 -0.951 -6.015 0.426 0.00 0.00 -0.274 OA ATOM 138 O CYS A 11 -3.244 -5.289 2.908 0.00 0.00 -0.274 OA ATOM 139 CB CYS A 11 -3.991 -3.553 0.260 0.00 0.00 +0.112 C ATOM 140 N ILE A 7 -12.728 0.747 0.411 0.00 0.00 -0.302 N ATOM 141 H ILE A 7 -13.311 0.315 -0.293 0.00 0.00 +0.150 HD ENDROOT BRANCH 50 142 ATOM 142 C CYS A 29 12.066 3.035 -0.290 0.00 0.00 +0.235 C ATOM 143 N GLY A 30 13.183 3.448 0.369 0.00 0.00 -0.305 N ATOM 144 H GLY A 30 13.585 4.291 -0.028 0.00 0.00 +0.149 HD ATOM 145 O CYS A 29 11.597 3.788 -1.151 0.00 0.00 -0.274 OA BRANCH 143 146 ATOM 146 CA GLY A 30 13.990 2.720 1.335 0.00 0.00 +0.200 C BRANCH 146 147 ATOM 147 C GLY A 30 15.110 1.956 0.634 0.00 0.00 +0.231 C ATOM 148 N SER A 31 16.361 2.261 1.095 0.00 0.00 -0.301 N ATOM 149 H SER A 31 16.501 3.024 1.744 0.00 0.00 +0.150 HD ATOM 150 O GLY A 30 14.887 1.145 -0.259 0.00 0.00 -0.274 OA BRANCH 148 151 ATOM 151 CA SER A 31 17.570 1.625 0.575 0.00 0.00 +0.184 C BRANCH 151 152 ATOM 152 C SER A 31 18.669 1.883 1.618 0.00 0.00 +0.236 C ATOM 153 N GLY A 32 19.200 3.159 1.603 0.00 0.00 -0.305 N ATOM 154 H GLY A 32 19.150 3.658 0.717 0.00 0.00 +0.149 HD ATOM 155 O SER A 31 18.937 1.069 2.500 0.00 0.00 -0.274 OA BRANCH 153 156 ATOM 156 CA GLY A 32 20.277 3.501 2.514 0.00 0.00 +0.200 C BRANCH 156 157 ATOM 157 C GLY A 32 21.575 2.808 2.089 0.00 0.00 +0.231 C ATOM 158 N SER A 33 22.416 2.499 3.135 0.00 0.00 -0.301 N ATOM 159 H SER A 33 22.307 3.048 3.979 0.00 0.00 +0.150 HD ATOM 160 O GLY A 32 21.831 2.530 0.919 0.00 0.00 -0.274 OA BRANCH 158 161 ATOM 161 CA SER A 33 23.771 1.960 2.926 0.00 0.00 +0.184 C BRANCH 161 162 ATOM 162 C SER A 33 24.703 3.134 2.531 0.00 0.00 +0.236 C ATOM 163 N ASP A 34 25.750 2.848 1.677 0.00 0.00 -0.300 N ATOM 164 H ASP A 34 26.101 1.894 1.773 0.00 0.00 +0.150 HD ATOM 165 O SER A 33 24.545 4.256 3.014 0.00 0.00 -0.274 OA BRANCH 163 166 ATOM 166 CA ASP A 34 26.814 3.840 1.475 0.00 0.00 +0.192 C BRANCH 166 167 ATOM 167 C ASP A 34 26.306 5.172 0.914 0.00 0.00 +0.326 C ATOM 168 O ASP A 34 25.369 5.359 0.158 0.00 0.00 -0.249 OA BRANCH 167 169 ATOM 169 OXT ASP A 34 27.106 6.202 1.271 0.00 0.00 -0.479 OA ATOM 170 HXT ASP A 34 26.645 6.986 0.900 0.00 0.00 +0.295 HD ENDBRANCH 167 169 ENDBRANCH 166 167 BRANCH 166 171 ATOM 171 CB ASP A 34 27.856 3.331 0.471 0.00 0.00 +0.154 C BRANCH 171 172 ATOM 172 CG ASP A 34 28.630 2.171 1.028 0.00 0.00 +0.307 C ATOM 173 OD1 ASP A 34 28.364 1.609 2.080 0.00 0.00 -0.251 OA BRANCH 172 174 ATOM 174 OD2 ASP A 34 29.644 1.776 0.226 0.00 0.00 -0.481 OA ATOM 175 HD2 ASP A 34 29.771 2.323 -0.573 0.00 0.00 +0.295 HD ENDBRANCH 172 174 ENDBRANCH 171 172 ENDBRANCH 166 171 ENDBRANCH 163 166 ENDBRANCH 161 162 BRANCH 161 176 ATOM 176 CB SER A 33 23.808 0.719 2.026 0.00 0.00 +0.187 C BRANCH 176 177 ATOM 177 OG SER A 33 22.896 -0.275 2.500 0.00 0.00 -0.393 OA ATOM 178 H SER A 33 22.002 0.099 2.380 0.00 0.00 +0.209 HD ENDBRANCH 176 177 ENDBRANCH 161 176 ENDBRANCH 158 161 ENDBRANCH 156 157 ENDBRANCH 153 156 ENDBRANCH 151 152 BRANCH 151 179 ATOM 179 CB SER A 31 17.952 2.115 -0.832 0.00 0.00 +0.187 C BRANCH 179 180 ATOM 180 OG SER A 31 18.055 3.550 -0.873 0.00 0.00 -0.393 OA ATOM 181 H SER A 31 18.206 3.781 -1.810 0.00 0.00 +0.209 HD ENDBRANCH 179 180 ENDBRANCH 151 179 ENDBRANCH 148 151 ENDBRANCH 146 147 ENDBRANCH 143 146 ENDBRANCH 50 142 BRANCH 107 182 ATOM 182 N CYS A 4 -7.858 7.677 0.228 0.00 0.00 -0.302 N ATOM 183 H CYS A 4 -7.478 7.498 -0.699 0.00 0.00 +0.150 HD ATOM 184 C GLN A 3 -7.959 9.042 0.364 0.00 0.00 +0.234 C ATOM 185 O GLN A 3 -7.259 9.754 -0.377 0.00 0.00 -0.274 OA BRANCH 184 186 ATOM 186 CA GLN A 3 -8.880 9.601 1.475 0.00 0.00 +0.159 C BRANCH 186 187 ATOM 187 N GLN A 3 -8.849 11.068 1.501 0.00 0.00 -0.303 N ATOM 188 H GLN A 3 -8.515 11.512 2.351 0.00 0.00 +0.149 HD ATOM 189 C GLY A 2 -9.370 11.867 0.508 0.00 0.00 +0.231 C ATOM 190 O GLY A 2 -9.921 11.422 -0.504 0.00 0.00 -0.274 OA BRANCH 189 191 ATOM 191 CA GLY A 2 -9.208 13.373 0.757 0.00 0.00 +0.200 C BRANCH 191 192 ATOM 192 N GLY A 2 -9.723 14.110 -0.379 0.00 0.00 -0.306 N ATOM 193 H GLY A 2 -9.766 13.614 -1.267 0.00 0.00 +0.149 HD ATOM 194 C GLY A 1 -9.767 15.479 -0.411 0.00 0.00 +0.227 C ATOM 195 O GLY A 1 -9.443 16.205 0.529 0.00 0.00 -0.274 OA BRANCH 194 196 ATOM 196 CA GLY A 1 -10.200 16.058 -1.759 0.00 0.00 +0.174 C BRANCH 196 197 ATOM 197 N GLY A 1 -9.062 16.036 -2.690 0.00 0.00 -0.322 NA ATOM 198 H1 GLY A 1 -9.300 16.581 -3.517 0.00 0.00 +0.119 HD ATOM 199 H2 GLY A 1 -8.287 16.538 -2.249 0.00 0.00 +0.119 HD ENDBRANCH 196 197 ENDBRANCH 194 196 ENDBRANCH 191 192 ENDBRANCH 189 191 ENDBRANCH 186 187 BRANCH 186 200 ATOM 200 CB GLN A 3 -10.299 9.008 1.356 0.00 0.00 +0.041 C BRANCH 200 201 ATOM 201 CG GLN A 3 -11.242 9.408 2.493 0.00 0.00 +0.098 C BRANCH 201 202 ATOM 202 CD GLN A 3 -11.727 10.838 2.439 0.00 0.00 +0.211 C ATOM 203 OE1 GLN A 3 -11.502 11.654 3.326 0.00 0.00 -0.276 OA ATOM 204 NE2 GLN A 3 -12.467 11.176 1.343 0.00 0.00 -0.329 N ATOM 205 HE21 GLN A 3 -12.692 12.160 1.278 0.00 0.00 +0.145 HD ATOM 206 HE22 GLN A 3 -12.225 10.758 0.452 0.00 0.00 +0.145 HD ENDBRANCH 201 202 ENDBRANCH 200 201 ENDBRANCH 186 200 ENDBRANCH 184 186 ENDBRANCH 107 182 BRANCH 1 207 ATOM 207 CB ILE A 7 -13.810 0.457 2.630 0.00 0.00 +0.015 C ATOM 208 CG2 ILE A 7 -15.117 -0.199 2.184 0.00 0.00 +0.010 C BRANCH 207 210 ATOM 209 CD1 ILE A 7 -14.496 0.786 5.080 0.00 0.00 +0.004 C ATOM 210 CG1 ILE A 7 -13.505 0.154 4.114 0.00 0.00 +0.002 C ENDBRANCH 207 210 ENDBRANCH 1 207 BRANCH 78 211 ATOM 211 CB ILE A 22 -3.547 0.752 -0.242 0.00 0.00 +0.015 C ATOM 212 CG2 ILE A 22 -3.264 0.645 1.262 0.00 0.00 +0.010 C BRANCH 211 213 ATOM 213 CG1 ILE A 22 -4.917 1.409 -0.504 0.00 0.00 +0.002 C ATOM 214 CD1 ILE A 22 -6.080 0.459 -0.245 0.00 0.00 +0.004 C ENDBRANCH 211 213 ENDBRANCH 78 211 BRANCH 25 215 ATOM 215 CB ARG A 12 -2.794 -8.895 0.576 0.00 0.00 +0.033 C BRANCH 215 216 ATOM 216 CG ARG A 12 -2.773 -8.701 -0.948 0.00 0.00 +0.023 C BRANCH 216 217 ATOM 217 CD ARG A 12 -2.860 -10.012 -1.729 0.00 0.00 +0.115 C BRANCH 217 218 ATOM 218 NE ARG A 12 -3.995 -10.843 -1.346 0.00 0.00 -0.356 N ATOM 219 HE ARG A 12 -3.697 -11.818 -1.365 0.00 0.00 +0.162 HD BRANCH 218 220 ATOM 220 CZ ARG A 12 -5.221 -10.720 -1.912 0.00 0.00 +0.188 C ATOM 221 NH1 ARG A 12 -5.827 -11.645 -2.560 0.00 0.00 -0.269 NA ATOM 222 HH1 ARG A 12 -5.238 -12.476 -2.621 0.00 0.00 +0.190 HD BRANCH 220 223 ATOM 223 NH2 ARG A 12 -5.877 -9.566 -1.693 0.00 0.00 -0.370 N ATOM 224 HH21 ARG A 12 -5.361 -8.741 -1.961 0.00 0.00 +0.159 HD ATOM 225 HH22 ARG A 12 -6.746 -9.597 -2.218 0.00 0.00 +0.159 HD ENDBRANCH 220 223 ENDBRANCH 218 220 ENDBRANCH 217 218 ENDBRANCH 216 217 ENDBRANCH 215 216 ENDBRANCH 25 215 BRANCH 41 226 ATOM 226 CB ASP A 16 4.828 -3.123 0.591 0.00 0.00 +0.152 C BRANCH 226 227 ATOM 227 CG ASP A 16 5.902 -4.165 0.612 0.00 0.00 +0.307 C ATOM 228 OD1 ASP A 16 5.743 -5.340 0.316 0.00 0.00 -0.251 OA BRANCH 227 229 ATOM 229 OD2 ASP A 16 7.109 -3.664 0.911 0.00 0.00 -0.481 OA ATOM 230 HD2 ASP A 16 7.749 -4.372 0.672 0.00 0.00 +0.295 HD ENDBRANCH 227 229 ENDBRANCH 226 227 ENDBRANCH 41 226 BRANCH 6 231 ATOM 231 CB LEU A 8 -14.479 -2.017 -0.740 0.00 0.00 +0.034 C BRANCH 231 232 ATOM 232 CG LEU A 8 -15.235 -2.773 -1.860 0.00 0.00 -0.015 C ATOM 233 CD2 LEU A 8 -15.383 -4.270 -1.572 0.00 0.00 +0.007 C ATOM 234 CD1 LEU A 8 -14.646 -2.551 -3.249 0.00 0.00 +0.007 C ENDBRANCH 231 232 ENDBRANCH 6 231 BRANCH 37 235 ATOM 235 CB SER A 15 2.539 -3.963 4.690 0.00 0.00 +0.187 C BRANCH 235 236 ATOM 236 OG SER A 15 1.958 -4.901 5.590 0.00 0.00 -0.393 OA ATOM 237 H SER A 15 2.315 -4.709 6.478 0.00 0.00 +0.209 HD ENDBRANCH 235 236 ENDBRANCH 37 235 BRANCH 33 238 ATOM 238 CB ASP A 14 3.722 -8.371 3.629 0.00 0.00 +0.152 C BRANCH 238 239 ATOM 239 CG ASP A 14 4.087 -8.915 4.979 0.00 0.00 +0.307 C ATOM 240 OD1 ASP A 14 3.792 -8.455 6.069 0.00 0.00 -0.251 OA BRANCH 239 241 ATOM 241 OD2 ASP A 14 4.826 -10.037 4.874 0.00 0.00 -0.481 OA ATOM 242 HD2 ASP A 14 4.954 -10.343 5.798 0.00 0.00 +0.295 HD ENDBRANCH 239 241 ENDBRANCH 238 239 ENDBRANCH 33 238 BRANCH 29 243 ATOM 243 CB ARG A 13 0.819 -9.915 1.505 0.00 0.00 +0.033 C BRANCH 243 244 ATOM 244 CG ARG A 13 0.524 -11.372 1.872 0.00 0.00 +0.023 C BRANCH 244 245 ATOM 245 CD ARG A 13 1.300 -12.304 0.935 0.00 0.00 +0.115 C BRANCH 245 246 ATOM 246 NE ARG A 13 0.769 -13.652 0.981 0.00 0.00 -0.356 N ATOM 247 HE ARG A 13 0.959 -14.138 1.854 0.00 0.00 +0.162 HD BRANCH 246 248 ATOM 248 CZ ARG A 13 -0.355 -14.071 0.368 0.00 0.00 +0.188 C ATOM 249 NH1 ARG A 13 -1.130 -13.425 -0.427 0.00 0.00 -0.269 NA ATOM 250 HH1 ARG A 13 -0.748 -12.489 -0.559 0.00 0.00 +0.190 HD BRANCH 248 251 ATOM 251 NH2 ARG A 13 -0.633 -15.351 0.678 0.00 0.00 -0.370 N ATOM 252 HH21 ARG A 13 -1.415 -15.685 0.118 0.00 0.00 +0.159 HD ATOM 253 HH22 ARG A 13 0.168 -15.961 0.565 0.00 0.00 +0.159 HD ENDBRANCH 248 251 ENDBRANCH 246 248 ENDBRANCH 245 246 ENDBRANCH 244 245 ENDBRANCH 243 244 ENDBRANCH 29 243 BRANCH 62 254 ATOM 254 CB ASN A 26 6.353 0.650 -3.962 0.00 0.00 +0.127 C BRANCH 254 255 ATOM 255 CG ASN A 26 5.989 1.224 -5.313 0.00 0.00 +0.213 C ATOM 256 OD1 ASN A 26 4.915 1.064 -5.880 0.00 0.00 -0.276 OA ATOM 257 ND2 ASN A 26 6.977 1.982 -5.872 0.00 0.00 -0.329 N ATOM 258 HD21 ASN A 26 7.932 1.923 -5.539 0.00 0.00 +0.145 HD ATOM 259 HD22 ASN A 26 6.828 2.300 -6.822 0.00 0.00 +0.145 HD ENDBRANCH 254 255 ENDBRANCH 62 254 BRANCH 112 260 ATOM 260 CB SER A 5 -8.333 2.542 2.057 0.00 0.00 +0.187 C BRANCH 260 261 ATOM 261 OG SER A 5 -9.270 2.559 3.140 0.00 0.00 -0.393 OA ATOM 262 H SER A 5 -9.043 1.806 3.717 0.00 0.00 +0.209 HD ENDBRANCH 260 261 ENDBRANCH 112 260 BRANCH 117 263 ATOM 263 CB ARG A 6 -12.112 3.824 1.737 0.00 0.00 +0.033 C BRANCH 263 264 ATOM 264 CG ARG A 6 -13.077 4.772 1.005 0.00 0.00 +0.023 C BRANCH 264 265 ATOM 265 CD ARG A 6 -14.506 4.236 0.931 0.00 0.00 +0.115 C BRANCH 265 266 ATOM 266 NE ARG A 6 -15.187 4.735 -0.239 0.00 0.00 -0.356 N ATOM 267 HE ARG A 6 -15.156 4.113 -1.040 0.00 0.00 +0.162 HD BRANCH 266 268 ATOM 268 CZ ARG A 6 -15.923 5.853 -0.343 0.00 0.00 +0.188 C ATOM 269 NH1 ARG A 6 -16.698 6.110 -1.335 0.00 0.00 -0.269 NA ATOM 270 HH1 ARG A 6 -16.681 5.315 -1.977 0.00 0.00 +0.190 HD BRANCH 268 271 ATOM 271 NH2 ARG A 6 -15.776 6.777 0.627 0.00 0.00 -0.370 N ATOM 272 HH21 ARG A 6 -14.807 7.045 0.710 0.00 0.00 +0.159 HD ATOM 273 HH22 ARG A 6 -16.327 7.586 0.346 0.00 0.00 +0.159 HD ENDBRANCH 268 271 ENDBRANCH 266 268 ENDBRANCH 265 266 ENDBRANCH 264 265 ENDBRANCH 263 264 ENDBRANCH 117 263 BRANCH 70 274 ATOM 274 CB ARG A 24 0.566 1.189 -5.940 0.00 0.00 +0.033 C BRANCH 274 275 ATOM 275 CG ARG A 24 -0.919 1.555 -5.992 0.00 0.00 +0.023 C BRANCH 275 276 ATOM 276 CD ARG A 24 -1.297 2.221 -7.320 0.00 0.00 +0.115 C BRANCH 276 277 ATOM 277 NE ARG A 24 -1.455 1.215 -8.354 0.00 0.00 -0.356 N ATOM 278 HE ARG A 24 -0.817 0.428 -8.262 0.00 0.00 +0.162 HD BRANCH 277 279 ATOM 279 CZ ARG A 24 -1.714 1.493 -9.647 0.00 0.00 +0.188 C ATOM 280 NH1 ARG A 24 -2.105 2.596 -10.163 0.00 0.00 -0.269 NA ATOM 281 HH1 ARG A 24 -2.206 3.294 -9.423 0.00 0.00 +0.190 HD BRANCH 279 282 ATOM 282 NH2 ARG A 24 -1.524 0.419 -10.433 0.00 0.00 -0.370 N ATOM 283 HH21 ARG A 24 -1.851 0.623 -11.374 0.00 0.00 +0.159 HD ATOM 284 HH22 ARG A 24 -1.987 -0.409 -10.080 0.00 0.00 +0.159 HD ENDBRANCH 279 282 ENDBRANCH 277 279 ENDBRANCH 276 277 ENDBRANCH 275 276 ENDBRANCH 274 275 ENDBRANCH 70 274 BRANCH 54 285 ATOM 285 CB TYR A 28 12.312 -1.065 -1.797 0.00 0.00 +0.067 C BRANCH 285 286 ATOM 286 CG TYR A 28 12.652 -0.650 -3.211 0.00 0.00 -0.045 A ATOM 287 CD2 TYR A 28 12.380 -1.493 -4.294 0.00 0.00 +0.007 A ATOM 288 CE2 TYR A 28 12.650 -1.083 -5.602 0.00 0.00 +0.045 A ATOM 289 CZ TYR A 28 13.221 0.166 -5.824 0.00 0.00 +0.117 A ATOM 290 CE1 TYR A 28 13.520 1.010 -4.763 0.00 0.00 +0.045 A ATOM 291 CD1 TYR A 28 13.234 0.605 -3.454 0.00 0.00 +0.007 A BRANCH 289 292 ATOM 292 OH TYR A 28 13.503 0.603 -7.081 0.00 0.00 -0.507 OA ATOM 293 HH TYR A 28 13.054 0.010 -7.713 0.00 0.00 +0.292 HD ENDBRANCH 289 292 ENDBRANCH 285 286 ENDBRANCH 54 285 BRANCH 16 294 ATOM 294 CB LYS A 10 -8.520 -5.039 2.038 0.00 0.00 +0.032 C BRANCH 294 295 ATOM 295 CG LYS A 10 -7.683 -6.283 1.721 0.00 0.00 +0.003 C BRANCH 295 296 ATOM 296 CD LYS A 10 -8.368 -7.596 2.123 0.00 0.00 +0.015 C BRANCH 296 297 ATOM 297 CE LYS A 10 -9.537 -8.027 1.237 0.00 0.00 +0.077 C BRANCH 297 298 ATOM 298 NZ LYS A 10 -9.121 -8.424 -0.107 0.00 0.00 -0.330 NA ATOM 299 HZ1 LYS A 10 -8.479 -9.220 -0.037 0.00 0.00 +0.118 HD ATOM 300 HZ2 LYS A 10 -8.577 -7.682 -0.542 0.00 0.00 +0.118 HD ENDBRANCH 297 298 ENDBRANCH 296 297 ENDBRANCH 295 296 ENDBRANCH 294 295 ENDBRANCH 16 294 BRANCH 11 301 ATOM 301 CB LYS A 9 -10.270 -4.575 -1.117 0.00 0.00 +0.032 C BRANCH 301 302 ATOM 302 CG LYS A 9 -10.302 -4.665 -2.648 0.00 0.00 +0.003 C BRANCH 302 303 ATOM 303 CD LYS A 9 -10.234 -6.100 -3.190 0.00 0.00 +0.015 C BRANCH 303 304 ATOM 304 CE LYS A 9 -11.496 -6.939 -2.987 0.00 0.00 +0.077 C BRANCH 304 305 ATOM 305 NZ LYS A 9 -11.739 -7.273 -1.588 0.00 0.00 -0.330 NA ATOM 306 HZ1 LYS A 9 -12.523 -7.926 -1.538 0.00 0.00 +0.118 HD ATOM 307 HZ2 LYS A 9 -10.936 -7.802 -1.220 0.00 0.00 +0.118 HD ENDBRANCH 304 305 ENDBRANCH 303 304 ENDBRANCH 302 303 ENDBRANCH 301 302 ENDBRANCH 11 301 TORSDOF 84