 |
| home | start a new run | job status | references&downloads | examples | help |
Should you encounter any unexpected behaviour,
|
*** RieskeMonomer ***elNémo ID: 2502081658053003366Job options:ID = 2502081658053003366 JOBID = RieskeMonomer USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER RieskeMonomer CRYST1 46.134 76.066 79.509 90.00 90.00 90.00 P 21 21 21 1 HETATM 1 S1 FES C 1 12.200 3.870 6.357 1.00 36.65 S HETATM 2 S2 FES C 1 15.301 3.239 7.905 1.00 50.80 S HETATM 3 FE1 FES C 1 14.410 3.667 5.927 1.00 42.35 Fe HETATM 4 FE2 FES C 1 13.109 3.439 8.374 1.00 34.51 Fe ATOM 5 N ARG A 52 -7.249 11.678 19.016 1.00 34.70 A N ATOM 6 CA ARG A 52 -7.558 11.392 20.415 1.00 33.92 A C ATOM 7 C ARG A 52 -8.280 10.070 20.592 1.00 33.09 A C ATOM 8 O ARG A 52 -9.285 9.804 19.938 1.00 33.02 A O ATOM 9 CB ARG A 52 -8.401 12.500 21.015 1.00 33.88 A C ATOM 10 CG ARG A 52 -7.616 13.675 21.494 1.00 35.95 A C ATOM 11 CD ARG A 52 -8.560 14.742 21.975 1.00 38.76 A C ATOM 12 NE ARG A 52 -8.497 14.862 23.422 1.00 49.46 A N ATOM 13 CZ ARG A 52 -9.463 14.477 24.244 1.00 49.89 A C ATOM 14 NH1 ARG A 52 -10.597 13.972 23.785 1.00 53.79 A N1+ ATOM 15 NH2 ARG A 52 -9.286 14.602 25.556 1.00 34.63 A N ATOM 16 N TYR A 53 -7.761 9.256 21.503 1.00 34.88 A N ATOM 17 CA TYR A 53 -8.256 7.909 21.756 1.00 33.97 A C ATOM 18 C TYR A 53 -7.659 7.432 23.075 1.00 29.35 A C ATOM 19 O TYR A 53 -6.731 8.040 23.605 1.00 31.21 A O ATOM 20 CB TYR A 53 -7.900 6.968 20.609 1.00 27.68 A C ATOM 21 CG TYR A 53 -6.439 6.986 20.211 1.00 28.78 A C ATOM 22 CD1 TYR A 53 -5.510 6.179 20.858 1.00 27.81 A C ATOM 23 CD2 TYR A 53 -5.996 7.788 19.161 1.00 30.19 A C ATOM 24 CE1 TYR A 53 -4.165 6.181 20.472 1.00 33.51 A C ATOM 25 CE2 TYR A 53 -4.662 7.796 18.768 1.00 27.51 A C ATOM 26 CZ TYR A 53 -3.757 6.991 19.425 1.00 26.37 A C ATOM 27 OH TYR A 53 -2.452 6.989 19.040 1.00 26.69 A O ATOM 28 N SER A 54 -8.191 6.335 23.595 1.00 28.62 A N ATOM 29 CA SER A 54 -7.820 5.859 24.920 1.00 33.33 A C ATOM 30 C SER A 54 -6.952 4.611 24.817 1.00 32.23 A C ATOM 31 O SER A 54 -7.122 3.799 23.906 1.00 39.69 A O ATOM 32 CB SER A 54 -9.068 5.556 25.750 1.00 33.09 A C ATOM 33 OG SER A 54 -8.728 4.981 26.997 1.00 32.14 A O ATOM 34 N ILE A 55 -6.010 4.454 25.749 1.00 28.23 A N ATOM 35 CA ILE A 55 -5.201 3.236 25.764 1.00 26.96 A C ATOM 36 C ILE A 55 -5.224 2.592 27.149 1.00 29.71 A C ATOM 37 O ILE A 55 -4.271 1.896 27.531 1.00 23.36 A O ATOM 38 CB ILE A 55 -3.755 3.502 25.296 1.00 24.61 A C ATOM 39 CG1 ILE A 55 -3.043 4.473 26.226 1.00 26.67 A C ATOM 40 CG2 ILE A 55 -3.727 4.053 23.868 1.00 25.56 A C ATOM 41 CD1 ILE A 55 -1.587 4.658 25.896 1.00 20.52 A C ATOM 42 N GLY A 56 -6.318 2.807 27.905 1.00 28.58 A N ATOM 43 CA GLY A 56 -6.531 2.113 29.166 1.00 28.94 A C ATOM 44 C GLY A 56 -5.865 2.780 30.352 1.00 28.22 A C ATOM 45 O GLY A 56 -5.393 3.916 30.289 1.00 30.57 A O ATOM 46 N PHE A 57 -5.863 2.046 31.490 1.00 28.48 A N ATOM 47 CA PHE A 57 -5.298 2.536 32.744 1.00 27.86 A C ATOM 48 C PHE A 57 -3.788 2.338 32.765 1.00 28.83 A C ATOM 49 O PHE A 57 -3.296 1.303 32.312 1.00 30.20 A O ATOM 50 CB PHE A 57 -5.892 1.805 33.950 1.00 30.37 A C ATOM 51 CG PHE A 57 -7.358 2.023 34.151 1.00 27.71 A C ATOM 52 CD1 PHE A 57 -7.832 3.170 34.765 1.00 28.15 A C ATOM 53 CD2 PHE A 57 -8.266 1.049 33.749 1.00 26.10 A C ATOM 54 CE1 PHE A 57 -9.196 3.341 34.962 1.00 36.65 A C ATOM 55 CE2 PHE A 57 -9.619 1.206 33.925 1.00 21.05 A C ATOM 56 CZ PHE A 57 -10.097 2.350 34.530 1.00 30.22 A C ATOM 57 N PRO A 58 -3.042 3.283 33.340 1.00 30.47 A N ATOM 58 CA PRO A 58 -1.583 3.131 33.402 1.00 34.61 A C ATOM 59 C PRO A 58 -1.125 1.829 34.044 1.00 37.26 A C ATOM 60 O PRO A 58 -0.056 1.315 33.676 1.00 31.83 A O ATOM 61 CB PRO A 58 -1.138 4.346 34.227 1.00 34.52 A C ATOM 62 CG PRO A 58 -2.281 5.310 34.215 1.00 25.01 A C ATOM 63 CD PRO A 58 -3.471 4.666 33.589 1.00 36.52 A C ATOM 64 N SER A 59 -1.898 1.272 34.984 1.00 33.99 A N ATOM 65 CA SER A 59 -1.485 0.033 35.639 1.00 34.80 A C ATOM 66 C SER A 59 -1.406 -1.144 34.666 1.00 42.07 A C ATOM 67 O SER A 59 -0.698 -2.123 34.944 1.00 44.23 A O ATOM 68 CB SER A 59 -2.429 -0.271 36.799 1.00 36.29 A C ATOM 69 OG SER A 59 -3.779 -0.036 36.446 1.00 36.63 A O ATOM 70 N GLN A 60 -2.062 -1.037 33.508 1.00 35.17 A N ATOM 71 CA GLN A 60 -2.123 -2.122 32.535 1.00 31.30 A C ATOM 72 C GLN A 60 -0.770 -2.395 31.878 1.00 40.22 A C ATOM 73 O GLN A 60 -0.609 -3.441 31.237 1.00 42.24 A O ATOM 74 CB GLN A 60 -3.180 -1.779 31.468 1.00 36.01 A C ATOM 75 CG GLN A 60 -4.641 -1.798 32.006 1.00 33.11 A C ATOM 76 CD GLN A 60 -5.682 -1.353 30.959 1.00 46.27 A C ATOM 77 NE2 GLN A 60 -5.240 -1.263 29.685 1.00 43.19 A N ATOM 78 OE1 GLN A 60 -6.860 -1.084 31.286 1.00 23.68 A O ATOM 79 N TYR A 61 0.208 -1.497 32.037 1.00 36.33 A N ATOM 80 CA TYR A 61 1.459 -1.537 31.291 1.00 25.81 A C ATOM 81 C TYR A 61 2.610 -1.875 32.221 1.00 31.68 A C ATOM 82 O TYR A 61 2.758 -1.268 33.281 1.00 36.42 A O ATOM 83 CB TYR A 61 1.695 -0.201 30.581 1.00 23.32 A C ATOM 84 CG TYR A 61 0.591 0.049 29.574 1.00 27.71 A C ATOM 85 CD1 TYR A 61 0.589 -0.592 28.334 1.00 25.13 A C ATOM 86 CD2 TYR A 61 -0.472 0.869 29.882 1.00 25.04 A C ATOM 87 CE1 TYR A 61 -0.430 -0.404 27.431 1.00 22.37 A C ATOM 88 CE2 TYR A 61 -1.479 1.074 28.994 1.00 27.81 A C ATOM 89 CZ TYR A 61 -1.466 0.435 27.766 1.00 26.51 A C ATOM 90 OH TYR A 61 -2.516 0.641 26.895 1.00 23.72 A O ATOM 91 N ALA A 62 3.402 -2.865 31.834 1.00 36.42 A N ATOM 92 CA ALA A 62 4.616 -3.194 32.551 1.00 31.87 A C ATOM 93 C ALA A 62 5.718 -2.203 32.194 1.00 31.12 A C ATOM 94 O ALA A 62 5.591 -1.395 31.271 1.00 31.27 A O ATOM 95 CB ALA A 62 5.056 -4.617 32.228 1.00 29.58 A C ATOM 96 N SER A 63 6.809 -2.248 32.953 1.00 30.97 A N ATOM 97 CA SER A 63 7.990 -1.508 32.533 1.00 31.94 A C ATOM 98 C SER A 63 8.485 -2.084 31.219 1.00 28.41 A C ATOM 99 O SER A 63 8.302 -3.271 30.929 1.00 28.35 A O ATOM 100 CB SER A 63 9.104 -1.551 33.592 1.00 25.06 A C ATOM 101 OG SER A 63 9.967 -2.649 33.378 1.00 24.48 A O ATOM 102 N GLY A 64 9.094 -1.218 30.409 1.00 32.71 A N ATOM 103 CA GLY A 64 9.505 -1.582 29.069 1.00 26.15 A C ATOM 104 C GLY A 64 8.480 -1.188 28.015 1.00 25.41 A C ATOM 105 O GLY A 64 7.727 -0.216 28.182 1.00 24.19 A O ATOM 106 N VAL A 65 8.426 -1.959 26.933 1.00 24.14 A N ATOM 107 CA VAL A 65 7.693 -1.604 25.724 1.00 21.90 A C ATOM 108 C VAL A 65 6.465 -2.495 25.617 1.00 23.91 A C ATOM 109 O VAL A 65 6.592 -3.723 25.523 1.00 27.02 A O ATOM 110 CB VAL A 65 8.578 -1.771 24.482 1.00 27.47 A C ATOM 111 CG1 VAL A 65 7.751 -1.554 23.196 1.00 23.59 A C ATOM 112 CG2 VAL A 65 9.829 -0.867 24.591 1.00 23.09 A C ATOM 113 N SER A 66 5.280 -1.890 25.611 1.00 19.33 A N ATOM 114 CA SER A 66 4.063 -2.605 25.263 1.00 22.20 A C ATOM 115 C SER A 66 3.748 -2.395 23.789 1.00 22.20 A C ATOM 116 O SER A 66 3.842 -1.272 23.282 1.00 18.24 A O ATOM 117 CB SER A 66 2.869 -2.156 26.099 1.00 23.00 A C ATOM 118 OG SER A 66 1.681 -2.666 25.508 1.00 23.93 A O ATOM 119 N GLU A 67 3.374 -3.482 23.113 1.00 24.72 A N ATOM 120 CA GLU A 67 2.878 -3.457 21.740 1.00 25.99 A C ATOM 121 C GLU A 67 1.374 -3.685 21.668 1.00 24.94 A C ATOM 122 O GLU A 67 0.864 -4.112 20.629 1.00 25.07 A O ATOM 123 CB GLU A 67 3.608 -4.505 20.908 1.00 24.33 A C ATOM 124 CG GLU A 67 5.112 -4.248 20.839 1.00 24.85 A C ATOM 125 CD GLU A 67 5.727 -4.978 19.690 1.00 27.13 A C ATOM 126 OE1 GLU A 67 6.094 -6.154 19.874 1.00 31.95 A O ATOM 127 OE2 GLU A 67 5.810 -4.391 18.595 1.00 29.13 A O1- ATOM 128 N LYS A 68 0.653 -3.419 22.763 1.00 27.95 A N ATOM 129 CA LYS A 68 -0.789 -3.643 22.768 1.00 25.97 A C ATOM 130 C LYS A 68 -1.459 -2.982 21.579 1.00 23.04 A C ATOM 131 O LYS A 68 -2.323 -3.583 20.929 1.00 32.32 A O ATOM 132 CB LYS A 68 -1.403 -3.120 24.063 1.00 22.45 A C ATOM 133 CG LYS A 68 -2.718 -3.763 24.421 1.00 27.53 A C ATOM 134 CD LYS A 68 -3.018 -3.605 25.918 1.00 28.74 A C ATOM 135 CE LYS A 68 -4.473 -3.204 26.119 1.00 29.40 A C ATOM 136 NZ LYS A 68 -5.383 -4.373 26.107 1.00 28.52 A N1+ ATOM 137 N PHE A 69 -1.075 -1.750 21.273 1.00 21.39 A N ATOM 138 CA PHE A 69 -1.810 -0.937 20.314 1.00 21.14 A C ATOM 139 C PHE A 69 -0.970 -0.607 19.093 1.00 20.77 A C ATOM 140 O PHE A 69 -1.237 0.388 18.410 1.00 22.95 A O ATOM 141 CB PHE A 69 -2.302 0.354 20.978 1.00 23.74 A C ATOM 142 CG PHE A 69 -3.335 0.140 22.056 1.00 24.48 A C ATOM 143 CD1 PHE A 69 -4.693 0.153 21.756 1.00 22.71 A C ATOM 144 CD2 PHE A 69 -2.947 -0.074 23.371 1.00 23.03 A C ATOM 145 CE1 PHE A 69 -5.644 -0.028 22.738 1.00 21.56 A C ATOM 146 CE2 PHE A 69 -3.907 -0.266 24.361 1.00 25.03 A C ATOM 147 CZ PHE A 69 -5.261 -0.245 24.040 1.00 19.91 A C ATOM 148 N LYS A 70 0.064 -1.397 18.814 1.00 21.84 A N ATOM 149 CA LYS A 70 0.863 -1.110 17.633 1.00 21.14 A C ATOM 150 C LYS A 70 0.045 -1.343 16.371 1.00 19.15 A C ATOM 151 O LYS A 70 -0.070 -0.452 15.527 1.00 18.86 A O ATOM 152 CB LYS A 70 2.127 -1.953 17.612 1.00 19.91 A C ATOM 153 CG LYS A 70 2.958 -1.620 16.392 1.00 25.44 A C ATOM 154 CD LYS A 70 3.948 -2.687 16.047 1.00 23.66 A C ATOM 155 CE LYS A 70 4.554 -2.380 14.707 1.00 22.50 A C ATOM 156 NZ LYS A 70 5.389 -3.506 14.250 1.00 35.80 A N1+ ATOM 157 N LYS A 71 -0.586 -2.513 16.255 1.00 20.96 A N ATOM 158 CA LYS A 71 -1.454 -2.777 15.105 1.00 24.66 A C ATOM 159 C LYS A 71 -2.584 -1.756 15.010 1.00 20.12 A C ATOM 160 O LYS A 71 -2.809 -1.157 13.953 1.00 17.53 A O ATOM 161 CB LYS A 71 -2.009 -4.204 15.182 1.00 19.68 A C ATOM 162 CG LYS A 71 -0.903 -5.243 14.946 1.00 36.96 A C ATOM 163 CD LYS A 71 -1.402 -6.528 14.286 1.00 47.20 A C ATOM 164 CE LYS A 71 -0.401 -7.678 14.486 1.00 47.94 A C ATOM 165 NZ LYS A 71 -0.992 -9.014 14.154 1.00 43.39 A N1+ ATOM 166 N GLN A 72 -3.266 -1.507 16.126 1.00 20.58 A N ATOM 167 CA GLN A 72 -4.464 -0.680 16.119 1.00 22.54 A C ATOM 168 C GLN A 72 -4.145 0.799 15.916 1.00 20.92 A C ATOM 169 O GLN A 72 -4.801 1.475 15.119 1.00 19.04 A O ATOM 170 CB GLN A 72 -5.216 -0.907 17.428 1.00 25.64 A C ATOM 171 CG GLN A 72 -6.462 -0.103 17.612 1.00 23.69 A C ATOM 172 CD GLN A 72 -7.265 -0.663 18.763 1.00 34.94 A C ATOM 173 NE2 GLN A 72 -7.689 0.198 19.694 1.00 29.51 A N ATOM 174 OE1 GLN A 72 -7.472 -1.874 18.832 1.00 44.61 A O ATOM 175 N PHE A 73 -3.147 1.325 16.638 1.00 23.86 A N ATOM 176 CA PHE A 73 -2.843 2.757 16.630 1.00 24.15 A C ATOM 177 C PHE A 73 -1.427 3.111 16.157 1.00 22.34 A C ATOM 178 O PHE A 73 -1.045 4.288 16.233 1.00 22.89 A O ATOM 179 CB PHE A 73 -3.044 3.353 18.024 1.00 23.75 A C ATOM 180 CG PHE A 73 -4.462 3.441 18.447 1.00 30.58 A C ATOM 181 CD1 PHE A 73 -5.410 4.037 17.625 1.00 31.46 A C ATOM 182 CD2 PHE A 73 -4.854 2.962 19.689 1.00 26.19 A C ATOM 183 CE1 PHE A 73 -6.725 4.124 18.031 1.00 27.94 A C ATOM 184 CE2 PHE A 73 -6.147 3.056 20.090 1.00 26.00 A C ATOM 185 CZ PHE A 73 -7.087 3.635 19.262 1.00 29.16 A C ATOM 186 N ARG A 74 -0.638 2.151 15.683 1.00 18.16 A N ATOM 187 CA ARG A 74 0.726 2.426 15.214 1.00 23.90 A C ATOM 188 C ARG A 74 1.561 3.140 16.286 1.00 23.27 A C ATOM 189 O ARG A 74 2.251 4.126 16.018 1.00 17.81 A O ATOM 190 CB ARG A 74 0.706 3.230 13.912 1.00 22.92 A C ATOM 191 CG ARG A 74 1.928 2.960 13.036 1.00 26.11 A C ATOM 192 CD ARG A 74 1.661 3.265 11.596 1.00 22.98 A C ATOM 193 NE ARG A 74 2.877 3.413 10.817 1.00 26.92 A N ATOM 194 CZ ARG A 74 3.075 4.327 9.875 1.00 29.20 A C ATOM 195 NH1 ARG A 74 2.178 5.261 9.616 1.00 30.68 A N1+ ATOM 196 NH2 ARG A 74 4.190 4.282 9.153 1.00 26.03 A N ATOM 197 N ILE A 75 1.471 2.644 17.526 1.00 21.60 A N ATOM 198 CA ILE A 75 2.148 3.265 18.658 1.00 19.29 A C ATOM 199 C ILE A 75 2.782 2.189 19.520 1.00 20.61 A C ATOM 200 O ILE A 75 2.285 1.064 19.616 1.00 23.50 A O ATOM 201 CB ILE A 75 1.205 4.126 19.510 1.00 18.87 A C ATOM 202 CG1 ILE A 75 0.006 3.281 19.972 1.00 26.45 A C ATOM 203 CG2 ILE A 75 0.772 5.372 18.750 1.00 19.30 A C ATOM 204 CD1 ILE A 75 -0.969 3.986 20.933 1.00 19.87 A C ATOM 205 N TRP A 76 3.904 2.536 20.133 1.00 20.00 A N ATOM 206 CA TRP A 76 4.438 1.778 21.244 1.00 21.39 A C ATOM 207 C TRP A 76 4.152 2.569 22.512 1.00 21.89 A C ATOM 208 O TRP A 76 4.331 3.790 22.523 1.00 25.05 A O ATOM 209 CB TRP A 76 5.933 1.532 21.071 1.00 20.92 A C ATOM 210 CG TRP A 76 6.224 0.550 19.997 1.00 19.51 A C ATOM 211 CD1 TRP A 76 5.915 -0.774 20.002 1.00 19.55 A C ATOM 212 CD2 TRP A 76 6.866 0.814 18.741 1.00 18.17 A C ATOM 213 CE2 TRP A 76 6.931 -0.408 18.045 1.00 18.96 A C ATOM 214 CE3 TRP A 76 7.403 1.963 18.148 1.00 18.71 A C ATOM 215 NE1 TRP A 76 6.338 -1.358 18.834 1.00 20.68 A N ATOM 216 CZ2 TRP A 76 7.508 -0.521 16.769 1.00 26.53 A C ATOM 217 CZ3 TRP A 76 7.998 1.852 16.897 1.00 26.06 A C ATOM 218 CH2 TRP A 76 8.027 0.618 16.207 1.00 26.71 A C ATOM 219 N ILE A 77 3.655 1.888 23.545 1.00 18.58 A N ATOM 220 CA ILE A 77 3.446 2.466 24.869 1.00 19.12 A C ATOM 221 C ILE A 77 4.587 1.978 25.749 1.00 22.75 A C ATOM 222 O ILE A 77 4.774 0.764 25.901 1.00 24.47 A O ATOM 223 CB ILE A 77 2.076 2.068 25.451 1.00 22.31 A C ATOM 224 CG1 ILE A 77 0.926 2.621 24.593 1.00 22.33 A C ATOM 225 CG2 ILE A 77 1.914 2.534 26.925 1.00 20.36 A C ATOM 226 CD1 ILE A 77 0.361 1.661 23.548 1.00 22.83 A C ATOM 227 N VAL A 78 5.362 2.915 26.313 1.00 24.53 A N ATOM 228 CA VAL A 78 6.656 2.633 26.935 1.00 22.49 A C ATOM 229 C VAL A 78 6.669 3.189 28.351 1.00 27.34 A C ATOM 230 O VAL A 78 6.263 4.336 28.578 1.00 26.95 A O ATOM 231 CB VAL A 78 7.823 3.224 26.121 1.00 26.76 A C ATOM 232 CG1 VAL A 78 9.180 2.913 26.792 1.00 25.69 A C ATOM 233 CG2 VAL A 78 7.804 2.674 24.721 1.00 26.19 A C ATOM 234 N LYS A 79 7.139 2.377 29.298 1.00 27.07 A N ATOM 235 CA LYS A 79 7.278 2.782 30.691 1.00 29.08 A C ATOM 236 C LYS A 79 8.748 2.684 31.085 1.00 33.21 A C ATOM 237 O LYS A 79 9.352 1.609 30.977 1.00 26.12 A O ATOM 238 CB LYS A 79 6.409 1.919 31.614 1.00 28.89 A C ATOM 239 CG LYS A 79 6.050 2.648 32.914 1.00 39.56 A C ATOM 240 CD LYS A 79 5.620 1.718 34.055 1.00 41.24 A C ATOM 241 CE LYS A 79 4.235 1.150 33.826 1.00 42.53 A C ATOM 242 NZ LYS A 79 3.319 1.350 34.986 1.00 44.49 A N1+ ATOM 243 N GLU A 80 9.331 3.812 31.503 1.00 36.02 A N ATOM 244 CA GLU A 80 10.686 3.832 32.044 1.00 38.92 A C ATOM 245 C GLU A 80 10.689 4.681 33.307 1.00 40.73 A C ATOM 246 O GLU A 80 10.155 5.796 33.310 1.00 40.76 A O ATOM 247 CB GLU A 80 11.709 4.344 31.015 1.00 42.45 A C ATOM 248 CG GLU A 80 11.681 5.824 30.693 1.00 41.31 A C ATOM 249 CD GLU A 80 12.989 6.292 30.045 1.00 50.66 A C ATOM 250 OE1 GLU A 80 13.184 6.045 28.835 1.00 51.17 A O ATOM 251 OE2 GLU A 80 13.838 6.889 30.752 1.00 52.59 A O1- ATOM 252 N ASP A 81 11.249 4.129 34.380 1.00 42.88 A N ATOM 253 CA ASP A 81 11.214 4.722 35.737 1.00 40.79 A C ATOM 254 C ASP A 81 9.738 4.987 36.062 1.00 44.82 A C ATOM 255 O ASP A 81 8.878 4.202 35.635 1.00 40.67 A O ATOM 256 CB ASP A 81 12.130 5.914 35.795 1.00 42.68 A C ATOM 257 CG ASP A 81 13.517 5.607 35.233 1.00 49.71 A C ATOM 258 OD1 ASP A 81 14.051 4.510 35.499 1.00 50.82 A O ATOM 259 OD2 ASP A 81 14.074 6.465 34.510 1.00 53.46 A O1- ATOM 260 N ASP A 82 9.391 6.071 36.772 1.00 47.22 A N ATOM 261 CA ASP A 82 7.984 6.319 37.091 1.00 41.14 A C ATOM 262 C ASP A 82 7.220 7.005 35.965 1.00 44.65 A C ATOM 263 O ASP A 82 6.096 7.473 36.207 1.00 40.87 A O ATOM 264 CB ASP A 82 7.836 7.150 38.368 1.00 46.94 A C ATOM 265 CG ASP A 82 7.284 6.330 39.543 1.00 62.05 A C ATOM 266 OD1 ASP A 82 7.456 5.089 39.541 1.00 61.08 A O ATOM 267 OD2 ASP A 82 6.618 6.916 40.438 1.00 63.79 A O1- ATOM 268 N THR A 83 7.781 7.066 34.757 1.00 36.49 A N ATOM 269 CA THR A 83 7.159 7.771 33.647 1.00 38.85 A C ATOM 270 C THR A 83 6.608 6.804 32.600 1.00 35.94 A C ATOM 271 O THR A 83 7.021 5.643 32.495 1.00 31.95 A O ATOM 272 CB THR A 83 8.156 8.755 33.011 1.00 46.41 A C ATOM 273 CG2 THR A 83 8.750 9.659 34.096 1.00 44.62 A C ATOM 274 OG1 THR A 83 9.214 8.040 32.342 1.00 44.02 A O ATOM 275 N LEU A 84 5.640 7.305 31.835 1.00 35.29 A N ATOM 276 CA LEU A 84 5.050 6.583 30.715 1.00 30.04 A C ATOM 277 C LEU A 84 4.911 7.547 29.541 1.00 29.51 A C ATOM 278 O LEU A 84 4.419 8.665 29.720 1.00 30.01 A O ATOM 279 CB LEU A 84 3.686 5.999 31.115 1.00 31.42 A C ATOM 280 CG LEU A 84 2.889 5.136 30.128 1.00 35.96 A C ATOM 281 CD1 LEU A 84 2.047 4.113 30.884 1.00 28.08 A C ATOM 282 CD2 LEU A 84 2.024 5.985 29.194 1.00 30.72 A C ATOM 283 N TYR A 85 5.330 7.124 28.345 1.00 24.40 A N ATOM 284 CA TYR A 85 5.139 7.941 27.155 1.00 30.30 A C ATOM 285 C TYR A 85 4.700 7.059 25.985 1.00 29.89 A C ATOM 286 O TYR A 85 4.732 5.824 26.057 1.00 25.47 A O ATOM 287 CB TYR A 85 6.412 8.736 26.804 1.00 29.65 A C ATOM 288 CG TYR A 85 7.684 7.926 26.844 1.00 28.15 A C ATOM 289 CD1 TYR A 85 8.105 7.194 25.743 1.00 24.07 A C ATOM 290 CD2 TYR A 85 8.473 7.901 27.993 1.00 31.24 A C ATOM 291 CE1 TYR A 85 9.272 6.447 25.791 1.00 27.13 A C ATOM 292 CE2 TYR A 85 9.628 7.166 28.053 1.00 22.46 A C ATOM 293 CZ TYR A 85 10.025 6.439 26.959 1.00 32.62 A C ATOM 294 OH TYR A 85 11.187 5.705 27.040 1.00 37.54 A O ATOM 295 N VAL A 86 4.288 7.698 24.887 1.00 24.66 A N ATOM 296 CA VAL A 86 3.831 6.975 23.705 1.00 27.37 A C ATOM 297 C VAL A 86 4.644 7.407 22.491 1.00 28.46 A C ATOM 298 O VAL A 86 4.699 8.602 22.169 1.00 30.00 A O ATOM 299 CB VAL A 86 2.329 7.183 23.456 1.00 21.56 A C ATOM 300 CG1 VAL A 86 1.890 6.343 22.287 1.00 19.44 A C ATOM 301 CG2 VAL A 86 1.544 6.792 24.703 1.00 20.99 A C ATOM 302 N ILE A 87 5.236 6.422 21.798 1.00 22.90 A N ATOM 303 CA ILE A 87 6.079 6.639 20.626 1.00 23.37 A C ATOM 304 C ILE A 87 5.293 6.263 19.369 1.00 26.32 A C ATOM 305 O ILE A 87 4.791 5.139 19.259 1.00 27.86 A O ATOM 306 CB ILE A 87 7.368 5.801 20.721 1.00 27.14 A C ATOM 307 CG1 ILE A 87 7.996 5.872 22.113 1.00 23.24 A C ATOM 308 CG2 ILE A 87 8.405 6.238 19.672 1.00 28.57 A C ATOM 309 CD1 ILE A 87 9.153 4.885 22.244 1.00 25.55 A C ATOM 310 N GLU A 88 5.189 7.191 18.418 1.00 30.18 A N ATOM 311 CA GLU A 88 4.693 6.863 17.081 1.00 26.36 A C ATOM 312 C GLU A 88 5.572 5.802 16.439 1.00 23.02 A C ATOM 313 O GLU A 88 6.795 5.923 16.436 1.00 27.36 A O ATOM 314 CB GLU A 88 4.682 8.125 16.214 1.00 27.09 A C ATOM 315 CG GLU A 88 4.148 7.946 14.816 1.00 27.65 A C ATOM 316 CD GLU A 88 4.219 9.223 13.995 1.00 34.33 A C ATOM 317 OE1 GLU A 88 5.047 10.104 14.331 1.00 31.27 A O ATOM 318 OE2 GLU A 88 3.432 9.356 13.023 1.00 39.70 A O1- ATOM 319 N ALA A 89 4.957 4.754 15.894 1.00 24.81 A N ATOM 320 CA ALA A 89 5.710 3.670 15.247 1.00 22.87 A C ATOM 321 C ALA A 89 5.912 3.961 13.759 1.00 26.71 A C ATOM 322 O ALA A 89 5.597 3.157 12.880 1.00 24.16 A O ATOM 323 CB ALA A 89 5.016 2.325 15.452 1.00 21.92 A C ATOM 324 N LYS A 90 6.494 5.129 13.497 1.00 28.71 A N ATOM 325 CA LYS A 90 6.766 5.600 12.145 1.00 30.84 A C ATOM 326 C LYS A 90 8.225 6.020 12.060 1.00 30.03 A C ATOM 327 O LYS A 90 8.659 6.920 12.791 1.00 30.77 A O ATOM 328 CB LYS A 90 5.842 6.767 11.784 1.00 31.09 A C ATOM 329 CG LYS A 90 5.916 7.176 10.348 1.00 30.20 A C ATOM 330 CD LYS A 90 5.448 8.606 10.188 1.00 31.05 A C ATOM 331 CE LYS A 90 3.992 8.663 9.775 1.00 33.37 A C ATOM 332 NZ LYS A 90 3.263 9.858 10.317 1.00 38.75 A N1+ ATOM 333 N CYS A 91 8.973 5.386 11.158 1.00 34.05 A N ATOM 334 CA CYS A 91 10.405 5.638 11.069 1.00 34.13 A C ATOM 335 C CYS A 91 10.676 7.044 10.546 1.00 37.26 A C ATOM 336 O CYS A 91 10.093 7.471 9.541 1.00 35.43 A O ATOM 337 CB CYS A 91 11.075 4.608 10.172 1.00 32.58 A C ATOM 338 SG CYS A 91 12.871 4.858 10.106 1.00 33.06 A S ATOM 339 N THR A 92 11.563 7.768 11.234 1.00 38.50 A N ATOM 340 CA THR A 92 11.842 9.149 10.866 1.00 38.39 A C ATOM 341 C THR A 92 12.785 9.257 9.680 1.00 35.83 A C ATOM 342 O THR A 92 13.207 10.374 9.350 1.00 34.51 A O ATOM 343 CB THR A 92 12.427 9.920 12.046 1.00 41.96 A C ATOM 344 CG2 THR A 92 11.405 10.040 13.158 1.00 31.09 A C ATOM 345 OG1 THR A 92 13.601 9.247 12.524 1.00 40.36 A O ATOM 346 N HIS A 93 13.149 8.130 9.064 1.00 32.36 A N ATOM 347 CA HIS A 93 13.874 8.163 7.805 1.00 33.74 A C ATOM 348 C HIS A 93 12.957 8.429 6.616 1.00 32.04 A C ATOM 349 O HIS A 93 12.835 9.575 6.167 1.00 29.66 A O ATOM 350 CB HIS A 93 14.564 6.820 7.596 1.00 34.88 A C ATOM 351 CG HIS A 93 15.295 6.719 6.302 1.00 34.81 A C ATOM 352 CD2 HIS A 93 16.141 7.580 5.685 1.00 33.97 A C ATOM 353 ND1 HIS A 93 15.226 5.603 5.498 1.00 36.02 A N ATOM 354 CE1 HIS A 93 15.986 5.787 4.430 1.00 39.18 A C ATOM 355 NE2 HIS A 93 16.555 6.977 4.521 1.00 31.93 A N ATOM 356 N LEU A 94 12.202 7.400 6.200 1.00 33.22 A N ATOM 357 CA LEU A 94 11.278 7.491 5.070 1.00 35.69 A C ATOM 358 C LEU A 94 9.909 6.895 5.398 1.00 35.96 A C ATOM 359 O LEU A 94 9.212 6.428 4.486 1.00 33.24 A O ATOM 360 CB LEU A 94 11.840 6.805 3.819 1.00 34.08 A C ATOM 361 CG LEU A 94 13.104 7.350 3.163 1.00 34.96 A C ATOM 362 CD1 LEU A 94 13.319 6.649 1.840 1.00 32.52 A C ATOM 363 CD2 LEU A 94 12.991 8.863 2.984 1.00 34.15 A C ATOM 364 N GLY A 95 9.525 6.865 6.673 1.00 27.46 A N ATOM 365 CA GLY A 95 8.145 6.637 7.034 1.00 32.07 A C ATOM 366 C GLY A 95 7.680 5.201 7.141 1.00 32.17 A C ATOM 367 O GLY A 95 6.466 4.982 7.242 1.00 30.26 A O ATOM 368 N CYS A 96 8.585 4.217 7.099 1.00 31.10 A N ATOM 369 CA CYS A 96 8.179 2.833 7.314 1.00 27.10 A C ATOM 370 C CYS A 96 7.861 2.594 8.779 1.00 29.08 A C ATOM 371 O CYS A 96 8.045 3.453 9.641 1.00 29.69 A O ATOM 372 CB CYS A 96 9.257 1.846 6.873 1.00 30.65 A C ATOM 373 SG CYS A 96 9.389 1.597 5.093 1.00 36.93 A S ATOM 374 N THR A 97 7.383 1.398 9.060 1.00 27.27 A N ATOM 375 CA THR A 97 6.931 1.095 10.402 1.00 27.33 A C ATOM 376 C THR A 97 7.865 0.066 11.008 1.00 34.84 A C ATOM 377 O THR A 97 7.892 -1.085 10.539 1.00 35.46 A O ATOM 378 CB THR A 97 5.489 0.589 10.370 1.00 28.68 A C ATOM 379 CG2 THR A 97 4.971 0.318 11.783 1.00 22.10 A C ATOM 380 OG1 THR A 97 4.667 1.590 9.749 1.00 25.93 A O ATOM 381 N PRO A 98 8.650 0.418 12.025 1.00 34.79 A N ATOM 382 CA PRO A 98 9.687 -0.489 12.514 1.00 35.82 A C ATOM 383 C PRO A 98 9.059 -1.602 13.351 1.00 36.05 A C ATOM 384 O PRO A 98 7.841 -1.667 13.551 1.00 29.96 A O ATOM 385 CB PRO A 98 10.600 0.430 13.347 1.00 35.46 A C ATOM 386 CG PRO A 98 10.135 1.863 13.041 1.00 30.94 A C ATOM 387 CD PRO A 98 8.680 1.700 12.752 1.00 28.75 A C ATOM 388 N ASN A 99 9.920 -2.509 13.809 1.00 38.19 A N ATOM 389 CA ASN A 99 9.524 -3.627 14.647 1.00 36.82 A C ATOM 390 C ASN A 99 10.302 -3.587 15.955 1.00 37.26 A C ATOM 391 O ASN A 99 11.376 -2.986 16.050 1.00 39.42 A O ATOM 392 CB ASN A 99 9.744 -4.981 13.952 1.00 33.36 A C ATOM 393 CG ASN A 99 9.098 -5.048 12.573 1.00 41.05 A C ATOM 394 ND2 ASN A 99 7.775 -5.146 12.549 1.00 39.87 A N ATOM 395 OD1 ASN A 99 9.776 -4.992 11.544 1.00 40.72 A O ATOM 396 N TRP A 100 9.736 -4.224 16.962 1.00 35.02 A N ATOM 397 CA TRP A 100 10.310 -4.274 18.292 1.00 33.43 A C ATOM 398 C TRP A 100 10.950 -5.645 18.476 1.00 37.22 A C ATOM 399 O TRP A 100 10.250 -6.660 18.458 1.00 36.35 A O ATOM 400 CB TRP A 100 9.219 -4.006 19.328 1.00 31.15 A C ATOM 401 CG TRP A 100 9.607 -4.299 20.748 1.00 28.92 A C ATOM 402 CD1 TRP A 100 8.982 -5.150 21.602 1.00 30.19 A C ATOM 403 CD2 TRP A 100 10.697 -3.736 21.470 1.00 27.57 A C ATOM 404 CE2 TRP A 100 10.673 -4.295 22.763 1.00 37.25 A C ATOM 405 CE3 TRP A 100 11.698 -2.816 21.151 1.00 30.76 A C ATOM 406 NE1 TRP A 100 9.606 -5.152 22.816 1.00 32.12 A N ATOM 407 CZ2 TRP A 100 11.618 -3.961 23.748 1.00 30.53 A C ATOM 408 CZ3 TRP A 100 12.635 -2.492 22.122 1.00 33.22 A C ATOM 409 CH2 TRP A 100 12.578 -3.056 23.409 1.00 29.91 A C ATOM 410 N LEU A 101 12.285 -5.683 18.619 1.00 44.49 A N ATOM 411 CA LEU A 101 12.998 -6.905 19.004 1.00 44.99 A C ATOM 412 C LEU A 101 13.338 -6.774 20.479 1.00 35.66 A C ATOM 413 O LEU A 101 14.261 -6.041 20.845 1.00 31.82 A O ATOM 414 CB LEU A 101 14.289 -7.133 18.223 1.00 43.54 A C ATOM 415 CG LEU A 101 14.517 -7.155 16.727 1.00 51.75 A C ATOM 416 CD1 LEU A 101 15.670 -6.189 16.475 1.00 52.96 A C ATOM 417 CD2 LEU A 101 14.853 -8.566 16.251 1.00 53.54 A C ATOM 418 N ALA A 102 12.615 -7.505 21.325 1.00 37.33 A N ATOM 419 CA ALA A 102 12.909 -7.448 22.752 1.00 37.31 A C ATOM 420 C ALA A 102 14.352 -7.856 23.016 1.00 39.64 A C ATOM 421 O ALA A 102 15.091 -7.150 23.709 1.00 35.65 A O ATOM 422 CB ALA A 102 11.941 -8.342 23.522 1.00 35.51 A C ATOM 423 N SER A 103 14.790 -8.956 22.398 1.00 40.07 A N ATOM 424 CA SER A 103 16.116 -9.495 22.675 1.00 33.05 A C ATOM 425 C SER A 103 17.208 -8.483 22.359 1.00 31.76 A C ATOM 426 O SER A 103 18.129 -8.283 23.162 1.00 41.26 A O ATOM 427 CB SER A 103 16.326 -10.797 21.897 1.00 34.17 A C ATOM 428 OG SER A 103 15.731 -10.744 20.605 1.00 41.17 A O ATOM 429 N GLU A 104 17.108 -7.807 21.224 1.00 33.44 A N ATOM 430 CA GLU A 104 18.133 -6.840 20.861 1.00 31.72 A C ATOM 431 C GLU A 104 17.941 -5.492 21.538 1.00 27.46 A C ATOM 432 O GLU A 104 18.751 -4.588 21.311 1.00 27.32 A O ATOM 433 CB GLU A 104 18.152 -6.642 19.350 1.00 34.15 A C ATOM 434 CG GLU A 104 18.404 -7.903 18.557 1.00 40.39 A C ATOM 435 CD GLU A 104 18.655 -7.624 17.073 1.00 45.98 A C ATOM 436 OE1 GLU A 104 18.609 -8.594 16.282 1.00 43.85 A O ATOM 437 OE2 GLU A 104 18.886 -6.447 16.700 1.00 50.06 A O1- ATOM 438 N GLY A 105 16.871 -5.317 22.307 1.00 31.92 A N ATOM 439 CA GLY A 105 16.600 -4.032 22.938 1.00 25.98 A C ATOM 440 C GLY A 105 16.511 -2.853 21.989 1.00 32.07 A C ATOM 441 O GLY A 105 17.017 -1.772 22.314 1.00 29.27 A O ATOM 442 N LYS A 106 15.875 -3.020 20.822 1.00 34.21 A N ATOM 443 CA LYS A 106 15.737 -1.865 19.934 1.00 35.34 A C ATOM 444 C LYS A 106 14.554 -2.000 18.970 1.00 33.85 A C ATOM 445 O LYS A 106 14.063 -3.102 18.683 1.00 34.15 A O ATOM 446 CB LYS A 106 17.043 -1.598 19.163 1.00 33.60 A C ATOM 447 CG LYS A 106 17.199 -2.313 17.834 1.00 35.53 A C ATOM 448 CD LYS A 106 18.648 -2.304 17.370 1.00 34.69 A C ATOM 449 CE LYS A 106 19.400 -3.529 17.874 1.00 49.25 A C ATOM 450 NZ LYS A 106 20.790 -3.708 17.298 1.00 48.66 A N1+ ATOM 451 N PHE A 107 14.088 -0.840 18.510 1.00 33.36 A N ATOM 452 CA PHE A 107 13.200 -0.726 17.356 1.00 33.47 A C ATOM 453 C PHE A 107 14.045 -0.644 16.088 1.00 36.84 A C ATOM 454 O PHE A 107 14.789 0.326 15.901 1.00 37.25 A O ATOM 455 CB PHE A 107 12.345 0.532 17.472 1.00 33.83 A C ATOM 456 CG PHE A 107 11.446 0.566 18.679 1.00 35.43 A C ATOM 457 CD1 PHE A 107 10.402 -0.343 18.823 1.00 24.82 A C ATOM 458 CD2 PHE A 107 11.663 1.505 19.682 1.00 33.90 A C ATOM 459 CE1 PHE A 107 9.595 -0.309 19.933 1.00 26.00 A C ATOM 460 CE2 PHE A 107 10.834 1.556 20.788 1.00 32.35 A C ATOM 461 CZ PHE A 107 9.795 0.650 20.911 1.00 27.20 A C ATOM 462 N LYS A 108 13.926 -1.641 15.213 1.00 38.22 A N ATOM 463 CA LYS A 108 14.640 -1.646 13.940 1.00 42.35 A C ATOM 464 C LYS A 108 13.669 -1.541 12.768 1.00 38.07 A C ATOM 465 O LYS A 108 12.736 -2.343 12.652 1.00 42.09 A O ATOM 466 CB LYS A 108 15.479 -2.912 13.776 1.00 49.38 A C ATOM 467 CG LYS A 108 14.684 -4.199 13.950 1.00 51.09 A C ATOM 468 CD LYS A 108 15.083 -5.230 12.908 1.00 49.82 A C ATOM 469 CE LYS A 108 14.337 -5.055 11.556 1.00 51.53 A C ATOM 470 NZ LYS A 108 12.828 -4.928 11.600 1.00 45.53 A N1+ ATOM 471 N CYS A 109 13.916 -0.577 11.885 1.00 37.49 A N ATOM 472 CA CYS A 109 13.116 -0.392 10.674 1.00 38.04 A C ATOM 473 C CYS A 109 13.516 -1.396 9.591 1.00 38.89 A C ATOM 474 O CYS A 109 14.707 -1.539 9.300 1.00 41.42 A O ATOM 475 CB CYS A 109 13.291 1.022 10.155 1.00 38.55 A C ATOM 476 SG CYS A 109 12.378 1.299 8.655 1.00 28.33 A S ATOM 477 N PRO A 110 12.561 -2.081 8.955 1.00 37.31 A N ATOM 478 CA PRO A 110 12.902 -3.140 7.998 1.00 39.24 A C ATOM 479 C PRO A 110 13.179 -2.650 6.585 1.00 43.80 A C ATOM 480 O PRO A 110 13.388 -3.479 5.693 1.00 39.89 A O ATOM 481 CB PRO A 110 11.650 -4.038 8.016 1.00 31.76 A C ATOM 482 CG PRO A 110 10.572 -3.249 8.768 1.00 36.78 A C ATOM 483 CD PRO A 110 11.108 -1.866 9.005 1.00 39.70 A C ATOM 484 N CYS A 111 13.191 -1.337 6.361 1.00 34.17 A N ATOM 485 CA CYS A 111 13.274 -0.784 5.022 1.00 43.41 A C ATOM 486 C CYS A 111 14.693 -0.347 4.697 1.00 44.91 A C ATOM 487 O CYS A 111 15.240 -0.724 3.656 1.00 43.70 A O ATOM 488 CB CYS A 111 12.276 0.387 4.867 1.00 44.84 A C ATOM 489 SG CYS A 111 10.492 -0.125 4.843 1.00 41.47 A S ATOM 490 N HIS A 112 15.313 0.422 5.583 1.00 46.06 A N ATOM 491 CA HIS A 112 16.725 0.740 5.427 1.00 50.92 A C ATOM 492 C HIS A 112 17.534 0.452 6.691 1.00 44.42 A C ATOM 493 O HIS A 112 18.659 0.944 6.815 1.00 44.98 A O ATOM 494 CB HIS A 112 16.887 2.197 4.980 1.00 47.08 A C ATOM 495 CG HIS A 112 16.015 2.563 3.816 1.00 49.74 A C ATOM 496 CD2 HIS A 112 16.117 2.270 2.497 1.00 51.60 A C ATOM 497 ND1 HIS A 112 14.862 3.305 3.952 1.00 43.78 A N ATOM 498 CE1 HIS A 112 14.297 3.465 2.768 1.00 46.19 A C ATOM 499 NE2 HIS A 112 15.037 2.844 1.868 1.00 47.01 A N ATOM 500 N GLY A 113 16.989 -0.324 7.628 1.00 42.19 A N ATOM 501 CA GLY A 113 17.746 -0.862 8.745 1.00 42.40 A C ATOM 502 C GLY A 113 17.980 0.062 9.918 1.00 45.49 A C ATOM 503 O GLY A 113 18.808 -0.265 10.775 1.00 50.60 A O ATOM 504 N SER A 114 17.284 1.194 10.006 1.00 46.20 A N ATOM 505 CA SER A 114 17.536 2.105 11.112 1.00 44.72 A C ATOM 506 C SER A 114 17.278 1.423 12.455 1.00 45.21 A C ATOM 507 O SER A 114 16.605 0.388 12.553 1.00 34.28 A O ATOM 508 CB SER A 114 16.681 3.367 10.991 1.00 39.25 A C ATOM 509 OG SER A 114 17.134 4.179 9.925 1.00 38.68 A O ATOM 510 N GLY A 115 17.859 2.017 13.498 1.00 49.22 A N ATOM 511 CA GLY A 115 17.814 1.466 14.836 1.00 36.01 A C ATOM 512 C GLY A 115 17.656 2.555 15.871 1.00 42.76 A C ATOM 513 O GLY A 115 18.327 3.598 15.817 1.00 40.83 A O ATOM 514 N PHE A 116 16.756 2.305 16.823 1.00 36.48 A N ATOM 515 CA PHE A 116 16.410 3.249 17.867 1.00 37.71 A C ATOM 516 C PHE A 116 16.390 2.518 19.203 1.00 37.79 A C ATOM 517 O PHE A 116 15.862 1.403 19.306 1.00 35.51 A O ATOM 518 CB PHE A 116 15.027 3.896 17.614 1.00 39.32 A C ATOM 519 CG PHE A 116 14.727 4.203 16.168 1.00 28.45 A C ATOM 520 CD1 PHE A 116 14.419 3.196 15.272 1.00 28.19 A C ATOM 521 CD2 PHE A 116 14.698 5.510 15.728 1.00 32.15 A C ATOM 522 CE1 PHE A 116 14.119 3.476 13.948 1.00 29.21 A C ATOM 523 CE2 PHE A 116 14.397 5.805 14.407 1.00 30.75 A C ATOM 524 CZ PHE A 116 14.099 4.785 13.518 1.00 31.49 A C ATOM 525 N THR A 117 16.948 3.148 20.230 1.00 33.17 A N ATOM 526 CA THR A 117 16.828 2.591 21.574 1.00 37.70 A C ATOM 527 C THR A 117 15.346 2.525 21.990 1.00 40.29 A C ATOM 528 O THR A 117 14.471 3.042 21.267 1.00 30.93 A O ATOM 529 CB THR A 117 17.675 3.410 22.560 1.00 34.23 A C ATOM 530 CG2 THR A 117 19.115 2.904 22.611 1.00 32.61 A C ATOM 531 OG1 THR A 117 17.657 4.798 22.198 1.00 33.72 A O ATOM 532 N PRO A 118 15.013 1.834 23.088 1.00 34.69 A N ATOM 533 CA PRO A 118 13.604 1.744 23.515 1.00 31.16 A C ATOM 534 C PRO A 118 12.995 3.056 23.976 1.00 31.28 A C ATOM 535 O PRO A 118 11.798 3.089 24.260 1.00 34.54 A O ATOM 536 CB PRO A 118 13.639 0.736 24.665 1.00 33.18 A C ATOM 537 CG PRO A 118 14.879 -0.073 24.460 1.00 36.64 A C ATOM 538 CD PRO A 118 15.851 0.779 23.693 1.00 36.24 A C ATOM 539 N ASP A 119 13.755 4.137 24.047 1.00 34.82 A N ATOM 540 CA ASP A 119 13.206 5.454 24.324 1.00 32.99 A C ATOM 541 C ASP A 119 12.979 6.261 23.053 1.00 36.08 A C ATOM 542 O ASP A 119 12.440 7.375 23.113 1.00 33.65 A O ATOM 543 CB ASP A 119 14.132 6.180 25.308 1.00 37.21 A C ATOM 544 CG ASP A 119 15.606 6.121 24.889 1.00 39.37 A C ATOM 545 OD1 ASP A 119 15.934 5.336 23.972 1.00 34.98 A O ATOM 546 OD2 ASP A 119 16.441 6.816 25.511 1.00 40.41 A O1- ATOM 547 N GLY A 120 13.331 5.703 21.903 1.00 34.85 A N ATOM 548 CA GLY A 120 13.029 6.299 20.632 1.00 40.20 A C ATOM 549 C GLY A 120 14.200 6.991 19.969 1.00 41.39 A C ATOM 550 O GLY A 120 14.137 7.263 18.757 1.00 42.58 A O ATOM 551 N ILE A 121 15.264 7.281 20.727 1.00 43.52 A N ATOM 552 CA ILE A 121 16.434 7.947 20.155 1.00 44.16 A C ATOM 553 C ILE A 121 17.080 7.037 19.127 1.00 39.27 A C ATOM 554 O ILE A 121 17.369 5.864 19.403 1.00 38.37 A O ATOM 555 CB ILE A 121 17.445 8.338 21.245 1.00 40.85 A C ATOM 556 CG1 ILE A 121 16.762 9.022 22.424 1.00 38.84 A C ATOM 557 CG2 ILE A 121 18.487 9.269 20.673 1.00 44.54 A C ATOM 558 CD1 ILE A 121 17.619 9.024 23.675 1.00 42.67 A C ATOM 559 N ASN A 122 17.297 7.566 17.927 1.00 43.45 A N ATOM 560 CA ASN A 122 17.932 6.775 16.886 1.00 40.45 A C ATOM 561 C ASN A 122 19.410 6.624 17.203 1.00 46.84 A C ATOM 562 O ASN A 122 20.070 7.561 17.665 1.00 41.22 A O ATOM 563 CB ASN A 122 17.765 7.420 15.515 1.00 40.76 A C ATOM 564 CG ASN A 122 18.595 8.664 15.366 1.00 45.81 A C ATOM 565 ND2 ASN A 122 19.521 8.642 14.406 1.00 40.31 A N ATOM 566 OD1 ASN A 122 18.439 9.627 16.128 1.00 43.73 A O ATOM 567 N ILE A 123 19.926 5.426 16.961 1.00 42.79 A N ATOM 568 CA ILE A 123 21.327 5.146 17.239 1.00 43.65 A C ATOM 569 C ILE A 123 22.073 4.654 16.020 1.00 45.39 A C ATOM 570 O ILE A 123 23.277 4.928 15.897 1.00 42.25 A O ATOM 571 CB ILE A 123 21.438 4.133 18.397 1.00 38.96 A C ATOM 572 CG1 ILE A 123 20.617 2.879 18.084 1.00 37.43 A C ATOM 573 CG2 ILE A 123 20.918 4.769 19.660 1.00 37.49 A C ATOM 574 CD1 ILE A 123 21.150 1.610 18.692 1.00 34.86 A C ATOM 575 N GLU A 124 21.399 4.023 15.062 1.00 44.01 A N ATOM 576 CA GLU A 124 22.050 3.405 13.922 1.00 37.86 A C ATOM 577 C GLU A 124 21.147 3.542 12.688 1.00 44.13 A C ATOM 578 O GLU A 124 20.055 4.134 12.741 1.00 37.57 A O ATOM 579 CB GLU A 124 22.393 1.950 14.267 1.00 38.67 A C ATOM 580 CG GLU A 124 21.292 0.966 13.916 1.00 42.16 A C ATOM 581 CD GLU A 124 21.282 -0.254 14.814 1.00 47.74 A C ATOM 582 OE1 GLU A 124 21.499 -1.382 14.306 1.00 46.17 A O ATOM 583 OE2 GLU A 124 21.072 -0.081 16.035 1.00 52.08 A O1- ATOM 584 N GLY A 125 21.624 2.998 11.560 1.00 39.91 A N ATOM 585 CA GLY A 125 20.954 3.104 10.281 1.00 35.82 A C ATOM 586 C GLY A 125 20.840 4.535 9.775 1.00 38.32 A C ATOM 587 O GLY A 125 21.367 5.482 10.380 1.00 32.72 A O ATOM 588 N PRO A 126 20.134 4.713 8.646 1.00 38.58 A N ATOM 589 CA PRO A 126 20.000 6.052 8.031 1.00 30.05 A C ATOM 590 C PRO A 126 19.096 7.036 8.758 1.00 38.84 A C ATOM 591 O PRO A 126 19.087 8.210 8.358 1.00 38.47 A O ATOM 592 CB PRO A 126 19.443 5.745 6.638 1.00 33.67 A C ATOM 593 CG PRO A 126 18.888 4.355 6.728 1.00 40.02 A C ATOM 594 CD PRO A 126 19.764 3.641 7.709 1.00 39.04 A C ATOM 595 N ALA A 127 18.334 6.624 9.781 1.00 41.17 A N ATOM 596 CA ALA A 127 17.355 7.531 10.394 1.00 37.36 A C ATOM 597 C ALA A 127 18.059 8.693 11.094 1.00 42.19 A C ATOM 598 O ALA A 127 18.991 8.474 11.880 1.00 39.93 A O ATOM 599 CB ALA A 127 16.457 6.792 11.382 1.00 33.18 A C ATOM 600 N PRO A 128 17.625 9.931 10.870 1.00 45.14 A N ATOM 601 CA PRO A 128 18.387 11.085 11.361 1.00 35.31 A C ATOM 602 C PRO A 128 18.008 11.571 12.745 1.00 42.22 A C ATOM 603 O PRO A 128 18.763 12.323 13.361 1.00 51.56 A O ATOM 604 CB PRO A 128 18.056 12.158 10.325 1.00 42.79 A C ATOM 605 CG PRO A 128 16.597 11.857 9.978 1.00 42.67 A C ATOM 606 CD PRO A 128 16.483 10.336 10.024 1.00 44.07 A C ATOM 607 N ARG A 129 16.845 11.194 13.248 1.00 42.46 A N ATOM 608 CA ARG A 129 16.322 11.846 14.438 1.00 46.89 A C ATOM 609 C ARG A 129 15.493 10.839 15.223 1.00 49.24 A C ATOM 610 O ARG A 129 15.158 9.768 14.701 1.00 48.17 A O ATOM 611 CB ARG A 129 15.513 13.098 14.059 1.00 45.51 A C ATOM 612 CG ARG A 129 14.099 12.846 13.578 1.00 47.71 A C ATOM 613 CD ARG A 129 13.390 14.171 13.286 1.00 48.52 A C ATOM 614 NE ARG A 129 12.404 14.037 12.221 1.00 52.38 A N ATOM 615 CZ ARG A 129 11.099 13.938 12.430 1.00 48.40 A C ATOM 616 NH1 ARG A 129 10.589 14.014 13.647 1.00 42.65 A N1+ ATOM 617 NH2 ARG A 129 10.287 13.763 11.391 1.00 45.34 A N ATOM 618 N PRO A 130 15.217 11.112 16.502 1.00 47.07 A N ATOM 619 CA PRO A 130 14.409 10.168 17.291 1.00 43.59 A C ATOM 620 C PRO A 130 12.988 10.014 16.753 1.00 41.21 A C ATOM 621 O PRO A 130 12.389 10.959 16.226 1.00 36.01 A O ATOM 622 CB PRO A 130 14.400 10.782 18.700 1.00 39.09 A C ATOM 623 CG PRO A 130 15.089 12.100 18.609 1.00 40.72 A C ATOM 624 CD PRO A 130 15.886 12.121 17.342 1.00 46.12 A C ATOM 625 N LEU A 131 12.458 8.789 16.902 1.00 41.76 A N ATOM 626 CA LEU A 131 11.033 8.519 16.739 1.00 31.79 A C ATOM 627 C LEU A 131 10.235 9.458 17.627 1.00 32.79 A C ATOM 628 O LEU A 131 10.704 9.895 18.680 1.00 38.79 A O ATOM 629 CB LEU A 131 10.710 7.069 17.106 1.00 28.08 A C ATOM 630 CG LEU A 131 11.399 5.966 16.304 1.00 28.96 A C ATOM 631 CD1 LEU A 131 11.206 4.584 16.926 1.00 22.01 A C ATOM 632 CD2 LEU A 131 10.944 5.977 14.854 1.00 31.86 A C ATOM 633 N GLU A 132 9.029 9.783 17.199 1.00 31.62 A N ATOM 634 CA GLU A 132 8.376 10.937 17.782 1.00 32.82 A C ATOM 635 C GLU A 132 7.418 10.471 18.881 1.00 34.21 A C ATOM 636 O GLU A 132 7.141 9.277 19.012 1.00 29.80 A O ATOM 637 CB GLU A 132 7.690 11.720 16.665 1.00 38.87 A C ATOM 638 CG GLU A 132 7.901 13.219 16.699 1.00 46.36 A C ATOM 639 CD GLU A 132 7.423 13.904 15.396 1.00 44.95 A C ATOM 640 OE1 GLU A 132 7.950 13.613 14.299 1.00 41.10 A O ATOM 641 OE2 GLU A 132 6.531 14.796 15.476 1.00 42.68 A O1- ATOM 642 N ARG A 133 6.996 11.409 19.738 1.00 32.53 A N ATOM 643 CA ARG A 133 6.149 11.095 20.884 1.00 32.93 A C ATOM 644 C ARG A 133 4.862 11.915 20.854 1.00 35.19 A C ATOM 645 O ARG A 133 4.843 13.054 20.378 1.00 36.50 A O ATOM 646 CB ARG A 133 6.850 11.351 22.222 1.00 27.89 A C ATOM 647 CG ARG A 133 7.791 10.260 22.696 1.00 31.10 A C ATOM 648 CD ARG A 133 8.687 10.792 23.811 1.00 30.61 A C ATOM 649 NE ARG A 133 9.824 9.916 24.090 1.00 38.80 A N ATOM 650 CZ ARG A 133 10.414 9.812 25.275 1.00 35.81 A C ATOM 651 NH1 ARG A 133 9.964 10.479 26.330 1.00 34.09 A N1+ ATOM 652 NH2 ARG A 133 11.487 9.033 25.401 1.00 34.59 A N ATOM 653 N PHE A 134 3.793 11.338 21.397 1.00 27.55 A N ATOM 654 CA PHE A 134 2.465 11.939 21.345 1.00 38.62 A C ATOM 655 C PHE A 134 2.031 12.404 22.732 1.00 37.02 A C ATOM 656 O PHE A 134 2.514 11.911 23.756 1.00 37.07 A O ATOM 657 CB PHE A 134 1.416 10.954 20.804 1.00 33.33 A C ATOM 658 CG PHE A 134 1.510 10.677 19.326 1.00 29.55 A C ATOM 659 CD1 PHE A 134 1.618 11.706 18.417 1.00 33.70 A C ATOM 660 CD2 PHE A 134 1.401 9.378 18.851 1.00 27.71 A C ATOM 661 CE1 PHE A 134 1.669 11.449 17.059 1.00 35.06 A C ATOM 662 CE2 PHE A 134 1.454 9.108 17.510 1.00 29.30 A C ATOM 663 CZ PHE A 134 1.589 10.146 16.601 1.00 35.26 A C ATOM 664 N LYS A 135 1.094 13.353 22.758 1.00 32.25 A N ATOM 665 CA LYS A 135 0.599 13.875 24.027 1.00 35.27 A C ATOM 666 C LYS A 135 -0.214 12.823 24.780 1.00 36.28 A C ATOM 667 O LYS A 135 -1.027 12.102 24.194 1.00 36.67 A O ATOM 668 CB LYS A 135 -0.246 15.124 23.791 1.00 36.44 A C ATOM 669 CG LYS A 135 -0.866 15.690 25.027 1.00 30.49 A C ATOM 670 CD LYS A 135 -1.616 16.950 24.710 1.00 36.56 A C ATOM 671 CE LYS A 135 -2.256 17.531 25.958 1.00 35.34 A C ATOM 672 NZ LYS A 135 -2.977 18.794 25.639 1.00 45.30 A N1+ ATOM 673 N VAL A 136 0.005 12.744 26.091 1.00 30.88 A N ATOM 674 CA VAL A 136 -0.658 11.779 26.957 1.00 30.11 A C ATOM 675 C VAL A 136 -1.226 12.521 28.150 1.00 34.88 A C ATOM 676 O VAL A 136 -0.491 13.205 28.870 1.00 37.80 A O ATOM 677 CB VAL A 136 0.303 10.677 27.439 1.00 38.21 A C ATOM 678 CG1 VAL A 136 0.590 9.693 26.336 1.00 29.75 A C ATOM 679 CG2 VAL A 136 1.611 11.301 27.930 1.00 38.79 A C ATOM 680 N ALA A 137 -2.520 12.360 28.381 1.00 30.85 A N ATOM 681 CA ALA A 137 -3.169 12.940 29.539 1.00 26.91 A C ATOM 682 C ALA A 137 -4.022 11.871 30.195 1.00 35.93 A C ATOM 683 O ALA A 137 -4.474 10.926 29.541 1.00 38.81 A O ATOM 684 CB ALA A 137 -4.045 14.147 29.176 1.00 24.77 A C ATOM 685 N LEU A 138 -4.233 12.034 31.501 1.00 41.34 A N ATOM 686 CA LEU A 138 -5.181 11.221 32.247 1.00 35.78 A C ATOM 687 C LEU A 138 -6.565 11.836 32.068 1.00 39.41 A C ATOM 688 O LEU A 138 -6.749 13.033 32.304 1.00 42.59 A O ATOM 689 CB LEU A 138 -4.809 11.185 33.730 1.00 33.86 A C ATOM 690 CG LEU A 138 -3.970 10.065 34.362 1.00 36.71 A C ATOM 691 CD1 LEU A 138 -4.274 9.991 35.866 1.00 32.56 A C ATOM 692 CD2 LEU A 138 -4.099 8.691 33.688 1.00 32.22 A C ATOM 693 N GLY A 139 -7.526 11.036 31.623 1.00 37.64 A N ATOM 694 CA GLY A 139 -8.883 11.522 31.515 1.00 41.22 A C ATOM 695 C GLY A 139 -9.573 11.553 32.870 1.00 46.59 A C ATOM 696 O GLY A 139 -9.028 11.098 33.876 1.00 46.46 A O ATOM 697 N ASP A 140 -10.792 12.108 32.890 1.00 44.50 A N ATOM 698 CA ASP A 140 -11.566 12.127 34.129 1.00 44.31 A C ATOM 699 C ASP A 140 -11.932 10.728 34.598 1.00 43.72 A C ATOM 700 O ASP A 140 -12.214 10.533 35.791 1.00 43.26 A O ATOM 701 CB ASP A 140 -12.842 12.958 33.965 1.00 47.39 A C ATOM 702 CG ASP A 140 -12.567 14.454 33.938 1.00 50.33 A C ATOM 703 OD1 ASP A 140 -11.521 14.865 34.493 1.00 47.13 A O ATOM 704 OD2 ASP A 140 -13.405 15.211 33.389 1.00 42.45 A O1- ATOM 705 N ASP A 141 -11.932 9.756 33.693 1.00 39.08 A N ATOM 706 CA ASP A 141 -12.222 8.374 34.037 1.00 36.86 A C ATOM 707 C ASP A 141 -10.988 7.628 34.521 1.00 33.32 A C ATOM 708 O ASP A 141 -11.083 6.443 34.861 1.00 32.32 A O ATOM 709 CB ASP A 141 -12.905 7.678 32.838 1.00 30.17 A C ATOM 710 CG ASP A 141 -11.964 7.374 31.687 1.00 40.17 A C ATOM 711 OD1 ASP A 141 -10.773 7.786 31.706 1.00 43.11 A O ATOM 712 OD2 ASP A 141 -12.443 6.743 30.717 1.00 39.26 A O1- ATOM 713 N GLY A 142 -9.847 8.312 34.596 1.00 36.86 A N ATOM 714 CA GLY A 142 -8.598 7.724 35.035 1.00 35.78 A C ATOM 715 C GLY A 142 -7.798 7.026 33.961 1.00 32.19 A C ATOM 716 O GLY A 142 -6.744 6.458 34.269 1.00 41.46 A O ATOM 717 N GLN A 143 -8.256 7.046 32.718 1.00 36.43 A N ATOM 718 CA GLN A 143 -7.620 6.315 31.638 1.00 33.98 A C ATOM 719 C GLN A 143 -6.782 7.257 30.780 1.00 36.26 A C ATOM 720 O GLN A 143 -6.980 8.477 30.774 1.00 32.98 A O ATOM 721 CB GLN A 143 -8.663 5.583 30.787 1.00 34.39 A C ATOM 722 CG GLN A 143 -9.163 4.295 31.462 1.00 32.98 A C ATOM 723 CD GLN A 143 -10.112 3.462 30.606 1.00 32.90 A C ATOM 724 NE2 GLN A 143 -11.146 4.100 30.043 1.00 29.42 A N ATOM 725 OE1 GLN A 143 -9.913 2.248 30.458 1.00 29.56 A O ATOM 726 N ILE A 144 -5.820 6.666 30.071 1.00 31.35 A N ATOM 727 CA ILE A 144 -4.849 7.419 29.288 1.00 28.63 A C ATOM 728 C ILE A 144 -5.459 7.841 27.960 1.00 31.18 A C ATOM 729 O ILE A 144 -5.879 6.999 27.156 1.00 29.64 A O ATOM 730 CB ILE A 144 -3.578 6.594 29.062 1.00 30.79 A C ATOM 731 CG1 ILE A 144 -3.005 6.138 30.407 1.00 30.17 A C ATOM 732 CG2 ILE A 144 -2.589 7.374 28.169 1.00 30.36 A C ATOM 733 CD1 ILE A 144 -1.687 5.462 30.300 1.00 27.12 A C ATOM 734 N ILE A 145 -5.474 9.149 27.713 1.00 35.14 A N ATOM 735 CA ILE A 145 -5.830 9.709 26.415 1.00 33.01 A C ATOM 736 C ILE A 145 -4.549 9.994 25.643 1.00 27.88 A C ATOM 737 O ILE A 145 -3.665 10.695 26.148 1.00 30.01 A O ATOM 738 CB ILE A 145 -6.654 10.997 26.566 1.00 33.16 A C ATOM 739 CG1 ILE A 145 -7.937 10.766 27.361 1.00 30.95 A C ATOM 740 CG2 ILE A 145 -6.961 11.575 25.185 1.00 35.27 A C ATOM 741 CD1 ILE A 145 -8.499 9.378 27.238 1.00 37.88 A C ATOM 742 N VAL A 146 -4.449 9.460 24.419 1.00 29.73 A N ATOM 743 CA VAL A 146 -3.376 9.797 23.485 1.00 26.53 A C ATOM 744 C VAL A 146 -3.911 10.826 22.503 1.00 27.35 A C ATOM 745 O VAL A 146 -4.990 10.647 21.941 1.00 26.69 A O ATOM 746 CB VAL A 146 -2.843 8.557 22.747 1.00 25.51 A C ATOM 747 CG1 VAL A 146 -1.871 8.985 21.649 1.00 31.91 A C ATOM 748 CG2 VAL A 146 -2.096 7.651 23.693 1.00 20.41 A C ATOM 749 N ASP A 147 -3.165 11.909 22.304 1.00 32.89 A N ATOM 750 CA ASP A 147 -3.560 13.000 21.416 1.00 31.79 A C ATOM 751 C ASP A 147 -2.484 13.153 20.341 1.00 37.78 A C ATOM 752 O ASP A 147 -1.427 13.750 20.583 1.00 36.24 A O ATOM 753 CB ASP A 147 -3.763 14.292 22.199 1.00 32.59 A C ATOM 754 CG ASP A 147 -4.352 15.405 21.345 1.00 40.01 A C ATOM 755 OD1 ASP A 147 -4.268 15.313 20.100 1.00 37.75 A O ATOM 756 OD2 ASP A 147 -4.929 16.359 21.915 1.00 40.42 A O1- ATOM 757 N GLU A 148 -2.770 12.637 19.143 1.00 32.84 A N ATOM 758 CA GLU A 148 -1.796 12.644 18.058 1.00 34.51 A C ATOM 759 C GLU A 148 -1.656 14.011 17.391 1.00 36.32 A C ATOM 760 O GLU A 148 -0.826 14.156 16.490 1.00 36.54 A O ATOM 761 CB GLU A 148 -2.163 11.576 17.018 1.00 28.66 A C ATOM 762 CG GLU A 148 -1.927 10.133 17.479 1.00 27.03 A C ATOM 763 CD GLU A 148 -2.154 9.114 16.352 1.00 31.56 A C ATOM 764 OE1 GLU A 148 -2.636 9.518 15.274 1.00 33.07 A O ATOM 765 OE2 GLU A 148 -1.854 7.908 16.538 1.00 30.89 A O1- ATOM 766 N SER A 149 -2.433 15.013 17.817 1.00 39.69 A N ATOM 767 CA SER A 149 -2.313 16.356 17.260 1.00 38.12 A C ATOM 768 C SER A 149 -1.099 17.094 17.802 1.00 45.48 A C ATOM 769 O SER A 149 -0.454 17.842 17.059 1.00 53.06 A O ATOM 770 CB SER A 149 -3.561 17.179 17.557 1.00 37.35 A C ATOM 771 OG SER A 149 -3.535 17.643 18.893 1.00 49.63 A O ATOM 772 N THR A 150 -0.765 16.904 19.075 1.00 44.77 A N ATOM 773 CA THR A 150 0.461 17.455 19.638 1.00 41.02 A C ATOM 774 C THR A 150 1.518 16.359 19.643 1.00 40.79 A C ATOM 775 O THR A 150 1.233 15.222 20.026 1.00 41.95 A O ATOM 776 CB THR A 150 0.248 17.997 21.056 1.00 44.60 A C ATOM 777 CG2 THR A 150 1.504 18.646 21.559 1.00 43.93 A C ATOM 778 OG1 THR A 150 -0.812 18.971 21.070 1.00 52.97 A O ATOM 779 N ARG A 151 2.718 16.700 19.185 1.00 41.90 A N ATOM 780 CA ARG A 151 3.861 15.804 19.081 1.00 39.34 A C ATOM 781 C ARG A 151 5.083 16.435 19.737 1.00 40.60 A C ATOM 782 O ARG A 151 5.154 17.651 19.904 1.00 41.39 A O ATOM 783 CB ARG A 151 4.146 15.518 17.613 1.00 43.93 A C ATOM 784 CG ARG A 151 3.126 14.654 16.872 1.00 41.04 A C ATOM 785 CD ARG A 151 3.424 14.786 15.367 1.00 34.17 A C ATOM 786 NE ARG A 151 3.217 13.591 14.576 1.00 30.54 A N ATOM 787 CZ ARG A 151 2.115 13.256 13.938 1.00 37.04 A C ATOM 788 NH1 ARG A 151 1.054 14.054 13.913 1.00 47.87 A N1+ ATOM 789 NH2 ARG A 151 2.091 12.101 13.281 1.00 34.98 A N ATOM 790 N TYR A 152 6.060 15.597 20.087 1.00 44.58 A N ATOM 791 CA TYR A 152 7.260 16.041 20.790 1.00 42.42 A C ATOM 792 C TYR A 152 8.467 15.360 20.180 1.00 45.16 A C ATOM 793 O TYR A 152 8.475 14.134 20.036 1.00 43.77 A O ATOM 794 CB TYR A 152 7.207 15.717 22.291 1.00 37.71 A C ATOM 795 CG TYR A 152 5.983 16.258 22.970 1.00 41.03 A C ATOM 796 CD1 TYR A 152 4.748 15.638 22.815 1.00 36.10 A C ATOM 797 CD2 TYR A 152 6.048 17.408 23.740 1.00 41.57 A C ATOM 798 CE1 TYR A 152 3.624 16.140 23.412 1.00 37.77 A C ATOM 799 CE2 TYR A 152 4.921 17.920 24.349 1.00 43.68 A C ATOM 800 CZ TYR A 152 3.708 17.277 24.177 1.00 41.54 A C ATOM 801 OH TYR A 152 2.564 17.759 24.770 1.00 47.55 A O ATOM 802 N ARG A 153 9.490 16.140 19.843 1.00 48.28 A N ATOM 803 CA ARG A 153 10.676 15.596 19.198 1.00 50.15 A C ATOM 804 C ARG A 153 11.875 15.662 20.138 1.00 50.63 A C ATOM 805 O ARG A 153 12.105 16.676 20.806 1.00 49.90 A O ATOM 806 CB ARG A 153 10.958 16.333 17.894 1.00 49.78 A C ATOM 807 CG ARG A 153 9.833 16.205 16.889 1.00 50.24 A C ATOM 808 CD ARG A 153 9.717 17.447 16.019 1.00 57.83 A C ATOM 809 NE ARG A 153 9.310 17.129 14.654 1.00 55.13 A N ATOM 810 CZ ARG A 153 9.971 17.514 13.569 1.00 58.12 A C ATOM 811 NH1 ARG A 153 11.102 18.194 13.655 1.00 59.95 A N1+ ATOM 812 NH2 ARG A 153 9.491 17.197 12.366 1.00 55.89 A N ATOM 813 N GLY A 154 12.625 14.560 20.202 1.00 47.42 A N ATOM 814 CA GLY A 154 13.730 14.483 21.145 1.00 49.28 A C ATOM 815 C GLY A 154 14.870 15.428 20.816 1.00 53.33 A C ATOM 816 O GLY A 154 15.380 16.128 21.695 1.00 53.87 A O ATOM 817 N GLU A 155 15.271 15.476 19.545 1.00 56.22 A N ATOM 818 CA GLU A 155 16.334 16.360 19.087 1.00 52.05 A C ATOM 819 C GLU A 155 15.967 17.828 19.222 1.00 52.06 A C ATOM 820 O GLU A 155 16.779 18.685 18.864 1.00 56.83 A O ATOM 821 CB GLU A 155 16.675 16.040 17.630 1.00 59.00 A C ATOM 822 CG GLU A 155 15.797 16.777 16.591 1.00 66.85 A C ATOM 823 CD GLU A 155 14.409 16.162 16.391 1.00 59.13 A C ATOM 824 OE1 GLU A 155 13.980 15.339 17.228 1.00 56.62 A O ATOM 825 OE2 GLU A 155 13.742 16.512 15.388 1.00 65.04 A O1- ATOM 826 N ARG A 156 14.763 18.138 19.707 1.00 52.12 A N ATOM 827 CA ARG A 156 14.361 19.506 20.003 1.00 49.98 A C ATOM 828 C ARG A 156 14.013 19.664 21.477 1.00 53.56 A C ATOM 829 O ARG A 156 13.324 20.620 21.857 1.00 47.81 A O ATOM 830 CB ARG A 156 13.192 19.927 19.111 1.00 53.50 A C ATOM 831 CG ARG A 156 13.561 20.085 17.632 1.00 56.08 A C ATOM 832 CD ARG A 156 12.421 19.612 16.733 1.00 61.35 A C ATOM 833 NE ARG A 156 12.542 20.100 15.363 1.00 63.59 A N ATOM 834 CZ ARG A 156 11.640 20.867 14.767 1.00 60.89 A C ATOM 835 NH1 ARG A 156 10.505 21.192 15.366 1.00 60.64 A N1+ ATOM 836 NH2 ARG A 156 11.884 21.323 13.543 1.00 56.96 A N ATOM 837 N GLY A 157 14.479 18.732 22.312 1.00 52.13 A N ATOM 838 CA GLY A 157 14.337 18.821 23.750 1.00 51.38 A C ATOM 839 C GLY A 157 12.904 18.997 24.198 1.00 54.79 A C ATOM 840 O GLY A 157 12.641 19.664 25.201 1.00 61.53 A O ATOM 841 N GLU A 158 11.970 18.416 23.447 1.00 51.71 A N ATOM 842 CA GLU A 158 10.547 18.531 23.740 1.00 52.19 A C ATOM 843 C GLU A 158 10.054 17.470 24.721 1.00 49.95 A C ATOM 844 O GLU A 158 8.951 17.610 25.255 1.00 52.45 A O ATOM 845 CB GLU A 158 9.721 18.431 22.442 1.00 52.85 A C ATOM 846 CG GLU A 158 10.301 19.122 21.181 1.00 50.21 A C ATOM 847 CD GLU A 158 9.256 19.933 20.407 1.00 57.26 A C ATOM 848 OE1 GLU A 158 9.236 19.843 19.161 1.00 60.13 A O ATOM 849 OE2 GLU A 158 8.464 20.674 21.032 1.00 54.95 A O1- ATOM 850 N TRP A 159 10.836 16.418 24.981 1.00 46.19 A N ATOM 851 CA TRP A 159 10.319 15.306 25.771 1.00 42.06 A C ATOM 852 C TRP A 159 10.099 15.700 27.229 1.00 48.04 A C ATOM 853 O TRP A 159 9.167 15.207 27.869 1.00 53.54 A O ATOM 854 CB TRP A 159 11.252 14.102 25.659 1.00 39.53 A C ATOM 855 CG TRP A 159 11.237 13.474 24.311 1.00 38.54 A C ATOM 856 CD1 TRP A 159 10.404 13.789 23.269 1.00 41.22 A C ATOM 857 CD2 TRP A 159 12.081 12.412 23.844 1.00 36.49 A C ATOM 858 CE2 TRP A 159 11.712 12.143 22.503 1.00 34.28 A C ATOM 859 CE3 TRP A 159 13.122 11.672 24.420 1.00 34.94 A C ATOM 860 NE1 TRP A 159 10.687 12.995 22.180 1.00 37.59 A N ATOM 861 CZ2 TRP A 159 12.342 11.164 21.734 1.00 29.79 A C ATOM 862 CZ3 TRP A 159 13.751 10.692 23.651 1.00 33.75 A C ATOM 863 CH2 TRP A 159 13.355 10.448 22.321 1.00 35.89 A C ATOM 864 N ASP A 160 10.936 16.581 27.778 1.00 54.65 A N ATOM 865 CA ASP A 160 10.702 17.048 29.142 1.00 54.90 A C ATOM 866 C ASP A 160 9.504 17.989 29.231 1.00 54.37 A C ATOM 867 O ASP A 160 8.997 18.220 30.334 1.00 60.04 A O ATOM 868 CB ASP A 160 11.943 17.751 29.705 1.00 55.99 A C ATOM 869 CG ASP A 160 12.635 18.646 28.680 1.00 65.46 A C ATOM 870 OD1 ASP A 160 13.019 18.152 27.591 1.00 62.32 A O ATOM 871 OD2 ASP A 160 12.772 19.862 28.961 1.00 73.10 A O1- ATOM 872 N LYS A 161 9.043 18.526 28.098 1.00 55.31 A N ATOM 873 CA LYS A 161 7.952 19.497 28.070 1.00 55.39 A C ATOM 874 C LYS A 161 6.680 18.857 28.632 1.00 53.14 A C ATOM 875 O LYS A 161 6.532 17.631 28.604 1.00 51.68 A O ATOM 876 CB LYS A 161 7.737 19.971 26.624 1.00 58.86 A C ATOM 877 CG LYS A 161 6.992 21.295 26.398 1.00 65.71 A C ATOM 878 CD LYS A 161 7.044 21.745 24.929 1.00 61.53 A C ATOM 879 CE LYS A 161 7.861 23.015 24.742 1.00 68.81 A C ATOM 880 NZ LYS A 161 6.978 24.183 24.443 1.00 70.33 A N1+ ATOM 881 N PRO A 162 5.760 19.647 29.183 1.00 53.87 A N ATOM 882 CA PRO A 162 4.541 19.062 29.751 1.00 49.95 A C ATOM 883 C PRO A 162 3.677 18.406 28.688 1.00 48.33 A C ATOM 884 O PRO A 162 3.733 18.737 27.501 1.00 52.15 A O ATOM 885 CB PRO A 162 3.827 20.264 30.376 1.00 52.62 A C ATOM 886 CG PRO A 162 4.897 21.259 30.602 1.00 42.79 A C ATOM 887 CD PRO A 162 5.835 21.091 29.461 1.00 53.72 A C ATOM 888 N GLY A 163 2.865 17.447 29.136 1.00 51.36 A N ATOM 889 CA GLY A 163 2.046 16.652 28.244 1.00 41.18 A C ATOM 890 C GLY A 163 2.801 15.590 27.473 1.00 44.99 A C ATOM 891 O GLY A 163 2.170 14.677 26.924 1.00 42.87 A O ATOM 892 N ALA A 164 4.137 15.670 27.424 1.00 41.17 A N ATOM 893 CA ALA A 164 4.936 14.734 26.648 1.00 39.51 A C ATOM 894 C ALA A 164 5.035 13.368 27.293 1.00 41.64 A C ATOM 895 O ALA A 164 5.559 12.446 26.657 1.00 44.85 A O ATOM 896 CB ALA A 164 6.346 15.280 26.438 1.00 41.38 A C ATOM 897 N PHE A 165 4.565 13.224 28.528 1.00 37.38 A N ATOM 898 CA PHE A 165 4.754 12.006 29.301 1.00 39.64 A C ATOM 899 C PHE A 165 3.759 12.018 30.456 1.00 44.88 A C ATOM 900 O PHE A 165 3.009 12.979 30.648 1.00 46.62 A O ATOM 901 CB PHE A 165 6.202 11.890 29.786 1.00 38.54 A C ATOM 902 CG PHE A 165 6.497 12.710 31.015 1.00 53.25 A C ATOM 903 CD1 PHE A 165 6.256 12.207 32.293 1.00 45.26 A C ATOM 904 CD2 PHE A 165 6.993 14.003 30.892 1.00 54.39 A C ATOM 905 CE1 PHE A 165 6.517 12.962 33.407 1.00 47.33 A C ATOM 906 CE2 PHE A 165 7.256 14.768 32.009 1.00 53.14 A C ATOM 907 CZ PHE A 165 7.014 14.247 33.270 1.00 56.86 A C ATOM 908 N LEU A 166 3.739 10.921 31.205 1.00 36.35 A N ATOM 909 CA LEU A 166 2.955 10.823 32.425 1.00 38.20 A C ATOM 910 C LEU A 166 3.819 10.175 33.489 1.00 41.83 A C ATOM 911 O LEU A 166 4.373 9.096 33.262 1.00 41.41 A O ATOM 912 CB LEU A 166 1.672 10.008 32.231 1.00 36.94 A C ATOM 913 CG LEU A 166 0.519 10.697 31.507 1.00 38.03 A C ATOM 914 CD1 LEU A 166 -0.631 9.724 31.280 1.00 33.44 A C ATOM 915 CD2 LEU A 166 0.071 11.923 32.295 1.00 30.39 A C ATOM 916 N LYS A 167 3.966 10.848 34.628 1.00 45.33 A N ATOM 917 CA LYS A 167 4.539 10.203 35.797 1.00 42.66 A C ATOM 918 C LYS A 167 3.450 9.324 36.391 1.00 43.90 A C ATOM 919 O LYS A 167 2.307 9.762 36.537 1.00 43.05 A O ATOM 920 CB LYS A 167 5.041 11.239 36.803 1.00 42.54 A C ATOM 921 CG LYS A 167 6.267 10.808 37.617 1.00 49.20 A C ATOM 922 CD LYS A 167 6.414 11.667 38.881 1.00 57.63 A C ATOM 923 CE LYS A 167 6.748 10.830 40.123 1.00 60.62 A C ATOM 924 NZ LYS A 167 6.344 11.505 41.395 1.00 58.19 A N1+ ATOM 925 N VAL A 168 3.781 8.072 36.674 1.00 46.59 A N ATOM 926 CA VAL A 168 2.755 7.121 37.085 1.00 40.15 A C ATOM 927 C VAL A 168 3.223 6.262 38.262 1.00 50.77 A C ATOM 928 O VAL A 168 4.406 6.198 38.613 1.00 50.48 A O ATOM 929 CB VAL A 168 2.324 6.232 35.889 1.00 51.59 A C ATOM 930 CG1 VAL A 168 1.397 7.004 34.931 1.00 47.27 A C ATOM 931 CG2 VAL A 168 3.540 5.686 35.151 1.00 42.54 A C ATOM 932 OXT VAL A 168 2.410 5.607 38.920 1.00 62.68 A O1- TER CONECT 1 3 4 CONECT 2 3 4 CONECT 3 1 2 CONECT 4 1 2 338 476 CONECT 338 4 CONECT 476 4 END If you find results from this site helpful for your research, please cite one of our papers:
elNémo
is maintained by Yves-Henri Sanejouand. |