Browse entries in the PDBbind-CN Database
HEADER 6BR3_COMPLEX COMPND 6BR3_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 216 ALA SER LEU THR GLU ILE GLU HIS LEU VAL GLN SER VAL SEQRES 2 A 216 CYS LYS SER TYR ARG GLU THR CYS GLN LEU ARG LEU GLU SEQRES 3 A 216 ASP LEU LEU ARG GLN ARG SER ASN ILE PHE SER ARG GLU SEQRES 4 A 216 GLU VAL THR GLY TYR GLN ARG LYS SER MET TRP GLU MET SEQRES 5 A 216 TRP GLU ARG CYS ALA HIS HIS LEU THR GLU ALA ILE GLN SEQRES 6 A 216 TYR VAL VAL GLU PHE ALA LYS ARG LEU SER GLY PHE MET SEQRES 7 A 216 GLU LEU CYS GLN ASN ASP GLN ILE VAL LEU LEU LYS ALA SEQRES 8 A 216 GLY ALA MET GLU VAL VAL LEU VAL ARG MET CYS ARG ALA SEQRES 9 A 216 TYR ASN ALA ASP ASN ARG THR VAL PHE PHE GLU GLY LYS SEQRES 10 A 216 TYR GLY GLY MET GLU LEU PHE ARG ALA LEU GLY CYS SER SEQRES 11 A 216 GLU LEU ILE SER SER ILE PHE ASP PHE SER HIS SER LEU SEQRES 12 A 216 SER ALA LEU HIS PHE SER GLU ASP GLU ILE ALA LEU TYR SEQRES 13 A 216 THR ALA LEU VAL LEU ILE ASN ALA HIS ARG PRO GLY LEU SEQRES 14 A 216 GLN GLU LYS ARG LYS VAL GLU GLN LEU GLN TYR ASN LEU SEQRES 15 A 216 GLU LEU ALA PHE HIS HIS HIS LEU CYS LYS THR HIS ARG SEQRES 16 A 216 GLN SER ILE LEU ALA LYS LEU PRO PRO LYS GLY LYS LEU SEQRES 17 A 216 ARG SER LEU CYS SER GLN HIS VAL HET E A 3V 68 ATOM 1 N ALA A 265 -6.368 101.954 -6.334 1.00107.67 N ATOM 2 CA ALA A 265 -4.944 101.938 -6.758 1.00103.92 C ATOM 3 C ALA A 265 -4.839 102.123 -8.280 1.00105.77 C ATOM 4 O ALA A 265 -5.331 101.288 -9.027 1.00106.46 O ATOM 5 CB ALA A 265 -4.299 100.625 -6.324 1.00 98.48 C ATOM 6 HN3 ALA A 265 -6.878 101.181 -6.807 1.00 0.00 H ATOM 7 HN2 ALA A 265 -6.796 102.865 -6.596 1.00 0.00 H ATOM 8 HN1 ALA A 265 -6.423 101.828 -5.303 1.00 0.00 H ATOM 9 N SER A 266 -4.223 103.222 -8.727 1.00104.85 N ATOM 10 CA SER A 266 -3.924 103.468 -10.157 1.00100.48 C ATOM 11 C SER A 266 -2.539 102.901 -10.539 1.00 95.97 C ATOM 12 O SER A 266 -1.896 102.242 -9.752 1.00 96.10 O ATOM 13 CB SER A 266 -3.970 104.967 -10.460 1.00101.61 C ATOM 14 OG SER A 266 -2.704 105.561 -10.208 1.00101.03 O ATOM 15 HG SER A 266 -2.749 106.529 -10.408 1.00 0.00 H ATOM 16 H SER A 266 -3.938 103.943 -8.034 1.00 0.00 H ATOM 17 N LEU A 267 -2.089 103.179 -11.760 1.00 92.48 N ATOM 18 CA LEU A 267 -0.892 102.529 -12.297 1.00 86.93 C ATOM 19 C LEU A 267 0.420 103.113 -11.810 1.00 84.06 C ATOM 20 O LEU A 267 1.416 102.406 -11.752 1.00 80.53 O ATOM 21 CB LEU A 267 -0.925 102.502 -13.835 1.00 87.82 C ATOM 22 CG LEU A 267 -0.018 101.470 -14.520 1.00 85.21 C ATOM 23 CD1 LEU A 267 -0.289 100.043 -14.056 1.00 83.77 C ATOM 24 CD2 LEU A 267 -0.198 101.535 -16.033 1.00 85.49 C ATOM 25 H LEU A 267 -2.598 103.872 -12.345 1.00 0.00 H ATOM 26 N THR A 268 0.459 104.400 -11.467 1.00 85.69 N ATOM 27 CA THR A 268 1.650 104.950 -10.794 1.00 88.18 C ATOM 28 C THR A 268 1.730 104.379 -9.377 1.00 88.76 C ATOM 29 O THR A 268 2.805 104.045 -8.904 1.00 88.28 O ATOM 30 CB THR A 268 1.674 106.483 -10.777 1.00 88.82 C ATOM 31 OG1 THR A 268 1.612 106.952 -12.121 1.00 89.75 O ATOM 32 CG2 THR A 268 2.972 107.024 -10.185 1.00 88.70 C ATOM 33 HG1 THR A 268 1.627 107.942 -12.125 1.00 0.00 H ATOM 34 H THR A 268 -0.352 105.017 -11.674 1.00 0.00 H ATOM 35 N GLU A 269 0.586 104.255 -8.717 1.00 90.85 N ATOM 36 CA GLU A 269 0.524 103.594 -7.406 1.00 90.52 C ATOM 37 C GLU A 269 0.991 102.141 -7.422 1.00 86.88 C ATOM 38 O GLU A 269 1.618 101.696 -6.478 1.00 88.88 O ATOM 39 CB GLU A 269 -0.883 103.741 -6.801 1.00 93.29 C ATOM 40 CG GLU A 269 -1.062 105.123 -6.164 1.00 98.63 C ATOM 41 CD GLU A 269 -2.423 105.766 -6.416 1.00103.97 C ATOM 42 OE1 GLU A 269 -3.425 105.014 -6.495 1.00107.93 O ATOM 43 OE2 GLU A 269 -2.478 107.006 -6.593 1.00107.02 O ATOM 44 H GLU A 269 -0.287 104.634 -9.137 1.00 0.00 H ATOM 45 N ILE A 270 0.711 101.405 -8.485 1.00 83.34 N ATOM 46 CA ILE A 270 1.255 100.044 -8.615 1.00 81.11 C ATOM 47 C ILE A 270 2.802 100.056 -8.697 1.00 79.34 C ATOM 48 O ILE A 270 3.421 99.182 -8.114 1.00 78.86 O ATOM 49 CB ILE A 270 0.563 99.216 -9.744 1.00 81.65 C ATOM 50 CG1 ILE A 270 -0.495 98.264 -9.153 1.00 81.84 C ATOM 51 CG2 ILE A 270 1.522 98.281 -10.497 1.00 81.47 C ATOM 52 CD1 ILE A 270 -1.589 98.923 -8.365 1.00 83.00 C ATOM 53 H ILE A 270 0.102 101.791 -9.234 1.00 0.00 H ATOM 54 N GLU A 271 3.410 101.014 -9.385 1.00 77.95 N ATOM 55 CA GLU A 271 4.874 101.116 -9.415 1.00 77.85 C ATOM 56 C GLU A 271 5.501 101.425 -8.043 1.00 75.97 C ATOM 57 O GLU A 271 6.611 100.964 -7.774 1.00 74.19 O ATOM 58 CB GLU A 271 5.339 102.132 -10.480 1.00 81.67 C ATOM 59 CG GLU A 271 5.273 101.591 -11.910 1.00 83.94 C ATOM 60 CD GLU A 271 5.306 102.653 -13.001 1.00 85.87 C ATOM 61 OE1 GLU A 271 5.404 103.855 -12.690 1.00 89.60 O ATOM 62 OE2 GLU A 271 5.208 102.268 -14.188 1.00 84.95 O ATOM 63 H GLU A 271 2.839 101.705 -9.912 1.00 0.00 H ATOM 64 N HIS A 272 4.810 102.169 -7.175 1.00 75.55 N ATOM 65 CA HIS A 272 5.288 102.367 -5.798 1.00 75.50 C ATOM 66 C HIS A 272 5.263 101.041 -5.055 1.00 70.95 C ATOM 67 O HIS A 272 6.247 100.688 -4.400 1.00 70.25 O ATOM 68 CB HIS A 272 4.477 103.401 -5.016 1.00 80.68 C ATOM 69 CG HIS A 272 4.719 104.818 -5.434 1.00 88.90 C ATOM 70 ND1 HIS A 272 4.457 105.271 -6.710 1.00 92.22 N ATOM 71 CD2 HIS A 272 5.161 105.896 -4.737 1.00 94.78 C ATOM 72 CE1 HIS A 272 4.739 106.562 -6.788 1.00 94.93 C ATOM 73 NE2 HIS A 272 5.170 106.965 -5.605 1.00 98.32 N ATOM 74 H HIS A 272 3.921 102.615 -7.477 1.00 0.00 H ATOM 75 N LEU A 273 4.161 100.299 -5.168 1.00 67.61 N ATOM 76 CA LEU A 273 4.061 98.966 -4.548 1.00 64.22 C ATOM 77 C LEU A 273 5.200 98.029 -4.997 1.00 62.91 C ATOM 78 O LEU A 273 5.800 97.343 -4.170 1.00 60.83 O ATOM 79 CB LEU A 273 2.702 98.322 -4.850 1.00 61.80 C ATOM 80 CG LEU A 273 2.480 96.858 -4.450 1.00 59.10 C ATOM 81 CD1 LEU A 273 2.757 96.682 -2.968 1.00 58.52 C ATOM 82 CD2 LEU A 273 1.066 96.384 -4.833 1.00 59.33 C ATOM 83 H LEU A 273 3.352 100.670 -5.707 1.00 0.00 H ATOM 84 N VAL A 274 5.480 98.006 -6.304 1.00 63.00 N ATOM 85 CA VAL A 274 6.535 97.156 -6.866 1.00 61.71 C ATOM 86 C VAL A 274 7.862 97.552 -6.255 1.00 61.26 C ATOM 87 O VAL A 274 8.585 96.710 -5.740 1.00 62.28 O ATOM 88 CB VAL A 274 6.654 97.282 -8.410 1.00 63.17 C ATOM 89 CG1 VAL A 274 7.908 96.591 -8.927 1.00 63.55 C ATOM 90 CG2 VAL A 274 5.435 96.720 -9.117 1.00 62.62 C ATOM 91 H VAL A 274 4.930 98.613 -6.945 1.00 0.00 H ATOM 92 N GLN A 275 8.177 98.838 -6.337 1.00 62.13 N ATOM 93 CA GLN A 275 9.402 99.365 -5.759 1.00 64.21 C ATOM 94 C GLN A 275 9.496 99.047 -4.276 1.00 65.02 C ATOM 95 O GLN A 275 10.566 98.676 -3.768 1.00 63.75 O ATOM 96 CB GLN A 275 9.493 100.874 -5.978 1.00 66.97 C ATOM 97 CG GLN A 275 10.072 101.226 -7.336 1.00 68.79 C ATOM 98 CD GLN A 275 9.446 102.463 -7.936 1.00 70.21 C ATOM 99 OE1 GLN A 275 9.362 103.498 -7.282 1.00 69.81 O ATOM 100 NE2 GLN A 275 8.991 102.354 -9.187 1.00 70.50 N ATOM 101 HE22 GLN A 275 9.087 101.454 -9.699 1.00 0.00 H ATOM 102 HE21 GLN A 275 8.541 103.170 -9.650 1.00 0.00 H ATOM 103 H GLN A 275 7.530 99.487 -6.828 1.00 0.00 H ATOM 104 N SER A 276 8.370 99.193 -3.589 1.00 66.38 N ATOM 105 CA SER A 276 8.319 98.920 -2.167 1.00 65.58 C ATOM 106 C SER A 276 8.670 97.466 -1.890 1.00 62.04 C ATOM 107 O SER A 276 9.536 97.199 -1.060 1.00 61.80 O ATOM 108 CB SER A 276 6.945 99.264 -1.601 1.00 67.27 C ATOM 109 OG SER A 276 6.916 98.960 -0.227 1.00 69.91 O ATOM 110 HG SER A 276 6.024 99.183 0.140 1.00 0.00 H ATOM 111 H SER A 276 7.509 99.509 -4.080 1.00 0.00 H ATOM 112 N VAL A 277 8.018 96.547 -2.612 1.00 59.48 N ATOM 113 CA VAL A 277 8.240 95.103 -2.450 1.00 57.22 C ATOM 114 C VAL A 277 9.691 94.738 -2.785 1.00 58.15 C ATOM 115 O VAL A 277 10.314 93.984 -2.070 1.00 58.05 O ATOM 116 CB VAL A 277 7.279 94.257 -3.328 1.00 56.02 C ATOM 117 CG1 VAL A 277 7.600 92.767 -3.229 1.00 54.85 C ATOM 118 CG2 VAL A 277 5.809 94.511 -2.987 1.00 56.97 C ATOM 119 H VAL A 277 7.325 96.868 -3.318 1.00 0.00 H ATOM 120 N CYS A 278 10.225 95.278 -3.876 1.00 61.45 N ATOM 121 CA CYS A 278 11.628 95.058 -4.252 1.00 62.18 C ATOM 122 C CYS A 278 12.652 95.544 -3.225 1.00 63.37 C ATOM 123 O CYS A 278 13.717 94.965 -3.108 1.00 61.28 O ATOM 124 CB CYS A 278 11.925 95.692 -5.615 1.00 63.77 C ATOM 125 SG CYS A 278 11.123 94.849 -7.003 1.00 65.90 S ATOM 126 H CYS A 278 9.630 95.876 -4.484 1.00 0.00 H ATOM 127 N LYS A 279 12.345 96.614 -2.497 1.00 68.23 N ATOM 128 CA LYS A 279 13.269 97.142 -1.478 1.00 69.84 C ATOM 129 C LYS A 279 13.123 96.344 -0.177 1.00 68.78 C ATOM 130 O LYS A 279 14.120 96.082 0.488 1.00 67.78 O ATOM 131 CB LYS A 279 13.062 98.646 -1.300 1.00 72.89 C ATOM 132 CG LYS A 279 13.589 99.306 -0.045 1.00 76.09 C ATOM 133 CD LYS A 279 12.627 100.413 0.376 1.00 79.57 C ATOM 134 CE LYS A 279 13.025 101.100 1.683 1.00 83.37 C ATOM 135 NZ LYS A 279 14.344 101.776 1.551 1.00 86.25 N ATOM 136 HZ1 LYS A 279 15.070 101.072 1.309 1.00 0.00 H ATOM 137 HZ2 LYS A 279 14.291 102.493 0.800 1.00 0.00 H ATOM 138 HZ3 LYS A 279 14.589 102.234 2.452 1.00 0.00 H ATOM 139 H LYS A 279 11.432 97.089 -2.650 1.00 0.00 H ATOM 140 N SER A 280 11.899 95.954 0.178 1.00 68.34 N ATOM 141 CA SER A 280 11.682 95.041 1.303 1.00 69.42 C ATOM 142 C SER A 280 12.437 93.751 1.104 1.00 67.55 C ATOM 143 O SER A 280 13.013 93.235 2.045 1.00 71.23 O ATOM 144 CB SER A 280 10.210 94.699 1.487 1.00 71.17 C ATOM 145 OG SER A 280 9.453 95.873 1.734 1.00 79.09 O ATOM 146 HG SER A 280 9.546 96.492 0.967 1.00 0.00 H ATOM 147 H SER A 280 11.079 96.306 -0.356 1.00 0.00 H ATOM 148 N TYR A 281 12.436 93.234 -0.121 1.00 65.40 N ATOM 149 CA TYR A 281 13.181 92.024 -0.442 1.00 62.54 C ATOM 150 C TYR A 281 14.673 92.254 -0.325 1.00 61.26 C ATOM 151 O TYR A 281 15.376 91.437 0.264 1.00 62.73 O ATOM 152 CB TYR A 281 12.852 91.506 -1.841 1.00 64.17 C ATOM 153 CG TYR A 281 13.712 90.328 -2.215 1.00 65.93 C ATOM 154 CD1 TYR A 281 13.530 89.104 -1.605 1.00 68.35 C ATOM 155 CD2 TYR A 281 14.736 90.450 -3.138 1.00 69.19 C ATOM 156 CE1 TYR A 281 14.332 88.027 -1.915 1.00 69.09 C ATOM 157 CE2 TYR A 281 15.541 89.376 -3.454 1.00 70.27 C ATOM 158 CZ TYR A 281 15.335 88.172 -2.830 1.00 70.89 C ATOM 159 OH TYR A 281 16.133 87.098 -3.124 1.00 78.13 O ATOM 160 HH TYR A 281 15.846 86.318 -2.586 1.00 0.00 H ATOM 161 H TYR A 281 11.889 93.706 -0.869 1.00 0.00 H ATOM 162 N ARG A 282 15.143 93.368 -0.881 1.00 62.48 N ATOM 163 CA ARG A 282 16.567 93.750 -0.856 1.00 64.69 C ATOM 164 C ARG A 282 17.130 93.795 0.558 1.00 65.56 C ATOM 165 O ARG A 282 18.217 93.287 0.825 1.00 66.52 O ATOM 166 CB ARG A 282 16.776 95.125 -1.520 1.00 67.94 C ATOM 167 CG ARG A 282 18.194 95.378 -1.997 1.00 69.30 C ATOM 168 CD ARG A 282 18.449 96.827 -2.374 1.00 70.29 C ATOM 169 NE ARG A 282 19.807 96.940 -2.914 1.00 71.39 N ATOM 170 CZ ARG A 282 20.511 98.064 -3.027 1.00 73.61 C ATOM 171 NH1 ARG A 282 21.748 98.008 -3.527 1.00 73.74 N ATOM 172 NH2 ARG A 282 20.003 99.237 -2.650 1.00 75.95 N ATOM 173 HE ARG A 282 20.262 96.063 -3.238 1.00 0.00 H ATOM 174 HH12 ARG A 282 22.311 98.878 -3.622 1.00 0.00 H ATOM 175 HH11 ARG A 282 22.149 97.095 -3.822 1.00 0.00 H ATOM 176 HH22 ARG A 282 20.569 100.104 -2.746 1.00 0.00 H ATOM 177 HH21 ARG A 282 19.040 99.285 -2.259 1.00 0.00 H ATOM 178 H ARG A 282 14.471 94.002 -1.358 1.00 0.00 H ATOM 179 N GLU A 283 16.365 94.395 1.456 1.00 66.66 N ATOM 180 CA GLU A 283 16.735 94.470 2.852 1.00 68.12 C ATOM 181 C GLU A 283 16.733 93.107 3.534 1.00 65.66 C ATOM 182 O GLU A 283 17.637 92.803 4.294 1.00 66.27 O ATOM 183 CB GLU A 283 15.813 95.458 3.567 1.00 72.30 C ATOM 184 CG GLU A 283 16.073 96.893 3.095 1.00 76.47 C ATOM 185 CD GLU A 283 15.045 97.915 3.551 1.00 79.60 C ATOM 186 OE1 GLU A 283 13.917 97.530 3.937 1.00 80.76 O ATOM 187 OE2 GLU A 283 15.372 99.123 3.538 1.00 83.04 O ATOM 188 H GLU A 283 15.470 94.826 1.148 1.00 0.00 H ATOM 189 N THR A 284 15.757 92.265 3.217 1.00 64.01 N ATOM 190 CA THR A 284 15.565 90.998 3.928 1.00 62.65 C ATOM 191 C THR A 284 16.045 89.734 3.204 1.00 60.85 C ATOM 192 O THR A 284 15.554 88.637 3.498 1.00 60.76 O ATOM 193 CB THR A 284 14.078 90.806 4.228 1.00 61.27 C ATOM 194 OG1 THR A 284 13.370 90.696 2.985 1.00 59.99 O ATOM 195 CG2 THR A 284 13.552 91.968 5.057 1.00 63.09 C ATOM 196 HG1 THR A 284 13.504 91.522 2.456 1.00 0.00 H ATOM 197 H THR A 284 15.110 92.512 2.441 1.00 0.00 H ATOM 198 N CYS A 285 16.998 89.857 2.288 1.00 60.83 N ATOM 199 CA CYS A 285 17.425 88.683 1.493 1.00 59.55 C ATOM 200 C CYS A 285 18.517 87.836 2.145 1.00 56.32 C ATOM 201 O CYS A 285 18.868 86.809 1.597 1.00 51.20 O ATOM 202 CB CYS A 285 17.891 89.095 0.090 1.00 60.61 C ATOM 203 SG CYS A 285 19.400 90.080 0.121 1.00 63.76 S ATOM 204 H CYS A 285 17.446 90.782 2.128 1.00 0.00 H ATOM 205 N GLN A 286 19.056 88.272 3.281 1.00 58.33 N ATOM 206 CA GLN A 286 20.129 87.567 4.013 1.00 58.93 C ATOM 207 C GLN A 286 21.419 87.449 3.212 1.00 60.00 C ATOM 208 O GLN A 286 22.426 88.014 3.610 1.00 62.98 O ATOM 209 CB GLN A 286 19.683 86.197 4.529 1.00 56.88 C ATOM 210 CG GLN A 286 20.703 85.495 5.416 1.00 58.53 C ATOM 211 CD GLN A 286 20.225 84.165 5.962 1.00 60.26 C ATOM 212 OE1 GLN A 286 19.446 83.451 5.324 1.00 61.56 O ATOM 213 NE2 GLN A 286 20.702 83.817 7.151 1.00 63.75 N ATOM 214 HE22 GLN A 286 21.357 84.449 7.654 1.00 0.00 H ATOM 215 HE21 GLN A 286 20.421 82.912 7.579 1.00 0.00 H ATOM 216 H GLN A 286 18.700 89.165 3.678 1.00 0.00 H ATOM 217 N LEU A 287 21.390 86.703 2.106 1.00 60.27 N ATOM 218 CA LEU A 287 22.541 86.557 1.213 1.00 60.36 C ATOM 219 C LEU A 287 22.424 87.481 0.002 1.00 61.78 C ATOM 220 O LEU A 287 21.472 87.391 -0.764 1.00 59.48 O ATOM 221 CB LEU A 287 22.692 85.107 0.756 1.00 57.86 C ATOM 222 CG LEU A 287 22.644 84.070 1.869 1.00 58.10 C ATOM 223 CD1 LEU A 287 22.694 82.654 1.312 1.00 57.60 C ATOM 224 CD2 LEU A 287 23.754 84.312 2.872 1.00 58.80 C ATOM 225 H LEU A 287 20.510 86.203 1.868 1.00 0.00 H ATOM 226 N ARG A 288 23.407 88.367 -0.140 1.00 66.01 N ATOM 227 CA ARG A 288 23.500 89.285 -1.263 1.00 68.95 C ATOM 228 C ARG A 288 23.849 88.506 -2.521 1.00 69.34 C ATOM 229 O ARG A 288 24.784 87.722 -2.506 1.00 67.05 O ATOM 230 CB ARG A 288 24.548 90.381 -0.972 1.00 74.13 C ATOM 231 CG ARG A 288 23.981 91.557 -0.170 1.00 79.92 C ATOM 232 CD ARG A 288 24.937 92.155 0.887 1.00 86.61 C ATOM 233 NE ARG A 288 26.329 92.303 0.436 1.00 91.24 N ATOM 234 CZ ARG A 288 26.778 93.200 -0.449 1.00 95.41 C ATOM 235 NH1 ARG A 288 25.961 94.070 -1.040 1.00 97.54 N ATOM 236 NH2 ARG A 288 28.069 93.213 -0.773 1.00 99.23 N ATOM 237 HE ARG A 288 27.029 91.650 0.843 1.00 0.00 H ATOM 238 HH12 ARG A 288 26.339 94.756 -1.724 1.00 0.00 H ATOM 239 HH11 ARG A 288 24.945 94.063 -0.817 1.00 0.00 H ATOM 240 HH22 ARG A 288 28.426 93.907 -1.460 1.00 0.00 H ATOM 241 HH21 ARG A 288 28.721 92.529 -0.339 1.00 0.00 H ATOM 242 H ARG A 288 24.147 88.404 0.590 1.00 0.00 H ATOM 243 N LEU A 289 23.094 88.725 -3.605 1.00 71.74 N ATOM 244 CA LEU A 289 23.321 88.050 -4.899 1.00 70.77 C ATOM 245 C LEU A 289 24.745 88.181 -5.406 1.00 73.17 C ATOM 246 O LEU A 289 25.301 87.209 -5.900 1.00 73.67 O ATOM 247 CB LEU A 289 22.389 88.596 -5.975 1.00 70.13 C ATOM 248 CG LEU A 289 22.508 87.919 -7.346 1.00 69.95 C ATOM 249 CD1 LEU A 289 22.016 86.488 -7.301 1.00 68.03 C ATOM 250 CD2 LEU A 289 21.729 88.706 -8.377 1.00 71.76 C ATOM 251 H LEU A 289 22.309 89.404 -3.532 1.00 0.00 H ATOM 252 N GLU A 290 25.313 89.382 -5.297 1.00 76.77 N ATOM 253 CA GLU A 290 26.713 89.613 -5.654 1.00 83.46 C ATOM 254 C GLU A 290 27.643 88.651 -4.913 1.00 82.43 C ATOM 255 O GLU A 290 28.514 88.029 -5.515 1.00 85.64 O ATOM 256 CB GLU A 290 27.138 91.049 -5.356 1.00 90.06 C ATOM 257 CG GLU A 290 28.507 91.403 -5.939 1.00 97.18 C ATOM 258 CD GLU A 290 28.545 92.744 -6.661 1.00104.41 C ATOM 259 OE1 GLU A 290 27.505 93.204 -7.193 1.00105.60 O ATOM 260 OE2 GLU A 290 29.641 93.340 -6.715 1.00109.16 O ATOM 261 H GLU A 290 24.744 90.179 -4.948 1.00 0.00 H ATOM 262 N ASP A 291 27.441 88.526 -3.607 1.00 77.25 N ATOM 263 CA ASP A 291 28.286 87.661 -2.797 1.00 73.96 C ATOM 264 C ASP A 291 28.150 86.182 -3.209 1.00 69.34 C ATOM 265 O ASP A 291 29.152 85.482 -3.371 1.00 66.11 O ATOM 266 CB ASP A 291 27.947 87.812 -1.315 1.00 73.99 C ATOM 267 CG ASP A 291 28.205 89.203 -0.774 1.00 74.55 C ATOM 268 OD1 ASP A 291 28.789 90.045 -1.473 1.00 73.61 O ATOM 269 OD2 ASP A 291 27.784 89.425 0.375 1.00 75.64 O ATOM 270 H ASP A 291 26.667 89.054 -3.156 1.00 0.00 H ATOM 271 N LEU A 292 26.909 85.723 -3.376 1.00 66.21 N ATOM 272 CA LEU A 292 26.640 84.356 -3.796 1.00 65.18 C ATOM 273 C LEU A 292 27.390 84.003 -5.080 1.00 67.33 C ATOM 274 O LEU A 292 28.096 82.992 -5.124 1.00 66.32 O ATOM 275 CB LEU A 292 25.132 84.130 -3.981 1.00 63.62 C ATOM 276 CG LEU A 292 24.304 84.011 -2.693 1.00 62.36 C ATOM 277 CD1 LEU A 292 22.812 83.922 -2.998 1.00 60.38 C ATOM 278 CD2 LEU A 292 24.728 82.807 -1.851 1.00 61.14 C ATOM 279 H LEU A 292 26.108 86.363 -3.200 1.00 0.00 H ATOM 280 N LEU A 293 27.262 84.852 -6.101 1.00 69.02 N ATOM 281 CA LEU A 293 27.876 84.603 -7.413 1.00 71.11 C ATOM 282 C LEU A 293 29.399 84.621 -7.359 1.00 75.19 C ATOM 283 O LEU A 293 30.030 83.798 -7.995 1.00 77.04 O ATOM 284 CB LEU A 293 27.410 85.632 -8.443 1.00 71.27 C ATOM 285 CG LEU A 293 25.915 85.710 -8.772 1.00 68.45 C ATOM 286 CD1 LEU A 293 25.624 86.991 -9.528 1.00 70.78 C ATOM 287 CD2 LEU A 293 25.437 84.521 -9.568 1.00 67.16 C ATOM 288 H LEU A 293 26.708 85.721 -5.964 1.00 0.00 H ATOM 289 N ARG A 294 29.979 85.557 -6.615 1.00 80.06 N ATOM 290 CA ARG A 294 31.435 85.635 -6.432 1.00 87.07 C ATOM 291 C ARG A 294 32.003 84.389 -5.731 1.00 85.39 C ATOM 292 O ARG A 294 33.063 83.884 -6.117 1.00 90.27 O ATOM 293 CB ARG A 294 31.795 86.904 -5.641 1.00 95.69 C ATOM 294 CG ARG A 294 33.283 87.228 -5.514 1.00105.39 C ATOM 295 CD ARG A 294 33.533 88.658 -4.988 1.00114.29 C ATOM 296 NE ARG A 294 32.589 89.081 -3.932 1.00118.48 N ATOM 297 CZ ARG A 294 32.576 88.643 -2.661 1.00121.30 C ATOM 298 NH1 ARG A 294 33.462 87.744 -2.218 1.00123.36 N ATOM 299 NH2 ARG A 294 31.651 89.101 -1.814 1.00119.53 N ATOM 300 HE ARG A 294 31.868 89.782 -4.197 1.00 0.00 H ATOM 301 HH12 ARG A 294 33.428 87.424 -1.229 1.00 0.00 H ATOM 302 HH11 ARG A 294 34.185 87.365 -2.862 1.00 0.00 H ATOM 303 HH22 ARG A 294 31.636 88.766 -0.830 1.00 0.00 H ATOM 304 HH21 ARG A 294 30.946 89.793 -2.139 1.00 0.00 H ATOM 305 H ARG A 294 29.378 86.263 -6.143 1.00 0.00 H ATOM 306 N GLN A 295 31.284 83.886 -4.727 1.00 81.20 N ATOM 307 CA GLN A 295 31.664 82.663 -4.012 1.00 77.55 C ATOM 308 C GLN A 295 31.563 81.360 -4.810 1.00 74.11 C ATOM 309 O GLN A 295 32.098 80.361 -4.365 1.00 71.29 O ATOM 310 CB GLN A 295 30.816 82.511 -2.734 1.00 77.41 C ATOM 311 CG GLN A 295 31.065 83.548 -1.656 1.00 78.24 C ATOM 312 CD GLN A 295 32.517 83.570 -1.211 1.00 82.55 C ATOM 313 OE1 GLN A 295 33.107 82.535 -0.894 1.00 79.24 O ATOM 314 NE2 GLN A 295 33.113 84.770 -1.223 1.00 87.10 N ATOM 315 HE22 GLN A 295 32.574 85.616 -1.498 1.00 0.00 H ATOM 316 HE21 GLN A 295 34.115 84.856 -0.957 1.00 0.00 H ATOM 317 H GLN A 295 30.417 84.382 -4.439 1.00 0.00 H ATOM 318 N ARG A 296 30.892 81.344 -5.961 1.00 74.69 N ATOM 319 CA ARG A 296 30.731 80.106 -6.756 1.00 75.71 C ATOM 320 C ARG A 296 32.037 79.359 -7.013 1.00 79.03 C ATOM 321 O ARG A 296 32.081 78.131 -6.900 1.00 79.30 O ATOM 322 CB ARG A 296 30.035 80.383 -8.085 1.00 76.59 C ATOM 323 CG ARG A 296 28.561 80.680 -7.936 1.00 77.88 C ATOM 324 CD ARG A 296 27.866 80.857 -9.277 1.00 81.78 C ATOM 325 NE ARG A 296 26.411 80.709 -9.156 1.00 84.40 N ATOM 326 CZ ARG A 296 25.542 80.697 -10.175 1.00 87.34 C ATOM 327 NH1 ARG A 296 25.952 80.832 -11.439 1.00 90.99 N ATOM 328 NH2 ARG A 296 24.240 80.548 -9.933 1.00 86.88 N ATOM 329 HE ARG A 296 26.022 80.605 -8.197 1.00 0.00 H ATOM 330 HH12 ARG A 296 25.259 80.820 -12.215 1.00 0.00 H ATOM 331 HH11 ARG A 296 26.964 80.949 -11.648 1.00 0.00 H ATOM 332 HH22 ARG A 296 23.562 80.538 -10.722 1.00 0.00 H ATOM 333 HH21 ARG A 296 23.902 80.442 -8.955 1.00 0.00 H ATOM 334 H ARG A 296 30.469 82.227 -6.311 1.00 0.00 H ATOM 335 N SER A 297 33.098 80.099 -7.333 1.00 83.36 N ATOM 336 CA SER A 297 34.432 79.508 -7.528 1.00 85.19 C ATOM 337 C SER A 297 35.006 78.860 -6.270 1.00 83.32 C ATOM 338 O SER A 297 35.908 78.041 -6.378 1.00 86.99 O ATOM 339 CB SER A 297 35.424 80.554 -8.045 1.00 89.49 C ATOM 340 OG SER A 297 35.726 81.521 -7.051 1.00 91.87 O ATOM 341 HG SER A 297 36.368 82.180 -7.417 1.00 0.00 H ATOM 342 H SER A 297 32.980 81.126 -7.449 1.00 0.00 H ATOM 343 N ASN A 298 34.506 79.258 -5.097 1.00 79.50 N ATOM 344 CA ASN A 298 34.918 78.734 -3.790 1.00 75.36 C ATOM 345 C ASN A 298 34.041 77.513 -3.417 1.00 69.59 C ATOM 346 O ASN A 298 32.918 77.667 -2.953 1.00 67.26 O ATOM 347 CB ASN A 298 34.804 79.885 -2.773 1.00 76.72 C ATOM 348 CG ASN A 298 35.273 79.519 -1.384 1.00 78.83 C ATOM 349 OD1 ASN A 298 36.040 78.577 -1.188 1.00 80.60 O ATOM 350 ND2 ASN A 298 34.804 80.289 -0.394 1.00 79.49 N ATOM 351 HD22 ASN A 298 34.157 81.075 -0.608 1.00 0.00 H ATOM 352 HD21 ASN A 298 35.086 80.101 0.589 1.00 0.00 H ATOM 353 H ASN A 298 33.771 79.993 -5.111 1.00 0.00 H ATOM 354 N ILE A 299 34.583 76.313 -3.624 1.00 67.20 N ATOM 355 CA ILE A 299 33.850 75.032 -3.606 1.00 64.15 C ATOM 356 C ILE A 299 34.505 74.098 -2.581 1.00 66.91 C ATOM 357 O ILE A 299 35.728 74.097 -2.470 1.00 71.33 O ATOM 358 CB ILE A 299 33.933 74.376 -5.012 1.00 62.11 C ATOM 359 CG1 ILE A 299 33.127 75.195 -6.018 1.00 61.10 C ATOM 360 CG2 ILE A 299 33.461 72.925 -5.003 1.00 61.46 C ATOM 361 CD1 ILE A 299 33.544 74.984 -7.448 1.00 63.55 C ATOM 362 H ILE A 299 35.605 76.276 -3.814 1.00 0.00 H ATOM 363 N PHE A 300 33.728 73.282 -1.854 1.00 66.26 N ATOM 364 CA PHE A 300 34.326 72.389 -0.843 1.00 64.45 C ATOM 365 C PHE A 300 35.269 71.367 -1.493 1.00 67.47 C ATOM 366 O PHE A 300 34.960 70.802 -2.560 1.00 66.86 O ATOM 367 CB PHE A 300 33.265 71.676 0.001 1.00 61.52 C ATOM 368 CG PHE A 300 32.577 72.567 1.001 1.00 61.25 C ATOM 369 CD1 PHE A 300 33.264 73.052 2.105 1.00 61.39 C ATOM 370 CD2 PHE A 300 31.238 72.927 0.849 1.00 59.72 C ATOM 371 CE1 PHE A 300 32.643 73.883 3.028 1.00 58.93 C ATOM 372 CE2 PHE A 300 30.619 73.751 1.775 1.00 57.19 C ATOM 373 CZ PHE A 300 31.328 74.227 2.866 1.00 57.13 C ATOM 374 H PHE A 300 32.699 73.279 -2.003 1.00 0.00 H ATOM 375 N SER A 301 36.424 71.168 -0.851 1.00 69.62 N ATOM 376 CA SER A 301 37.405 70.175 -1.275 1.00 72.49 C ATOM 377 C SER A 301 36.921 68.815 -0.862 1.00 73.91 C ATOM 378 O SER A 301 36.144 68.709 0.085 1.00 77.28 O ATOM 379 CB SER A 301 38.739 70.426 -0.594 1.00 73.98 C ATOM 380 OG SER A 301 38.636 70.213 0.802 1.00 72.08 O ATOM 381 HG SER A 301 37.962 70.831 1.180 1.00 0.00 H ATOM 382 H SER A 301 36.633 71.746 -0.012 1.00 0.00 H ATOM 383 N ARG A 302 37.411 67.772 -1.530 1.00 77.54 N ATOM 384 CA ARG A 302 36.994 66.402 -1.218 1.00 78.42 C ATOM 385 C ARG A 302 37.272 66.045 0.231 1.00 76.22 C ATOM 386 O ARG A 302 36.513 65.280 0.836 1.00 76.72 O ATOM 387 CB ARG A 302 37.659 65.381 -2.130 1.00 83.69 C ATOM 388 CG ARG A 302 37.033 63.990 -2.011 1.00 89.18 C ATOM 389 CD ARG A 302 37.998 62.857 -2.364 1.00 97.09 C ATOM 390 NE ARG A 302 37.960 62.489 -3.790 1.00100.86 N ATOM 391 CZ ARG A 302 38.686 61.522 -4.345 1.00102.54 C ATOM 392 NH1 ARG A 302 39.540 60.803 -3.612 1.00104.90 N ATOM 393 NH2 ARG A 302 38.563 61.273 -5.647 1.00103.26 N ATOM 394 HE ARG A 302 37.318 63.025 -4.409 1.00 0.00 H ATOM 395 HH12 ARG A 302 40.102 60.050 -4.058 1.00 0.00 H ATOM 396 HH11 ARG A 302 39.643 60.996 -2.595 1.00 0.00 H ATOM 397 HH22 ARG A 302 39.127 60.519 -6.088 1.00 0.00 H ATOM 398 HH21 ARG A 302 37.903 61.833 -6.223 1.00 0.00 H ATOM 399 H ARG A 302 38.104 67.933 -2.289 1.00 0.00 H ATOM 400 N GLU A 303 38.331 66.623 0.797 1.00 75.18 N ATOM 401 CA GLU A 303 38.641 66.412 2.213 1.00 74.72 C ATOM 402 C GLU A 303 37.549 67.010 3.078 1.00 67.98 C ATOM 403 O GLU A 303 37.088 66.369 4.009 1.00 65.06 O ATOM 404 CB GLU A 303 40.025 66.962 2.609 1.00 80.62 C ATOM 405 CG GLU A 303 41.208 66.176 2.021 1.00 85.53 C ATOM 406 CD GLU A 303 41.341 66.296 0.497 1.00 89.32 C ATOM 407 OE1 GLU A 303 41.253 67.434 -0.055 1.00 87.64 O ATOM 408 OE2 GLU A 303 41.506 65.236 -0.151 1.00 93.28 O ATOM 409 H GLU A 303 38.947 67.234 0.224 1.00 0.00 H ATOM 410 N GLU A 304 37.116 68.218 2.740 1.00 66.43 N ATOM 411 CA GLU A 304 36.052 68.909 3.487 1.00 64.70 C ATOM 412 C GLU A 304 34.694 68.242 3.386 1.00 59.85 C ATOM 413 O GLU A 304 33.974 68.105 4.400 1.00 57.07 O ATOM 414 CB GLU A 304 35.926 70.352 3.015 1.00 66.92 C ATOM 415 CG GLU A 304 37.074 71.215 3.494 1.00 70.17 C ATOM 416 CD GLU A 304 37.023 72.598 2.914 1.00 71.55 C ATOM 417 OE1 GLU A 304 36.978 73.549 3.722 1.00 73.83 O ATOM 418 OE2 GLU A 304 37.013 72.727 1.662 1.00 72.04 O ATOM 419 H GLU A 304 37.543 68.693 1.919 1.00 0.00 H ATOM 420 N VAL A 305 34.358 67.824 2.170 1.00 56.93 N ATOM 421 CA VAL A 305 33.133 67.079 1.945 1.00 55.96 C ATOM 422 C VAL A 305 33.093 65.828 2.841 1.00 57.58 C ATOM 423 O VAL A 305 32.118 65.615 3.574 1.00 57.65 O ATOM 424 CB VAL A 305 32.964 66.693 0.473 1.00 54.50 C ATOM 425 CG1 VAL A 305 31.756 65.783 0.301 1.00 54.22 C ATOM 426 CG2 VAL A 305 32.788 67.936 -0.367 1.00 53.52 C ATOM 427 H VAL A 305 34.983 68.034 1.366 1.00 0.00 H ATOM 428 N THR A 306 34.154 65.023 2.799 1.00 58.37 N ATOM 429 CA THR A 306 34.274 63.863 3.692 1.00 58.48 C ATOM 430 C THR A 306 34.110 64.228 5.170 1.00 57.68 C ATOM 431 O THR A 306 33.536 63.467 5.941 1.00 56.53 O ATOM 432 CB THR A 306 35.618 63.162 3.493 1.00 59.50 C ATOM 433 OG1 THR A 306 35.738 62.824 2.114 1.00 58.85 O ATOM 434 CG2 THR A 306 35.728 61.883 4.362 1.00 61.06 C ATOM 435 HG1 THR A 306 35.698 63.649 1.568 1.00 0.00 H ATOM 436 H THR A 306 34.915 65.221 2.118 1.00 0.00 H ATOM 437 N GLY A 307 34.620 65.387 5.553 1.00 58.35 N ATOM 438 CA GLY A 307 34.432 65.893 6.899 1.00 60.14 C ATOM 439 C GLY A 307 32.974 66.000 7.269 1.00 61.41 C ATOM 440 O GLY A 307 32.568 65.509 8.323 1.00 63.58 O ATOM 441 H GLY A 307 35.169 65.949 4.872 1.00 0.00 H ATOM 442 N TYR A 308 32.194 66.647 6.402 1.00 61.34 N ATOM 443 CA TYR A 308 30.746 66.793 6.608 1.00 59.66 C ATOM 444 C TYR A 308 29.990 65.458 6.559 1.00 61.93 C ATOM 445 O TYR A 308 28.991 65.276 7.249 1.00 65.84 O ATOM 446 CB TYR A 308 30.142 67.726 5.556 1.00 57.11 C ATOM 447 CG TYR A 308 30.285 69.204 5.830 1.00 55.86 C ATOM 448 CD1 TYR A 308 29.668 69.793 6.927 1.00 54.77 C ATOM 449 CD2 TYR A 308 30.985 70.034 4.957 1.00 55.22 C ATOM 450 CE1 TYR A 308 29.771 71.157 7.166 1.00 53.00 C ATOM 451 CE2 TYR A 308 31.085 71.396 5.190 1.00 54.08 C ATOM 452 CZ TYR A 308 30.473 71.949 6.299 1.00 52.88 C ATOM 453 OH TYR A 308 30.581 73.301 6.517 1.00 54.46 O ATOM 454 HH TYR A 308 30.093 73.541 7.344 1.00 0.00 H ATOM 455 H TYR A 308 32.625 67.062 5.551 1.00 0.00 H ATOM 456 N GLN A 309 30.435 64.547 5.704 1.00 61.78 N ATOM 457 CA GLN A 309 29.787 63.253 5.567 1.00 61.48 C ATOM 458 C GLN A 309 30.040 62.386 6.773 1.00 62.47 C ATOM 459 O GLN A 309 29.227 61.528 7.089 1.00 62.51 O ATOM 460 CB GLN A 309 30.302 62.534 4.334 1.00 62.31 C ATOM 461 CG GLN A 309 29.888 63.171 3.024 1.00 61.39 C ATOM 462 CD GLN A 309 30.544 62.523 1.833 1.00 62.96 C ATOM 463 OE1 GLN A 309 31.632 61.960 1.925 1.00 66.93 O ATOM 464 NE2 GLN A 309 29.888 62.605 0.700 1.00 63.60 N ATOM 465 HE22 GLN A 309 28.969 63.091 0.665 1.00 0.00 H ATOM 466 HE21 GLN A 309 30.287 62.184 -0.163 1.00 0.00 H ATOM 467 H GLN A 309 31.267 64.763 5.118 1.00 0.00 H ATOM 468 N ARG A 310 31.188 62.593 7.420 1.00 64.81 N ATOM 469 CA ARG A 310 31.576 61.823 8.607 1.00 67.32 C ATOM 470 C ARG A 310 30.713 62.192 9.813 1.00 65.91 C ATOM 471 O ARG A 310 30.644 61.427 10.760 1.00 67.22 O ATOM 472 CB ARG A 310 33.074 62.029 8.957 1.00 70.12 C ATOM 473 CG ARG A 310 34.079 61.218 8.130 1.00 73.07 C ATOM 474 CD ARG A 310 34.757 60.117 8.943 1.00 76.87 C ATOM 475 NE ARG A 310 35.913 60.580 9.731 1.00 79.26 N ATOM 476 CZ ARG A 310 36.307 60.107 10.928 1.00 83.49 C ATOM 477 NH1 ARG A 310 35.643 59.146 11.590 1.00 85.69 N ATOM 478 NH2 ARG A 310 37.392 60.625 11.511 1.00 84.47 N ATOM 479 HE ARG A 310 36.481 61.349 9.321 1.00 0.00 H ATOM 480 HH12 ARG A 310 35.990 58.816 12.513 1.00 0.00 H ATOM 481 HH11 ARG A 310 34.782 58.732 11.180 1.00 0.00 H ATOM 482 HH22 ARG A 310 37.706 60.268 12.436 1.00 0.00 H ATOM 483 HH21 ARG A 310 37.922 61.386 11.040 1.00 0.00 H ATOM 484 H ARG A 310 31.833 63.329 7.069 1.00 0.00 H ATOM 485 N LYS A 311 30.060 63.351 9.777 1.00 64.15 N ATOM 486 CA LYS A 311 29.284 63.838 10.915 1.00 65.70 C ATOM 487 C LYS A 311 28.038 63.019 11.239 1.00 66.02 C ATOM 488 O LYS A 311 27.524 62.250 10.410 1.00 64.98 O ATOM 489 CB LYS A 311 28.880 65.303 10.709 1.00 64.96 C ATOM 490 CG LYS A 311 30.059 66.260 10.703 1.00 65.62 C ATOM 491 CD LYS A 311 29.624 67.661 10.320 1.00 65.21 C ATOM 492 CE LYS A 311 30.804 68.603 10.152 1.00 66.20 C ATOM 493 NZ LYS A 311 31.436 68.984 11.449 1.00 70.32 N ATOM 494 HZ1 LYS A 311 30.733 69.461 12.049 1.00 0.00 H ATOM 495 HZ2 LYS A 311 31.780 68.129 11.930 1.00 0.00 H ATOM 496 HZ3 LYS A 311 32.234 69.627 11.269 1.00 0.00 H ATOM 497 H LYS A 311 30.103 63.928 8.913 1.00 0.00 H ATOM 498 N SER A 312 27.570 63.196 12.471 1.00 65.31 N ATOM 499 CA SER A 312 26.325 62.608 12.893 1.00 66.95 C ATOM 500 C SER A 312 25.198 63.250 12.110 1.00 65.63 C ATOM 501 O SER A 312 25.288 64.414 11.737 1.00 63.49 O ATOM 502 CB SER A 312 26.114 62.829 14.387 1.00 69.59 C ATOM 503 OG SER A 312 24.938 62.175 14.841 1.00 72.73 O ATOM 504 HG SER A 312 24.827 62.335 15.812 1.00 0.00 H ATOM 505 H SER A 312 28.115 63.772 13.144 1.00 0.00 H ATOM 506 N MET A 313 24.139 62.487 11.850 1.00 67.55 N ATOM 507 CA MET A 313 22.919 63.039 11.267 1.00 65.73 C ATOM 508 C MET A 313 22.458 64.177 12.147 1.00 65.31 C ATOM 509 O MET A 313 22.082 65.227 11.658 1.00 62.91 O ATOM 510 CB MET A 313 21.819 61.973 11.109 1.00 67.81 C ATOM 511 CG MET A 313 21.254 61.381 12.393 1.00 71.16 C ATOM 512 SD MET A 313 20.266 59.889 12.135 1.00 77.23 S ATOM 513 CE MET A 313 19.125 60.506 10.877 1.00 76.65 C ATOM 514 H MET A 313 24.181 61.471 12.068 1.00 0.00 H ATOM 515 N TRP A 314 22.560 63.967 13.455 1.00 69.11 N ATOM 516 CA TRP A 314 22.161 64.940 14.459 1.00 69.95 C ATOM 517 C TRP A 314 22.895 66.262 14.373 1.00 67.74 C ATOM 518 O TRP A 314 22.282 67.299 14.574 1.00 68.41 O ATOM 519 CB TRP A 314 22.362 64.352 15.841 1.00 72.50 C ATOM 520 CG TRP A 314 21.343 63.364 16.200 1.00 75.74 C ATOM 521 CD1 TRP A 314 21.487 62.006 16.257 1.00 78.75 C ATOM 522 CD2 TRP A 314 20.003 63.648 16.588 1.00 78.95 C ATOM 523 NE1 TRP A 314 20.308 61.422 16.668 1.00 82.13 N ATOM 524 CE2 TRP A 314 19.380 62.408 16.885 1.00 82.27 C ATOM 525 CE3 TRP A 314 19.267 64.834 16.736 1.00 79.76 C ATOM 526 CZ2 TRP A 314 18.051 62.317 17.317 1.00 84.23 C ATOM 527 CZ3 TRP A 314 17.940 64.747 17.156 1.00 82.83 C ATOM 528 CH2 TRP A 314 17.348 63.489 17.444 1.00 84.78 C ATOM 529 HE1 TRP A 314 20.149 60.402 16.793 1.00 0.00 H ATOM 530 H TRP A 314 22.946 63.057 13.778 1.00 0.00 H ATOM 531 N GLU A 315 24.187 66.244 14.075 1.00 66.62 N ATOM 532 CA GLU A 315 24.922 67.497 13.981 1.00 67.21 C ATOM 533 C GLU A 315 24.531 68.238 12.717 1.00 64.22 C ATOM 534 O GLU A 315 24.265 69.435 12.764 1.00 63.98 O ATOM 535 CB GLU A 315 26.435 67.300 14.044 1.00 69.51 C ATOM 536 CG GLU A 315 27.139 68.410 14.802 1.00 72.31 C ATOM 537 CD GLU A 315 28.388 68.888 14.109 1.00 76.26 C ATOM 538 OE1 GLU A 315 29.329 68.072 13.969 1.00 79.59 O ATOM 539 OE2 GLU A 315 28.425 70.088 13.728 1.00 79.50 O ATOM 540 H GLU A 315 24.673 65.339 13.909 1.00 0.00 H ATOM 541 N MET A 316 24.481 67.518 11.597 1.00 63.49 N ATOM 542 CA MET A 316 23.959 68.074 10.356 1.00 61.97 C ATOM 543 C MET A 316 22.528 68.611 10.477 1.00 63.06 C ATOM 544 O MET A 316 22.232 69.650 9.899 1.00 60.44 O ATOM 545 CB MET A 316 24.025 67.047 9.226 1.00 60.33 C ATOM 546 CG MET A 316 25.410 66.779 8.690 1.00 59.36 C ATOM 547 SD MET A 316 26.269 68.271 8.206 1.00 58.02 S ATOM 548 CE MET A 316 25.317 68.770 6.785 1.00 59.14 C ATOM 549 H MET A 316 24.823 66.536 11.609 1.00 0.00 H ATOM 550 N TRP A 317 21.645 67.922 11.208 1.00 67.34 N ATOM 551 CA TRP A 317 20.285 68.428 11.395 1.00 69.54 C ATOM 552 C TRP A 317 20.340 69.743 12.140 1.00 67.59 C ATOM 553 O TRP A 317 19.642 70.673 11.767 1.00 68.56 O ATOM 554 CB TRP A 317 19.356 67.453 12.116 1.00 77.51 C ATOM 555 CG TRP A 317 17.961 68.056 12.371 1.00 88.09 C ATOM 556 CD1 TRP A 317 16.975 68.298 11.432 1.00 90.17 C ATOM 557 CD2 TRP A 317 17.422 68.509 13.638 1.00 95.95 C ATOM 558 NE1 TRP A 317 15.860 68.859 12.041 1.00 92.57 N ATOM 559 CE2 TRP A 317 16.106 69.000 13.386 1.00 96.42 C ATOM 560 CE3 TRP A 317 17.916 68.534 14.962 1.00 99.58 C ATOM 561 CZ2 TRP A 317 15.281 69.514 14.412 1.00 99.93 C ATOM 562 CZ3 TRP A 317 17.091 69.049 15.985 1.00103.35 C ATOM 563 CH2 TRP A 317 15.788 69.533 15.697 1.00102.79 C ATOM 564 HE1 TRP A 317 14.980 69.129 11.557 1.00 0.00 H ATOM 565 H TRP A 317 21.927 67.022 11.646 1.00 0.00 H ATOM 566 N GLU A 318 21.192 69.840 13.159 1.00 68.68 N ATOM 567 CA GLU A 318 21.307 71.077 13.945 1.00 68.55 C ATOM 568 C GLU A 318 21.825 72.251 13.137 1.00 62.66 C ATOM 569 O GLU A 318 21.282 73.343 13.209 1.00 58.80 O ATOM 570 CB GLU A 318 22.184 70.870 15.169 1.00 72.68 C ATOM 571 CG GLU A 318 21.472 70.158 16.302 1.00 78.26 C ATOM 572 CD GLU A 318 22.391 69.944 17.492 1.00 84.89 C ATOM 573 OE1 GLU A 318 22.019 69.143 18.398 1.00 90.62 O ATOM 574 OE2 GLU A 318 23.499 70.553 17.504 1.00 84.94 O ATOM 575 H GLU A 318 21.788 69.024 13.404 1.00 0.00 H ATOM 576 N ARG A 319 22.864 72.016 12.358 1.00 61.06 N ATOM 577 CA ARG A 319 23.386 73.050 11.481 1.00 60.67 C ATOM 578 C ARG A 319 22.336 73.486 10.479 1.00 59.27 C ATOM 579 O ARG A 319 22.055 74.662 10.367 1.00 61.39 O ATOM 580 CB ARG A 319 24.616 72.557 10.739 1.00 60.73 C ATOM 581 CG ARG A 319 25.761 72.298 11.671 1.00 62.34 C ATOM 582 CD ARG A 319 27.066 72.257 10.947 1.00 63.24 C ATOM 583 NE ARG A 319 28.161 72.018 11.860 1.00 65.60 N ATOM 584 CZ ARG A 319 29.432 72.290 11.594 1.00 68.91 C ATOM 585 NH1 ARG A 319 29.806 72.818 10.433 1.00 70.23 N ATOM 586 NH2 ARG A 319 30.369 72.000 12.496 1.00 72.51 N ATOM 587 HE ARG A 319 27.937 71.605 12.788 1.00 0.00 H ATOM 588 HH12 ARG A 319 30.810 73.020 10.253 1.00 0.00 H ATOM 589 HH11 ARG A 319 29.094 73.029 9.704 1.00 0.00 H ATOM 590 HH22 ARG A 319 31.367 72.210 12.295 1.00 0.00 H ATOM 591 HH21 ARG A 319 30.102 71.563 13.401 1.00 0.00 H ATOM 592 H ARG A 319 23.315 71.079 12.372 1.00 0.00 H ATOM 593 N CYS A 320 21.763 72.529 9.761 1.00 57.66 N ATOM 594 CA CYS A 320 20.744 72.812 8.755 1.00 55.00 C ATOM 595 C CYS A 320 19.508 73.464 9.369 1.00 54.91 C ATOM 596 O CYS A 320 19.020 74.473 8.841 1.00 55.75 O ATOM 597 CB CYS A 320 20.359 71.539 8.019 1.00 54.87 C ATOM 598 SG CYS A 320 21.680 70.938 6.945 1.00 56.43 S ATOM 599 H CYS A 320 22.050 71.542 9.921 1.00 0.00 H ATOM 600 N ALA A 321 19.027 72.910 10.484 1.00 53.41 N ATOM 601 CA ALA A 321 17.875 73.468 11.190 1.00 53.36 C ATOM 602 C ALA A 321 18.148 74.873 11.699 1.00 54.54 C ATOM 603 O ALA A 321 17.254 75.710 11.686 1.00 52.66 O ATOM 604 CB ALA A 321 17.437 72.570 12.328 1.00 55.42 C ATOM 605 H ALA A 321 19.485 72.056 10.862 1.00 0.00 H ATOM 606 N HIS A 322 19.383 75.134 12.127 1.00 58.07 N ATOM 607 CA HIS A 322 19.775 76.479 12.529 1.00 61.31 C ATOM 608 C HIS A 322 19.694 77.422 11.350 1.00 59.82 C ATOM 609 O HIS A 322 18.964 78.388 11.399 1.00 62.15 O ATOM 610 CB HIS A 322 21.189 76.510 13.101 1.00 64.53 C ATOM 611 CG HIS A 322 21.657 77.885 13.461 1.00 69.40 C ATOM 612 ND1 HIS A 322 21.421 78.455 14.698 1.00 74.04 N ATOM 613 CD2 HIS A 322 22.335 78.810 12.742 1.00 71.19 C ATOM 614 CE1 HIS A 322 21.933 79.672 14.724 1.00 76.30 C ATOM 615 NE2 HIS A 322 22.482 79.916 13.546 1.00 76.08 N ATOM 616 H HIS A 322 20.080 74.364 12.175 1.00 0.00 H ATOM 617 N HIS A 323 20.429 77.113 10.289 1.00 58.42 N ATOM 618 CA HIS A 323 20.580 78.012 9.144 1.00 57.27 C ATOM 619 C HIS A 323 19.257 78.309 8.473 1.00 57.09 C ATOM 620 O HIS A 323 19.029 79.449 8.058 1.00 58.31 O ATOM 621 CB HIS A 323 21.568 77.452 8.109 1.00 56.73 C ATOM 622 CG HIS A 323 22.950 77.219 8.648 1.00 57.50 C ATOM 623 ND1 HIS A 323 23.556 78.068 9.549 1.00 58.28 N ATOM 624 CD2 HIS A 323 23.838 76.227 8.411 1.00 57.52 C ATOM 625 CE1 HIS A 323 24.748 77.598 9.856 1.00 59.54 C ATOM 626 NE2 HIS A 323 24.947 76.485 9.174 1.00 58.60 N ATOM 627 H HIS A 323 20.917 76.195 10.270 1.00 0.00 H ATOM 628 N LEU A 324 18.395 77.296 8.385 1.00 56.83 N ATOM 629 CA LEU A 324 17.068 77.445 7.779 1.00 57.98 C ATOM 630 C LEU A 324 16.054 78.147 8.666 1.00 58.32 C ATOM 631 O LEU A 324 15.100 78.745 8.168 1.00 59.68 O ATOM 632 CB LEU A 324 16.506 76.081 7.339 1.00 59.72 C ATOM 633 CG LEU A 324 17.250 75.401 6.171 1.00 60.85 C ATOM 634 CD1 LEU A 324 16.668 74.020 5.930 1.00 61.61 C ATOM 635 CD2 LEU A 324 17.255 76.226 4.885 1.00 59.67 C ATOM 636 H LEU A 324 18.674 76.367 8.760 1.00 0.00 H ATOM 637 N THR A 325 16.235 78.051 9.976 1.00 58.66 N ATOM 638 CA THR A 325 15.422 78.824 10.911 1.00 58.01 C ATOM 639 C THR A 325 15.717 80.302 10.742 1.00 58.60 C ATOM 640 O THR A 325 14.809 81.109 10.684 1.00 60.61 O ATOM 641 CB THR A 325 15.678 78.381 12.346 1.00 56.37 C ATOM 642 OG1 THR A 325 15.137 77.077 12.494 1.00 55.49 O ATOM 643 CG2 THR A 325 15.015 79.299 13.337 1.00 57.53 C ATOM 644 HG1 THR A 325 15.581 76.462 11.858 1.00 0.00 H ATOM 645 H THR A 325 16.969 77.413 10.344 1.00 0.00 H ATOM 646 N GLU A 326 16.996 80.633 10.666 1.00 59.69 N ATOM 647 CA GLU A 326 17.450 81.985 10.380 1.00 62.54 C ATOM 648 C GLU A 326 16.834 82.447 9.064 1.00 61.68 C ATOM 649 O GLU A 326 16.258 83.530 8.976 1.00 62.90 O ATOM 650 CB GLU A 326 18.969 81.992 10.288 1.00 67.11 C ATOM 651 CG GLU A 326 19.652 83.305 10.584 1.00 73.44 C ATOM 652 CD GLU A 326 21.114 83.094 11.011 1.00 80.13 C ATOM 653 OE1 GLU A 326 21.707 82.025 10.700 1.00 84.03 O ATOM 654 OE2 GLU A 326 21.681 83.978 11.691 1.00 85.15 O ATOM 655 H GLU A 326 17.710 79.892 10.818 1.00 0.00 H ATOM 656 N ALA A 327 16.910 81.585 8.054 1.00 59.63 N ATOM 657 CA ALA A 327 16.331 81.873 6.751 1.00 56.48 C ATOM 658 C ALA A 327 14.845 82.236 6.853 1.00 55.64 C ATOM 659 O ALA A 327 14.385 83.187 6.216 1.00 54.55 O ATOM 660 CB ALA A 327 16.540 80.690 5.816 1.00 55.79 C ATOM 661 H ALA A 327 17.398 80.678 8.200 1.00 0.00 H ATOM 662 N ILE A 328 14.111 81.483 7.665 1.00 56.10 N ATOM 663 CA ILE A 328 12.697 81.767 7.909 1.00 56.93 C ATOM 664 C ILE A 328 12.503 83.103 8.603 1.00 58.12 C ATOM 665 O ILE A 328 11.581 83.838 8.264 1.00 62.28 O ATOM 666 CB ILE A 328 11.995 80.630 8.682 1.00 56.38 C ATOM 667 CG1 ILE A 328 11.788 79.439 7.739 1.00 56.03 C ATOM 668 CG2 ILE A 328 10.644 81.076 9.226 1.00 56.95 C ATOM 669 CD1 ILE A 328 11.503 78.140 8.459 1.00 58.42 C ATOM 670 H ILE A 328 14.553 80.670 8.140 1.00 0.00 H ATOM 671 N GLN A 329 13.362 83.426 9.558 1.00 59.78 N ATOM 672 CA GLN A 329 13.257 84.709 10.251 1.00 63.10 C ATOM 673 C GLN A 329 13.378 85.859 9.248 1.00 59.89 C ATOM 674 O GLN A 329 12.613 86.818 9.300 1.00 59.65 O ATOM 675 CB GLN A 329 14.277 84.830 11.399 1.00 67.06 C ATOM 676 CG GLN A 329 13.981 83.932 12.606 1.00 70.32 C ATOM 677 CD GLN A 329 15.116 83.933 13.639 1.00 75.81 C ATOM 678 OE1 GLN A 329 16.256 84.309 13.330 1.00 77.79 O ATOM 679 NE2 GLN A 329 14.811 83.507 14.874 1.00 78.88 N ATOM 680 HE22 GLN A 329 13.842 83.200 15.094 1.00 0.00 H ATOM 681 HE21 GLN A 329 15.544 83.484 15.612 1.00 0.00 H ATOM 682 H GLN A 329 14.118 82.761 9.817 1.00 0.00 H ATOM 683 N TYR A 330 14.299 85.729 8.303 1.00 57.43 N ATOM 684 CA TYR A 330 14.427 86.724 7.246 1.00 56.86 C ATOM 685 C TYR A 330 13.180 86.854 6.366 1.00 56.28 C ATOM 686 O TYR A 330 12.858 87.956 5.932 1.00 57.55 O ATOM 687 CB TYR A 330 15.643 86.450 6.374 1.00 55.06 C ATOM 688 CG TYR A 330 16.911 87.030 6.931 1.00 57.08 C ATOM 689 CD1 TYR A 330 17.281 88.338 6.640 1.00 58.66 C ATOM 690 CD2 TYR A 330 17.758 86.272 7.724 1.00 58.40 C ATOM 691 CE1 TYR A 330 18.459 88.872 7.119 1.00 60.26 C ATOM 692 CE2 TYR A 330 18.938 86.799 8.215 1.00 60.32 C ATOM 693 CZ TYR A 330 19.278 88.097 7.908 1.00 61.49 C ATOM 694 OH TYR A 330 20.444 88.623 8.387 1.00 64.63 O ATOM 695 HH TYR A 330 20.535 89.558 8.076 1.00 0.00 H ATOM 696 H TYR A 330 14.937 84.908 8.316 1.00 0.00 H ATOM 697 N VAL A 331 12.493 85.743 6.099 1.00 54.96 N ATOM 698 CA VAL A 331 11.232 85.787 5.341 1.00 53.17 C ATOM 699 C VAL A 331 10.149 86.490 6.154 1.00 53.24 C ATOM 700 O VAL A 331 9.354 87.248 5.618 1.00 51.51 O ATOM 701 CB VAL A 331 10.765 84.383 4.895 1.00 52.15 C ATOM 702 CG1 VAL A 331 9.384 84.437 4.250 1.00 53.02 C ATOM 703 CG2 VAL A 331 11.752 83.816 3.902 1.00 51.11 C ATOM 704 H VAL A 331 12.855 84.827 6.433 1.00 0.00 H ATOM 705 N VAL A 332 10.133 86.260 7.450 1.00 54.15 N ATOM 706 CA VAL A 332 9.150 86.916 8.278 1.00 57.54 C ATOM 707 C VAL A 332 9.354 88.435 8.234 1.00 60.83 C ATOM 708 O VAL A 332 8.391 89.201 8.085 1.00 61.64 O ATOM 709 CB VAL A 332 9.197 86.373 9.701 1.00 57.84 C ATOM 710 CG1 VAL A 332 8.301 87.195 10.616 1.00 59.96 C ATOM 711 CG2 VAL A 332 8.765 84.912 9.693 1.00 57.15 C ATOM 712 H VAL A 332 10.825 85.610 7.875 1.00 0.00 H ATOM 713 N GLU A 333 10.613 88.852 8.334 1.00 63.91 N ATOM 714 CA GLU A 333 10.979 90.260 8.174 1.00 66.15 C ATOM 715 C GLU A 333 10.521 90.875 6.862 1.00 64.68 C ATOM 716 O GLU A 333 10.064 92.009 6.841 1.00 68.02 O ATOM 717 CB GLU A 333 12.495 90.446 8.306 1.00 68.88 C ATOM 718 CG GLU A 333 12.931 90.821 9.707 1.00 74.42 C ATOM 719 CD GLU A 333 12.211 92.063 10.212 1.00 80.21 C ATOM 720 OE1 GLU A 333 12.055 93.039 9.421 1.00 81.04 O ATOM 721 OE2 GLU A 333 11.786 92.042 11.388 1.00 84.20 O ATOM 722 H GLU A 333 11.360 88.156 8.532 1.00 0.00 H ATOM 723 N PHE A 334 10.684 90.125 5.780 1.00 62.49 N ATOM 724 CA PHE A 334 10.193 90.498 4.455 1.00 61.08 C ATOM 725 C PHE A 334 8.704 90.751 4.503 1.00 62.14 C ATOM 726 O PHE A 334 8.236 91.787 4.052 1.00 62.68 O ATOM 727 CB PHE A 334 10.475 89.357 3.473 1.00 58.54 C ATOM 728 CG PHE A 334 9.930 89.575 2.087 1.00 56.96 C ATOM 729 CD1 PHE A 334 10.313 90.683 1.338 1.00 57.48 C ATOM 730 CD2 PHE A 334 9.063 88.648 1.515 1.00 54.68 C ATOM 731 CE1 PHE A 334 9.830 90.869 0.055 1.00 56.52 C ATOM 732 CE2 PHE A 334 8.588 88.829 0.238 1.00 54.99 C ATOM 733 CZ PHE A 334 8.973 89.939 -0.497 1.00 55.89 C ATOM 734 H PHE A 334 11.189 89.221 5.880 1.00 0.00 H ATOM 735 N ALA A 335 7.977 89.794 5.067 1.00 63.09 N ATOM 736 CA ALA A 335 6.528 89.857 5.132 1.00 64.48 C ATOM 737 C ALA A 335 6.099 91.068 5.921 1.00 66.47 C ATOM 738 O ALA A 335 5.247 91.824 5.462 1.00 67.16 O ATOM 739 CB ALA A 335 5.968 88.597 5.767 1.00 66.20 C ATOM 740 H ALA A 335 8.462 88.970 5.477 1.00 0.00 H ATOM 741 N LYS A 336 6.713 91.259 7.090 1.00 67.70 N ATOM 742 CA LYS A 336 6.438 92.427 7.929 1.00 70.93 C ATOM 743 C LYS A 336 6.566 93.770 7.181 1.00 72.43 C ATOM 744 O LYS A 336 5.814 94.701 7.466 1.00 76.36 O ATOM 745 CB LYS A 336 7.339 92.430 9.167 1.00 72.33 C ATOM 746 CG LYS A 336 6.954 91.385 10.209 1.00 74.36 C ATOM 747 CD LYS A 336 8.038 91.151 11.258 1.00 76.68 C ATOM 748 CE LYS A 336 8.093 92.263 12.299 1.00 80.80 C ATOM 749 NZ LYS A 336 9.443 92.315 12.930 1.00 81.53 N ATOM 750 HZ1 LYS A 336 9.643 91.406 13.393 1.00 0.00 H ATOM 751 HZ2 LYS A 336 10.159 92.498 12.199 1.00 0.00 H ATOM 752 HZ3 LYS A 336 9.465 93.077 13.637 1.00 0.00 H ATOM 753 H LYS A 336 7.408 90.557 7.415 1.00 0.00 H ATOM 754 N ARG A 337 7.498 93.846 6.228 1.00 69.71 N ATOM 755 CA ARG A 337 7.727 95.038 5.410 1.00 68.95 C ATOM 756 C ARG A 337 6.894 95.148 4.149 1.00 67.89 C ATOM 757 O ARG A 337 7.011 96.138 3.442 1.00 70.21 O ATOM 758 CB ARG A 337 9.192 95.109 5.007 1.00 68.94 C ATOM 759 CG ARG A 337 10.085 95.260 6.207 1.00 72.38 C ATOM 760 CD ARG A 337 11.548 95.317 5.841 1.00 73.77 C ATOM 761 NE ARG A 337 12.333 95.059 7.046 1.00 76.85 N ATOM 762 CZ ARG A 337 13.487 95.640 7.365 1.00 81.66 C ATOM 763 NH1 ARG A 337 14.061 96.562 6.580 1.00 84.96 N ATOM 764 NH2 ARG A 337 14.079 95.298 8.507 1.00 82.78 N ATOM 765 HE ARG A 337 11.956 94.358 7.715 1.00 0.00 H ATOM 766 HH12 ARG A 337 14.964 96.995 6.861 1.00 0.00 H ATOM 767 HH11 ARG A 337 13.604 96.844 5.690 1.00 0.00 H ATOM 768 HH22 ARG A 337 14.981 95.739 8.777 1.00 0.00 H ATOM 769 HH21 ARG A 337 13.639 94.590 9.129 1.00 0.00 H ATOM 770 H ARG A 337 8.095 93.011 6.057 1.00 0.00 H ATOM 771 N LEU A 338 6.086 94.148 3.829 1.00 66.92 N ATOM 772 CA LEU A 338 5.178 94.265 2.699 1.00 67.37 C ATOM 773 C LEU A 338 4.056 95.187 3.095 1.00 71.66 C ATOM 774 O LEU A 338 3.626 95.187 4.247 1.00 72.78 O ATOM 775 CB LEU A 338 4.581 92.921 2.312 1.00 66.52 C ATOM 776 CG LEU A 338 5.508 91.881 1.710 1.00 64.89 C ATOM 777 CD1 LEU A 338 4.740 90.593 1.419 1.00 63.92 C ATOM 778 CD2 LEU A 338 6.143 92.434 0.456 1.00 64.94 C ATOM 779 H LEU A 338 6.101 93.273 4.390 1.00 0.00 H ATOM 780 N SER A 339 3.581 95.969 2.123 1.00 75.90 N ATOM 781 CA SER A 339 2.554 96.974 2.371 1.00 77.66 C ATOM 782 C SER A 339 1.242 96.239 2.633 1.00 78.63 C ATOM 783 O SER A 339 0.780 95.466 1.806 1.00 76.95 O ATOM 784 CB SER A 339 2.421 97.943 1.190 1.00 76.67 C ATOM 785 OG SER A 339 2.054 99.218 1.671 1.00 78.92 O ATOM 786 HG SER A 339 1.968 99.845 0.909 1.00 0.00 H ATOM 787 H SER A 339 3.955 95.858 1.159 1.00 0.00 H ATOM 788 N GLY A 340 0.670 96.448 3.810 1.00 81.22 N ATOM 789 CA GLY A 340 -0.623 95.873 4.130 1.00 81.20 C ATOM 790 C GLY A 340 -0.615 94.457 4.668 1.00 79.60 C ATOM 791 O GLY A 340 -1.681 93.907 4.935 1.00 81.58 O ATOM 792 H GLY A 340 1.157 97.035 4.517 1.00 0.00 H ATOM 793 N PHE A 341 0.559 93.846 4.826 1.00 77.50 N ATOM 794 CA PHE A 341 0.657 92.604 5.591 1.00 75.74 C ATOM 795 C PHE A 341 0.370 92.885 7.062 1.00 77.64 C ATOM 796 O PHE A 341 -0.436 92.195 7.675 1.00 77.19 O ATOM 797 CB PHE A 341 2.039 91.954 5.449 1.00 72.59 C ATOM 798 CG PHE A 341 2.175 90.676 6.221 1.00 70.54 C ATOM 799 CD1 PHE A 341 1.649 89.497 5.724 1.00 68.62 C ATOM 800 CD2 PHE A 341 2.789 90.660 7.472 1.00 72.47 C ATOM 801 CE1 PHE A 341 1.745 88.318 6.449 1.00 69.43 C ATOM 802 CE2 PHE A 341 2.899 89.482 8.192 1.00 72.65 C ATOM 803 CZ PHE A 341 2.376 88.309 7.679 1.00 71.25 C ATOM 804 H PHE A 341 1.414 94.257 4.401 1.00 0.00 H ATOM 805 N MET A 342 1.035 93.902 7.614 1.00 80.83 N ATOM 806 CA MET A 342 0.847 94.310 9.017 1.00 85.81 C ATOM 807 C MET A 342 -0.542 94.851 9.315 1.00 89.36 C ATOM 808 O MET A 342 -0.978 94.839 10.466 1.00 90.84 O ATOM 809 CB MET A 342 1.898 95.350 9.429 1.00 87.66 C ATOM 810 CG MET A 342 3.320 94.802 9.517 1.00 86.20 C ATOM 811 SD MET A 342 3.556 93.483 10.741 1.00 88.91 S ATOM 812 CE MET A 342 2.917 94.163 12.282 1.00 93.34 C ATOM 813 H MET A 342 1.715 94.429 7.029 1.00 0.00 H ATOM 814 N GLU A 343 -1.220 95.339 8.281 1.00 90.56 N ATOM 815 CA GLU A 343 -2.620 95.739 8.396 1.00 92.73 C ATOM 816 C GLU A 343 -3.586 94.546 8.510 1.00 88.10 C ATOM 817 O GLU A 343 -4.686 94.723 9.002 1.00 91.47 O ATOM 818 CB GLU A 343 -3.028 96.677 7.244 1.00 97.02 C ATOM 819 CG GLU A 343 -2.688 98.162 7.478 1.00103.32 C ATOM 820 CD GLU A 343 -1.330 98.568 6.938 1.00104.78 C ATOM 821 OE1 GLU A 343 -0.308 98.470 7.666 1.00107.93 O ATOM 822 OE2 GLU A 343 -1.300 98.981 5.760 1.00103.99 O ATOM 823 H GLU A 343 -0.740 95.439 7.364 1.00 0.00 H ATOM 824 N LEU A 344 -3.184 93.351 8.079 1.00 82.62 N ATOM 825 CA LEU A 344 -4.002 92.124 8.273 1.00 81.03 C ATOM 826 C LEU A 344 -4.148 91.816 9.746 1.00 83.00 C ATOM 827 O LEU A 344 -3.449 92.391 10.577 1.00 84.17 O ATOM 828 CB LEU A 344 -3.382 90.889 7.587 1.00 76.88 C ATOM 829 CG LEU A 344 -3.138 90.922 6.072 1.00 72.97 C ATOM 830 CD1 LEU A 344 -2.608 89.585 5.613 1.00 70.37 C ATOM 831 CD2 LEU A 344 -4.394 91.292 5.296 1.00 73.50 C ATOM 832 H LEU A 344 -2.269 93.274 7.591 1.00 0.00 H ATOM 833 N CYS A 345 -5.046 90.897 10.075 1.00 84.32 N ATOM 834 CA CYS A 345 -5.240 90.527 11.473 1.00 88.37 C ATOM 835 C CYS A 345 -4.118 89.601 11.921 1.00 86.70 C ATOM 836 O CYS A 345 -3.317 89.158 11.107 1.00 83.94 O ATOM 837 CB CYS A 345 -6.641 89.942 11.711 1.00 92.60 C ATOM 838 SG CYS A 345 -6.927 88.267 11.129 1.00 93.78 S ATOM 839 H CYS A 345 -5.614 90.439 9.334 1.00 0.00 H ATOM 840 N GLN A 346 -4.041 89.336 13.220 1.00 90.43 N ATOM 841 CA GLN A 346 -2.976 88.504 13.779 1.00 90.86 C ATOM 842 C GLN A 346 -3.097 87.044 13.286 1.00 89.15 C ATOM 843 O GLN A 346 -2.105 86.464 12.818 1.00 87.43 O ATOM 844 CB GLN A 346 -3.019 88.588 15.311 1.00 96.03 C ATOM 845 CG GLN A 346 -1.877 87.921 16.081 1.00 96.52 C ATOM 846 CD GLN A 346 -2.271 87.563 17.518 1.00102.30 C ATOM 847 OE1 GLN A 346 -3.458 87.423 17.843 1.00104.22 O ATOM 848 NE2 GLN A 346 -1.271 87.402 18.382 1.00106.24 N ATOM 849 HE22 GLN A 346 -0.287 87.529 18.069 1.00 0.00 H ATOM 850 HE21 GLN A 346 -1.473 87.149 19.370 1.00 0.00 H ATOM 851 H GLN A 346 -4.760 89.732 13.859 1.00 0.00 H ATOM 852 N ASN A 347 -4.310 86.478 13.365 1.00 89.59 N ATOM 853 CA ASN A 347 -4.585 85.092 12.938 1.00 88.31 C ATOM 854 C ASN A 347 -4.210 84.854 11.488 1.00 84.03 C ATOM 855 O ASN A 347 -3.573 83.850 11.180 1.00 82.64 O ATOM 856 CB ASN A 347 -6.072 84.746 13.120 1.00 92.28 C ATOM 857 CG ASN A 347 -6.468 83.443 12.427 1.00 91.14 C ATOM 858 OD1 ASN A 347 -6.204 82.340 12.920 1.00 89.03 O ATOM 859 ND2 ASN A 347 -7.116 83.576 11.275 1.00 89.79 N ATOM 860 HD22 ASN A 347 -7.317 84.524 10.898 1.00 0.00 H ATOM 861 HD21 ASN A 347 -7.423 82.732 10.750 1.00 0.00 H ATOM 862 H ASN A 347 -5.096 87.043 13.746 1.00 0.00 H ATOM 863 N ASP A 348 -4.637 85.773 10.614 1.00 82.04 N ATOM 864 CA ASP A 348 -4.297 85.751 9.182 1.00 77.14 C ATOM 865 C ASP A 348 -2.796 85.838 8.922 1.00 73.10 C ATOM 866 O ASP A 348 -2.266 85.047 8.144 1.00 70.90 O ATOM 867 CB ASP A 348 -5.015 86.881 8.432 1.00 77.88 C ATOM 868 CG ASP A 348 -6.507 86.618 8.246 1.00 82.27 C ATOM 869 OD1 ASP A 348 -7.011 85.587 8.767 1.00 85.21 O ATOM 870 OD2 ASP A 348 -7.181 87.445 7.581 1.00 82.13 O ATOM 871 H ASP A 348 -5.241 86.543 10.965 1.00 0.00 H ATOM 872 N GLN A 349 -2.114 86.777 9.572 1.00 72.44 N ATOM 873 CA GLN A 349 -0.654 86.912 9.438 1.00 70.49 C ATOM 874 C GLN A 349 0.113 85.638 9.772 1.00 69.13 C ATOM 875 O GLN A 349 1.116 85.320 9.124 1.00 67.48 O ATOM 876 CB GLN A 349 -0.131 88.049 10.315 1.00 72.61 C ATOM 877 CG GLN A 349 -0.391 89.422 9.722 1.00 73.92 C ATOM 878 CD GLN A 349 -0.083 90.549 10.676 1.00 76.01 C ATOM 879 OE1 GLN A 349 0.675 90.384 11.619 1.00 76.66 O ATOM 880 NE2 GLN A 349 -0.676 91.707 10.429 1.00 78.76 N ATOM 881 HE22 GLN A 349 -1.314 91.801 9.613 1.00 0.00 H ATOM 882 HE21 GLN A 349 -0.503 92.523 11.051 1.00 0.00 H ATOM 883 H GLN A 349 -2.627 87.435 10.193 1.00 0.00 H ATOM 884 N ILE A 350 -0.349 84.924 10.792 1.00 70.62 N ATOM 885 CA ILE A 350 0.277 83.662 11.199 1.00 69.57 C ATOM 886 C ILE A 350 -0.038 82.546 10.195 1.00 68.05 C ATOM 887 O ILE A 350 0.861 81.826 9.790 1.00 65.98 O ATOM 888 CB ILE A 350 -0.115 83.278 12.646 1.00 71.53 C ATOM 889 CG1 ILE A 350 0.465 84.319 13.615 1.00 71.19 C ATOM 890 CG2 ILE A 350 0.379 81.876 12.991 1.00 71.54 C ATOM 891 CD1 ILE A 350 -0.192 84.364 14.969 1.00 75.51 C ATOM 892 H ILE A 350 -1.178 85.270 11.317 1.00 0.00 H ATOM 893 N VAL A 351 -1.300 82.428 9.786 1.00 69.74 N ATOM 894 CA VAL A 351 -1.717 81.427 8.790 1.00 70.02 C ATOM 895 C VAL A 351 -0.883 81.549 7.503 1.00 67.49 C ATOM 896 O VAL A 351 -0.408 80.543 6.964 1.00 67.57 O ATOM 897 CB VAL A 351 -3.238 81.534 8.448 1.00 72.43 C ATOM 898 CG1 VAL A 351 -3.620 80.634 7.261 1.00 72.72 C ATOM 899 CG2 VAL A 351 -4.096 81.209 9.672 1.00 75.43 C ATOM 900 H VAL A 351 -2.017 83.067 10.185 1.00 0.00 H ATOM 901 N LEU A 352 -0.714 82.780 7.028 1.00 65.64 N ATOM 902 CA LEU A 352 0.005 83.036 5.796 1.00 63.61 C ATOM 903 C LEU A 352 1.471 82.656 5.880 1.00 63.09 C ATOM 904 O LEU A 352 2.027 82.172 4.886 1.00 62.94 O ATOM 905 CB LEU A 352 -0.108 84.510 5.402 1.00 62.99 C ATOM 906 CG LEU A 352 -1.467 85.021 4.921 1.00 64.99 C ATOM 907 CD1 LEU A 352 -1.321 86.445 4.420 1.00 64.37 C ATOM 908 CD2 LEU A 352 -2.085 84.152 3.826 1.00 65.52 C ATOM 909 H LEU A 352 -1.110 83.583 7.557 1.00 0.00 H ATOM 910 N LEU A 353 2.080 82.904 7.045 1.00 64.69 N ATOM 911 CA LEU A 353 3.515 82.659 7.277 1.00 64.51 C ATOM 912 C LEU A 353 3.790 81.209 7.617 1.00 65.62 C ATOM 913 O LEU A 353 4.822 80.669 7.239 1.00 64.72 O ATOM 914 CB LEU A 353 4.056 83.547 8.415 1.00 64.75 C ATOM 915 CG LEU A 353 4.240 85.025 8.084 1.00 63.89 C ATOM 916 CD1 LEU A 353 4.428 85.838 9.343 1.00 64.86 C ATOM 917 CD2 LEU A 353 5.420 85.217 7.146 1.00 62.10 C ATOM 918 H LEU A 353 1.512 83.289 7.827 1.00 0.00 H ATOM 919 N LYS A 354 2.873 80.598 8.353 1.00 68.45 N ATOM 920 CA LYS A 354 2.921 79.174 8.646 1.00 69.64 C ATOM 921 C LYS A 354 2.858 78.372 7.343 1.00 67.00 C ATOM 922 O LYS A 354 3.627 77.446 7.147 1.00 64.36 O ATOM 923 CB LYS A 354 1.769 78.788 9.591 1.00 75.49 C ATOM 924 CG LYS A 354 1.984 77.482 10.338 1.00 79.64 C ATOM 925 CD LYS A 354 1.006 77.324 11.510 1.00 84.65 C ATOM 926 CE LYS A 354 0.884 75.873 11.985 1.00 87.36 C ATOM 927 NZ LYS A 354 -0.481 75.544 12.499 1.00 91.77 N ATOM 928 HZ1 LYS A 354 -0.705 76.162 13.305 1.00 0.00 H ATOM 929 HZ2 LYS A 354 -1.180 75.691 11.743 1.00 0.00 H ATOM 930 HZ3 LYS A 354 -0.504 74.551 12.806 1.00 0.00 H ATOM 931 H LYS A 354 2.087 81.160 8.737 1.00 0.00 H ATOM 932 N ALA A 355 1.966 78.763 6.439 1.00 67.09 N ATOM 933 CA ALA A 355 1.829 78.102 5.135 1.00 65.19 C ATOM 934 C ALA A 355 2.897 78.484 4.115 1.00 63.25 C ATOM 935 O ALA A 355 3.243 77.673 3.277 1.00 63.33 O ATOM 936 CB ALA A 355 0.453 78.389 4.548 1.00 66.39 C ATOM 937 H ALA A 355 1.343 79.565 6.663 1.00 0.00 H ATOM 938 N GLY A 356 3.404 79.715 4.171 1.00 63.17 N ATOM 939 CA GLY A 356 4.212 80.281 3.084 1.00 60.80 C ATOM 940 C GLY A 356 5.693 80.503 3.307 1.00 58.99 C ATOM 941 O GLY A 356 6.457 80.498 2.345 1.00 56.88 O ATOM 942 H GLY A 356 3.221 80.295 5.014 1.00 0.00 H ATOM 943 N ALA A 357 6.115 80.722 4.548 1.00 60.03 N ATOM 944 CA ALA A 357 7.528 81.012 4.815 1.00 62.01 C ATOM 945 C ALA A 357 8.484 79.955 4.236 1.00 62.82 C ATOM 946 O ALA A 357 9.433 80.322 3.548 1.00 61.90 O ATOM 947 CB ALA A 357 7.780 81.208 6.306 1.00 63.55 C ATOM 948 H ALA A 357 5.438 80.688 5.337 1.00 0.00 H ATOM 949 N MET A 358 8.215 78.665 4.483 1.00 65.71 N ATOM 950 CA MET A 358 9.091 77.590 3.989 1.00 65.93 C ATOM 951 C MET A 358 9.106 77.512 2.477 1.00 62.38 C ATOM 952 O MET A 358 10.140 77.224 1.885 1.00 59.72 O ATOM 953 CB MET A 358 8.763 76.204 4.590 1.00 73.57 C ATOM 954 CG MET A 358 9.752 75.737 5.676 1.00 80.68 C ATOM 955 SD MET A 358 11.563 75.828 5.354 1.00 85.35 S ATOM 956 CE MET A 358 11.833 74.304 4.457 1.00 81.90 C ATOM 957 H MET A 358 7.369 78.418 5.036 1.00 0.00 H ATOM 958 N GLU A 359 7.964 77.794 1.859 1.00 62.28 N ATOM 959 CA GLU A 359 7.873 77.871 0.403 1.00 60.96 C ATOM 960 C GLU A 359 8.737 79.004 -0.131 1.00 56.86 C ATOM 961 O GLU A 359 9.448 78.817 -1.096 1.00 55.34 O ATOM 962 CB GLU A 359 6.413 78.034 -0.052 1.00 64.51 C ATOM 963 CG GLU A 359 5.509 76.846 0.270 1.00 68.66 C ATOM 964 CD GLU A 359 4.027 77.108 0.047 1.00 73.65 C ATOM 965 OE1 GLU A 359 3.197 76.208 0.359 1.00 78.75 O ATOM 966 OE2 GLU A 359 3.671 78.201 -0.441 1.00 75.07 O ATOM 967 H GLU A 359 7.110 77.965 2.428 1.00 0.00 H ATOM 968 N VAL A 360 8.702 80.171 0.508 1.00 55.37 N ATOM 969 CA VAL A 360 9.554 81.298 0.082 1.00 53.72 C ATOM 970 C VAL A 360 11.032 80.940 0.204 1.00 52.31 C ATOM 971 O VAL A 360 11.812 81.261 -0.692 1.00 51.21 O ATOM 972 CB VAL A 360 9.253 82.598 0.859 1.00 53.30 C ATOM 973 CG1 VAL A 360 10.257 83.698 0.537 1.00 52.43 C ATOM 974 CG2 VAL A 360 7.852 83.091 0.549 1.00 54.84 C ATOM 975 H VAL A 360 8.064 80.291 1.321 1.00 0.00 H ATOM 976 N VAL A 361 11.400 80.260 1.290 1.00 53.11 N ATOM 977 CA VAL A 361 12.787 79.840 1.519 1.00 54.26 C ATOM 978 C VAL A 361 13.249 78.932 0.373 1.00 55.72 C ATOM 979 O VAL A 361 14.348 79.092 -0.145 1.00 56.39 O ATOM 980 CB VAL A 361 12.983 79.157 2.902 1.00 55.44 C ATOM 981 CG1 VAL A 361 14.419 78.682 3.098 1.00 54.44 C ATOM 982 CG2 VAL A 361 12.644 80.112 4.056 1.00 57.67 C ATOM 983 H VAL A 361 10.679 80.019 2.000 1.00 0.00 H ATOM 984 N LEU A 362 12.399 78.000 -0.039 1.00 58.42 N ATOM 985 CA LEU A 362 12.731 77.087 -1.143 1.00 59.91 C ATOM 986 C LEU A 362 12.934 77.817 -2.478 1.00 58.41 C ATOM 987 O LEU A 362 13.783 77.413 -3.290 1.00 61.25 O ATOM 988 CB LEU A 362 11.634 76.017 -1.270 1.00 63.78 C ATOM 989 CG LEU A 362 11.664 74.894 -2.295 1.00 67.23 C ATOM 990 CD1 LEU A 362 12.976 74.133 -2.161 1.00 69.72 C ATOM 991 CD2 LEU A 362 10.458 73.971 -2.107 1.00 68.21 C ATOM 992 H LEU A 362 11.475 77.913 0.431 1.00 0.00 H ATOM 993 N VAL A 363 12.164 78.884 -2.701 1.00 55.63 N ATOM 994 CA VAL A 363 12.287 79.675 -3.918 1.00 53.97 C ATOM 995 C VAL A 363 13.541 80.516 -3.838 1.00 52.27 C ATOM 996 O VAL A 363 14.327 80.533 -4.776 1.00 53.10 O ATOM 997 CB VAL A 363 11.067 80.578 -4.166 1.00 54.14 C ATOM 998 CG1 VAL A 363 11.299 81.469 -5.372 1.00 55.10 C ATOM 999 CG2 VAL A 363 9.825 79.736 -4.404 1.00 54.33 C ATOM 1000 H VAL A 363 11.458 79.158 -1.988 1.00 0.00 H ATOM 1001 N ARG A 364 13.733 81.201 -2.713 1.00 50.56 N ATOM 1002 CA ARG A 364 14.962 81.971 -2.477 1.00 50.81 C ATOM 1003 C ARG A 364 16.247 81.165 -2.647 1.00 52.08 C ATOM 1004 O ARG A 364 17.298 81.730 -2.948 1.00 54.10 O ATOM 1005 CB ARG A 364 14.967 82.558 -1.080 1.00 49.86 C ATOM 1006 CG ARG A 364 14.073 83.755 -0.894 1.00 50.44 C ATOM 1007 CD ARG A 364 14.194 84.238 0.550 1.00 51.62 C ATOM 1008 NE ARG A 364 13.511 85.510 0.741 1.00 53.57 N ATOM 1009 CZ ARG A 364 13.838 86.437 1.639 1.00 55.49 C ATOM 1010 NH1 ARG A 364 14.838 86.260 2.489 1.00 56.42 N ATOM 1011 NH2 ARG A 364 13.137 87.566 1.694 1.00 57.89 N ATOM 1012 HE ARG A 364 12.699 85.711 0.123 1.00 0.00 H ATOM 1013 HH12 ARG A 364 15.071 87.002 3.180 1.00 0.00 H ATOM 1014 HH11 ARG A 364 15.391 85.379 2.466 1.00 0.00 H ATOM 1015 HH22 ARG A 364 13.383 88.297 2.391 1.00 0.00 H ATOM 1016 HH21 ARG A 364 12.343 87.717 1.040 1.00 0.00 H ATOM 1017 H ARG A 364 12.994 81.191 -1.982 1.00 0.00 H ATOM 1018 N MET A 365 16.166 79.857 -2.416 1.00 54.70 N ATOM 1019 CA MET A 365 17.334 78.989 -2.444 1.00 55.60 C ATOM 1020 C MET A 365 17.961 78.877 -3.820 1.00 55.95 C ATOM 1021 O MET A 365 19.174 78.643 -3.912 1.00 56.08 O ATOM 1022 CB MET A 365 16.990 77.596 -1.909 1.00 57.23 C ATOM 1023 CG MET A 365 18.211 76.727 -1.686 1.00 58.41 C ATOM 1024 SD MET A 365 17.940 75.392 -0.507 1.00 59.27 S ATOM 1025 CE MET A 365 17.919 76.289 1.031 1.00 56.99 C ATOM 1026 H MET A 365 15.236 79.441 -2.208 1.00 0.00 H ATOM 1027 N CYS A 366 17.165 79.068 -4.879 1.00 56.07 N ATOM 1028 CA CYS A 366 17.689 79.017 -6.256 1.00 56.76 C ATOM 1029 C CYS A 366 18.811 80.029 -6.550 1.00 56.58 C ATOM 1030 O CYS A 366 19.599 79.817 -7.474 1.00 59.46 O ATOM 1031 CB CYS A 366 16.572 79.173 -7.283 1.00 57.33 C ATOM 1032 SG CYS A 366 15.944 80.855 -7.483 1.00 58.83 S ATOM 1033 H CYS A 366 16.154 79.257 -4.727 1.00 0.00 H ATOM 1034 N ARG A 367 18.884 81.108 -5.768 1.00 54.23 N ATOM 1035 CA ARG A 367 19.965 82.091 -5.879 1.00 53.88 C ATOM 1036 C ARG A 367 21.273 81.548 -5.354 1.00 54.05 C ATOM 1037 O ARG A 367 22.333 82.041 -5.737 1.00 58.98 O ATOM 1038 CB ARG A 367 19.663 83.349 -5.077 1.00 54.32 C ATOM 1039 CG ARG A 367 18.368 84.025 -5.433 1.00 55.65 C ATOM 1040 CD ARG A 367 17.848 84.884 -4.302 1.00 55.54 C ATOM 1041 NE ARG A 367 18.620 86.118 -4.180 1.00 57.11 N ATOM 1042 CZ ARG A 367 19.465 86.411 -3.198 1.00 59.74 C ATOM 1043 NH1 ARG A 367 19.698 85.568 -2.202 1.00 61.91 N ATOM 1044 NH2 ARG A 367 20.099 87.569 -3.216 1.00 62.50 N ATOM 1045 HE ARG A 367 18.497 86.830 -4.928 1.00 0.00 H ATOM 1046 HH12 ARG A 367 20.365 85.826 -1.447 1.00 0.00 H ATOM 1047 HH11 ARG A 367 19.213 84.648 -2.175 1.00 0.00 H ATOM 1048 HH22 ARG A 367 20.763 87.810 -2.453 1.00 0.00 H ATOM 1049 HH21 ARG A 367 19.934 88.240 -3.993 1.00 0.00 H ATOM 1050 H ARG A 367 18.145 81.257 -5.052 1.00 0.00 H ATOM 1051 N ALA A 368 21.207 80.582 -4.441 1.00 50.96 N ATOM 1052 CA ALA A 368 22.400 79.992 -3.859 1.00 50.76 C ATOM 1053 C ALA A 368 22.841 78.714 -4.590 1.00 52.20 C ATOM 1054 O ALA A 368 23.763 78.034 -4.125 1.00 52.87 O ATOM 1055 CB ALA A 368 22.141 79.700 -2.400 1.00 49.33 C ATOM 1056 H ALA A 368 20.274 80.239 -4.135 1.00 0.00 H ATOM 1057 N TYR A 369 22.198 78.401 -5.723 1.00 52.73 N ATOM 1058 CA TYR A 369 22.427 77.164 -6.454 1.00 54.61 C ATOM 1059 C TYR A 369 23.131 77.452 -7.746 1.00 56.50 C ATOM 1060 O TYR A 369 22.655 78.261 -8.532 1.00 58.76 O ATOM 1061 CB TYR A 369 21.108 76.516 -6.804 1.00 56.28 C ATOM 1062 CG TYR A 369 21.247 75.219 -7.568 1.00 59.95 C ATOM 1063 CD1 TYR A 369 21.609 74.058 -6.916 1.00 62.94 C ATOM 1064 CD2 TYR A 369 20.997 75.140 -8.932 1.00 62.05 C ATOM 1065 CE1 TYR A 369 21.715 72.850 -7.593 1.00 64.07 C ATOM 1066 CE2 TYR A 369 21.103 73.931 -9.621 1.00 63.02 C ATOM 1067 CZ TYR A 369 21.459 72.793 -8.942 1.00 62.81 C ATOM 1068 OH TYR A 369 21.590 71.590 -9.566 1.00 65.79 O ATOM 1069 HH TYR A 369 20.727 71.339 -9.981 1.00 0.00 H ATOM 1070 H TYR A 369 21.501 79.075 -6.098 1.00 0.00 H ATOM 1071 N ASN A 370 24.237 76.762 -7.983 1.00 57.70 N ATOM 1072 CA ASN A 370 24.996 76.931 -9.205 1.00 59.65 C ATOM 1073 C ASN A 370 24.692 75.746 -10.100 1.00 61.29 C ATOM 1074 O ASN A 370 25.111 74.632 -9.818 1.00 61.70 O ATOM 1075 CB ASN A 370 26.483 77.016 -8.891 1.00 59.54 C ATOM 1076 CG ASN A 370 27.346 77.140 -10.133 1.00 61.15 C ATOM 1077 OD1 ASN A 370 26.886 76.985 -11.259 1.00 60.17 O ATOM 1078 ND2 ASN A 370 28.622 77.414 -9.918 1.00 63.35 N ATOM 1079 HD22 ASN A 370 28.971 77.538 -8.946 1.00 0.00 H ATOM 1080 HD21 ASN A 370 29.277 77.506 -10.721 1.00 0.00 H ATOM 1081 H ASN A 370 24.569 76.080 -7.272 1.00 0.00 H ATOM 1082 N ALA A 371 23.985 76.006 -11.192 1.00 63.02 N ATOM 1083 CA ALA A 371 23.569 74.958 -12.106 1.00 64.86 C ATOM 1084 C ALA A 371 24.704 74.405 -12.964 1.00 67.76 C ATOM 1085 O ALA A 371 24.583 73.301 -13.472 1.00 70.33 O ATOM 1086 CB ALA A 371 22.433 75.467 -12.974 1.00 66.50 C ATOM 1087 H ALA A 371 23.721 76.990 -11.399 1.00 0.00 H ATOM 1088 N ASP A 372 25.801 75.152 -13.121 1.00 70.67 N ATOM 1089 CA ASP A 372 26.992 74.660 -13.856 1.00 75.72 C ATOM 1090 C ASP A 372 27.567 73.381 -13.252 1.00 73.43 C ATOM 1091 O ASP A 372 27.873 72.451 -13.975 1.00 77.20 O ATOM 1092 CB ASP A 372 28.123 75.702 -13.915 1.00 80.68 C ATOM 1093 CG ASP A 372 27.791 76.899 -14.814 1.00 85.97 C ATOM 1094 OD1 ASP A 372 26.686 77.480 -14.693 1.00 86.50 O ATOM 1095 OD2 ASP A 372 28.646 77.272 -15.659 1.00 93.02 O ATOM 1096 H ASP A 372 25.820 76.109 -12.715 1.00 0.00 H ATOM 1097 N ASN A 373 27.714 73.349 -11.930 1.00 69.81 N ATOM 1098 CA ASN A 373 28.319 72.211 -11.213 1.00 67.66 C ATOM 1099 C ASN A 373 27.358 71.496 -10.247 1.00 65.54 C ATOM 1100 O ASN A 373 27.786 70.619 -9.502 1.00 66.00 O ATOM 1101 CB ASN A 373 29.590 72.671 -10.472 1.00 66.30 C ATOM 1102 CG ASN A 373 29.321 73.761 -9.462 1.00 63.58 C ATOM 1103 OD1 ASN A 373 28.195 74.201 -9.302 1.00 62.71 O ATOM 1104 ND2 ASN A 373 30.354 74.199 -8.774 1.00 64.01 N ATOM 1105 HD22 ASN A 373 31.298 73.797 -8.941 1.00 0.00 H ATOM 1106 HD21 ASN A 373 30.226 74.947 -8.063 1.00 0.00 H ATOM 1107 H ASN A 373 27.387 74.166 -11.376 1.00 0.00 H ATOM 1108 N ARG A 374 26.073 71.858 -10.280 1.00 64.55 N ATOM 1109 CA ARG A 374 25.058 71.329 -9.358 1.00 62.47 C ATOM 1110 C ARG A 374 25.480 71.427 -7.890 1.00 58.66 C ATOM 1111 O ARG A 374 25.537 70.423 -7.178 1.00 56.23 O ATOM 1112 CB ARG A 374 24.719 69.887 -9.692 1.00 64.91 C ATOM 1113 CG ARG A 374 24.243 69.669 -11.097 1.00 69.17 C ATOM 1114 CD ARG A 374 23.627 68.292 -11.239 1.00 74.36 C ATOM 1115 NE ARG A 374 22.407 68.341 -12.051 1.00 79.08 N ATOM 1116 CZ ARG A 374 22.322 68.093 -13.356 1.00 83.21 C ATOM 1117 NH1 ARG A 374 23.380 67.734 -14.089 1.00 85.98 N ATOM 1118 NH2 ARG A 374 21.130 68.184 -13.942 1.00 85.98 N ATOM 1119 HE ARG A 374 21.525 68.593 -11.561 1.00 0.00 H ATOM 1120 HH12 ARG A 374 23.269 67.549 -15.106 1.00 0.00 H ATOM 1121 HH11 ARG A 374 24.314 67.639 -13.642 1.00 0.00 H ATOM 1122 HH22 ARG A 374 21.035 67.995 -14.960 1.00 0.00 H ATOM 1123 HH21 ARG A 374 20.293 68.444 -13.381 1.00 0.00 H ATOM 1124 H ARG A 374 25.775 72.551 -10.996 1.00 0.00 H ATOM 1125 N THR A 375 25.792 72.641 -7.459 1.00 58.01 N ATOM 1126 CA THR A 375 26.176 72.895 -6.070 1.00 58.02 C ATOM 1127 C THR A 375 25.345 74.004 -5.440 1.00 55.43 C ATOM 1128 O THR A 375 24.718 74.796 -6.143 1.00 56.35 O ATOM 1129 CB THR A 375 27.677 73.234 -5.934 1.00 58.83 C ATOM 1130 OG1 THR A 375 27.984 74.412 -6.684 1.00 61.37 O ATOM 1131 CG2 THR A 375 28.512 72.089 -6.442 1.00 60.42 C ATOM 1132 HG1 THR A 375 27.770 74.259 -7.638 1.00 0.00 H ATOM 1133 H THR A 375 25.763 73.437 -8.128 1.00 0.00 H ATOM 1134 N VAL A 376 25.359 74.036 -4.111 1.00 53.01 N ATOM 1135 CA VAL A 376 24.583 74.991 -3.337 1.00 51.75 C ATOM 1136 C VAL A 376 25.446 75.573 -2.228 1.00 51.67 C ATOM 1137 O VAL A 376 26.338 74.902 -1.708 1.00 50.57 O ATOM 1138 CB VAL A 376 23.321 74.341 -2.725 1.00 50.87 C ATOM 1139 CG1 VAL A 376 23.680 73.309 -1.653 1.00 50.85 C ATOM 1140 CG2 VAL A 376 22.377 75.400 -2.169 1.00 48.85 C ATOM 1141 H VAL A 376 25.951 73.348 -3.603 1.00 0.00 H ATOM 1142 N PHE A 377 25.158 76.818 -1.862 1.00 51.51 N ATOM 1143 CA PHE A 377 25.896 77.503 -0.812 1.00 52.37 C ATOM 1144 C PHE A 377 25.492 76.992 0.581 1.00 52.21 C ATOM 1145 O PHE A 377 24.296 76.917 0.924 1.00 50.87 O ATOM 1146 CB PHE A 377 25.683 79.014 -0.933 1.00 53.14 C ATOM 1147 CG PHE A 377 26.419 79.825 0.097 1.00 53.75 C ATOM 1148 CD1 PHE A 377 27.785 80.068 -0.034 1.00 54.91 C ATOM 1149 CD2 PHE A 377 25.739 80.360 1.183 1.00 52.15 C ATOM 1150 CE1 PHE A 377 28.458 80.804 0.918 1.00 56.36 C ATOM 1151 CE2 PHE A 377 26.404 81.102 2.134 1.00 53.67 C ATOM 1152 CZ PHE A 377 27.765 81.324 2.007 1.00 56.21 C ATOM 1153 H PHE A 377 24.382 77.318 -2.341 1.00 0.00 H ATOM 1154 N PHE A 378 26.512 76.646 1.365 1.00 52.54 N ATOM 1155 CA PHE A 378 26.339 76.070 2.688 1.00 52.80 C ATOM 1156 C PHE A 378 27.590 76.294 3.521 1.00 55.27 C ATOM 1157 O PHE A 378 28.621 75.712 3.240 1.00 56.14 O ATOM 1158 CB PHE A 378 26.052 74.574 2.596 1.00 51.36 C ATOM 1159 CG PHE A 378 25.823 73.921 3.934 1.00 50.58 C ATOM 1160 CD1 PHE A 378 24.649 74.157 4.645 1.00 49.89 C ATOM 1161 CD2 PHE A 378 26.772 73.076 4.484 1.00 50.89 C ATOM 1162 CE1 PHE A 378 24.428 73.568 5.872 1.00 50.08 C ATOM 1163 CE2 PHE A 378 26.551 72.462 5.706 1.00 51.01 C ATOM 1164 CZ PHE A 378 25.377 72.704 6.403 1.00 51.20 C ATOM 1165 H PHE A 378 27.479 76.795 1.013 1.00 0.00 H ATOM 1166 N GLU A 379 27.484 77.156 4.528 1.00 57.68 N ATOM 1167 CA GLU A 379 28.565 77.420 5.482 1.00 59.14 C ATOM 1168 C GLU A 379 29.856 77.882 4.805 1.00 60.56 C ATOM 1169 O GLU A 379 30.922 77.321 5.019 1.00 63.82 O ATOM 1170 CB GLU A 379 28.794 76.200 6.388 1.00 58.10 C ATOM 1171 CG GLU A 379 27.527 75.776 7.117 1.00 56.43 C ATOM 1172 CD GLU A 379 27.782 74.834 8.276 1.00 56.71 C ATOM 1173 OE1 GLU A 379 28.644 73.934 8.153 1.00 55.74 O ATOM 1174 OE2 GLU A 379 27.101 74.984 9.316 1.00 57.83 O ATOM 1175 H GLU A 379 26.587 77.670 4.645 1.00 0.00 H ATOM 1176 N GLY A 380 29.723 78.901 3.968 1.00 60.97 N ATOM 1177 CA GLY A 380 30.856 79.622 3.401 1.00 62.09 C ATOM 1178 C GLY A 380 31.287 79.203 2.016 1.00 61.17 C ATOM 1179 O GLY A 380 31.966 79.974 1.345 1.00 63.00 O ATOM 1180 H GLY A 380 28.763 79.201 3.703 1.00 0.00 H ATOM 1181 N LYS A 381 30.938 77.992 1.590 1.00 59.33 N ATOM 1182 CA LYS A 381 31.332 77.519 0.263 1.00 61.05 C ATOM 1183 C LYS A 381 30.217 76.735 -0.409 1.00 58.92 C ATOM 1184 O LYS A 381 29.144 76.565 0.165 1.00 59.05 O ATOM 1185 CB LYS A 381 32.576 76.641 0.355 1.00 64.54 C ATOM 1186 CG LYS A 381 33.703 77.196 1.207 1.00 66.65 C ATOM 1187 CD LYS A 381 34.905 76.288 1.109 1.00 67.54 C ATOM 1188 CE LYS A 381 35.819 76.402 2.302 1.00 68.13 C ATOM 1189 NZ LYS A 381 37.114 75.764 1.941 1.00 70.56 N ATOM 1190 HZ1 LYS A 381 36.952 74.765 1.702 1.00 0.00 H ATOM 1191 HZ2 LYS A 381 37.525 76.255 1.121 1.00 0.00 H ATOM 1192 HZ3 LYS A 381 37.767 75.828 2.748 1.00 0.00 H ATOM 1193 H LYS A 381 30.377 77.373 2.209 1.00 0.00 H ATOM 1194 N TYR A 382 30.483 76.289 -1.638 1.00 59.04 N ATOM 1195 CA TYR A 382 29.533 75.527 -2.440 1.00 58.41 C ATOM 1196 C TYR A 382 29.843 74.036 -2.326 1.00 58.47 C ATOM 1197 O TYR A 382 31.010 73.630 -2.339 1.00 59.54 O ATOM 1198 CB TYR A 382 29.575 75.979 -3.908 1.00 60.76 C ATOM 1199 CG TYR A 382 28.807 77.257 -4.151 1.00 61.65 C ATOM 1200 CD1 TYR A 382 29.314 78.497 -3.743 1.00 62.14 C ATOM 1201 CD2 TYR A 382 27.556 77.234 -4.772 1.00 62.00 C ATOM 1202 CE1 TYR A 382 28.601 79.674 -3.946 1.00 61.69 C ATOM 1203 CE2 TYR A 382 26.840 78.403 -4.982 1.00 61.85 C ATOM 1204 CZ TYR A 382 27.362 79.623 -4.561 1.00 62.12 C ATOM 1205 OH TYR A 382 26.633 80.770 -4.777 1.00 62.47 O ATOM 1206 HH TYR A 382 27.133 81.549 -4.425 1.00 0.00 H ATOM 1207 H TYR A 382 31.417 76.496 -2.046 1.00 0.00 H ATOM 1208 N GLY A 383 28.787 73.233 -2.204 1.00 56.73 N ATOM 1209 CA GLY A 383 28.897 71.777 -2.157 1.00 56.22 C ATOM 1210 C GLY A 383 27.781 71.112 -2.942 1.00 55.56 C ATOM 1211 O GLY A 383 26.692 71.661 -3.079 1.00 56.27 O ATOM 1212 H GLY A 383 27.842 73.662 -2.139 1.00 0.00 H ATOM 1213 N GLY A 384 28.044 69.913 -3.443 1.00 56.36 N ATOM 1214 CA GLY A 384 27.030 69.129 -4.143 1.00 57.94 C ATOM 1215 C GLY A 384 26.088 68.514 -3.148 1.00 58.19 C ATOM 1216 O GLY A 384 26.131 68.844 -1.963 1.00 58.20 O ATOM 1217 H GLY A 384 29.000 69.519 -3.334 1.00 0.00 H ATOM 1218 N MET A 385 25.229 67.613 -3.603 1.00 60.12 N ATOM 1219 CA MET A 385 24.283 67.020 -2.658 1.00 61.25 C ATOM 1220 C MET A 385 24.898 65.952 -1.754 1.00 61.49 C ATOM 1221 O MET A 385 24.351 65.649 -0.690 1.00 60.55 O ATOM 1222 CB MET A 385 23.032 66.519 -3.346 1.00 63.12 C ATOM 1223 CG MET A 385 23.220 65.459 -4.378 1.00 66.57 C ATOM 1224 SD MET A 385 21.538 65.161 -4.976 1.00 70.23 S ATOM 1225 CE MET A 385 21.033 63.906 -3.773 1.00 73.72 C ATOM 1226 H MET A 385 25.228 67.335 -4.605 1.00 0.00 H ATOM 1227 N GLU A 386 26.046 65.413 -2.154 1.00 63.44 N ATOM 1228 CA GLU A 386 26.751 64.430 -1.333 1.00 65.20 C ATOM 1229 C GLU A 386 27.298 65.020 -0.028 1.00 61.13 C ATOM 1230 O GLU A 386 27.672 64.295 0.880 1.00 61.23 O ATOM 1231 CB GLU A 386 27.826 63.680 -2.142 1.00 71.50 C ATOM 1232 CG GLU A 386 29.175 64.378 -2.347 1.00 76.88 C ATOM 1233 CD GLU A 386 29.144 65.553 -3.331 1.00 81.98 C ATOM 1234 OE1 GLU A 386 28.102 65.743 -4.018 1.00 86.97 O ATOM 1235 OE2 GLU A 386 30.155 66.299 -3.392 1.00 83.01 O ATOM 1236 H GLU A 386 26.450 65.696 -3.069 1.00 0.00 H ATOM 1237 N LEU A 387 27.323 66.335 0.070 1.00 59.20 N ATOM 1238 CA LEU A 387 27.634 67.015 1.325 1.00 60.32 C ATOM 1239 C LEU A 387 26.704 66.627 2.476 1.00 60.36 C ATOM 1240 O LEU A 387 27.142 66.494 3.626 1.00 64.87 O ATOM 1241 CB LEU A 387 27.535 68.520 1.105 1.00 61.25 C ATOM 1242 CG LEU A 387 28.253 69.458 2.061 1.00 62.80 C ATOM 1243 CD1 LEU A 387 29.766 69.398 1.899 1.00 63.93 C ATOM 1244 CD2 LEU A 387 27.738 70.857 1.771 1.00 64.56 C ATOM 1245 H LEU A 387 27.115 66.906 -0.774 1.00 0.00 H ATOM 1246 N PHE A 388 25.421 66.433 2.157 1.00 58.72 N ATOM 1247 CA PHE A 388 24.373 66.191 3.165 1.00 56.50 C ATOM 1248 C PHE A 388 24.063 64.699 3.313 1.00 56.79 C ATOM 1249 O PHE A 388 22.932 64.316 3.688 1.00 57.92 O ATOM 1250 CB PHE A 388 23.097 66.960 2.802 1.00 54.58 C ATOM 1251 CG PHE A 388 23.319 68.414 2.562 1.00 53.18 C ATOM 1252 CD1 PHE A 388 23.225 69.321 3.599 1.00 53.07 C ATOM 1253 CD2 PHE A 388 23.648 68.880 1.296 1.00 52.78 C ATOM 1254 CE1 PHE A 388 23.443 70.671 3.377 1.00 52.37 C ATOM 1255 CE2 PHE A 388 23.877 70.224 1.071 1.00 51.96 C ATOM 1256 CZ PHE A 388 23.770 71.121 2.112 1.00 51.42 C ATOM 1257 H PHE A 388 25.150 66.454 1.153 1.00 0.00 H ATOM 1258 N ARG A 389 25.067 63.861 3.057 1.00 55.57 N ATOM 1259 CA ARG A 389 24.877 62.426 3.057 1.00 57.73 C ATOM 1260 C ARG A 389 24.470 61.930 4.445 1.00 56.98 C ATOM 1261 O ARG A 389 23.672 61.008 4.566 1.00 57.23 O ATOM 1262 CB ARG A 389 26.150 61.717 2.589 1.00 59.90 C ATOM 1263 CG ARG A 389 25.981 60.228 2.323 1.00 64.47 C ATOM 1264 CD ARG A 389 27.015 59.399 3.061 1.00 68.58 C ATOM 1265 NE ARG A 389 28.311 59.411 2.377 1.00 73.02 N ATOM 1266 CZ ARG A 389 29.491 59.100 2.935 1.00 76.32 C ATOM 1267 NH1 ARG A 389 30.597 59.154 2.193 1.00 78.64 N ATOM 1268 NH2 ARG A 389 29.592 58.730 4.220 1.00 75.59 N ATOM 1269 HE ARG A 389 28.317 59.684 1.373 1.00 0.00 H ATOM 1270 HH12 ARG A 389 31.518 58.915 2.614 1.00 0.00 H ATOM 1271 HH11 ARG A 389 30.539 59.435 1.193 1.00 0.00 H ATOM 1272 HH22 ARG A 389 30.522 58.495 4.622 1.00 0.00 H ATOM 1273 HH21 ARG A 389 28.740 58.678 4.815 1.00 0.00 H ATOM 1274 H ARG A 389 26.010 64.248 2.852 1.00 0.00 H ATOM 1275 N ALA A 390 25.001 62.570 5.484 1.00 56.26 N ATOM 1276 CA ALA A 390 24.756 62.137 6.850 1.00 56.91 C ATOM 1277 C ALA A 390 23.290 62.170 7.253 1.00 56.29 C ATOM 1278 O ALA A 390 22.867 61.342 8.050 1.00 56.93 O ATOM 1279 CB ALA A 390 25.568 62.978 7.819 1.00 57.62 C ATOM 1280 H ALA A 390 25.605 63.399 5.315 1.00 0.00 H ATOM 1281 N LEU A 391 22.524 63.107 6.689 1.00 55.41 N ATOM 1282 CA LEU A 391 21.112 63.282 7.027 1.00 56.44 C ATOM 1283 C LEU A 391 20.246 62.091 6.676 1.00 58.96 C ATOM 1284 O LEU A 391 19.180 61.921 7.252 1.00 61.82 O ATOM 1285 CB LEU A 391 20.537 64.512 6.328 1.00 54.63 C ATOM 1286 CG LEU A 391 21.136 65.846 6.732 1.00 54.50 C ATOM 1287 CD1 LEU A 391 20.589 66.979 5.891 1.00 53.84 C ATOM 1288 CD2 LEU A 391 20.854 66.113 8.200 1.00 55.58 C ATOM 1289 H LEU A 391 22.949 63.738 5.980 1.00 0.00 H ATOM 1290 N GLY A 392 20.679 61.295 5.704 1.00 60.43 N ATOM 1291 CA GLY A 392 19.947 60.112 5.314 1.00 62.92 C ATOM 1292 C GLY A 392 18.604 60.373 4.671 1.00 64.31 C ATOM 1293 O GLY A 392 17.670 59.614 4.880 1.00 66.03 O ATOM 1294 H GLY A 392 21.565 61.529 5.213 1.00 0.00 H ATOM 1295 N CYS A 393 18.507 61.445 3.890 1.00 66.52 N ATOM 1296 CA CYS A 393 17.339 61.668 3.027 1.00 70.82 C ATOM 1297 C CYS A 393 17.738 62.400 1.753 1.00 67.81 C ATOM 1298 O CYS A 393 17.651 63.624 1.657 1.00 64.89 O ATOM 1299 CB CYS A 393 16.221 62.385 3.776 1.00 73.13 C ATOM 1300 SG CYS A 393 16.855 63.631 4.885 1.00 74.90 S ATOM 1301 H CYS A 393 19.278 62.143 3.890 1.00 0.00 H ATOM 1302 N SER A 394 18.186 61.601 0.787 1.00 69.86 N ATOM 1303 CA SER A 394 18.537 62.063 -0.544 1.00 70.06 C ATOM 1304 C SER A 394 17.286 62.339 -1.349 1.00 73.19 C ATOM 1305 O SER A 394 17.328 63.224 -2.199 1.00 76.65 O ATOM 1306 CB SER A 394 19.430 61.039 -1.260 1.00 70.81 C ATOM 1307 OG SER A 394 19.051 59.715 -0.914 1.00 73.69 O ATOM 1308 HG SER A 394 19.638 59.071 -1.385 1.00 0.00 H ATOM 1309 H SER A 394 18.291 60.588 0.998 1.00 0.00 H ATOM 1310 N GLU A 395 16.195 61.604 -1.095 1.00 76.27 N ATOM 1311 CA GLU A 395 14.877 61.916 -1.674 1.00 77.21 C ATOM 1312 C GLU A 395 14.607 63.412 -1.574 1.00 74.93 C ATOM 1313 O GLU A 395 14.480 64.097 -2.593 1.00 76.81 O ATOM 1314 CB GLU A 395 13.735 61.184 -0.927 1.00 80.27 C ATOM 1315 CG GLU A 395 13.725 59.662 -0.943 1.00 85.25 C ATOM 1316 CD GLU A 395 13.603 59.050 0.461 1.00 87.32 C ATOM 1317 OE1 GLU A 395 14.306 59.548 1.392 1.00 84.63 O ATOM 1318 OE2 GLU A 395 12.833 58.068 0.614 1.00 89.65 O ATOM 1319 H GLU A 395 16.282 60.781 -0.465 1.00 0.00 H ATOM 1320 N LEU A 396 14.569 63.922 -0.341 1.00 72.82 N ATOM 1321 CA LEU A 396 14.285 65.335 -0.078 1.00 69.43 C ATOM 1322 C LEU A 396 15.327 66.249 -0.702 1.00 64.62 C ATOM 1323 O LEU A 396 15.009 67.332 -1.174 1.00 62.52 O ATOM 1324 CB LEU A 396 14.240 65.602 1.442 1.00 71.71 C ATOM 1325 CG LEU A 396 13.891 67.049 1.879 1.00 72.88 C ATOM 1326 CD1 LEU A 396 12.363 67.258 1.876 1.00 76.17 C ATOM 1327 CD2 LEU A 396 14.568 67.494 3.188 1.00 69.70 C ATOM 1328 H LEU A 396 14.748 63.291 0.466 1.00 0.00 H ATOM 1329 N ILE A 397 16.580 65.821 -0.669 1.00 64.00 N ATOM 1330 CA ILE A 397 17.687 66.684 -1.036 1.00 63.14 C ATOM 1331 C ILE A 397 17.821 66.811 -2.553 1.00 64.99 C ATOM 1332 O ILE A 397 17.996 67.936 -3.040 1.00 64.23 O ATOM 1333 CB ILE A 397 18.993 66.274 -0.298 1.00 62.36 C ATOM 1334 CG1 ILE A 397 18.922 66.813 1.130 1.00 62.17 C ATOM 1335 CG2 ILE A 397 20.226 66.863 -0.958 1.00 61.59 C ATOM 1336 CD1 ILE A 397 19.873 66.187 2.102 1.00 63.39 C ATOM 1337 H ILE A 397 16.775 64.843 -0.373 1.00 0.00 H ATOM 1338 N SER A 398 17.720 65.701 -3.295 1.00 66.70 N ATOM 1339 CA SER A 398 17.782 65.776 -4.765 1.00 67.10 C ATOM 1340 C SER A 398 16.600 66.539 -5.299 1.00 65.16 C ATOM 1341 O SER A 398 16.761 67.347 -6.217 1.00 67.75 O ATOM 1342 CB SER A 398 17.861 64.408 -5.450 1.00 70.46 C ATOM 1343 OG SER A 398 17.029 63.482 -4.801 1.00 73.67 O ATOM 1344 HG SER A 398 17.316 63.386 -3.858 1.00 0.00 H ATOM 1345 H SER A 398 17.597 64.779 -2.830 1.00 0.00 H ATOM 1346 N SER A 399 15.428 66.324 -4.708 1.00 62.71 N ATOM 1347 CA SER A 399 14.251 67.039 -5.164 1.00 63.38 C ATOM 1348 C SER A 399 14.349 68.534 -4.848 1.00 57.65 C ATOM 1349 O SER A 399 13.871 69.342 -5.619 1.00 58.49 O ATOM 1350 CB SER A 399 12.969 66.415 -4.604 1.00 66.89 C ATOM 1351 OG SER A 399 12.738 66.842 -3.282 1.00 66.41 O ATOM 1352 HG SER A 399 13.500 66.571 -2.711 1.00 0.00 H ATOM 1353 H SER A 399 15.356 65.646 -3.922 1.00 0.00 H ATOM 1354 N ILE A 400 14.987 68.908 -3.749 1.00 54.47 N ATOM 1355 CA ILE A 400 15.323 70.323 -3.511 1.00 53.29 C ATOM 1356 C ILE A 400 16.346 70.825 -4.530 1.00 53.11 C ATOM 1357 O ILE A 400 16.205 71.936 -5.035 1.00 51.87 O ATOM 1358 CB ILE A 400 15.789 70.577 -2.046 1.00 52.19 C ATOM 1359 CG1 ILE A 400 14.558 70.565 -1.149 1.00 52.15 C ATOM 1360 CG2 ILE A 400 16.524 71.919 -1.870 1.00 50.41 C ATOM 1361 CD1 ILE A 400 14.861 70.348 0.305 1.00 53.68 C ATOM 1362 H ILE A 400 15.255 68.192 -3.044 1.00 0.00 H ATOM 1363 N PHE A 401 17.359 70.015 -4.829 1.00 53.81 N ATOM 1364 CA PHE A 401 18.316 70.364 -5.876 1.00 54.75 C ATOM 1365 C PHE A 401 17.669 70.435 -7.269 1.00 56.47 C ATOM 1366 O PHE A 401 18.057 71.293 -8.065 1.00 56.62 O ATOM 1367 CB PHE A 401 19.516 69.415 -5.890 1.00 55.39 C ATOM 1368 CG PHE A 401 20.632 69.815 -4.950 1.00 54.68 C ATOM 1369 CD1 PHE A 401 20.402 69.974 -3.584 1.00 55.14 C ATOM 1370 CD2 PHE A 401 21.917 69.980 -5.410 1.00 53.88 C ATOM 1371 CE1 PHE A 401 21.432 70.299 -2.711 1.00 52.29 C ATOM 1372 CE2 PHE A 401 22.940 70.312 -4.540 1.00 53.09 C ATOM 1373 CZ PHE A 401 22.699 70.472 -3.189 1.00 51.42 C ATOM 1374 H PHE A 401 17.471 69.121 -4.310 1.00 0.00 H ATOM 1375 N ASP A 402 16.701 69.562 -7.556 1.00 58.22 N ATOM 1376 CA ASP A 402 16.041 69.565 -8.860 1.00 62.98 C ATOM 1377 C ASP A 402 15.218 70.831 -9.036 1.00 63.17 C ATOM 1378 O ASP A 402 15.293 71.512 -10.066 1.00 66.29 O ATOM 1379 CB ASP A 402 15.134 68.347 -9.042 1.00 67.95 C ATOM 1380 CG ASP A 402 15.913 67.040 -9.213 1.00 73.41 C ATOM 1381 OD1 ASP A 402 17.141 67.070 -9.488 1.00 75.40 O ATOM 1382 OD2 ASP A 402 15.285 65.961 -9.054 1.00 78.34 O ATOM 1383 H ASP A 402 16.411 68.867 -6.839 1.00 0.00 H ATOM 1384 N PHE A 403 14.436 71.145 -8.018 1.00 61.59 N ATOM 1385 CA PHE A 403 13.608 72.340 -8.026 1.00 59.70 C ATOM 1386 C PHE A 403 14.460 73.592 -8.181 1.00 56.87 C ATOM 1387 O PHE A 403 14.143 74.474 -8.966 1.00 58.77 O ATOM 1388 CB PHE A 403 12.776 72.419 -6.743 1.00 59.71 C ATOM 1389 CG PHE A 403 11.801 73.540 -6.742 1.00 58.71 C ATOM 1390 CD1 PHE A 403 10.579 73.421 -7.391 1.00 59.91 C ATOM 1391 CD2 PHE A 403 12.118 74.731 -6.120 1.00 58.52 C ATOM 1392 CE1 PHE A 403 9.684 74.484 -7.419 1.00 59.86 C ATOM 1393 CE2 PHE A 403 11.225 75.787 -6.119 1.00 58.39 C ATOM 1394 CZ PHE A 403 10.005 75.663 -6.777 1.00 58.52 C ATOM 1395 H PHE A 403 14.412 70.519 -7.187 1.00 0.00 H ATOM 1396 N SER A 404 15.543 73.660 -7.426 1.00 54.89 N ATOM 1397 CA SER A 404 16.494 74.759 -7.550 1.00 54.11 C ATOM 1398 C SER A 404 17.065 74.817 -8.953 1.00 54.88 C ATOM 1399 O SER A 404 17.232 75.898 -9.495 1.00 57.35 O ATOM 1400 CB SER A 404 17.619 74.649 -6.506 1.00 53.85 C ATOM 1401 OG SER A 404 17.183 75.077 -5.216 1.00 53.55 O ATOM 1402 HG SER A 404 16.426 74.512 -4.921 1.00 0.00 H ATOM 1403 H SER A 404 15.721 72.911 -6.726 1.00 0.00 H ATOM 1404 N HIS A 405 17.348 73.659 -9.542 1.00 57.19 N ATOM 1405 CA HIS A 405 17.933 73.596 -10.887 1.00 58.59 C ATOM 1406 C HIS A 405 16.989 74.116 -11.942 1.00 61.04 C ATOM 1407 O HIS A 405 17.429 74.808 -12.844 1.00 64.55 O ATOM 1408 CB HIS A 405 18.316 72.174 -11.251 1.00 59.44 C ATOM 1409 CG HIS A 405 19.258 72.075 -12.406 1.00 60.59 C ATOM 1410 ND1 HIS A 405 20.615 72.242 -12.273 1.00 61.09 N ATOM 1411 CD2 HIS A 405 19.037 71.801 -13.713 1.00 62.43 C ATOM 1412 CE1 HIS A 405 21.196 72.071 -13.446 1.00 63.62 C ATOM 1413 NE2 HIS A 405 20.258 71.814 -14.339 1.00 65.44 N ATOM 1414 H HIS A 405 17.149 72.773 -9.035 1.00 0.00 H ATOM 1415 N SER A 406 15.706 73.780 -11.836 1.00 61.93 N ATOM 1416 CA SER A 406 14.709 74.261 -12.792 1.00 64.68 C ATOM 1417 C SER A 406 14.420 75.760 -12.669 1.00 63.59 C ATOM 1418 O SER A 406 14.211 76.431 -13.683 1.00 69.21 O ATOM 1419 CB SER A 406 13.423 73.457 -12.687 1.00 65.71 C ATOM 1420 OG SER A 406 13.085 73.297 -11.342 1.00 64.91 O ATOM 1421 HG SER A 406 13.814 72.818 -10.874 1.00 0.00 H ATOM 1422 H SER A 406 15.405 73.161 -11.056 1.00 0.00 H ATOM 1423 N LEU A 407 14.412 76.296 -11.457 1.00 60.40 N ATOM 1424 CA LEU A 407 14.324 77.740 -11.296 1.00 60.68 C ATOM 1425 C LEU A 407 15.582 78.454 -11.772 1.00 61.58 C ATOM 1426 O LEU A 407 15.512 79.618 -12.176 1.00 65.79 O ATOM 1427 CB LEU A 407 14.054 78.123 -9.843 1.00 60.64 C ATOM 1428 CG LEU A 407 12.716 77.711 -9.229 1.00 62.71 C ATOM 1429 CD1 LEU A 407 12.500 78.497 -7.948 1.00 61.73 C ATOM 1430 CD2 LEU A 407 11.530 77.907 -10.182 1.00 65.44 C ATOM 1431 H LEU A 407 14.469 75.683 -10.619 1.00 0.00 H ATOM 1432 N SER A 408 16.731 77.792 -11.698 1.00 61.15 N ATOM 1433 CA SER A 408 17.952 78.346 -12.277 1.00 63.93 C ATOM 1434 C SER A 408 17.824 78.602 -13.776 1.00 65.87 C ATOM 1435 O SER A 408 18.301 79.621 -14.278 1.00 67.19 O ATOM 1436 CB SER A 408 19.163 77.443 -12.002 1.00 65.72 C ATOM 1437 OG SER A 408 19.618 77.675 -10.685 1.00 65.84 O ATOM 1438 HG SER A 408 18.892 77.466 -10.045 1.00 0.00 H ATOM 1439 H SER A 408 16.762 76.868 -11.222 1.00 0.00 H ATOM 1440 N ALA A 409 17.170 77.680 -14.472 1.00 66.83 N ATOM 1441 CA ALA A 409 16.935 77.813 -15.902 1.00 69.55 C ATOM 1442 C ALA A 409 16.293 79.152 -16.290 1.00 70.54 C ATOM 1443 O ALA A 409 16.667 79.715 -17.313 1.00 75.74 O ATOM 1444 CB ALA A 409 16.102 76.649 -16.424 1.00 70.36 C ATOM 1445 H ALA A 409 16.814 76.836 -13.980 1.00 0.00 H ATOM 1446 N LEU A 410 15.374 79.667 -15.468 1.00 67.76 N ATOM 1447 CA LEU A 410 14.701 80.961 -15.732 1.00 67.67 C ATOM 1448 C LEU A 410 15.560 82.234 -15.591 1.00 67.01 C ATOM 1449 O LEU A 410 15.137 83.320 -16.018 1.00 67.01 O ATOM 1450 CB LEU A 410 13.528 81.156 -14.775 1.00 67.63 C ATOM 1451 CG LEU A 410 12.502 80.064 -14.531 1.00 68.68 C ATOM 1452 CD1 LEU A 410 11.302 80.732 -13.860 1.00 68.59 C ATOM 1453 CD2 LEU A 410 12.119 79.378 -15.839 1.00 71.04 C ATOM 1454 H LEU A 410 15.121 79.139 -14.609 1.00 0.00 H ATOM 1455 N HIS A 411 16.713 82.120 -14.939 1.00 65.70 N ATOM 1456 CA HIS A 411 17.531 83.266 -14.584 1.00 66.53 C ATOM 1457 C HIS A 411 16.717 84.399 -13.956 1.00 66.48 C ATOM 1458 O HIS A 411 16.782 85.525 -14.390 1.00 66.65 O ATOM 1459 CB HIS A 411 18.329 83.729 -15.794 1.00 69.56 C ATOM 1460 CG HIS A 411 19.337 82.726 -16.260 1.00 72.52 C ATOM 1461 ND1 HIS A 411 19.198 82.011 -17.432 1.00 75.99 N ATOM 1462 CD2 HIS A 411 20.492 82.300 -15.697 1.00 72.96 C ATOM 1463 CE1 HIS A 411 20.228 81.199 -17.579 1.00 77.31 C ATOM 1464 NE2 HIS A 411 21.029 81.355 -16.539 1.00 75.59 N ATOM 1465 H HIS A 411 17.043 81.170 -14.672 1.00 0.00 H ATOM 1466 N PHE A 412 15.938 84.060 -12.930 1.00 69.21 N ATOM 1467 CA PHE A 412 15.163 85.023 -12.153 1.00 69.97 C ATOM 1468 C PHE A 412 15.964 86.275 -11.842 1.00 69.71 C ATOM 1469 O PHE A 412 17.045 86.175 -11.313 1.00 68.57 O ATOM 1470 CB PHE A 412 14.801 84.434 -10.797 1.00 72.78 C ATOM 1471 CG PHE A 412 13.465 83.783 -10.734 1.00 79.69 C ATOM 1472 CD1 PHE A 412 12.322 84.547 -10.647 1.00 83.93 C ATOM 1473 CD2 PHE A 412 13.350 82.411 -10.671 1.00 85.56 C ATOM 1474 CE1 PHE A 412 11.071 83.959 -10.543 1.00 85.39 C ATOM 1475 CE2 PHE A 412 12.103 81.812 -10.559 1.00 87.78 C ATOM 1476 CZ PHE A 412 10.958 82.588 -10.499 1.00 86.67 C ATOM 1477 H PHE A 412 15.879 83.055 -12.668 1.00 0.00 H ATOM 1478 N SER A 413 15.418 87.447 -12.159 1.00 71.83 N ATOM 1479 CA SER A 413 15.881 88.728 -11.604 1.00 68.91 C ATOM 1480 C SER A 413 15.688 88.708 -10.088 1.00 65.54 C ATOM 1481 O SER A 413 14.906 87.925 -9.570 1.00 65.53 O ATOM 1482 CB SER A 413 15.066 89.884 -12.212 1.00 70.69 C ATOM 1483 OG SER A 413 15.265 91.123 -11.531 1.00 72.64 O ATOM 1484 HG SER A 413 14.719 91.827 -11.963 1.00 0.00 H ATOM 1485 H SER A 413 14.625 87.457 -12.832 1.00 0.00 H ATOM 1486 N GLU A 414 16.402 89.567 -9.376 1.00 64.38 N ATOM 1487 CA GLU A 414 16.127 89.799 -7.956 1.00 60.51 C ATOM 1488 C GLU A 414 14.716 90.283 -7.748 1.00 59.12 C ATOM 1489 O GLU A 414 14.009 89.715 -6.930 1.00 61.16 O ATOM 1490 CB GLU A 414 17.098 90.812 -7.369 1.00 61.34 C ATOM 1491 CG GLU A 414 18.489 90.259 -7.169 1.00 62.17 C ATOM 1492 CD GLU A 414 18.555 89.250 -6.033 1.00 61.04 C ATOM 1493 OE1 GLU A 414 18.743 89.705 -4.889 1.00 59.29 O ATOM 1494 OE2 GLU A 414 18.428 88.015 -6.286 1.00 60.17 O ATOM 1495 H GLU A 414 17.175 90.089 -9.836 1.00 0.00 H ATOM 1496 N ASP A 415 14.308 91.304 -8.505 1.00 60.29 N ATOM 1497 CA ASP A 415 12.939 91.857 -8.426 1.00 59.38 C ATOM 1498 C ASP A 415 11.855 90.831 -8.747 1.00 55.82 C ATOM 1499 O ASP A 415 10.771 90.864 -8.158 1.00 56.77 O ATOM 1500 CB ASP A 415 12.750 93.028 -9.385 1.00 64.60 C ATOM 1501 CG ASP A 415 13.718 94.169 -9.136 1.00 69.11 C ATOM 1502 OD1 ASP A 415 14.170 94.349 -7.986 1.00 69.54 O ATOM 1503 OD2 ASP A 415 14.004 94.898 -10.116 1.00 75.45 O ATOM 1504 H ASP A 415 14.980 91.727 -9.177 1.00 0.00 H ATOM 1505 N GLU A 416 12.138 89.930 -9.683 1.00 53.14 N ATOM 1506 CA GLU A 416 11.194 88.859 -10.005 1.00 52.38 C ATOM 1507 C GLU A 416 10.990 87.931 -8.802 1.00 50.60 C ATOM 1508 O GLU A 416 9.865 87.549 -8.505 1.00 49.45 O ATOM 1509 CB GLU A 416 11.639 88.083 -11.254 1.00 53.27 C ATOM 1510 CG GLU A 416 11.336 88.831 -12.541 1.00 55.93 C ATOM 1511 CD GLU A 416 12.174 88.443 -13.752 1.00 56.22 C ATOM 1512 OE1 GLU A 416 13.129 87.652 -13.619 1.00 52.34 O ATOM 1513 OE2 GLU A 416 11.875 88.969 -14.862 1.00 57.62 O ATOM 1514 H GLU A 416 13.042 89.987 -10.193 1.00 0.00 H ATOM 1515 N ILE A 417 12.075 87.602 -8.106 1.00 50.87 N ATOM 1516 CA ILE A 417 12.006 86.795 -6.882 1.00 51.92 C ATOM 1517 C ILE A 417 11.212 87.519 -5.801 1.00 51.27 C ATOM 1518 O ILE A 417 10.348 86.918 -5.156 1.00 52.00 O ATOM 1519 CB ILE A 417 13.422 86.374 -6.373 1.00 53.44 C ATOM 1520 CG1 ILE A 417 13.871 85.119 -7.109 1.00 54.63 C ATOM 1521 CG2 ILE A 417 13.434 86.017 -4.891 1.00 53.79 C ATOM 1522 CD1 ILE A 417 15.320 84.771 -6.893 1.00 55.03 C ATOM 1523 H ILE A 417 13.004 87.928 -8.441 1.00 0.00 H ATOM 1524 N ALA A 418 11.515 88.799 -5.612 1.00 51.32 N ATOM 1525 CA ALA A 418 10.816 89.636 -4.644 1.00 52.68 C ATOM 1526 C ALA A 418 9.308 89.620 -4.874 1.00 54.23 C ATOM 1527 O ALA A 418 8.511 89.360 -3.963 1.00 53.56 O ATOM 1528 CB ALA A 418 11.330 91.063 -4.723 1.00 53.62 C ATOM 1529 H ALA A 418 12.280 89.220 -6.176 1.00 0.00 H ATOM 1530 N LEU A 419 8.923 89.888 -6.114 1.00 55.64 N ATOM 1531 CA LEU A 419 7.512 89.972 -6.458 1.00 56.25 C ATOM 1532 C LEU A 419 6.807 88.611 -6.395 1.00 55.38 C ATOM 1533 O LEU A 419 5.687 88.523 -5.895 1.00 53.94 O ATOM 1534 CB LEU A 419 7.358 90.620 -7.834 1.00 56.21 C ATOM 1535 CG LEU A 419 7.599 92.116 -7.860 1.00 57.00 C ATOM 1536 CD1 LEU A 419 7.886 92.558 -9.283 1.00 58.97 C ATOM 1537 CD2 LEU A 419 6.390 92.859 -7.305 1.00 58.83 C ATOM 1538 H LEU A 419 9.640 90.040 -6.852 1.00 0.00 H ATOM 1539 N TYR A 420 7.479 87.573 -6.899 1.00 56.46 N ATOM 1540 CA TYR A 420 6.948 86.214 -6.899 1.00 57.56 C ATOM 1541 C TYR A 420 6.812 85.687 -5.468 1.00 58.20 C ATOM 1542 O TYR A 420 5.751 85.178 -5.111 1.00 60.36 O ATOM 1543 CB TYR A 420 7.817 85.274 -7.751 1.00 58.19 C ATOM 1544 CG TYR A 420 7.317 83.833 -7.799 1.00 60.27 C ATOM 1545 CD1 TYR A 420 6.087 83.521 -8.374 1.00 63.43 C ATOM 1546 CD2 TYR A 420 8.076 82.778 -7.273 1.00 60.65 C ATOM 1547 CE1 TYR A 420 5.623 82.207 -8.418 1.00 64.63 C ATOM 1548 CE2 TYR A 420 7.618 81.468 -7.303 1.00 61.62 C ATOM 1549 CZ TYR A 420 6.387 81.192 -7.878 1.00 63.92 C ATOM 1550 OH TYR A 420 5.914 79.909 -7.927 1.00 67.98 O ATOM 1551 HH TYR A 420 5.028 79.902 -8.369 1.00 0.00 H ATOM 1552 H TYR A 420 8.420 87.740 -7.309 1.00 0.00 H ATOM 1553 N THR A 421 7.856 85.831 -4.640 1.00 56.19 N ATOM 1554 CA THR A 421 7.789 85.360 -3.245 1.00 53.19 C ATOM 1555 C THR A 421 6.788 86.128 -2.388 1.00 53.20 C ATOM 1556 O THR A 421 6.245 85.574 -1.438 1.00 55.45 O ATOM 1557 CB THR A 421 9.158 85.288 -2.537 1.00 52.67 C ATOM 1558 OG1 THR A 421 9.757 86.596 -2.405 1.00 53.72 O ATOM 1559 CG2 THR A 421 10.080 84.324 -3.281 1.00 52.42 C ATOM 1560 HG1 THR A 421 9.889 86.989 -3.304 1.00 0.00 H ATOM 1561 H THR A 421 8.727 86.282 -4.987 1.00 0.00 H ATOM 1562 N ALA A 422 6.529 87.391 -2.716 1.00 52.26 N ATOM 1563 CA ALA A 422 5.430 88.126 -2.084 1.00 52.20 C ATOM 1564 C ALA A 422 4.068 87.487 -2.397 1.00 52.46 C ATOM 1565 O ALA A 422 3.217 87.382 -1.530 1.00 52.03 O ATOM 1566 CB ALA A 422 5.447 89.567 -2.526 1.00 53.09 C ATOM 1567 H ALA A 422 7.116 87.864 -3.432 1.00 0.00 H ATOM 1568 N LEU A 423 3.879 87.046 -3.636 1.00 52.65 N ATOM 1569 CA LEU A 423 2.666 86.311 -4.020 1.00 55.25 C ATOM 1570 C LEU A 423 2.548 84.889 -3.443 1.00 56.40 C ATOM 1571 O LEU A 423 1.435 84.373 -3.286 1.00 58.28 O ATOM 1572 CB LEU A 423 2.547 86.231 -5.537 1.00 55.67 C ATOM 1573 CG LEU A 423 2.228 87.549 -6.207 1.00 55.89 C ATOM 1574 CD1 LEU A 423 2.461 87.407 -7.705 1.00 57.01 C ATOM 1575 CD2 LEU A 423 0.805 87.993 -5.877 1.00 56.91 C ATOM 1576 H LEU A 423 4.610 87.226 -4.354 1.00 0.00 H ATOM 1577 N VAL A 424 3.682 84.248 -3.170 1.00 56.00 N ATOM 1578 CA VAL A 424 3.697 82.977 -2.435 1.00 56.14 C ATOM 1579 C VAL A 424 3.065 83.132 -1.047 1.00 58.20 C ATOM 1580 O VAL A 424 2.196 82.335 -0.665 1.00 58.86 O ATOM 1581 CB VAL A 424 5.129 82.415 -2.317 1.00 53.43 C ATOM 1582 CG1 VAL A 424 5.226 81.330 -1.252 1.00 53.16 C ATOM 1583 CG2 VAL A 424 5.588 81.892 -3.672 1.00 53.66 C ATOM 1584 H VAL A 424 4.583 84.659 -3.486 1.00 0.00 H ATOM 1585 N LEU A 425 3.494 84.162 -0.315 1.00 59.15 N ATOM 1586 CA LEU A 425 2.939 84.454 1.008 1.00 61.58 C ATOM 1587 C LEU A 425 1.473 84.875 0.948 1.00 62.79 C ATOM 1588 O LEU A 425 0.624 84.232 1.579 1.00 64.72 O ATOM 1589 CB LEU A 425 3.738 85.555 1.690 1.00 61.51 C ATOM 1590 CG LEU A 425 5.154 85.139 2.056 1.00 60.82 C ATOM 1591 CD1 LEU A 425 5.980 86.389 2.276 1.00 61.63 C ATOM 1592 CD2 LEU A 425 5.183 84.230 3.280 1.00 61.71 C ATOM 1593 H LEU A 425 4.244 84.775 -0.695 1.00 0.00 H ATOM 1594 N ILE A 426 1.208 85.932 0.178 1.00 59.84 N ATOM 1595 CA ILE A 426 -0.081 86.592 0.175 1.00 60.52 C ATOM 1596 C ILE A 426 -1.012 85.831 -0.751 1.00 61.73 C ATOM 1597 O ILE A 426 -1.158 86.154 -1.925 1.00 62.38 O ATOM 1598 CB ILE A 426 0.020 88.069 -0.261 1.00 60.22 C ATOM 1599 CG1 ILE A 426 1.058 88.849 0.576 1.00 60.67 C ATOM 1600 CG2 ILE A 426 -1.335 88.739 -0.144 1.00 62.25 C ATOM 1601 CD1 ILE A 426 0.893 88.764 2.084 1.00 63.12 C ATOM 1602 H ILE A 426 1.957 86.296 -0.445 1.00 0.00 H ATOM 1603 N ASN A 427 -1.637 84.807 -0.191 1.00 63.82 N ATOM 1604 CA ASN A 427 -2.427 83.835 -0.938 1.00 64.73 C ATOM 1605 C ASN A 427 -3.711 83.610 -0.163 1.00 65.19 C ATOM 1606 O ASN A 427 -3.692 83.055 0.925 1.00 65.91 O ATOM 1607 CB ASN A 427 -1.612 82.534 -1.051 1.00 66.10 C ATOM 1608 CG ASN A 427 -2.345 81.403 -1.761 1.00 68.09 C ATOM 1609 OD1 ASN A 427 -3.357 81.587 -2.433 1.00 67.93 O ATOM 1610 ND2 ASN A 427 -1.801 80.208 -1.618 1.00 69.74 N ATOM 1611 HD22 ASN A 427 -0.944 80.093 -1.041 1.00 0.00 H ATOM 1612 HD21 ASN A 427 -2.230 79.382 -2.083 1.00 0.00 H ATOM 1613 H ASN A 427 -1.560 84.689 0.839 1.00 0.00 H ATOM 1614 N ALA A 428 -4.825 84.059 -0.720 1.00 65.48 N ATOM 1615 CA ALA A 428 -6.104 83.988 -0.033 1.00 68.98 C ATOM 1616 C ALA A 428 -6.823 82.640 -0.196 1.00 72.17 C ATOM 1617 O ALA A 428 -8.022 82.557 0.053 1.00 75.36 O ATOM 1618 CB ALA A 428 -6.999 85.124 -0.505 1.00 70.50 C ATOM 1619 H ALA A 428 -4.784 84.473 -1.673 1.00 0.00 H ATOM 1620 N HIS A 429 -6.119 81.597 -0.625 1.00 73.48 N ATOM 1621 CA HIS A 429 -6.665 80.243 -0.627 1.00 78.30 C ATOM 1622 C HIS A 429 -6.115 79.394 0.526 1.00 78.58 C ATOM 1623 O HIS A 429 -6.458 78.218 0.632 1.00 83.62 O ATOM 1624 CB HIS A 429 -6.401 79.560 -1.974 1.00 81.18 C ATOM 1625 CG HIS A 429 -7.255 80.082 -3.087 1.00 85.32 C ATOM 1626 ND1 HIS A 429 -6.729 80.707 -4.199 1.00 84.99 N ATOM 1627 CD2 HIS A 429 -8.599 80.080 -3.253 1.00 90.15 C ATOM 1628 CE1 HIS A 429 -7.712 81.067 -5.004 1.00 88.73 C ATOM 1629 NE2 HIS A 429 -8.857 80.697 -4.454 1.00 92.04 N ATOM 1630 H HIS A 429 -5.150 81.750 -0.970 1.00 0.00 H ATOM 1631 N ARG A 430 -5.299 79.979 1.404 1.00 75.34 N ATOM 1632 CA ARG A 430 -4.789 79.262 2.569 1.00 74.06 C ATOM 1633 C ARG A 430 -5.960 78.987 3.489 1.00 77.97 C ATOM 1634 O ARG A 430 -6.712 79.920 3.787 1.00 78.68 O ATOM 1635 CB ARG A 430 -3.795 80.099 3.365 1.00 71.96 C ATOM 1636 CG ARG A 430 -2.602 80.587 2.597 1.00 68.57 C ATOM 1637 CD ARG A 430 -1.730 79.454 2.133 1.00 68.48 C ATOM 1638 NE ARG A 430 -0.402 79.968 1.827 1.00 66.79 N ATOM 1639 CZ ARG A 430 0.512 79.339 1.108 1.00 65.45 C ATOM 1640 NH1 ARG A 430 0.281 78.132 0.599 1.00 64.52 N ATOM 1641 NH2 ARG A 430 1.680 79.941 0.908 1.00 66.33 N ATOM 1642 HE ARG A 430 -0.153 80.905 2.204 1.00 0.00 H ATOM 1643 HH12 ARG A 430 1.015 77.656 0.036 1.00 0.00 H ATOM 1644 HH11 ARG A 430 -0.633 77.664 0.764 1.00 0.00 H ATOM 1645 HH22 ARG A 430 2.418 79.470 0.346 1.00 0.00 H ATOM 1646 HH21 ARG A 430 1.856 80.883 1.313 1.00 0.00 H ATOM 1647 H ARG A 430 -5.019 80.970 1.255 1.00 0.00 H ATOM 1648 N PRO A 431 -6.119 77.733 3.957 1.00 80.35 N ATOM 1649 CA PRO A 431 -7.184 77.489 4.928 1.00 84.46 C ATOM 1650 C PRO A 431 -6.829 78.059 6.309 1.00 85.01 C ATOM 1651 O PRO A 431 -5.682 77.958 6.727 1.00 83.79 O ATOM 1652 CB PRO A 431 -7.285 75.958 4.970 1.00 86.95 C ATOM 1653 CG PRO A 431 -6.238 75.426 4.036 1.00 84.01 C ATOM 1654 CD PRO A 431 -5.296 76.532 3.742 1.00 79.62 C ATOM 1655 N GLY A 432 -7.810 78.655 6.987 1.00 88.09 N ATOM 1656 CA GLY A 432 -7.619 79.255 8.314 1.00 89.52 C ATOM 1657 C GLY A 432 -7.751 80.771 8.416 1.00 89.02 C ATOM 1658 O GLY A 432 -7.679 81.315 9.521 1.00 92.09 O ATOM 1659 H GLY A 432 -8.755 78.697 6.556 1.00 0.00 H ATOM 1660 N LEU A 433 -7.948 81.457 7.289 1.00 86.56 N ATOM 1661 CA LEU A 433 -7.986 82.922 7.261 1.00 83.60 C ATOM 1662 C LEU A 433 -9.323 83.422 7.756 1.00 86.59 C ATOM 1663 O LEU A 433 -10.356 82.876 7.399 1.00 88.28 O ATOM 1664 CB LEU A 433 -7.770 83.449 5.840 1.00 80.21 C ATOM 1665 CG LEU A 433 -6.450 83.085 5.173 1.00 76.53 C ATOM 1666 CD1 LEU A 433 -6.516 83.407 3.686 1.00 74.43 C ATOM 1667 CD2 LEU A 433 -5.312 83.819 5.874 1.00 75.14 C ATOM 1668 H LEU A 433 -8.079 80.934 6.400 1.00 0.00 H ATOM 1669 N GLN A 434 -9.297 84.460 8.578 1.00 87.53 N ATOM 1670 CA GLN A 434 -10.517 85.088 9.060 1.00 92.07 C ATOM 1671 C GLN A 434 -10.974 86.238 8.180 1.00 90.96 C ATOM 1672 O GLN A 434 -12.139 86.588 8.202 1.00 94.29 O ATOM 1673 CB GLN A 434 -10.339 85.546 10.512 1.00 95.55 C ATOM 1674 CG GLN A 434 -10.564 84.417 11.522 1.00 98.49 C ATOM 1675 CD GLN A 434 -9.728 84.541 12.780 1.00 98.90 C ATOM 1676 OE1 GLN A 434 -9.345 85.636 13.192 1.00 99.09 O ATOM 1677 NE2 GLN A 434 -9.435 83.408 13.394 1.00 99.90 N ATOM 1678 HE22 GLN A 434 -9.780 82.505 13.011 1.00 0.00 H ATOM 1679 HE21 GLN A 434 -8.860 83.420 14.260 1.00 0.00 H ATOM 1680 H GLN A 434 -8.378 84.837 8.888 1.00 0.00 H ATOM 1681 N GLU A 435 -10.078 86.824 7.405 1.00 89.34 N ATOM 1682 CA GLU A 435 -10.446 87.930 6.529 1.00 91.58 C ATOM 1683 C GLU A 435 -9.943 87.687 5.100 1.00 89.58 C ATOM 1684 O GLU A 435 -9.087 88.416 4.584 1.00 86.98 O ATOM 1685 CB GLU A 435 -9.914 89.243 7.090 1.00 92.93 C ATOM 1686 CG GLU A 435 -10.430 89.615 8.473 1.00 97.25 C ATOM 1687 CD GLU A 435 -9.710 90.826 9.056 1.00 98.25 C ATOM 1688 OE1 GLU A 435 -8.515 91.036 8.735 1.00 95.86 O ATOM 1689 OE2 GLU A 435 -10.341 91.567 9.844 1.00102.71 O ATOM 1690 H GLU A 435 -9.093 86.490 7.420 1.00 0.00 H ATOM 1691 N LYS A 436 -10.502 86.647 4.479 1.00 90.93 N ATOM 1692 CA LYS A 436 -10.252 86.291 3.074 1.00 88.16 C ATOM 1693 C LYS A 436 -10.295 87.545 2.193 1.00 84.72 C ATOM 1694 O LYS A 436 -9.337 87.805 1.491 1.00 81.52 O ATOM 1695 CB LYS A 436 -11.303 85.265 2.594 1.00 92.64 C ATOM 1696 CG LYS A 436 -10.876 84.194 1.592 1.00 91.39 C ATOM 1697 CD LYS A 436 -12.136 83.501 1.038 1.00 95.00 C ATOM 1698 CE LYS A 436 -12.020 81.991 0.865 1.00 96.89 C ATOM 1699 NZ LYS A 436 -11.292 81.585 -0.371 1.00 95.60 N ATOM 1700 HZ1 LYS A 436 -11.792 81.956 -1.204 1.00 0.00 H ATOM 1701 HZ2 LYS A 436 -10.326 81.970 -0.345 1.00 0.00 H ATOM 1702 HZ3 LYS A 436 -11.252 80.547 -0.423 1.00 0.00 H ATOM 1703 H LYS A 436 -11.157 86.050 5.023 1.00 0.00 H ATOM 1704 N ARG A 437 -11.375 88.330 2.270 1.00 85.21 N ATOM 1705 CA ARG A 437 -11.523 89.508 1.407 1.00 84.91 C ATOM 1706 C ARG A 437 -10.353 90.485 1.507 1.00 81.71 C ATOM 1707 O ARG A 437 -9.934 91.028 0.488 1.00 79.33 O ATOM 1708 CB ARG A 437 -12.821 90.255 1.695 1.00 90.60 C ATOM 1709 CG ARG A 437 -14.095 89.557 1.237 1.00 96.05 C ATOM 1710 CD ARG A 437 -15.318 90.314 1.772 1.00102.39 C ATOM 1711 NE ARG A 437 -16.447 90.428 0.839 1.00107.63 N ATOM 1712 CZ ARG A 437 -16.465 91.141 -0.298 1.00107.56 C ATOM 1713 NH1 ARG A 437 -15.385 91.800 -0.724 1.00106.12 N ATOM 1714 NH2 ARG A 437 -17.573 91.177 -1.040 1.00109.01 N ATOM 1715 HE ARG A 437 -17.314 89.907 1.082 1.00 0.00 H ATOM 1716 HH12 ARG A 437 -15.424 92.346 -1.609 1.00 0.00 H ATOM 1717 HH11 ARG A 437 -14.505 91.768 -0.171 1.00 0.00 H ATOM 1718 HH22 ARG A 437 -17.591 91.728 -1.922 1.00 0.00 H ATOM 1719 HH21 ARG A 437 -18.419 90.654 -0.737 1.00 0.00 H ATOM 1720 H ARG A 437 -12.124 88.101 2.954 1.00 0.00 H ATOM 1721 N LYS A 438 -9.818 90.679 2.715 1.00 82.23 N ATOM 1722 CA LYS A 438 -8.689 91.611 2.956 1.00 80.04 C ATOM 1723 C LYS A 438 -7.391 91.155 2.283 1.00 75.02 C ATOM 1724 O LYS A 438 -6.601 91.986 1.802 1.00 73.78 O ATOM 1725 CB LYS A 438 -8.398 91.768 4.455 1.00 83.73 C ATOM 1726 CG LYS A 438 -9.532 92.259 5.334 1.00 90.90 C ATOM 1727 CD LYS A 438 -9.779 93.750 5.198 1.00 94.84 C ATOM 1728 CE LYS A 438 -11.129 94.162 5.780 1.00100.10 C ATOM 1729 NZ LYS A 438 -11.626 95.400 5.102 1.00101.29 N ATOM 1730 HZ1 LYS A 438 -10.943 96.171 5.246 1.00 0.00 H ATOM 1731 HZ2 LYS A 438 -11.735 95.217 4.084 1.00 0.00 H ATOM 1732 HZ3 LYS A 438 -12.545 95.670 5.507 1.00 0.00 H ATOM 1733 H LYS A 438 -10.210 90.154 3.522 1.00 0.00 H ATOM 1734 N VAL A 439 -7.184 89.833 2.277 1.00 71.41 N ATOM 1735 CA VAL A 439 -5.989 89.188 1.726 1.00 66.89 C ATOM 1736 C VAL A 439 -6.039 89.103 0.194 1.00 66.50 C ATOM 1737 O VAL A 439 -5.003 89.174 -0.475 1.00 65.49 O ATOM 1738 CB VAL A 439 -5.822 87.779 2.320 1.00 66.29 C ATOM 1739 CG1 VAL A 439 -4.638 87.057 1.720 1.00 64.31 C ATOM 1740 CG2 VAL A 439 -5.657 87.848 3.827 1.00 68.80 C ATOM 1741 H VAL A 439 -7.919 89.224 2.690 1.00 0.00 H ATOM 1742 N GLU A 440 -7.240 88.936 -0.351 1.00 68.80 N ATOM 1743 CA GLU A 440 -7.471 89.024 -1.792 1.00 68.20 C ATOM 1744 C GLU A 440 -7.144 90.402 -2.327 1.00 69.70 C ATOM 1745 O GLU A 440 -6.558 90.520 -3.408 1.00 68.29 O ATOM 1746 CB GLU A 440 -8.925 88.749 -2.113 1.00 69.63 C ATOM 1747 CG GLU A 440 -9.320 87.307 -1.940 1.00 70.13 C ATOM 1748 CD GLU A 440 -10.805 87.079 -2.094 1.00 72.69 C ATOM 1749 OE1 GLU A 440 -11.581 88.043 -2.331 1.00 71.98 O ATOM 1750 OE2 GLU A 440 -11.179 85.905 -1.947 1.00 74.63 O ATOM 1751 H GLU A 440 -8.048 88.735 0.273 1.00 0.00 H ATOM 1752 N GLN A 441 -7.563 91.429 -1.583 1.00 72.99 N ATOM 1753 CA GLN A 441 -7.219 92.815 -1.886 1.00 75.11 C ATOM 1754 C GLN A 441 -5.718 92.952 -2.170 1.00 73.42 C ATOM 1755 O GLN A 441 -5.329 93.470 -3.224 1.00 72.13 O ATOM 1756 CB GLN A 441 -7.598 93.724 -0.716 1.00 80.90 C ATOM 1757 CG GLN A 441 -7.623 95.221 -1.029 1.00 84.52 C ATOM 1758 CD GLN A 441 -8.895 95.667 -1.727 1.00 87.22 C ATOM 1759 OE1 GLN A 441 -8.853 96.218 -2.833 1.00 90.02 O ATOM 1760 NE2 GLN A 441 -10.035 95.451 -1.074 1.00 87.27 N ATOM 1761 HE22 GLN A 441 -10.022 94.983 -0.145 1.00 0.00 H ATOM 1762 HE21 GLN A 441 -10.939 95.750 -1.493 1.00 0.00 H ATOM 1763 H GLN A 441 -8.159 91.233 -0.753 1.00 0.00 H ATOM 1764 N LEU A 442 -4.882 92.466 -1.247 1.00 73.31 N ATOM 1765 CA LEU A 442 -3.435 92.519 -1.428 1.00 72.63 C ATOM 1766 C LEU A 442 -2.935 91.637 -2.529 1.00 69.19 C ATOM 1767 O LEU A 442 -2.067 92.053 -3.290 1.00 72.69 O ATOM 1768 CB LEU A 442 -2.690 92.091 -0.184 1.00 75.64 C ATOM 1769 CG LEU A 442 -2.461 93.202 0.828 1.00 79.94 C ATOM 1770 CD1 LEU A 442 -3.754 93.524 1.610 1.00 82.49 C ATOM 1771 CD2 LEU A 442 -1.322 92.701 1.707 1.00 80.40 C ATOM 1772 H LEU A 442 -5.271 92.041 -0.381 1.00 0.00 H ATOM 1773 N GLN A 443 -3.428 90.405 -2.576 1.00 66.10 N ATOM 1774 CA GLN A 443 -3.020 89.455 -3.612 1.00 63.88 C ATOM 1775 C GLN A 443 -3.254 90.026 -5.006 1.00 63.67 C ATOM 1776 O GLN A 443 -2.373 89.976 -5.863 1.00 62.60 O ATOM 1777 CB GLN A 443 -3.790 88.158 -3.458 1.00 64.98 C ATOM 1778 CG GLN A 443 -3.347 87.041 -4.378 1.00 64.80 C ATOM 1779 CD GLN A 443 -4.286 85.857 -4.338 1.00 65.81 C ATOM 1780 OE1 GLN A 443 -4.921 85.581 -3.332 1.00 68.58 O ATOM 1781 NE2 GLN A 443 -4.396 85.164 -5.448 1.00 67.52 N ATOM 1782 HE22 GLN A 443 -3.838 85.430 -6.285 1.00 0.00 H ATOM 1783 HE21 GLN A 443 -5.041 84.349 -5.491 1.00 0.00 H ATOM 1784 H GLN A 443 -4.121 90.108 -1.859 1.00 0.00 H ATOM 1785 N TYR A 444 -4.438 90.594 -5.212 1.00 65.16 N ATOM 1786 CA TYR A 444 -4.823 91.148 -6.506 1.00 64.23 C ATOM 1787 C TYR A 444 -3.920 92.305 -6.920 1.00 63.28 C ATOM 1788 O TYR A 444 -3.449 92.330 -8.046 1.00 63.40 O ATOM 1789 CB TYR A 444 -6.285 91.548 -6.482 1.00 65.39 C ATOM 1790 CG TYR A 444 -7.256 90.396 -6.297 1.00 65.67 C ATOM 1791 CD1 TYR A 444 -6.895 89.061 -6.536 1.00 65.74 C ATOM 1792 CD2 TYR A 444 -8.548 90.650 -5.884 1.00 67.82 C ATOM 1793 CE1 TYR A 444 -7.804 88.029 -6.357 1.00 68.29 C ATOM 1794 CE2 TYR A 444 -9.477 89.629 -5.711 1.00 69.82 C ATOM 1795 CZ TYR A 444 -9.100 88.318 -5.944 1.00 70.29 C ATOM 1796 OH TYR A 444 -10.015 87.302 -5.787 1.00 72.58 O ATOM 1797 HH TYR A 444 -9.583 86.435 -5.992 1.00 0.00 H ATOM 1798 H TYR A 444 -5.114 90.645 -4.423 1.00 0.00 H ATOM 1799 N ASN A 445 -3.651 93.233 -6.010 1.00 64.42 N ATOM 1800 CA ASN A 445 -2.716 94.331 -6.307 1.00 64.29 C ATOM 1801 C ASN A 445 -1.313 93.836 -6.556 1.00 62.09 C ATOM 1802 O ASN A 445 -0.628 94.382 -7.410 1.00 62.27 O ATOM 1803 CB ASN A 445 -2.652 95.351 -5.174 1.00 65.41 C ATOM 1804 CG ASN A 445 -3.937 96.105 -5.010 1.00 67.98 C ATOM 1805 OD1 ASN A 445 -4.537 96.563 -5.981 1.00 69.84 O ATOM 1806 ND2 ASN A 445 -4.374 96.233 -3.771 1.00 69.75 N ATOM 1807 HD22 ASN A 445 -3.830 95.827 -2.983 1.00 0.00 H ATOM 1808 HD21 ASN A 445 -5.263 96.740 -3.583 1.00 0.00 H ATOM 1809 H ASN A 445 -4.106 93.184 -5.076 1.00 0.00 H ATOM 1810 N LEU A 446 -0.887 92.824 -5.801 1.00 59.93 N ATOM 1811 CA LEU A 446 0.438 92.251 -5.981 1.00 58.30 C ATOM 1812 C LEU A 446 0.543 91.508 -7.290 1.00 59.01 C ATOM 1813 O LEU A 446 1.598 91.531 -7.915 1.00 60.92 O ATOM 1814 CB LEU A 446 0.811 91.325 -4.835 1.00 57.23 C ATOM 1815 CG LEU A 446 1.240 92.015 -3.549 1.00 57.08 C ATOM 1816 CD1 LEU A 446 1.306 90.966 -2.448 1.00 57.15 C ATOM 1817 CD2 LEU A 446 2.585 92.725 -3.720 1.00 56.64 C ATOM 1818 H LEU A 446 -1.515 92.436 -5.068 1.00 0.00 H ATOM 1819 N GLU A 447 -0.538 90.850 -7.703 1.00 60.05 N ATOM 1820 CA GLU A 447 -0.578 90.206 -9.024 1.00 61.62 C ATOM 1821 C GLU A 447 -0.449 91.240 -10.134 1.00 60.23 C ATOM 1822 O GLU A 447 0.283 91.024 -11.092 1.00 58.01 O ATOM 1823 CB GLU A 447 -1.864 89.389 -9.215 1.00 65.20 C ATOM 1824 CG GLU A 447 -1.886 88.061 -8.452 1.00 65.98 C ATOM 1825 CD GLU A 447 -3.283 87.432 -8.321 1.00 69.54 C ATOM 1826 OE1 GLU A 447 -4.309 87.999 -8.835 1.00 73.15 O ATOM 1827 OE2 GLU A 447 -3.340 86.335 -7.714 1.00 66.95 O ATOM 1828 H GLU A 447 -1.369 90.790 -7.080 1.00 0.00 H ATOM 1829 N LEU A 448 -1.156 92.361 -9.997 1.00 60.37 N ATOM 1830 CA LEU A 448 -1.051 93.427 -10.974 1.00 61.50 C ATOM 1831 C LEU A 448 0.351 93.984 -10.997 1.00 60.75 C ATOM 1832 O LEU A 448 0.892 94.227 -12.058 1.00 65.38 O ATOM 1833 CB LEU A 448 -2.018 94.558 -10.676 1.00 63.62 C ATOM 1834 CG LEU A 448 -2.016 95.671 -11.732 1.00 66.01 C ATOM 1835 CD1 LEU A 448 -2.433 95.158 -13.100 1.00 68.21 C ATOM 1836 CD2 LEU A 448 -2.915 96.827 -11.338 1.00 67.20 C ATOM 1837 H LEU A 448 -1.790 92.473 -9.180 1.00 0.00 H ATOM 1838 N ALA A 449 0.924 94.209 -9.822 1.00 58.41 N ATOM 1839 CA ALA A 449 2.310 94.661 -9.696 1.00 56.92 C ATOM 1840 C ALA A 449 3.281 93.726 -10.421 1.00 56.28 C ATOM 1841 O ALA A 449 4.113 94.173 -11.194 1.00 55.50 O ATOM 1842 CB ALA A 449 2.684 94.792 -8.231 1.00 56.25 C ATOM 1843 H ALA A 449 0.367 94.058 -8.957 1.00 0.00 H ATOM 1844 N PHE A 450 3.151 92.429 -10.198 1.00 55.51 N ATOM 1845 CA PHE A 450 4.040 91.454 -10.822 1.00 55.98 C ATOM 1846 C PHE A 450 3.916 91.496 -12.348 1.00 58.07 C ATOM 1847 O PHE A 450 4.912 91.635 -13.046 1.00 60.99 O ATOM 1848 CB PHE A 450 3.720 90.057 -10.263 1.00 56.07 C ATOM 1849 CG PHE A 450 4.688 88.978 -10.661 1.00 55.76 C ATOM 1850 CD1 PHE A 450 6.061 89.197 -10.691 1.00 55.33 C ATOM 1851 CD2 PHE A 450 4.216 87.711 -10.960 1.00 57.52 C ATOM 1852 CE1 PHE A 450 6.935 88.181 -11.047 1.00 56.18 C ATOM 1853 CE2 PHE A 450 5.084 86.697 -11.319 1.00 58.44 C ATOM 1854 CZ PHE A 450 6.450 86.925 -11.345 1.00 57.64 C ATOM 1855 H PHE A 450 2.398 92.096 -9.563 1.00 0.00 H ATOM 1856 N HIS A 451 2.685 91.415 -12.841 1.00 58.69 N ATOM 1857 CA HIS A 451 2.394 91.426 -14.272 1.00 59.57 C ATOM 1858 C HIS A 451 2.821 92.741 -14.953 1.00 60.50 C ATOM 1859 O HIS A 451 3.364 92.742 -16.063 1.00 60.45 O ATOM 1860 CB HIS A 451 0.887 91.234 -14.510 1.00 61.77 C ATOM 1861 CG HIS A 451 0.423 89.814 -14.482 1.00 62.20 C ATOM 1862 ND1 HIS A 451 -0.350 89.264 -15.484 1.00 63.58 N ATOM 1863 CD2 HIS A 451 0.602 88.837 -13.568 1.00 61.88 C ATOM 1864 CE1 HIS A 451 -0.612 88.005 -15.192 1.00 63.50 C ATOM 1865 NE2 HIS A 451 -0.054 87.722 -14.031 1.00 62.19 N ATOM 1866 H HIS A 451 1.890 91.340 -12.175 1.00 0.00 H ATOM 1867 N HIS A 452 2.550 93.856 -14.290 1.00 59.98 N ATOM 1868 CA HIS A 452 3.003 95.142 -14.774 1.00 61.06 C ATOM 1869 C HIS A 452 4.521 95.204 -14.926 1.00 62.54 C ATOM 1870 O HIS A 452 5.025 95.620 -15.962 1.00 65.11 O ATOM 1871 CB HIS A 452 2.579 96.239 -13.824 1.00 59.59 C ATOM 1872 CG HIS A 452 2.936 97.592 -14.308 1.00 60.52 C ATOM 1873 ND1 HIS A 452 2.644 98.014 -15.586 1.00 62.62 N ATOM 1874 CD2 HIS A 452 3.582 98.614 -13.704 1.00 60.86 C ATOM 1875 CE1 HIS A 452 3.089 99.249 -15.742 1.00 64.83 C ATOM 1876 NE2 HIS A 452 3.650 99.641 -14.610 1.00 63.50 N ATOM 1877 H HIS A 452 2.003 93.806 -13.407 1.00 0.00 H ATOM 1878 N HIS A 453 5.239 94.788 -13.890 1.00 61.41 N ATOM 1879 CA HIS A 453 6.704 94.819 -13.911 1.00 61.59 C ATOM 1880 C HIS A 453 7.277 93.918 -14.992 1.00 61.82 C ATOM 1881 O HIS A 453 8.283 94.256 -15.587 1.00 63.33 O ATOM 1882 CB HIS A 453 7.319 94.449 -12.549 1.00 60.43 C ATOM 1883 CG HIS A 453 8.764 94.809 -12.437 1.00 60.84 C ATOM 1884 ND1 HIS A 453 9.216 96.101 -12.615 1.00 62.29 N ATOM 1885 CD2 HIS A 453 9.862 94.054 -12.186 1.00 61.04 C ATOM 1886 CE1 HIS A 453 10.531 96.129 -12.466 1.00 63.92 C ATOM 1887 NE2 HIS A 453 10.950 94.900 -12.205 1.00 63.74 N ATOM 1888 H HIS A 453 4.751 94.432 -13.044 1.00 0.00 H ATOM 1889 N LEU A 454 6.647 92.781 -15.253 1.00 61.97 N ATOM 1890 CA LEU A 454 7.134 91.881 -16.294 1.00 64.11 C ATOM 1891 C LEU A 454 6.954 92.503 -17.672 1.00 67.44 C ATOM 1892 O LEU A 454 7.751 92.252 -18.565 1.00 70.83 O ATOM 1893 CB LEU A 454 6.472 90.504 -16.193 1.00 62.94 C ATOM 1894 CG LEU A 454 6.770 89.739 -14.892 1.00 60.96 C ATOM 1895 CD1 LEU A 454 5.966 88.463 -14.811 1.00 60.39 C ATOM 1896 CD2 LEU A 454 8.243 89.412 -14.716 1.00 61.02 C ATOM 1897 H LEU A 454 5.797 92.528 -14.710 1.00 0.00 H ATOM 1898 N CYS A 455 5.932 93.334 -17.840 1.00 69.25 N ATOM 1899 CA CYS A 455 5.781 94.128 -19.064 1.00 74.67 C ATOM 1900 C CYS A 455 6.810 95.204 -19.207 1.00 75.42 C ATOM 1901 O CYS A 455 7.356 95.395 -20.282 1.00 80.60 O ATOM 1902 CB CYS A 455 4.414 94.755 -19.119 1.00 77.92 C ATOM 1903 SG CYS A 455 3.253 93.373 -19.196 1.00 82.68 S ATOM 1904 H CYS A 455 5.222 93.424 -17.086 1.00 0.00 H ATOM 1905 N LYS A 456 7.042 95.931 -18.125 1.00 72.99 N ATOM 1906 CA LYS A 456 8.054 96.990 -18.090 1.00 72.97 C ATOM 1907 C LYS A 456 9.442 96.485 -18.481 1.00 70.56 C ATOM 1908 O LYS A 456 10.207 97.211 -19.110 1.00 72.52 O ATOM 1909 CB LYS A 456 8.104 97.631 -16.698 1.00 73.79 C ATOM 1910 CG LYS A 456 6.929 98.556 -16.394 1.00 76.74 C ATOM 1911 CD LYS A 456 7.188 99.960 -16.909 1.00 82.31 C ATOM 1912 CE LYS A 456 5.882 100.679 -17.239 1.00 86.77 C ATOM 1913 NZ LYS A 456 5.996 102.171 -17.333 1.00 91.29 N ATOM 1914 HZ1 LYS A 456 6.328 102.550 -16.423 1.00 0.00 H ATOM 1915 HZ2 LYS A 456 6.674 102.419 -18.081 1.00 0.00 H ATOM 1916 HZ3 LYS A 456 5.065 102.575 -17.560 1.00 0.00 H ATOM 1917 H LYS A 456 6.485 95.743 -17.267 1.00 0.00 H ATOM 1918 N THR A 457 9.745 95.244 -18.101 1.00 66.62 N ATOM 1919 CA THR A 457 11.053 94.622 -18.304 1.00 64.41 C ATOM 1920 C THR A 457 11.070 93.567 -19.411 1.00 64.29 C ATOM 1921 O THR A 457 12.049 92.838 -19.536 1.00 65.15 O ATOM 1922 CB THR A 457 11.562 93.981 -16.981 1.00 60.50 C ATOM 1923 OG1 THR A 457 10.735 92.867 -16.608 1.00 59.30 O ATOM 1924 CG2 THR A 457 11.569 95.000 -15.855 1.00 58.50 C ATOM 1925 HG1 THR A 457 9.804 93.178 -16.477 1.00 0.00 H ATOM 1926 H THR A 457 9.006 94.683 -17.631 1.00 0.00 H ATOM 1927 N HIS A 458 10.009 93.500 -20.215 1.00 65.25 N ATOM 1928 CA HIS A 458 9.891 92.527 -21.321 1.00 68.03 C ATOM 1929 C HIS A 458 10.238 91.082 -20.908 1.00 65.88 C ATOM 1930 O HIS A 458 10.980 90.374 -21.587 1.00 63.94 O ATOM 1931 CB HIS A 458 10.748 92.969 -22.505 1.00 72.70 C ATOM 1932 CG HIS A 458 10.612 94.423 -22.842 1.00 76.05 C ATOM 1933 ND1 HIS A 458 9.544 94.937 -23.548 1.00 78.47 N ATOM 1934 CD2 HIS A 458 11.419 95.473 -22.569 1.00 77.49 C ATOM 1935 CE1 HIS A 458 9.696 96.241 -23.688 1.00 80.29 C ATOM 1936 NE2 HIS A 458 10.835 96.590 -23.120 1.00 79.41 N ATOM 1937 H HIS A 458 9.226 94.165 -20.056 1.00 0.00 H ATOM 1938 N ARG A 459 9.682 90.678 -19.772 1.00 63.76 N ATOM 1939 CA ARG A 459 9.924 89.380 -19.181 1.00 62.82 C ATOM 1940 C ARG A 459 8.606 88.663 -18.907 1.00 62.57 C ATOM 1941 O ARG A 459 8.501 87.889 -17.959 1.00 61.73 O ATOM 1942 CB ARG A 459 10.729 89.564 -17.888 1.00 61.37 C ATOM 1943 CG ARG A 459 12.185 89.920 -18.125 1.00 62.52 C ATOM 1944 CD ARG A 459 13.037 88.667 -18.318 1.00 62.51 C ATOM 1945 NE ARG A 459 13.130 87.889 -17.098 1.00 60.56 N ATOM 1946 CZ ARG A 459 13.782 86.736 -16.985 1.00 61.62 C ATOM 1947 NH1 ARG A 459 14.422 86.229 -18.020 1.00 63.91 N ATOM 1948 NH2 ARG A 459 13.807 86.076 -15.822 1.00 60.15 N ATOM 1949 HE ARG A 459 12.653 88.259 -16.251 1.00 0.00 H ATOM 1950 HH12 ARG A 459 14.930 85.327 -17.926 1.00 0.00 H ATOM 1951 HH11 ARG A 459 14.418 86.731 -18.931 1.00 0.00 H ATOM 1952 HH22 ARG A 459 14.321 85.175 -15.746 1.00 0.00 H ATOM 1953 HH21 ARG A 459 13.313 86.464 -14.993 1.00 0.00 H ATOM 1954 H ARG A 459 9.038 91.330 -19.281 1.00 0.00 H ATOM 1955 N GLN A 460 7.623 88.877 -19.776 1.00 64.12 N ATOM 1956 CA GLN A 460 6.340 88.178 -19.676 1.00 64.20 C ATOM 1957 C GLN A 460 6.495 86.674 -19.977 1.00 65.58 C ATOM 1958 O GLN A 460 5.660 85.855 -19.573 1.00 62.81 O ATOM 1959 CB GLN A 460 5.323 88.767 -20.647 1.00 66.29 C ATOM 1960 CG GLN A 460 5.164 90.271 -20.608 1.00 66.50 C ATOM 1961 CD GLN A 460 5.882 90.991 -21.743 1.00 69.60 C ATOM 1962 OE1 GLN A 460 6.972 90.603 -22.168 1.00 71.10 O ATOM 1963 NE2 GLN A 460 5.277 92.060 -22.226 1.00 71.34 N ATOM 1964 HE22 GLN A 460 4.357 92.356 -21.841 1.00 0.00 H ATOM 1965 HE21 GLN A 460 5.720 92.607 -22.992 1.00 0.00 H ATOM 1966 H GLN A 460 7.769 89.559 -20.547 1.00 0.00 H ATOM 1967 N SER A 461 7.559 86.326 -20.702 1.00 70.02 N ATOM 1968 CA SER A 461 7.835 84.941 -21.030 1.00 73.82 C ATOM 1969 C SER A 461 7.908 84.049 -19.793 1.00 73.03 C ATOM 1970 O SER A 461 7.600 82.859 -19.898 1.00 75.89 O ATOM 1971 CB SER A 461 9.136 84.805 -21.825 1.00 76.11 C ATOM 1972 OG SER A 461 10.256 84.784 -20.955 1.00 74.92 O ATOM 1973 HG SER A 461 11.085 84.696 -21.489 1.00 0.00 H ATOM 1974 H SER A 461 8.206 87.066 -21.040 1.00 0.00 H ATOM 1975 N ILE A 462 8.326 84.595 -18.642 1.00 70.92 N ATOM 1976 CA ILE A 462 8.467 83.751 -17.447 1.00 70.36 C ATOM 1977 C ILE A 462 7.156 83.286 -16.798 1.00 68.86 C ATOM 1978 O ILE A 462 7.174 82.296 -16.088 1.00 69.87 O ATOM 1979 CB ILE A 462 9.409 84.331 -16.354 1.00 69.95 C ATOM 1980 CG1 ILE A 462 8.829 85.574 -15.681 1.00 69.64 C ATOM 1981 CG2 ILE A 462 10.802 84.614 -16.913 1.00 70.86 C ATOM 1982 CD1 ILE A 462 9.382 85.777 -14.292 1.00 68.27 C ATOM 1983 H ILE A 462 8.549 85.610 -18.595 1.00 0.00 H ATOM 1984 N LEU A 463 6.033 83.959 -17.036 1.00 68.47 N ATOM 1985 CA LEU A 463 4.749 83.527 -16.448 1.00 66.64 C ATOM 1986 C LEU A 463 4.391 82.086 -16.794 1.00 69.75 C ATOM 1987 O LEU A 463 4.025 81.321 -15.920 1.00 71.57 O ATOM 1988 CB LEU A 463 3.603 84.438 -16.877 1.00 65.39 C ATOM 1989 CG LEU A 463 3.610 85.841 -16.283 1.00 62.97 C ATOM 1990 CD1 LEU A 463 2.548 86.709 -16.944 1.00 62.21 C ATOM 1991 CD2 LEU A 463 3.455 85.807 -14.746 1.00 61.79 C ATOM 1992 H LEU A 463 6.060 84.802 -17.645 1.00 0.00 H ATOM 1993 N ALA A 464 4.536 81.709 -18.058 1.00 74.07 N ATOM 1994 CA ALA A 464 4.330 80.318 -18.486 1.00 76.77 C ATOM 1995 C ALA A 464 5.286 79.272 -17.851 1.00 76.63 C ATOM 1996 O ALA A 464 5.017 78.079 -17.935 1.00 80.18 O ATOM 1997 CB ALA A 464 4.402 80.233 -20.006 1.00 79.34 C ATOM 1998 H ALA A 464 4.804 82.420 -18.768 1.00 0.00 H ATOM 1999 N LYS A 465 6.377 79.707 -17.225 1.00 75.58 N ATOM 2000 CA LYS A 465 7.451 78.818 -16.759 1.00 77.13 C ATOM 2001 C LYS A 465 7.617 78.719 -15.248 1.00 74.64 C ATOM 2002 O LYS A 465 8.410 77.909 -14.764 1.00 72.39 O ATOM 2003 CB LYS A 465 8.769 79.305 -17.356 1.00 79.41 C ATOM 2004 CG LYS A 465 8.711 79.447 -18.864 1.00 85.68 C ATOM 2005 CD LYS A 465 10.020 79.983 -19.401 1.00 88.16 C ATOM 2006 CE LYS A 465 10.064 79.944 -20.907 1.00 92.92 C ATOM 2007 NZ LYS A 465 11.477 79.786 -21.344 1.00 96.20 N ATOM 2008 HZ1 LYS A 465 12.038 80.590 -20.996 1.00 0.00 H ATOM 2009 HZ2 LYS A 465 11.861 78.900 -20.957 1.00 0.00 H ATOM 2010 HZ3 LYS A 465 11.516 79.758 -22.383 1.00 0.00 H ATOM 2011 H LYS A 465 6.475 80.729 -17.057 1.00 0.00 H ATOM 2012 N LEU A 466 6.890 79.546 -14.502 1.00 75.32 N ATOM 2013 CA LEU A 466 6.935 79.484 -13.061 1.00 76.77 C ATOM 2014 C LEU A 466 6.283 78.181 -12.661 1.00 81.58 C ATOM 2015 O LEU A 466 5.318 77.764 -13.319 1.00 81.98 O ATOM 2016 CB LEU A 466 6.135 80.623 -12.439 1.00 77.18 C ATOM 2017 CG LEU A 466 6.478 82.089 -12.690 1.00 76.82 C ATOM 2018 CD1 LEU A 466 5.250 82.931 -12.351 1.00 76.03 C ATOM 2019 CD2 LEU A 466 7.716 82.528 -11.896 1.00 75.75 C ATOM 2020 H LEU A 466 6.279 80.249 -14.965 1.00 0.00 H ATOM 2021 N PRO A 467 6.769 77.552 -11.575 1.00 86.92 N ATOM 2022 CA PRO A 467 6.135 76.293 -11.147 1.00 91.39 C ATOM 2023 C PRO A 467 4.685 76.521 -10.686 1.00 93.17 C ATOM 2024 O PRO A 467 4.366 77.635 -10.253 1.00 91.13 O ATOM 2025 CB PRO A 467 7.022 75.836 -9.973 1.00 89.31 C ATOM 2026 CG PRO A 467 7.593 77.101 -9.426 1.00 84.44 C ATOM 2027 CD PRO A 467 7.816 77.992 -10.629 1.00 83.88 C ATOM 2028 N PRO A 468 3.808 75.492 -10.787 1.00 97.07 N ATOM 2029 CA PRO A 468 2.453 75.653 -10.219 1.00103.13 C ATOM 2030 C PRO A 468 2.475 75.790 -8.676 1.00112.84 C ATOM 2031 O PRO A 468 3.316 75.149 -8.000 1.00119.15 O ATOM 2032 CB PRO A 468 1.722 74.374 -10.650 1.00102.18 C ATOM 2033 CG PRO A 468 2.584 73.753 -11.703 1.00100.62 C ATOM 2034 CD PRO A 468 3.987 74.165 -11.400 1.00 96.55 C ATOM 2035 N LYS A 469 1.579 76.626 -8.131 1.00117.07 N ATOM 2036 CA LYS A 469 1.537 76.894 -6.671 1.00113.74 C ATOM 2037 C LYS A 469 0.923 75.743 -5.858 1.00116.17 C ATOM 2038 O LYS A 469 1.034 75.731 -4.620 1.00115.22 O ATOM 2039 CB LYS A 469 0.867 78.243 -6.352 1.00110.77 C ATOM 2040 CG LYS A 469 1.871 79.390 -6.345 1.00106.77 C ATOM 2041 CD LYS A 469 1.195 80.746 -6.199 1.00103.27 C ATOM 2042 CE LYS A 469 2.155 81.887 -6.511 1.00100.59 C ATOM 2043 NZ LYS A 469 1.542 82.912 -7.410 1.00102.50 N ATOM 2044 HZ1 LYS A 469 1.269 82.465 -8.308 1.00 0.00 H ATOM 2045 HZ2 LYS A 469 0.700 83.314 -6.951 1.00 0.00 H ATOM 2046 HZ3 LYS A 469 2.233 83.668 -7.594 1.00 0.00 H ATOM 2047 H LYS A 469 0.892 77.102 -8.750 1.00 0.00 H ATOM 2048 N GLY A 470 0.291 74.788 -6.551 1.00113.33 N ATOM 2049 CA GLY A 470 0.044 73.462 -5.998 1.00112.41 C ATOM 2050 C GLY A 470 1.338 72.709 -5.695 1.00110.62 C ATOM 2051 O GLY A 470 1.490 72.177 -4.594 1.00109.42 O ATOM 2052 H GLY A 470 -0.035 74.999 -7.516 1.00 0.00 H ATOM 2053 N LYS A 471 2.265 72.692 -6.659 1.00109.92 N ATOM 2054 CA LYS A 471 3.523 71.899 -6.574 1.00109.88 C ATOM 2055 C LYS A 471 4.606 72.486 -5.657 1.00106.66 C ATOM 2056 O LYS A 471 5.494 71.765 -5.181 1.00106.46 O ATOM 2057 CB LYS A 471 4.109 71.640 -7.980 1.00111.19 C ATOM 2058 CG LYS A 471 5.611 71.335 -8.009 1.00109.77 C ATOM 2059 CD LYS A 471 6.123 71.008 -9.393 1.00113.25 C ATOM 2060 CE LYS A 471 7.628 70.730 -9.381 1.00110.87 C ATOM 2061 NZ LYS A 471 8.343 71.525 -10.421 1.00109.38 N ATOM 2062 HZ1 LYS A 471 7.971 71.279 -11.360 1.00 0.00 H ATOM 2063 HZ2 LYS A 471 8.195 72.539 -10.243 1.00 0.00 H ATOM 2064 HZ3 LYS A 471 9.360 71.310 -10.382 1.00 0.00 H ATOM 2065 H LYS A 471 2.099 73.262 -7.513 1.00 0.00 H ATOM 2066 N LEU A 472 4.544 73.791 -5.444 1.00106.51 N ATOM 2067 CA LEU A 472 5.353 74.456 -4.432 1.00102.54 C ATOM 2068 C LEU A 472 4.947 73.951 -3.028 1.00102.81 C ATOM 2069 O LEU A 472 5.798 73.539 -2.222 1.00 97.04 O ATOM 2070 CB LEU A 472 5.168 75.981 -4.567 1.00 99.97 C ATOM 2071 CG LEU A 472 6.221 76.931 -3.985 1.00 93.47 C ATOM 2072 CD1 LEU A 472 7.613 76.557 -4.474 1.00 92.36 C ATOM 2073 CD2 LEU A 472 5.888 78.351 -4.402 1.00 91.45 C ATOM 2074 H LEU A 472 3.894 74.362 -6.020 1.00 0.00 H ATOM 2075 N ARG A 473 3.630 73.952 -2.785 1.00106.94 N ATOM 2076 CA ARG A 473 3.018 73.491 -1.518 1.00107.99 C ATOM 2077 C ARG A 473 3.139 71.994 -1.243 1.00108.05 C ATOM 2078 O ARG A 473 3.183 71.594 -0.078 1.00108.42 O ATOM 2079 CB ARG A 473 1.543 73.912 -1.445 1.00110.33 C ATOM 2080 CG ARG A 473 0.893 73.734 -0.067 1.00113.70 C ATOM 2081 CD ARG A 473 -0.481 74.365 0.013 1.00119.79 C ATOM 2082 NE ARG A 473 -1.406 73.820 -0.986 1.00126.39 N ATOM 2083 CZ ARG A 473 -1.723 74.379 -2.162 1.00127.43 C ATOM 2084 NH1 ARG A 473 -1.199 75.544 -2.547 1.00124.62 N ATOM 2085 NH2 ARG A 473 -2.580 73.757 -2.972 1.00129.78 N ATOM 2086 HE ARG A 473 -1.860 72.912 -0.760 1.00 0.00 H ATOM 2087 HH12 ARG A 473 -1.463 75.955 -3.465 1.00 0.00 H ATOM 2088 HH11 ARG A 473 -0.527 76.041 -1.929 1.00 0.00 H ATOM 2089 HH22 ARG A 473 -2.833 74.182 -3.887 1.00 0.00 H ATOM 2090 HH21 ARG A 473 -2.996 72.847 -2.689 1.00 0.00 H ATOM 2091 H ARG A 473 2.997 74.299 -3.534 1.00 0.00 H ATOM 2092 N SER A 474 3.178 71.172 -2.291 1.00108.57 N ATOM 2093 CA SER A 474 3.270 69.711 -2.127 1.00112.26 C ATOM 2094 C SER A 474 4.691 69.225 -1.806 1.00109.49 C ATOM 2095 O SER A 474 4.842 68.181 -1.155 1.00109.24 O ATOM 2096 CB SER A 474 2.726 68.983 -3.361 1.00116.33 C ATOM 2097 OG SER A 474 3.645 69.039 -4.438 1.00117.91 O ATOM 2098 HG SER A 474 3.813 69.985 -4.678 1.00 0.00 H ATOM 2099 H SER A 474 3.143 71.573 -3.250 1.00 0.00 H ATOM 2100 N LEU A 475 5.711 69.963 -2.265 1.00106.47 N ATOM 2101 CA LEU A 475 7.107 69.691 -1.881 1.00107.85 C ATOM 2102 C LEU A 475 7.499 70.232 -0.498 1.00105.97 C ATOM 2103 O LEU A 475 8.607 69.949 -0.032 1.00106.58 O ATOM 2104 CB LEU A 475 8.096 70.202 -2.943 1.00107.66 C ATOM 2105 CG LEU A 475 8.118 69.451 -4.271 1.00113.17 C ATOM 2106 CD1 LEU A 475 8.958 70.247 -5.269 1.00115.23 C ATOM 2107 CD2 LEU A 475 8.627 68.018 -4.119 1.00113.56 C ATOM 2108 H LEU A 475 5.511 70.752 -2.912 1.00 0.00 H ATOM 2109 N CYS A 476 6.602 71.003 0.135 1.00104.41 N ATOM 2110 CA CYS A 476 6.749 71.438 1.521 1.00 99.25 C ATOM 2111 C CYS A 476 5.881 70.632 2.491 1.00100.81 C ATOM 2112 O CYS A 476 6.276 70.458 3.638 1.00102.99 O ATOM 2113 CB CYS A 476 6.452 72.930 1.641 1.00 95.61 C ATOM 2114 SG CYS A 476 7.791 73.884 0.904 1.00 92.19 S ATOM 2115 H CYS A 476 5.757 71.307 -0.389 1.00 0.00 H ATOM 2116 N SER A 477 4.703 70.183 2.046 1.00101.41 N ATOM 2117 CA SER A 477 3.883 69.244 2.825 1.00103.00 C ATOM 2118 C SER A 477 4.608 67.904 3.026 1.00107.56 C ATOM 2119 O SER A 477 4.490 67.291 4.093 1.00111.95 O ATOM 2120 CB SER A 477 2.512 69.046 2.180 1.00101.00 C ATOM 2121 OG SER A 477 1.847 70.292 2.086 1.00 95.73 O ATOM 2122 HG SER A 477 2.385 70.911 1.532 1.00 0.00 H ATOM 2123 H SER A 477 4.356 70.508 1.121 1.00 0.00 H ATOM 2124 N GLN A 478 5.386 67.482 2.028 1.00108.67 N ATOM 2125 CA GLN A 478 6.223 66.282 2.151 1.00112.78 C ATOM 2126 C GLN A 478 7.507 66.504 2.992 1.00113.20 C ATOM 2127 O GLN A 478 7.777 65.701 3.885 1.00115.22 O ATOM 2128 CB GLN A 478 6.532 65.719 0.768 1.00114.98 C ATOM 2129 CG GLN A 478 5.289 65.212 0.042 1.00116.79 C ATOM 2130 CD GLN A 478 5.616 64.595 -1.301 1.00117.35 C ATOM 2131 OE1 GLN A 478 5.151 63.500 -1.619 1.00119.81 O ATOM 2132 NE2 GLN A 478 6.442 65.282 -2.089 1.00113.84 N ATOM 2133 HE22 GLN A 478 6.810 66.204 -1.779 1.00 0.00 H ATOM 2134 HE21 GLN A 478 6.718 64.897 -3.015 1.00 0.00 H ATOM 2135 H GLN A 478 5.400 68.018 1.137 1.00 0.00 H ATOM 2136 N HIS A 479 8.289 67.559 2.693 1.00112.07 N ATOM 2137 CA HIS A 479 9.283 68.174 3.632 1.00109.52 C ATOM 2138 C HIS A 479 8.948 67.801 5.091 1.00106.64 C ATOM 2139 O HIS A 479 9.752 67.185 5.775 1.00107.43 O ATOM 2140 CB HIS A 479 9.272 69.718 3.459 1.00115.26 C ATOM 2141 CG HIS A 479 10.604 70.415 3.598 1.00120.43 C ATOM 2142 ND1 HIS A 479 11.332 70.435 4.771 1.00121.54 N ATOM 2143 CD2 HIS A 479 11.277 71.216 2.732 1.00120.15 C ATOM 2144 CE1 HIS A 479 12.425 71.160 4.601 1.00118.52 C ATOM 2145 NE2 HIS A 479 12.413 71.650 3.373 1.00117.55 N ATOM 2146 H HIS A 479 8.197 67.976 1.745 1.00 0.00 H ATOM 2147 N VAL A 480 7.734 68.143 5.533 1.00106.52 N ATOM 2148 CA VAL A 480 7.194 67.745 6.847 1.00105.98 C ATOM 2149 C VAL A 480 6.312 66.489 6.707 1.00104.46 C ATOM 2150 O VAL A 480 6.525 65.473 7.370 1.00100.99 O ATOM 2151 CB VAL A 480 6.351 68.885 7.469 1.00106.36 C ATOM 2152 CG1 VAL A 480 5.992 68.555 8.921 1.00108.79 C ATOM 2153 CG2 VAL A 480 7.080 70.230 7.356 1.00101.55 C ATOM 2154 H VAL A 480 7.134 68.724 4.914 1.00 0.00 H TER 2155 VAL A 480 HETATM 2156 O HOH 1 20.083 91.160 4.322 1.00 36.21 O HETATM 2157 O HOH 2 7.732 98.914 -12.524 1.00 57.70 O HETATM 2158 C4 E A 3 20.195 79.397 0.592 1.00 -0.02 C HETATM 2159 C5 E A 3 21.276 78.889 1.270 1.00 -0.05 C HETATM 2160 C6 E A 3 21.447 79.174 2.606 1.00 0.02 C HETATM 2161 C7 E A 3 22.604 78.623 3.372 1.00 0.17 C HETATM 2162 C26 E A 3 22.171 77.263 3.855 1.00 0.25 C HETATM 2163 N28 E A 3 22.433 76.226 2.960 1.00 -0.21 N HETATM 2164 C29 E A 3 21.652 75.033 2.909 1.00 0.10 C HETATM 2165 C30 E A 3 21.560 74.310 1.732 1.00 -0.01 C HETATM 2166 C31 E A 3 20.795 73.154 1.697 1.00 -0.03 C HETATM 2167 C37 E A 3 20.115 72.694 2.810 1.00 -0.04 C HETATM 2168 C38 E A 3 20.216 73.421 3.983 1.00 0.14 C HETATM 2169 C40 E A 3 20.976 74.567 4.024 1.00 0.02 C HETATM 2170 H9 E A 3 21.047 75.120 4.954 1.00 0.06 H HETATM 2171 F39 E A 3 19.581 73.036 5.095 1.00 -0.16 F HETATM 2172 C34 E A 3 19.350 71.434 2.509 1.00 -0.07 C HETATM 2173 C33 E A 3 19.799 71.108 1.102 1.00 -0.07 C HETATM 2174 C32 E A 3 20.583 72.266 0.527 1.00 -0.02 C HETATM 2175 H10 E A 3 21.543 71.924 0.113 1.00 0.05 H HETATM 2176 H11 E A 3 20.008 72.779 -0.258 1.00 0.05 H HETATM 2177 H14 E A 3 20.436 70.211 1.122 1.00 0.02 H HETATM 2178 H15 E A 3 18.917 70.918 0.473 1.00 0.02 H HETATM 2179 C35 E A 3 19.644 70.286 3.443 1.00 -0.10 C HETATM 2180 H22 E A 3 19.310 70.545 4.458 1.00 0.01 H HETATM 2181 H23 E A 3 20.726 70.089 3.452 1.00 0.01 H HETATM 2182 H24 E A 3 19.110 69.388 3.099 1.00 0.01 H HETATM 2183 C36 E A 3 17.859 71.697 2.537 1.00 -0.10 C HETATM 2184 H25 E A 3 17.621 72.532 1.862 1.00 0.01 H HETATM 2185 H26 E A 3 17.551 71.955 3.561 1.00 0.01 H HETATM 2186 H27 E A 3 17.321 70.795 2.208 1.00 0.01 H HETATM 2187 H8 E A 3 22.083 74.645 0.844 1.00 0.05 H HETATM 2188 H31 E A 3 23.201 76.323 2.327 1.00 0.25 H HETATM 2189 O27 E A 3 21.613 77.140 4.937 1.00 -0.37 O HETATM 2190 N9 E A 3 22.947 79.376 4.584 1.00 -0.24 N HETATM 2191 C10 E A 3 22.107 80.503 4.981 1.00 0.05 C HETATM 2192 C11 E A 3 20.643 80.323 4.660 1.00 0.01 C HETATM 2193 C12 E A 3 20.506 79.976 3.222 1.00 0.03 C HETATM 2194 N13 E A 3 19.445 80.487 2.599 1.00 -0.28 N HETATM 2195 C3 E A 3 19.313 80.179 1.305 1.00 0.15 C HETATM 2196 O2 E A 3 18.226 80.696 0.628 1.00 -0.31 O HETATM 2197 C1 E A 3 17.066 80.065 1.141 1.00 0.06 C HETATM 2198 H28 E A 3 16.177 80.454 0.623 1.00 0.06 H HETATM 2199 H29 E A 3 16.982 80.272 2.218 1.00 0.06 H HETATM 2200 H30 E A 3 17.138 78.979 0.981 1.00 0.06 H HETATM 2201 H12 E A 3 20.102 81.258 4.868 1.00 0.05 H HETATM 2202 H13 E A 3 20.226 79.513 5.277 1.00 0.05 H HETATM 2203 H4 E A 3 22.208 80.643 6.067 1.00 0.06 H HETATM 2204 H5 E A 3 22.467 81.403 4.460 1.00 0.06 H HETATM 2205 C14 E A 3 24.182 79.182 5.186 1.00 0.19 C HETATM 2206 C16 E A 3 24.523 80.225 6.261 1.00 0.05 C HETATM 2207 C18 E A 3 25.276 81.484 5.841 1.00 -0.03 C HETATM 2208 C19 E A 3 25.757 81.533 7.284 1.00 -0.02 C HETATM 2209 C21 E A 3 27.105 82.188 7.513 1.00 0.00 C HETATM 2210 C22 E A 3 28.251 81.704 6.679 1.00 0.04 C HETATM 2211 O24 E A 3 28.986 80.776 6.988 1.00 -0.57 O HETATM 2212 O23 E A 3 28.360 82.445 5.543 1.00 -0.57 O HETATM 2213 H6 E A 3 26.987 83.264 7.320 1.00 0.04 H HETATM 2214 H7 E A 3 27.374 82.031 8.568 1.00 0.04 H HETATM 2215 C25 E A 3 25.665 80.004 7.249 1.00 -0.03 C HETATM 2216 H18 E A 3 26.547 79.492 6.837 1.00 0.03 H HETATM 2217 H19 E A 3 25.376 79.531 8.199 1.00 0.03 H HETATM 2218 H21 E A 3 25.040 81.994 7.979 1.00 0.03 H HETATM 2219 H16 E A 3 24.640 82.327 5.533 1.00 0.03 H HETATM 2220 H17 E A 3 26.066 81.327 5.091 1.00 0.03 H HETATM 2221 H20 E A 3 23.576 80.451 6.773 1.00 0.05 H HETATM 2222 O15 E A 3 24.932 78.264 4.885 1.00 -0.40 O HETATM 2223 H3 E A 3 23.484 78.556 2.715 1.00 0.10 H HETATM 2224 H2 E A 3 21.995 78.263 0.753 1.00 0.06 H HETATM 2225 H1 E A 3 20.042 79.191 -0.461 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 2158 2159 2195 2225 CONECT 2159 2158 2160 2224 CONECT 2160 2159 2161 2193 CONECT 2161 2160 2162 2190 2223 CONECT 2162 2161 2163 2189 CONECT 2163 2162 2164 2188 CONECT 2164 2163 2165 2169 CONECT 2165 2164 2166 2187 CONECT 2166 2165 2167 2174 CONECT 2167 2166 2168 2172 CONECT 2168 2167 2169 2171 CONECT 2169 2164 2168 2170 CONECT 2170 2169 CONECT 2171 2168 CONECT 2172 2167 2173 2179 2183 CONECT 2173 2172 2174 2177 2178 CONECT 2174 2166 2173 2175 2176 CONECT 2175 2174 CONECT 2176 2174 CONECT 2177 2173 CONECT 2178 2173 CONECT 2179 2172 2180 2181 2182 CONECT 2180 2179 CONECT 2181 2179 CONECT 2182 2179 CONECT 2183 2172 2184 2185 2186 CONECT 2184 2183 CONECT 2185 2183 CONECT 2186 2183 CONECT 2187 2165 CONECT 2188 2163 CONECT 2189 2162 CONECT 2190 2161 2191 2205 CONECT 2191 2190 2192 2203 2204 CONECT 2192 2191 2193 2201 2202 CONECT 2193 2160 2192 2194 CONECT 2194 2193 2195 CONECT 2195 2158 2194 2196 CONECT 2196 2195 2197 CONECT 2197 2196 2198 2199 2200 CONECT 2198 2197 CONECT 2199 2197 CONECT 2200 2197 CONECT 2201 2192 CONECT 2202 2192 CONECT 2203 2191 CONECT 2204 2191 CONECT 2205 2190 2206 2222 CONECT 2206 2205 2207 2215 2221 CONECT 2207 2206 2208 2219 2220 CONECT 2208 2207 2209 2215 2218 CONECT 2209 2208 2210 2213 2214 CONECT 2210 2209 2211 2212 CONECT 2211 2210 CONECT 2212 2210 CONECT 2213 2209 CONECT 2214 2209 CONECT 2215 2206 2208 2216 2217 CONECT 2216 2215 CONECT 2217 2215 CONECT 2218 2208 CONECT 2219 2207 CONECT 2220 2207 CONECT 2221 2206 CONECT 2222 2205 CONECT 2223 2161 CONECT 2224 2159 CONECT 2225 2158 MASTER 0 0 0 0 0 0 0 0 2224 1 72 17 END
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11aa, >3OAP_2|Chain... at 100%
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RCSB PDB
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13aa, >4K6I_2|Chain... at 100%
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RCSB PDB
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PDBbind
251aa, >4NB6_1|Chains... at 97%
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RCSB PDB
PDBbind
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4poh
RCSB PDB
PDBbind
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4poj
RCSB PDB
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RCSB PDB
PDBbind
13aa, >4PP3_2|Chain... at 100%
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PDBbind
13aa, >4PP5_2|Chain... at 100%
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RCSB PDB
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RCSB PDB
PDBbind
280aa, >4YMQ_1|Chain... at 93%
4zjr
RCSB PDB
PDBbind
225aa, >4ZJR_1|Chains... at 99%
4zjw
RCSB PDB
PDBbind
225aa, >4ZJW_1|Chains... at 99%
4zom
RCSB PDB
PDBbind
225aa, >4ZOM_1|Chains... at 99%
4zsh
RCSB PDB
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5apj
RCSB PDB
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5c4o
RCSB PDB
PDBbind
241aa, >5C4O_1|Chain... at 99%
5c4s
RCSB PDB
PDBbind
241aa, >5C4S_1|Chain... at 99%
5c4t
RCSB PDB
PDBbind
241aa, >5C4T_1|Chain... at 99%
5c4u
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PDBbind
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5eth
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PDBbind
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5g43
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5g45
RCSB PDB
PDBbind
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5g46
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5ni5
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5ni8
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5nib
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5ntk
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5ntp
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238aa, >5NTP_1|Chain... at 98%
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PDBbind
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5uhi
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RCSB PDB
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5za1
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PDBbind
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RCSB PDB
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RCSB PDB
PDBbind
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RCSB PDB
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6cn6
RCSB PDB
PDBbind
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6esn
RCSB PDB
PDBbind
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6fgq
RCSB PDB
PDBbind
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6r7k
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
238aa, >6Q7H_1|Chain... at 98%
6q7a
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PDBbind
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PDBbind
238aa, >6Q6M_1|Chain... at 98%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6br3
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Nuclear receptor ROR-gamma
Ligand Name
E3V
EC.Number
E.C.-.-.-.-
Resolution
3(Å)
Affinity (Kd/Ki/IC50)
IC50=1.9nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) J. Med. Chem. Vol. 61: pp. 2973-2988
Ligand Properties
Formula
C
2
8
H
3
2
FN
3
O
5
Molecular Weight
509.569
Exact Mass
509.233
No. of atoms
69
No. of bonds
73
Polar Surface Area
108.83
LOGP Value
5.09 (
Computed with XLOGP3
)
4.03 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 5
Canonical SMILES
COc1ccc2c(n1)CCN([C@H]2C(=O)Nc1cc(F)c2c(c1)CCC2(C)C)C(=O)[C@@H]1C[C@@H](C1)CC(=O)O
InChI String
InChI=1S/C28H32FN3O5/c1-28(2)8-6-16-13-18(14-20(29)24(16)28)30-26(35)25-19-4-5-22(37-3)31-21(19)7-9-32(25)27(36)17-10-15(11-17)12-23(33)34/h4-5,13-15,17,25H,6-12H2,1-3H3,(H,30,35)(H,33,34)/t15-,17+,25-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P51449
Entrez Gene ID
NCBI Entrez Gene ID:
6097
ASD
Information of known allosteric effects of PDB entries
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