Browse entries in the PDBbind-CN Database
HEADER 4RX7_COMPLEX COMPND 4RX7_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 45 VAL TYR LEU ASP ARG LYS LEU LEU THR LEU GLU ASP LYS SEQRES 2 A 45 GLU LEU GLY SER GLY ASN PHE GLY THR VAL LYS LYS GLY SEQRES 3 A 45 TYR TYR GLN MET LYS LYS VAL VAL LYS THR VAL ALA VAL SEQRES 4 A 45 LYS ILE LEU LYS ASN GLU SEQRES 1 A 227 PRO ALA LEU LYS ASP GLU LEU LEU ALA GLU ALA ASN VAL SEQRES 2 A 227 MET GLN GLN LEU ASP ASN PRO TYR ILE VAL ARG MET ILE SEQRES 3 A 227 GLY ILE CYS GLU ALA GLU SER TRP MET LEU VAL MET GLU SEQRES 4 A 227 MET ALA GLU LEU GLY PRO LEU ASN LYS TYR LEU GLN GLN SEQRES 5 A 227 ASN ARG HIS VAL THR ASP LYS ASN ILE ILE GLU LEU VAL SEQRES 6 A 227 HIS GLN VAL SER MET GLY MET LYS TYR LEU GLU GLU SER SEQRES 7 A 227 ASN PHE VAL HIS ARG ASP LEU ALA ALA ARG ASN VAL LEU SEQRES 8 A 227 LEU VAL THR GLN HIS TYR ALA LYS ILE SER ASP PHE GLY SEQRES 9 A 227 LEU SER LYS ALA LEU ARG ALA ASP GLU ASN TYR TYR LYS SEQRES 10 A 227 ALA GLN THR HIS GLY LYS TRP PRO VAL LYS TRP TYR ALA SEQRES 11 A 227 PRO GLU CYS ILE ASN TYR TYR LYS PHE SER SER LYS SER SEQRES 12 A 227 ASP VAL TRP SER PHE GLY VAL LEU MET TRP GLU ALA PHE SEQRES 13 A 227 SER TYR GLY GLN LYS PRO TYR ARG GLY MET LYS GLY SER SEQRES 14 A 227 GLU VAL THR ALA MET LEU GLU LYS GLY GLU ARG MET GLY SEQRES 15 A 227 CYS PRO ALA GLY CYS PRO ARG GLU MET TYR ASP LEU MET SEQRES 16 A 227 ASN LEU CYS TRP THR TYR ASP VAL GLU ASN ARG PRO GLY SEQRES 17 A 227 PHE ALA ALA VAL GLU LEU ARG LEU ARG ASN TYR TYR TYR SEQRES 18 A 227 ASP VAL VAL ASN HIS HIS HET UNN A 437 52 ATOM 1 N VAL A 363 21.648 0.357 11.048 1.00 46.82 N ATOM 2 CA VAL A 363 21.823 -1.096 11.089 1.00 46.70 C ATOM 3 C VAL A 363 21.152 -1.773 9.884 1.00 46.49 C ATOM 4 O VAL A 363 19.922 -1.762 9.776 1.00 41.95 O ATOM 5 CB VAL A 363 21.353 -1.705 12.437 1.00 50.74 C ATOM 6 HN3 VAL A 363 20.633 0.583 11.063 1.00 0.00 H ATOM 7 HN2 VAL A 363 22.075 0.732 10.177 1.00 0.00 H ATOM 8 HN1 VAL A 363 22.112 0.784 11.875 1.00 0.00 H ATOM 9 N TYR A 364 21.971 -2.346 8.968 1.00 43.57 N ATOM 10 CA TYR A 364 21.478 -3.011 7.760 1.00 43.02 C ATOM 11 C TYR A 364 21.125 -4.466 8.011 1.00 42.18 C ATOM 12 O TYR A 364 21.983 -5.278 8.362 1.00 42.72 O ATOM 13 CB TYR A 364 22.439 -2.829 6.575 1.00 45.93 C ATOM 14 CG TYR A 364 22.388 -1.419 6.024 1.00 49.58 C ATOM 15 CD1 TYR A 364 21.431 -1.051 5.081 1.00 51.95 C ATOM 16 CD2 TYR A 364 23.261 -0.437 6.484 1.00 51.09 C ATOM 17 CE1 TYR A 364 21.360 0.255 4.593 1.00 54.46 C ATOM 18 CE2 TYR A 364 23.199 0.872 6.004 1.00 52.35 C ATOM 19 CZ TYR A 364 22.244 1.215 5.061 1.00 62.55 C ATOM 20 OH TYR A 364 22.181 2.506 4.586 1.00 65.13 O ATOM 21 HH TYR A 364 21.448 2.578 3.925 1.00 0.00 H ATOM 22 H TYR A 364 22.998 -2.312 9.131 1.00 0.00 H ATOM 23 N LEU A 365 19.847 -4.793 7.820 1.00 33.53 N ATOM 24 CA LEU A 365 19.327 -6.138 8.078 1.00 32.31 C ATOM 25 C LEU A 365 19.355 -7.037 6.874 1.00 38.12 C ATOM 26 O LEU A 365 19.371 -6.553 5.737 1.00 39.56 O ATOM 27 CB LEU A 365 17.902 -6.065 8.654 1.00 30.14 C ATOM 28 CG LEU A 365 17.709 -5.156 9.874 1.00 32.01 C ATOM 29 CD1 LEU A 365 16.246 -5.102 10.262 1.00 29.62 C ATOM 30 CD2 LEU A 365 18.583 -5.610 11.068 1.00 31.91 C ATOM 31 H LEU A 365 19.192 -4.063 7.474 1.00 0.00 H ATOM 32 N ASP A 366 19.331 -8.354 7.129 1.00 34.32 N ATOM 33 CA ASP A 366 19.346 -9.381 6.111 1.00 35.34 C ATOM 34 C ASP A 366 17.900 -9.763 5.756 1.00 39.28 C ATOM 35 O ASP A 366 17.170 -10.263 6.612 1.00 37.11 O ATOM 36 CB ASP A 366 20.167 -10.585 6.634 1.00 38.48 C ATOM 37 CG ASP A 366 20.399 -11.747 5.688 1.00 50.24 C ATOM 38 OD1 ASP A 366 19.788 -11.763 4.598 1.00 50.78 O ATOM 39 OD2 ASP A 366 21.149 -12.670 6.064 1.00 54.31 O ATOM 40 H ASP A 366 19.300 -8.656 8.124 1.00 0.00 H ATOM 41 N ARG A 367 17.490 -9.521 4.486 1.00 38.01 N ATOM 42 CA ARG A 367 16.138 -9.835 3.978 1.00 37.90 C ATOM 43 C ARG A 367 15.771 -11.313 4.170 1.00 40.15 C ATOM 44 O ARG A 367 14.605 -11.611 4.452 1.00 40.59 O ATOM 45 CB ARG A 367 15.964 -9.397 2.495 1.00 39.48 C ATOM 46 CG ARG A 367 14.537 -9.548 1.898 1.00 43.40 C ATOM 47 CD ARG A 367 13.481 -8.742 2.647 1.00 44.85 C ATOM 48 NE ARG A 367 12.122 -8.899 2.111 1.00 42.80 N ATOM 49 CZ ARG A 367 11.269 -9.850 2.487 1.00 58.46 C ATOM 50 NH1 ARG A 367 11.634 -10.767 3.376 1.00 47.37 N ATOM 51 NH2 ARG A 367 10.052 -9.901 1.966 1.00 48.96 N ATOM 52 HE ARG A 367 11.805 -8.221 1.389 1.00 0.00 H ATOM 53 HH12 ARG A 367 10.963 -11.507 3.665 1.00 0.00 H ATOM 54 HH11 ARG A 367 12.591 -10.745 3.783 1.00 0.00 H ATOM 55 HH22 ARG A 367 9.390 -10.646 2.263 1.00 0.00 H ATOM 56 HH21 ARG A 367 9.759 -9.196 1.260 1.00 0.00 H ATOM 57 H ARG A 367 18.169 -9.087 3.829 1.00 0.00 H ATOM 58 N LYS A 368 16.761 -12.230 4.069 1.00 36.94 N ATOM 59 CA LYS A 368 16.530 -13.660 4.270 1.00 38.22 C ATOM 60 C LYS A 368 16.048 -13.983 5.698 1.00 40.58 C ATOM 61 O LYS A 368 15.361 -14.990 5.887 1.00 40.55 O ATOM 62 CB LYS A 368 17.788 -14.484 3.917 1.00 42.94 C ATOM 63 H LYS A 368 17.722 -11.906 3.840 1.00 0.00 H ATOM 64 N LEU A 369 16.392 -13.112 6.687 1.00 35.23 N ATOM 65 CA LEU A 369 16.032 -13.258 8.103 1.00 33.66 C ATOM 66 C LEU A 369 14.700 -12.585 8.488 1.00 38.38 C ATOM 67 O LEU A 369 14.266 -12.699 9.637 1.00 37.50 O ATOM 68 CB LEU A 369 17.169 -12.769 9.018 1.00 32.73 C ATOM 69 CG LEU A 369 18.522 -13.514 8.942 1.00 39.56 C ATOM 70 CD1 LEU A 369 19.521 -12.912 9.919 1.00 39.39 C ATOM 71 CD2 LEU A 369 18.364 -15.039 9.204 1.00 44.35 C ATOM 72 H LEU A 369 16.953 -12.279 6.418 1.00 0.00 H ATOM 73 N LEU A 370 14.036 -11.939 7.522 1.00 35.08 N ATOM 74 CA LEU A 370 12.753 -11.260 7.722 1.00 33.42 C ATOM 75 C LEU A 370 11.638 -12.003 6.996 1.00 37.94 C ATOM 76 O LEU A 370 11.801 -12.342 5.817 1.00 39.31 O ATOM 77 CB LEU A 370 12.842 -9.803 7.220 1.00 32.32 C ATOM 78 CG LEU A 370 11.555 -8.954 7.308 1.00 36.26 C ATOM 79 CD1 LEU A 370 11.249 -8.516 8.769 1.00 35.50 C ATOM 80 CD2 LEU A 370 11.671 -7.721 6.444 1.00 37.85 C ATOM 81 H LEU A 370 14.456 -11.918 6.571 1.00 0.00 H ATOM 82 N THR A 371 10.523 -12.271 7.702 1.00 33.82 N ATOM 83 CA THR A 371 9.329 -12.927 7.154 1.00 35.64 C ATOM 84 C THR A 371 8.141 -11.972 7.326 1.00 41.67 C ATOM 85 O THR A 371 7.675 -11.774 8.456 1.00 40.72 O ATOM 86 CB THR A 371 9.050 -14.288 7.833 1.00 44.45 C ATOM 87 OG1 THR A 371 10.212 -15.118 7.805 1.00 43.86 O ATOM 88 CG2 THR A 371 7.878 -15.031 7.189 1.00 45.12 C ATOM 89 HG1 THR A 371 10.950 -14.667 8.286 1.00 0.00 H ATOM 90 H THR A 371 10.506 -11.994 8.704 1.00 0.00 H ATOM 91 N LEU A 372 7.662 -11.376 6.218 1.00 39.67 N ATOM 92 CA LEU A 372 6.532 -10.444 6.239 1.00 39.64 C ATOM 93 C LEU A 372 5.194 -11.154 6.031 1.00 47.21 C ATOM 94 O LEU A 372 5.090 -12.021 5.170 1.00 47.94 O ATOM 95 CB LEU A 372 6.686 -9.360 5.158 1.00 39.43 C ATOM 96 CG LEU A 372 7.828 -8.376 5.267 1.00 41.95 C ATOM 97 CD1 LEU A 372 8.015 -7.645 3.960 1.00 42.10 C ATOM 98 CD2 LEU A 372 7.605 -7.398 6.397 1.00 42.49 C ATOM 99 H LEU A 372 8.115 -11.587 5.306 1.00 0.00 H ATOM 100 N GLU A 373 4.168 -10.755 6.796 1.00 45.64 N ATOM 101 CA GLU A 373 2.790 -11.237 6.672 1.00 48.11 C ATOM 102 C GLU A 373 2.169 -10.375 5.576 1.00 55.05 C ATOM 103 O GLU A 373 2.428 -9.169 5.551 1.00 54.27 O ATOM 104 CB GLU A 373 2.020 -11.004 7.993 1.00 48.56 C ATOM 105 CG GLU A 373 1.997 -12.205 8.925 1.00 59.68 C ATOM 106 CD GLU A 373 1.447 -11.959 10.320 1.00 77.96 C ATOM 107 OE1 GLU A 373 0.745 -10.940 10.525 1.00 72.02 O ATOM 108 OE2 GLU A 373 1.722 -12.793 11.213 1.00 65.60 O ATOM 109 H GLU A 373 4.365 -10.049 7.534 1.00 0.00 H ATOM 110 N ASP A 374 1.362 -10.967 4.684 1.00 54.57 N ATOM 111 CA ASP A 374 0.731 -10.251 3.564 1.00 56.19 C ATOM 112 C ASP A 374 -0.230 -9.125 3.978 1.00 60.34 C ATOM 113 O ASP A 374 -0.271 -8.088 3.312 1.00 59.63 O ATOM 114 CB ASP A 374 0.026 -11.228 2.613 1.00 60.83 C ATOM 115 CG ASP A 374 0.969 -12.191 1.924 1.00 78.55 C ATOM 116 OD1 ASP A 374 1.724 -11.745 1.030 1.00 80.00 O ATOM 117 OD2 ASP A 374 0.931 -13.398 2.256 1.00 88.32 O ATOM 118 H ASP A 374 1.172 -11.984 4.789 1.00 0.00 H ATOM 119 N LYS A 375 -0.991 -9.326 5.069 1.00 57.30 N ATOM 120 CA LYS A 375 -1.967 -8.353 5.563 1.00 56.26 C ATOM 121 C LYS A 375 -1.329 -7.084 6.124 1.00 58.36 C ATOM 122 O LYS A 375 -0.427 -7.154 6.963 1.00 57.98 O ATOM 123 CB LYS A 375 -2.909 -8.987 6.599 1.00 58.45 C ATOM 124 H LYS A 375 -0.880 -10.220 5.589 1.00 0.00 H ATOM 125 N GLU A 376 -1.809 -5.923 5.645 1.00 53.17 N ATOM 126 CA GLU A 376 -1.376 -4.606 6.093 1.00 50.99 C ATOM 127 C GLU A 376 -2.047 -4.289 7.426 1.00 52.06 C ATOM 128 O GLU A 376 -3.197 -4.671 7.635 1.00 52.02 O ATOM 129 CB GLU A 376 -1.750 -3.534 5.059 1.00 52.77 C ATOM 130 CG GLU A 376 -0.869 -3.550 3.823 1.00 63.79 C ATOM 131 CD GLU A 376 -1.538 -3.099 2.540 1.00 87.21 C ATOM 132 OE1 GLU A 376 -1.456 -3.848 1.541 1.00 76.38 O ATOM 133 OE2 GLU A 376 -2.126 -1.992 2.524 1.00 84.72 O ATOM 134 H GLU A 376 -2.538 -5.968 4.905 1.00 0.00 H ATOM 135 N LEU A 377 -1.323 -3.624 8.334 1.00 45.83 N ATOM 136 CA LEU A 377 -1.869 -3.209 9.627 1.00 44.65 C ATOM 137 C LEU A 377 -2.421 -1.793 9.497 1.00 50.00 C ATOM 138 O LEU A 377 -3.321 -1.408 10.236 1.00 50.01 O ATOM 139 CB LEU A 377 -0.805 -3.245 10.736 1.00 43.45 C ATOM 140 CG LEU A 377 -0.098 -4.571 11.039 1.00 48.72 C ATOM 141 CD1 LEU A 377 1.097 -4.330 11.928 1.00 47.89 C ATOM 142 CD2 LEU A 377 -1.031 -5.589 11.672 1.00 51.43 C ATOM 143 H LEU A 377 -0.334 -3.393 8.112 1.00 0.00 H ATOM 144 N GLY A 378 -1.851 -1.028 8.573 1.00 47.70 N ATOM 145 CA GLY A 378 -2.231 0.350 8.311 1.00 47.79 C ATOM 146 C GLY A 378 -1.430 0.951 7.182 1.00 54.11 C ATOM 147 O GLY A 378 -0.757 0.224 6.441 1.00 53.96 O ATOM 148 H GLY A 378 -1.086 -1.440 8.002 1.00 0.00 H ATOM 149 N SER A 379 -1.514 2.290 7.047 1.00 52.13 N ATOM 150 CA SER A 379 -0.834 3.062 6.007 1.00 53.14 C ATOM 151 C SER A 379 -0.765 4.562 6.324 1.00 58.06 C ATOM 152 O SER A 379 -1.518 5.073 7.157 1.00 56.57 O ATOM 153 CB SER A 379 -1.499 2.848 4.643 1.00 57.51 C ATOM 154 OG SER A 379 -2.799 3.414 4.598 1.00 65.22 O ATOM 155 HG SER A 379 -3.196 3.256 3.705 1.00 0.00 H ATOM 156 H SER A 379 -2.103 2.810 7.729 1.00 0.00 H ATOM 157 N GLY A 380 0.144 5.230 5.621 1.00 56.25 N ATOM 158 CA GLY A 380 0.384 6.667 5.644 1.00 55.78 C ATOM 159 C GLY A 380 0.804 7.089 4.253 1.00 61.65 C ATOM 160 O GLY A 380 0.685 6.292 3.315 1.00 63.54 O ATOM 161 H GLY A 380 0.748 4.668 4.988 1.00 0.00 H ATOM 162 N ASN A 381 1.311 8.325 4.095 1.00 57.51 N ATOM 163 CA ASN A 381 1.774 8.817 2.788 1.00 58.11 C ATOM 164 C ASN A 381 2.985 8.001 2.297 1.00 59.87 C ATOM 165 O ASN A 381 3.131 7.777 1.092 1.00 60.46 O ATOM 166 CB ASN A 381 2.122 10.309 2.857 1.00 60.67 C ATOM 167 H ASN A 381 1.378 8.952 4.922 1.00 0.00 H ATOM 168 N PHE A 382 3.822 7.541 3.255 1.00 53.32 N ATOM 169 CA PHE A 382 5.036 6.741 3.064 1.00 52.11 C ATOM 170 C PHE A 382 4.803 5.421 2.327 1.00 53.99 C ATOM 171 O PHE A 382 5.569 5.076 1.427 1.00 54.89 O ATOM 172 CB PHE A 382 5.751 6.494 4.414 1.00 52.35 C ATOM 173 CG PHE A 382 4.965 5.693 5.429 1.00 53.16 C ATOM 174 CD1 PHE A 382 5.035 4.302 5.450 1.00 56.08 C ATOM 175 CD2 PHE A 382 4.174 6.327 6.377 1.00 54.47 C ATOM 176 CE1 PHE A 382 4.280 3.560 6.363 1.00 56.34 C ATOM 177 CE2 PHE A 382 3.444 5.584 7.312 1.00 56.65 C ATOM 178 CZ PHE A 382 3.498 4.206 7.292 1.00 54.90 C ATOM 179 H PHE A 382 3.577 7.782 4.237 1.00 0.00 H ATOM 180 N GLY A 383 3.752 4.712 2.724 1.00 47.69 N ATOM 181 CA GLY A 383 3.389 3.406 2.201 1.00 47.36 C ATOM 182 C GLY A 383 2.564 2.657 3.219 1.00 47.70 C ATOM 183 O GLY A 383 1.592 3.210 3.738 1.00 47.36 O ATOM 184 H GLY A 383 3.145 5.121 3.463 1.00 0.00 H ATOM 185 N THR A 384 2.953 1.407 3.541 1.00 40.37 N ATOM 186 CA THR A 384 2.205 0.578 4.488 1.00 37.77 C ATOM 187 C THR A 384 3.027 0.116 5.706 1.00 36.40 C ATOM 188 O THR A 384 4.257 0.173 5.693 1.00 34.46 O ATOM 189 CB THR A 384 1.597 -0.652 3.782 1.00 47.84 C ATOM 190 OG1 THR A 384 2.631 -1.596 3.498 1.00 46.29 O ATOM 191 CG2 THR A 384 0.809 -0.299 2.514 1.00 49.86 C ATOM 192 HG1 THR A 384 2.241 -2.385 3.045 1.00 0.00 H ATOM 193 H THR A 384 3.812 1.019 3.102 1.00 0.00 H ATOM 194 N VAL A 385 2.315 -0.367 6.743 1.00 30.51 N ATOM 195 CA VAL A 385 2.874 -0.956 7.960 1.00 28.26 C ATOM 196 C VAL A 385 2.443 -2.383 7.929 1.00 31.99 C ATOM 197 O VAL A 385 1.246 -2.657 7.836 1.00 31.39 O ATOM 198 CB VAL A 385 2.389 -0.298 9.285 1.00 30.15 C ATOM 199 CG1 VAL A 385 3.152 -0.869 10.480 1.00 29.34 C ATOM 200 CG2 VAL A 385 2.530 1.217 9.241 1.00 28.44 C ATOM 201 H VAL A 385 1.279 -0.317 6.672 1.00 0.00 H ATOM 202 N LYS A 386 3.400 -3.301 8.008 1.00 28.55 N ATOM 203 CA LYS A 386 3.077 -4.704 8.007 1.00 30.03 C ATOM 204 C LYS A 386 3.720 -5.385 9.197 1.00 32.98 C ATOM 205 O LYS A 386 4.697 -4.891 9.758 1.00 32.19 O ATOM 206 CB LYS A 386 3.488 -5.365 6.670 1.00 33.90 C ATOM 207 CG LYS A 386 2.430 -5.167 5.581 1.00 48.66 C ATOM 208 CD LYS A 386 2.968 -5.306 4.159 1.00 57.68 C ATOM 209 CE LYS A 386 2.716 -6.647 3.525 1.00 69.47 C ATOM 210 H LYS A 386 4.394 -3.003 8.071 1.00 0.00 H ATOM 211 N LYS A 387 3.156 -6.496 9.591 1.00 28.70 N ATOM 212 CA LYS A 387 3.691 -7.318 10.666 1.00 28.75 C ATOM 213 C LYS A 387 4.648 -8.320 10.062 1.00 33.50 C ATOM 214 O LYS A 387 4.400 -8.858 8.975 1.00 34.38 O ATOM 215 CB LYS A 387 2.553 -8.040 11.415 1.00 32.34 C ATOM 216 CG LYS A 387 3.022 -9.006 12.492 1.00 40.54 C ATOM 217 CD LYS A 387 1.880 -9.439 13.396 1.00 40.68 C ATOM 218 CE LYS A 387 2.300 -10.603 14.263 1.00 52.12 C ATOM 219 NZ LYS A 387 1.268 -10.926 15.282 1.00 54.67 N ATOM 220 HZ1 LYS A 387 1.115 -10.099 15.893 1.00 0.00 H ATOM 221 HZ2 LYS A 387 0.378 -11.175 14.805 1.00 0.00 H ATOM 222 HZ3 LYS A 387 1.591 -11.729 15.858 1.00 0.00 H ATOM 223 H LYS A 387 2.285 -6.807 9.115 1.00 0.00 H ATOM 224 N GLY A 388 5.722 -8.587 10.788 1.00 29.83 N ATOM 225 CA GLY A 388 6.718 -9.563 10.376 1.00 30.53 C ATOM 226 C GLY A 388 7.439 -10.185 11.554 1.00 32.30 C ATOM 227 O GLY A 388 7.145 -9.870 12.714 1.00 27.55 O ATOM 228 H GLY A 388 5.859 -8.080 11.686 1.00 0.00 H ATOM 229 N TYR A 389 8.412 -11.041 11.243 1.00 30.84 N ATOM 230 CA TYR A 389 9.248 -11.726 12.219 1.00 32.64 C ATOM 231 C TYR A 389 10.668 -11.628 11.753 1.00 36.53 C ATOM 232 O TYR A 389 10.949 -11.853 10.571 1.00 37.91 O ATOM 233 CB TYR A 389 8.895 -13.235 12.351 1.00 37.40 C ATOM 234 CG TYR A 389 7.436 -13.553 12.558 1.00 41.68 C ATOM 235 CD1 TYR A 389 6.610 -13.852 11.481 1.00 45.65 C ATOM 236 CD2 TYR A 389 6.888 -13.610 13.839 1.00 42.13 C ATOM 237 CE1 TYR A 389 5.261 -14.151 11.665 1.00 48.28 C ATOM 238 CE2 TYR A 389 5.538 -13.902 14.036 1.00 43.43 C ATOM 239 CZ TYR A 389 4.732 -14.190 12.945 1.00 56.05 C ATOM 240 OH TYR A 389 3.409 -14.519 13.115 1.00 60.80 O ATOM 241 HH TYR A 389 2.997 -14.690 12.231 1.00 0.00 H ATOM 242 H TYR A 389 8.586 -11.233 10.236 1.00 0.00 H ATOM 243 N TYR A 390 11.572 -11.322 12.683 1.00 32.21 N ATOM 244 CA TYR A 390 12.998 -11.256 12.411 1.00 31.57 C ATOM 245 C TYR A 390 13.769 -12.259 13.262 1.00 36.34 C ATOM 246 O TYR A 390 13.628 -12.276 14.483 1.00 34.84 O ATOM 247 CB TYR A 390 13.552 -9.821 12.585 1.00 31.70 C ATOM 248 CG TYR A 390 14.879 -9.631 11.873 1.00 34.33 C ATOM 249 CD1 TYR A 390 16.072 -9.540 12.587 1.00 35.80 C ATOM 250 CD2 TYR A 390 14.945 -9.577 10.481 1.00 35.31 C ATOM 251 CE1 TYR A 390 17.296 -9.385 11.933 1.00 34.80 C ATOM 252 CE2 TYR A 390 16.162 -9.441 9.819 1.00 36.36 C ATOM 253 CZ TYR A 390 17.337 -9.361 10.548 1.00 42.58 C ATOM 254 OH TYR A 390 18.534 -9.211 9.890 1.00 44.26 O ATOM 255 HH TYR A 390 19.270 -9.171 10.551 1.00 0.00 H ATOM 256 H TYR A 390 11.242 -11.121 13.648 1.00 0.00 H ATOM 257 N GLN A 391 14.608 -13.065 12.614 1.00 36.00 N ATOM 258 CA GLN A 391 15.458 -14.065 13.273 1.00 38.38 C ATOM 259 C GLN A 391 16.611 -13.290 13.938 1.00 44.94 C ATOM 260 O GLN A 391 17.420 -12.682 13.232 1.00 43.62 O ATOM 261 CB GLN A 391 15.974 -15.081 12.230 1.00 40.87 C ATOM 262 CG GLN A 391 16.967 -16.135 12.755 1.00 55.56 C ATOM 263 CD GLN A 391 16.449 -16.904 13.947 1.00 66.79 C ATOM 264 OE1 GLN A 391 15.524 -17.723 13.839 1.00 59.48 O ATOM 265 NE2 GLN A 391 17.024 -16.636 15.112 1.00 51.21 N ATOM 266 HE22 GLN A 391 17.797 -15.943 15.163 1.00 0.00 H ATOM 267 HE21 GLN A 391 16.701 -17.119 15.975 1.00 0.00 H ATOM 268 H GLN A 391 14.665 -12.981 11.579 1.00 0.00 H ATOM 269 N MET A 392 16.635 -13.243 15.290 1.00 43.00 N ATOM 270 CA MET A 392 17.686 -12.519 16.022 1.00 43.36 C ATOM 271 C MET A 392 18.815 -13.507 16.332 1.00 49.25 C ATOM 272 O MET A 392 18.808 -14.618 15.795 1.00 48.75 O ATOM 273 CB MET A 392 17.153 -11.847 17.314 1.00 44.88 C ATOM 274 CG MET A 392 15.927 -10.975 17.124 1.00 47.39 C ATOM 275 SD MET A 392 16.192 -9.355 16.330 1.00 50.82 S ATOM 276 CE MET A 392 16.700 -8.363 17.728 1.00 46.16 C ATOM 277 H MET A 392 15.890 -13.732 15.826 1.00 0.00 H ATOM 278 N LYS A 393 19.685 -13.167 17.268 1.00 47.22 N ATOM 279 CA LYS A 393 20.802 -14.014 17.531 1.00 48.93 C ATOM 280 C LYS A 393 20.321 -15.398 17.944 1.00 52.34 C ATOM 281 O LYS A 393 20.911 -16.370 17.545 1.00 51.98 O ATOM 282 CB LYS A 393 21.684 -13.423 18.603 1.00 52.43 C ATOM 283 CG LYS A 393 22.967 -12.806 18.092 1.00 65.65 C ATOM 284 H LYS A 393 19.556 -12.288 17.809 1.00 0.00 H ATOM 285 N LYS A 394 19.295 -15.452 18.796 1.00 47.74 N ATOM 286 CA LYS A 394 18.686 -16.719 19.217 1.00 47.68 C ATOM 287 C LYS A 394 17.161 -16.811 19.020 1.00 49.29 C ATOM 288 O LYS A 394 16.660 -17.761 18.418 1.00 49.38 O ATOM 289 CB LYS A 394 19.039 -17.016 20.678 1.00 51.16 C ATOM 290 CG LYS A 394 18.911 -18.482 21.061 1.00 52.84 C ATOM 291 CD LYS A 394 19.009 -18.669 22.566 1.00 49.40 C ATOM 292 CE LYS A 394 18.800 -20.123 22.956 1.00 37.31 C ATOM 293 NZ LYS A 394 19.835 -20.596 23.916 1.00 45.22 N ATOM 294 HZ1 LYS A 394 20.776 -20.507 23.481 1.00 0.00 H ATOM 295 HZ2 LYS A 394 19.795 -20.018 24.780 1.00 0.00 H ATOM 296 HZ3 LYS A 394 19.655 -21.592 24.155 1.00 0.00 H ATOM 297 H LYS A 394 18.913 -14.563 19.176 1.00 0.00 H ATOM 298 N VAL A 395 16.439 -15.820 19.541 1.00 44.27 N ATOM 299 CA VAL A 395 14.993 -15.799 19.544 1.00 42.61 C ATOM 300 C VAL A 395 14.524 -15.250 18.231 1.00 43.13 C ATOM 301 O VAL A 395 15.292 -14.672 17.498 1.00 42.66 O ATOM 302 CB VAL A 395 14.473 -14.988 20.703 1.00 44.77 C ATOM 303 CG1 VAL A 395 14.907 -15.606 22.004 1.00 45.28 C ATOM 304 CG2 VAL A 395 14.988 -13.572 20.611 1.00 43.09 C ATOM 305 H VAL A 395 16.943 -15.017 19.969 1.00 0.00 H ATOM 306 N VAL A 396 13.261 -15.428 17.936 1.00 37.07 N ATOM 307 CA VAL A 396 12.637 -14.784 16.790 1.00 34.52 C ATOM 308 C VAL A 396 11.871 -13.581 17.370 1.00 32.65 C ATOM 309 O VAL A 396 11.227 -13.715 18.404 1.00 30.91 O ATOM 310 CB VAL A 396 11.812 -15.773 15.940 1.00 39.96 C ATOM 311 CG1 VAL A 396 10.801 -15.058 15.060 1.00 39.39 C ATOM 312 CG2 VAL A 396 12.739 -16.642 15.093 1.00 41.80 C ATOM 313 H VAL A 396 12.686 -16.049 18.540 1.00 0.00 H ATOM 314 N LYS A 397 12.041 -12.380 16.785 1.00 27.73 N ATOM 315 CA LYS A 397 11.385 -11.187 17.301 1.00 25.13 C ATOM 316 C LYS A 397 10.289 -10.746 16.355 1.00 28.79 C ATOM 317 O LYS A 397 10.528 -10.613 15.150 1.00 27.95 O ATOM 318 CB LYS A 397 12.416 -10.056 17.499 1.00 26.05 C ATOM 319 CG LYS A 397 11.940 -8.940 18.442 1.00 25.75 C ATOM 320 CD LYS A 397 12.995 -7.861 18.664 1.00 33.71 C ATOM 321 CE LYS A 397 12.421 -6.653 19.373 1.00 30.54 C ATOM 322 NZ LYS A 397 12.075 -6.940 20.802 1.00 29.93 N ATOM 323 HZ1 LYS A 397 11.368 -7.701 20.840 1.00 0.00 H ATOM 324 HZ2 LYS A 397 12.932 -7.235 21.312 1.00 0.00 H ATOM 325 HZ3 LYS A 397 11.686 -6.082 21.242 1.00 0.00 H ATOM 326 H LYS A 397 12.653 -12.303 15.948 1.00 0.00 H ATOM 327 N THR A 398 9.088 -10.521 16.896 1.00 24.24 N ATOM 328 CA THR A 398 7.968 -9.985 16.123 1.00 23.05 C ATOM 329 C THR A 398 8.288 -8.515 15.848 1.00 26.63 C ATOM 330 O THR A 398 8.665 -7.761 16.766 1.00 25.06 O ATOM 331 CB THR A 398 6.671 -10.092 16.907 1.00 26.43 C ATOM 332 OG1 THR A 398 6.489 -11.461 17.269 1.00 27.70 O ATOM 333 CG2 THR A 398 5.475 -9.633 16.088 1.00 29.84 C ATOM 334 HG1 THR A 398 5.648 -11.556 17.782 1.00 0.00 H ATOM 335 H THR A 398 8.944 -10.735 17.904 1.00 0.00 H ATOM 336 N VAL A 399 8.099 -8.092 14.597 1.00 21.89 N ATOM 337 CA VAL A 399 8.429 -6.717 14.245 1.00 19.76 C ATOM 338 C VAL A 399 7.285 -6.017 13.502 1.00 24.14 C ATOM 339 O VAL A 399 6.414 -6.672 12.918 1.00 25.01 O ATOM 340 CB VAL A 399 9.757 -6.667 13.426 1.00 23.26 C ATOM 341 CG1 VAL A 399 10.980 -7.083 14.262 1.00 22.61 C ATOM 342 CG2 VAL A 399 9.672 -7.505 12.153 1.00 24.54 C ATOM 343 H VAL A 399 7.719 -8.739 13.878 1.00 0.00 H ATOM 344 N ALA A 400 7.322 -4.695 13.511 1.00 19.44 N ATOM 345 CA ALA A 400 6.414 -3.872 12.724 1.00 19.56 C ATOM 346 C ALA A 400 7.323 -3.290 11.663 1.00 24.32 C ATOM 347 O ALA A 400 8.420 -2.828 11.984 1.00 22.25 O ATOM 348 CB ALA A 400 5.813 -2.778 13.562 1.00 18.82 C ATOM 349 H ALA A 400 8.031 -4.222 14.107 1.00 0.00 H ATOM 350 N VAL A 401 6.918 -3.394 10.388 1.00 21.64 N ATOM 351 CA VAL A 401 7.753 -2.949 9.287 1.00 20.66 C ATOM 352 C VAL A 401 7.062 -1.863 8.470 1.00 26.54 C ATOM 353 O VAL A 401 5.974 -2.098 7.932 1.00 27.77 O ATOM 354 CB VAL A 401 8.175 -4.140 8.383 1.00 26.21 C ATOM 355 CG1 VAL A 401 9.118 -3.667 7.263 1.00 25.74 C ATOM 356 CG2 VAL A 401 8.822 -5.270 9.198 1.00 26.22 C ATOM 357 H VAL A 401 5.984 -3.803 10.184 1.00 0.00 H ATOM 358 N LYS A 402 7.714 -0.703 8.348 1.00 21.88 N ATOM 359 CA LYS A 402 7.243 0.374 7.492 1.00 22.77 C ATOM 360 C LYS A 402 7.846 0.148 6.114 1.00 30.69 C ATOM 361 O LYS A 402 9.070 0.044 5.980 1.00 30.56 O ATOM 362 CB LYS A 402 7.620 1.739 8.056 1.00 24.38 C ATOM 363 CG LYS A 402 6.568 2.257 9.003 1.00 33.29 C ATOM 364 CD LYS A 402 6.735 3.756 9.152 1.00 35.84 C ATOM 365 CE LYS A 402 6.003 4.272 10.360 1.00 35.56 C ATOM 366 NZ LYS A 402 6.487 5.625 10.716 1.00 33.75 N ATOM 367 HZ1 LYS A 402 7.504 5.583 10.927 1.00 0.00 H ATOM 368 HZ2 LYS A 402 6.324 6.271 9.918 1.00 0.00 H ATOM 369 HZ3 LYS A 402 5.972 5.967 11.552 1.00 0.00 H ATOM 370 H LYS A 402 8.593 -0.565 8.886 1.00 0.00 H ATOM 371 N ILE A 403 6.982 -0.044 5.107 1.00 29.99 N ATOM 372 CA ILE A 403 7.411 -0.349 3.734 1.00 32.09 C ATOM 373 C ILE A 403 7.029 0.806 2.814 1.00 39.84 C ATOM 374 O ILE A 403 5.871 1.206 2.794 1.00 38.87 O ATOM 375 CB ILE A 403 6.788 -1.708 3.287 1.00 37.03 C ATOM 376 CG1 ILE A 403 7.244 -2.844 4.226 1.00 37.74 C ATOM 377 CG2 ILE A 403 7.137 -2.049 1.808 1.00 39.08 C ATOM 378 CD1 ILE A 403 6.286 -3.988 4.409 1.00 47.59 C ATOM 379 H ILE A 403 5.964 0.026 5.306 1.00 0.00 H ATOM 380 N LEU A 404 7.993 1.349 2.071 1.00 41.80 N ATOM 381 CA LEU A 404 7.727 2.481 1.174 1.00 44.60 C ATOM 382 C LEU A 404 6.917 2.141 -0.065 1.00 52.60 C ATOM 383 O LEU A 404 7.123 1.085 -0.665 1.00 52.36 O ATOM 384 CB LEU A 404 9.017 3.198 0.758 1.00 45.02 C ATOM 385 CG LEU A 404 9.755 3.995 1.823 1.00 48.71 C ATOM 386 CD1 LEU A 404 10.956 4.674 1.211 1.00 49.33 C ATOM 387 CD2 LEU A 404 8.849 5.050 2.491 1.00 50.07 C ATOM 388 H LEU A 404 8.957 0.962 2.128 1.00 0.00 H ATOM 389 N LYS A 405 6.018 3.068 -0.469 1.00 52.49 N ATOM 390 CA LYS A 405 5.197 2.933 -1.680 1.00 55.51 C ATOM 391 C LYS A 405 6.122 2.957 -2.906 1.00 64.21 C ATOM 392 O LYS A 405 6.109 2.010 -3.695 1.00 66.45 O ATOM 393 CB LYS A 405 4.143 4.053 -1.763 1.00 57.65 C ATOM 394 H LYS A 405 5.902 3.924 0.110 1.00 0.00 H ATOM 395 N ASN A 406 6.961 4.018 -3.012 1.00 62.08 N ATOM 396 CA ASN A 406 7.978 4.283 -4.043 1.00 63.62 C ATOM 397 C ASN A 406 7.526 3.941 -5.476 1.00 70.45 C ATOM 398 O ASN A 406 8.253 3.268 -6.214 1.00 71.95 O ATOM 399 CB ASN A 406 9.302 3.586 -3.687 1.00 64.87 C ATOM 400 H ASN A 406 6.874 4.739 -2.267 1.00 0.00 H ATOM 401 N GLU A 407 6.325 4.416 -5.861 1.00 67.52 N ATOM 402 CA GLU A 407 5.751 4.174 -7.188 1.00100.54 C ATOM 403 C GLU A 407 6.270 5.183 -8.212 1.00124.51 C ATOM 404 O GLU A 407 7.475 5.265 -8.447 1.00 85.17 O ATOM 405 CB GLU A 407 4.216 4.207 -7.129 1.00102.24 C ATOM 406 H GLU A 407 5.778 4.983 -5.182 1.00 0.00 H TER 407 GLU A 407 ATOM 408 N PRO A 411 12.691 10.298 -4.920 1.00 68.91 N ATOM 409 CA PRO A 411 13.587 9.823 -3.856 1.00 67.37 C ATOM 410 C PRO A 411 13.353 10.501 -2.500 1.00 68.75 C ATOM 411 O PRO A 411 14.076 10.212 -1.540 1.00 67.71 O ATOM 412 CB PRO A 411 14.984 10.111 -4.419 1.00 70.09 C ATOM 413 CG PRO A 411 14.782 11.221 -5.435 1.00 75.67 C ATOM 414 CD PRO A 411 13.306 11.381 -5.709 1.00 71.31 C ATOM 415 HN2 PRO A 411 11.813 10.652 -4.489 1.00 0.00 H ATOM 416 HN1 PRO A 411 12.469 9.504 -5.553 1.00 0.00 H ATOM 417 N ALA A 412 12.333 11.390 -2.420 1.00 63.27 N ATOM 418 CA ALA A 412 11.968 12.125 -1.211 1.00 61.02 C ATOM 419 C ALA A 412 11.567 11.171 -0.094 1.00 62.15 C ATOM 420 O ALA A 412 12.081 11.310 1.016 1.00 60.99 O ATOM 421 CB ALA A 412 10.839 13.108 -1.499 1.00 61.84 C ATOM 422 H ALA A 412 11.771 11.561 -3.278 1.00 0.00 H ATOM 423 N LEU A 413 10.687 10.180 -0.396 1.00 57.07 N ATOM 424 CA LEU A 413 10.228 9.176 0.574 1.00 54.75 C ATOM 425 C LEU A 413 11.364 8.312 1.112 1.00 52.99 C ATOM 426 O LEU A 413 11.369 8.021 2.308 1.00 51.45 O ATOM 427 CB LEU A 413 9.092 8.301 0.016 1.00 55.95 C ATOM 428 CG LEU A 413 7.713 8.964 -0.114 1.00 61.13 C ATOM 429 CD1 LEU A 413 6.782 8.115 -0.956 1.00 62.79 C ATOM 430 CD2 LEU A 413 7.084 9.232 1.246 1.00 61.63 C ATOM 431 H LEU A 413 10.318 10.130 -1.367 1.00 0.00 H ATOM 432 N LYS A 414 12.343 7.950 0.256 1.00 47.67 N ATOM 433 CA LYS A 414 13.510 7.151 0.660 1.00 46.02 C ATOM 434 C LYS A 414 14.391 7.948 1.617 1.00 44.84 C ATOM 435 O LYS A 414 14.745 7.438 2.686 1.00 40.79 O ATOM 436 CB LYS A 414 14.307 6.636 -0.547 1.00 49.49 C ATOM 437 H LYS A 414 12.269 8.250 -0.737 1.00 0.00 H ATOM 438 N ASP A 415 14.686 9.224 1.260 1.00 40.21 N ATOM 439 CA ASP A 415 15.490 10.123 2.077 1.00 38.52 C ATOM 440 C ASP A 415 14.821 10.328 3.427 1.00 38.29 C ATOM 441 O ASP A 415 15.484 10.206 4.452 1.00 38.15 O ATOM 442 CB ASP A 415 15.720 11.471 1.357 1.00 41.48 C ATOM 443 CG ASP A 415 16.679 11.416 0.177 1.00 55.88 C ATOM 444 OD1 ASP A 415 17.544 10.508 0.150 1.00 57.18 O ATOM 445 OD2 ASP A 415 16.596 12.310 -0.698 1.00 63.99 O ATOM 446 H ASP A 415 14.318 9.579 0.354 1.00 0.00 H ATOM 447 N GLU A 416 13.496 10.556 3.429 1.00 32.97 N ATOM 448 CA GLU A 416 12.695 10.732 4.632 1.00 31.44 C ATOM 449 C GLU A 416 12.694 9.479 5.517 1.00 32.13 C ATOM 450 O GLU A 416 12.746 9.606 6.741 1.00 28.35 O ATOM 451 CB GLU A 416 11.261 11.149 4.274 1.00 33.13 C ATOM 452 CG GLU A 416 11.156 12.587 3.787 1.00 45.45 C ATOM 453 CD GLU A 416 9.993 12.926 2.874 1.00 72.61 C ATOM 454 OE1 GLU A 416 9.002 12.161 2.837 1.00 73.71 O ATOM 455 OE2 GLU A 416 10.065 13.986 2.212 1.00 73.18 O ATOM 456 H GLU A 416 13.011 10.610 2.511 1.00 0.00 H ATOM 457 N LEU A 417 12.663 8.275 4.909 1.00 29.62 N ATOM 458 CA LEU A 417 12.693 7.039 5.696 1.00 28.54 C ATOM 459 C LEU A 417 14.084 6.845 6.324 1.00 29.32 C ATOM 460 O LEU A 417 14.165 6.511 7.510 1.00 25.99 O ATOM 461 CB LEU A 417 12.272 5.816 4.858 1.00 30.20 C ATOM 462 CG LEU A 417 11.947 4.555 5.678 1.00 35.82 C ATOM 463 CD1 LEU A 417 10.569 4.653 6.315 1.00 37.27 C ATOM 464 CD2 LEU A 417 12.022 3.317 4.831 1.00 39.50 C ATOM 465 H LEU A 417 12.617 8.223 3.871 1.00 0.00 H ATOM 466 N LEU A 418 15.171 7.125 5.561 1.00 27.68 N ATOM 467 CA LEU A 418 16.548 7.037 6.079 1.00 27.69 C ATOM 468 C LEU A 418 16.779 8.075 7.189 1.00 30.34 C ATOM 469 O LEU A 418 17.394 7.736 8.200 1.00 28.52 O ATOM 470 CB LEU A 418 17.613 7.157 4.969 1.00 29.10 C ATOM 471 CG LEU A 418 17.597 6.073 3.863 1.00 35.71 C ATOM 472 CD1 LEU A 418 18.578 6.422 2.728 1.00 37.93 C ATOM 473 CD2 LEU A 418 17.909 4.704 4.408 1.00 37.64 C ATOM 474 H LEU A 418 15.027 7.413 4.572 1.00 0.00 H ATOM 475 N ALA A 419 16.245 9.313 7.037 1.00 29.46 N ATOM 476 CA ALA A 419 16.384 10.326 8.105 1.00 29.29 C ATOM 477 C ALA A 419 15.632 9.881 9.383 1.00 30.22 C ATOM 478 O ALA A 419 16.152 10.034 10.487 1.00 28.74 O ATOM 479 CB ALA A 419 15.885 11.686 7.636 1.00 30.77 C ATOM 480 H ALA A 419 15.734 9.551 6.163 1.00 0.00 H ATOM 481 N GLU A 420 14.431 9.275 9.226 1.00 26.51 N ATOM 482 CA GLU A 420 13.639 8.740 10.336 1.00 24.35 C ATOM 483 C GLU A 420 14.450 7.634 11.054 1.00 27.02 C ATOM 484 O GLU A 420 14.581 7.616 12.285 1.00 23.60 O ATOM 485 CB GLU A 420 12.330 8.168 9.764 1.00 25.47 C ATOM 486 CG GLU A 420 11.325 7.684 10.804 1.00 29.10 C ATOM 487 CD GLU A 420 10.000 7.246 10.213 1.00 35.09 C ATOM 488 OE1 GLU A 420 9.728 7.562 9.032 1.00 29.72 O ATOM 489 OE2 GLU A 420 9.195 6.651 10.960 1.00 40.33 O ATOM 490 H GLU A 420 14.049 9.184 8.263 1.00 0.00 H ATOM 491 N ALA A 421 15.040 6.737 10.260 1.00 25.35 N ATOM 492 CA ALA A 421 15.873 5.646 10.749 1.00 25.76 C ATOM 493 C ALA A 421 17.045 6.201 11.554 1.00 29.34 C ATOM 494 O ALA A 421 17.343 5.684 12.628 1.00 27.91 O ATOM 495 CB ALA A 421 16.389 4.833 9.561 1.00 27.52 C ATOM 496 H ALA A 421 14.897 6.822 9.233 1.00 0.00 H ATOM 497 N ASN A 422 17.678 7.273 11.032 1.00 28.05 N ATOM 498 CA ASN A 422 18.820 7.942 11.643 1.00 28.76 C ATOM 499 C ASN A 422 18.464 8.551 13.005 1.00 31.74 C ATOM 500 O ASN A 422 19.275 8.471 13.935 1.00 31.24 O ATOM 501 CB ASN A 422 19.394 8.968 10.709 1.00 30.74 C ATOM 502 CG ASN A 422 20.680 9.569 11.209 1.00 64.52 C ATOM 503 OD1 ASN A 422 21.719 8.900 11.313 1.00 62.15 O ATOM 504 ND2 ASN A 422 20.622 10.847 11.548 1.00 57.16 N ATOM 505 HD22 ASN A 422 19.730 11.372 11.445 1.00 0.00 H ATOM 506 HD21 ASN A 422 21.468 11.326 11.917 1.00 0.00 H ATOM 507 H ASN A 422 17.325 7.649 10.129 1.00 0.00 H ATOM 508 N VAL A 423 17.243 9.111 13.131 1.00 23.96 N ATOM 509 CA VAL A 423 16.765 9.634 14.408 1.00 22.29 C ATOM 510 C VAL A 423 16.566 8.503 15.409 1.00 23.32 C ATOM 511 O VAL A 423 17.094 8.582 16.516 1.00 22.09 O ATOM 512 CB VAL A 423 15.468 10.487 14.242 1.00 24.57 C ATOM 513 CG1 VAL A 423 14.811 10.773 15.605 1.00 23.45 C ATOM 514 CG2 VAL A 423 15.768 11.781 13.478 1.00 24.41 C ATOM 515 H VAL A 423 16.626 9.172 12.296 1.00 0.00 H ATOM 516 N MET A 424 15.756 7.475 15.048 1.00 20.69 N ATOM 517 CA MET A 424 15.410 6.352 15.936 1.00 21.20 C ATOM 518 C MET A 424 16.648 5.593 16.438 1.00 25.80 C ATOM 519 O MET A 424 16.656 5.164 17.587 1.00 23.29 O ATOM 520 CB MET A 424 14.428 5.374 15.253 1.00 22.69 C ATOM 521 CG MET A 424 13.079 6.001 14.917 1.00 25.30 C ATOM 522 SD MET A 424 11.930 4.734 14.296 1.00 29.55 S ATOM 523 CE MET A 424 11.365 4.030 15.817 1.00 26.72 C ATOM 524 H MET A 424 15.356 7.481 14.088 1.00 0.00 H ATOM 525 N GLN A 425 17.698 5.504 15.599 1.00 25.13 N ATOM 526 CA GLN A 425 18.967 4.834 15.959 1.00 27.01 C ATOM 527 C GLN A 425 19.654 5.536 17.142 1.00 28.88 C ATOM 528 O GLN A 425 20.316 4.875 17.936 1.00 28.49 O ATOM 529 CB GLN A 425 19.923 4.826 14.758 1.00 29.58 C ATOM 530 CG GLN A 425 20.979 3.723 14.829 1.00 50.01 C ATOM 531 H GLN A 425 17.613 5.927 14.653 1.00 0.00 H ATOM 532 N GLN A 426 19.470 6.869 17.272 1.00 25.45 N ATOM 533 CA GLN A 426 20.102 7.631 18.347 1.00 24.91 C ATOM 534 C GLN A 426 19.318 7.599 19.669 1.00 28.47 C ATOM 535 O GLN A 426 19.819 8.096 20.692 1.00 28.74 O ATOM 536 CB GLN A 426 20.368 9.063 17.895 1.00 26.08 C ATOM 537 CG GLN A 426 21.171 9.153 16.600 1.00 35.62 C ATOM 538 CD GLN A 426 21.201 10.554 16.069 1.00 52.60 C ATOM 539 OE1 GLN A 426 21.797 11.452 16.665 1.00 54.00 O ATOM 540 NE2 GLN A 426 20.536 10.778 14.944 1.00 46.01 N ATOM 541 HE22 GLN A 426 20.044 9.996 14.467 1.00 0.00 H ATOM 542 HE21 GLN A 426 20.507 11.735 14.539 1.00 0.00 H ATOM 543 H GLN A 426 18.863 7.365 16.589 1.00 0.00 H ATOM 544 N LEU A 427 18.085 7.045 19.650 1.00 22.35 N ATOM 545 CA LEU A 427 17.196 7.027 20.810 1.00 21.86 C ATOM 546 C LEU A 427 17.158 5.719 21.525 1.00 28.31 C ATOM 547 O LEU A 427 17.069 4.680 20.885 1.00 29.85 O ATOM 548 CB LEU A 427 15.753 7.447 20.401 1.00 20.53 C ATOM 549 CG LEU A 427 15.661 8.759 19.642 1.00 23.34 C ATOM 550 CD1 LEU A 427 14.232 9.027 19.200 1.00 21.44 C ATOM 551 CD2 LEU A 427 16.284 9.930 20.454 1.00 21.57 C ATOM 552 H LEU A 427 17.752 6.610 18.766 1.00 0.00 H ATOM 553 N ASP A 428 17.190 5.771 22.861 1.00 23.78 N ATOM 554 CA ASP A 428 17.220 4.593 23.707 1.00 23.67 C ATOM 555 C ASP A 428 16.459 4.873 25.006 1.00 25.70 C ATOM 556 O ASP A 428 17.014 5.408 25.970 1.00 25.87 O ATOM 557 CB ASP A 428 18.702 4.196 23.956 1.00 26.75 C ATOM 558 CG ASP A 428 18.926 3.050 24.916 1.00 37.62 C ATOM 559 OD1 ASP A 428 18.022 2.195 25.045 1.00 36.15 O ATOM 560 OD2 ASP A 428 20.022 2.990 25.518 1.00 46.45 O ATOM 561 H ASP A 428 17.194 6.705 23.318 1.00 0.00 H ATOM 562 N ASN A 429 15.160 4.553 25.011 1.00 21.39 N ATOM 563 CA ASN A 429 14.300 4.846 26.153 1.00 19.66 C ATOM 564 C ASN A 429 13.159 3.845 26.206 1.00 19.90 C ATOM 565 O ASN A 429 12.659 3.449 25.152 1.00 19.31 O ATOM 566 CB ASN A 429 13.781 6.298 26.063 1.00 18.90 C ATOM 567 CG ASN A 429 12.932 6.714 27.245 1.00 27.91 C ATOM 568 OD1 ASN A 429 11.732 6.520 27.242 1.00 19.59 O ATOM 569 ND2 ASN A 429 13.534 7.208 28.318 1.00 21.37 N ATOM 570 HD22 ASN A 429 14.561 7.370 28.310 1.00 0.00 H ATOM 571 HD21 ASN A 429 12.979 7.433 29.168 1.00 0.00 H ATOM 572 H ASN A 429 14.752 4.083 24.178 1.00 0.00 H ATOM 573 N PRO A 430 12.723 3.386 27.398 1.00 19.10 N ATOM 574 CA PRO A 430 11.628 2.392 27.428 1.00 20.06 C ATOM 575 C PRO A 430 10.310 2.886 26.845 1.00 23.90 C ATOM 576 O PRO A 430 9.495 2.061 26.461 1.00 23.78 O ATOM 577 CB PRO A 430 11.450 2.083 28.925 1.00 23.43 C ATOM 578 CG PRO A 430 12.729 2.531 29.583 1.00 27.96 C ATOM 579 CD PRO A 430 13.188 3.712 28.765 1.00 22.22 C ATOM 580 N TYR A 431 10.113 4.218 26.749 1.00 19.37 N ATOM 581 CA TYR A 431 8.852 4.772 26.234 1.00 17.78 C ATOM 582 C TYR A 431 8.956 5.291 24.813 1.00 18.58 C ATOM 583 O TYR A 431 8.107 6.061 24.350 1.00 17.19 O ATOM 584 CB TYR A 431 8.321 5.823 27.200 1.00 17.94 C ATOM 585 CG TYR A 431 8.257 5.239 28.595 1.00 18.38 C ATOM 586 CD1 TYR A 431 7.377 4.202 28.894 1.00 19.83 C ATOM 587 CD2 TYR A 431 9.180 5.614 29.571 1.00 19.72 C ATOM 588 CE1 TYR A 431 7.348 3.617 30.159 1.00 22.07 C ATOM 589 CE2 TYR A 431 9.184 5.012 30.833 1.00 21.16 C ATOM 590 CZ TYR A 431 8.252 4.022 31.123 1.00 26.86 C ATOM 591 OH TYR A 431 8.203 3.425 32.357 1.00 28.18 O ATOM 592 HH TYR A 431 9.069 2.983 32.543 1.00 0.00 H ATOM 593 H TYR A 431 10.870 4.867 27.046 1.00 0.00 H ATOM 594 N ILE A 432 9.993 4.834 24.113 1.00 15.05 N ATOM 595 CA ILE A 432 10.198 5.186 22.718 1.00 15.28 C ATOM 596 C ILE A 432 10.355 3.884 21.918 1.00 20.55 C ATOM 597 O ILE A 432 11.116 3.007 22.334 1.00 20.07 O ATOM 598 CB ILE A 432 11.368 6.192 22.506 1.00 18.55 C ATOM 599 CG1 ILE A 432 10.965 7.599 23.073 1.00 19.17 C ATOM 600 CG2 ILE A 432 11.669 6.302 20.992 1.00 19.17 C ATOM 601 CD1 ILE A 432 12.016 8.671 23.001 1.00 26.61 C ATOM 602 H ILE A 432 10.678 4.205 24.580 1.00 0.00 H ATOM 603 N VAL A 433 9.638 3.771 20.783 1.00 17.50 N ATOM 604 CA VAL A 433 9.720 2.590 19.920 1.00 17.69 C ATOM 605 C VAL A 433 11.178 2.399 19.449 1.00 22.04 C ATOM 606 O VAL A 433 11.794 3.336 18.958 1.00 20.32 O ATOM 607 CB VAL A 433 8.733 2.657 18.725 1.00 20.07 C ATOM 608 CG1 VAL A 433 9.073 1.587 17.684 1.00 20.40 C ATOM 609 CG2 VAL A 433 7.289 2.458 19.226 1.00 18.71 C ATOM 610 H VAL A 433 9.004 4.549 20.510 1.00 0.00 H ATOM 611 N ARG A 434 11.699 1.182 19.620 1.00 19.31 N ATOM 612 CA ARG A 434 13.074 0.859 19.210 1.00 19.40 C ATOM 613 C ARG A 434 13.142 0.446 17.746 1.00 22.85 C ATOM 614 O ARG A 434 12.326 -0.347 17.284 1.00 22.90 O ATOM 615 CB ARG A 434 13.645 -0.264 20.092 1.00 24.46 C ATOM 616 CG ARG A 434 13.744 0.144 21.558 1.00 35.72 C ATOM 617 CD ARG A 434 14.483 -0.856 22.420 1.00 51.57 C ATOM 618 NE ARG A 434 14.282 -0.615 23.855 1.00 56.22 N ATOM 619 CZ ARG A 434 14.873 0.353 24.554 1.00 63.64 C ATOM 620 NH1 ARG A 434 15.679 1.224 23.949 1.00 35.70 N ATOM 621 NH2 ARG A 434 14.629 0.483 25.855 1.00 47.28 N ATOM 622 HE ARG A 434 13.630 -1.247 24.363 1.00 0.00 H ATOM 623 HH12 ARG A 434 16.138 1.978 24.500 1.00 0.00 H ATOM 624 HH11 ARG A 434 15.850 1.151 22.926 1.00 0.00 H ATOM 625 HH22 ARG A 434 15.092 1.240 26.398 1.00 0.00 H ATOM 626 HH21 ARG A 434 13.975 -0.172 26.329 1.00 0.00 H ATOM 627 H ARG A 434 11.115 0.440 20.056 1.00 0.00 H ATOM 628 N MET A 435 14.140 0.941 17.030 1.00 20.53 N ATOM 629 CA MET A 435 14.348 0.509 15.654 1.00 21.95 C ATOM 630 C MET A 435 15.287 -0.713 15.696 1.00 26.42 C ATOM 631 O MET A 435 16.327 -0.658 16.356 1.00 26.03 O ATOM 632 CB MET A 435 15.012 1.631 14.828 1.00 25.34 C ATOM 633 CG MET A 435 15.270 1.227 13.383 1.00 31.93 C ATOM 634 SD MET A 435 16.192 2.461 12.428 1.00 39.16 S ATOM 635 CE MET A 435 17.820 2.126 12.999 1.00 36.69 C ATOM 636 H MET A 435 14.780 1.643 17.453 1.00 0.00 H ATOM 637 N ILE A 436 14.956 -1.770 14.949 1.00 21.94 N ATOM 638 CA ILE A 436 15.834 -2.955 14.813 1.00 21.69 C ATOM 639 C ILE A 436 16.867 -2.644 13.725 1.00 27.42 C ATOM 640 O ILE A 436 18.067 -2.924 13.882 1.00 28.93 O ATOM 641 CB ILE A 436 15.014 -4.231 14.482 1.00 24.59 C ATOM 642 CG1 ILE A 436 13.861 -4.447 15.500 1.00 24.73 C ATOM 643 CG2 ILE A 436 15.946 -5.491 14.416 1.00 25.82 C ATOM 644 CD1 ILE A 436 14.293 -4.704 16.925 1.00 26.89 C ATOM 645 H ILE A 436 14.047 -1.760 14.444 1.00 0.00 H ATOM 646 N GLY A 437 16.387 -2.067 12.627 1.00 24.78 N ATOM 647 CA GLY A 437 17.237 -1.707 11.507 1.00 25.07 C ATOM 648 C GLY A 437 16.473 -1.439 10.239 1.00 29.29 C ATOM 649 O GLY A 437 15.248 -1.286 10.260 1.00 26.30 O ATOM 650 H GLY A 437 15.368 -1.867 12.569 1.00 0.00 H ATOM 651 N ILE A 438 17.219 -1.340 9.133 1.00 27.10 N ATOM 652 CA ILE A 438 16.667 -1.061 7.819 1.00 27.81 C ATOM 653 C ILE A 438 17.050 -2.150 6.847 1.00 32.74 C ATOM 654 O ILE A 438 18.078 -2.826 7.021 1.00 34.16 O ATOM 655 CB ILE A 438 17.037 0.369 7.289 1.00 31.15 C ATOM 656 CG1 ILE A 438 18.578 0.552 7.158 1.00 32.19 C ATOM 657 CG2 ILE A 438 16.404 1.452 8.166 1.00 30.49 C ATOM 658 CD1 ILE A 438 19.045 2.065 6.854 1.00 40.89 C ATOM 659 H ILE A 438 18.247 -1.470 9.219 1.00 0.00 H ATOM 660 N CYS A 439 16.247 -2.305 5.790 1.00 30.88 N ATOM 661 CA CYS A 439 16.500 -3.317 4.767 1.00 32.63 C ATOM 662 C CYS A 439 16.086 -2.763 3.404 1.00 34.80 C ATOM 663 O CYS A 439 15.014 -2.172 3.301 1.00 32.28 O ATOM 664 CB CYS A 439 15.740 -4.600 5.111 1.00 34.89 C ATOM 665 SG CYS A 439 16.140 -6.017 4.058 1.00 42.49 S ATOM 666 H CYS A 439 15.417 -1.686 5.693 1.00 0.00 H ATOM 667 N GLU A 440 16.930 -2.948 2.370 1.00 32.90 N ATOM 668 CA GLU A 440 16.648 -2.540 0.989 1.00 34.20 C ATOM 669 C GLU A 440 16.381 -3.787 0.144 1.00 39.67 C ATOM 670 O GLU A 440 17.306 -4.538 -0.181 1.00 40.75 O ATOM 671 CB GLU A 440 17.775 -1.667 0.394 1.00 36.28 C ATOM 672 CG GLU A 440 17.483 -1.174 -1.025 1.00 44.29 C ATOM 673 CD GLU A 440 18.560 -0.373 -1.743 1.00 67.49 C ATOM 674 OE1 GLU A 440 18.238 0.226 -2.795 1.00 66.24 O ATOM 675 OE2 GLU A 440 19.723 -0.354 -1.274 1.00 54.87 O ATOM 676 H GLU A 440 17.841 -3.410 2.563 1.00 0.00 H ATOM 677 N ALA A 441 15.099 -4.027 -0.148 1.00 37.01 N ATOM 678 CA ALA A 441 14.656 -5.150 -0.984 1.00 40.49 C ATOM 679 C ALA A 441 13.650 -4.730 -2.069 1.00 45.99 C ATOM 680 O ALA A 441 13.931 -3.842 -2.874 1.00 43.84 O ATOM 681 CB ALA A 441 14.071 -6.256 -0.117 1.00 41.45 C ATOM 682 H ALA A 441 14.377 -3.385 0.237 1.00 0.00 H ATOM 683 N GLU A 442 12.477 -5.369 -2.078 1.00 46.48 N ATOM 684 CA GLU A 442 11.386 -5.009 -3.011 1.00 48.39 C ATOM 685 C GLU A 442 11.177 -3.492 -2.953 1.00 51.35 C ATOM 686 O GLU A 442 10.948 -2.854 -3.980 1.00 51.82 O ATOM 687 CB GLU A 442 10.061 -5.722 -2.659 1.00 50.30 C ATOM 688 CG GLU A 442 10.166 -7.199 -2.310 1.00 62.66 C ATOM 689 CD GLU A 442 10.256 -7.449 -0.818 1.00 77.83 C ATOM 690 OE1 GLU A 442 11.379 -7.716 -0.335 1.00 53.07 O ATOM 691 OE2 GLU A 442 9.219 -7.338 -0.124 1.00 72.49 O ATOM 692 H GLU A 442 12.325 -6.147 -1.405 1.00 0.00 H ATOM 693 N SER A 443 11.295 -2.928 -1.730 1.00 45.48 N ATOM 694 CA SER A 443 11.245 -1.510 -1.392 1.00 43.36 C ATOM 695 C SER A 443 12.137 -1.289 -0.143 1.00 42.65 C ATOM 696 O SER A 443 12.665 -2.263 0.396 1.00 40.51 O ATOM 697 CB SER A 443 9.807 -1.084 -1.105 1.00 47.32 C ATOM 698 OG SER A 443 9.734 0.326 -0.971 1.00 57.11 O ATOM 699 HG SER A 443 8.798 0.591 -0.785 1.00 0.00 H ATOM 700 H SER A 443 11.439 -3.583 -0.935 1.00 0.00 H ATOM 701 N TRP A 444 12.333 -0.026 0.287 1.00 38.08 N ATOM 702 CA TRP A 444 13.094 0.305 1.503 1.00 36.71 C ATOM 703 C TRP A 444 12.169 0.003 2.683 1.00 34.69 C ATOM 704 O TRP A 444 10.976 0.323 2.618 1.00 33.21 O ATOM 705 CB TRP A 444 13.520 1.792 1.537 1.00 36.19 C ATOM 706 CG TRP A 444 14.856 2.062 0.907 1.00 39.36 C ATOM 707 CD1 TRP A 444 15.089 2.550 -0.347 1.00 43.88 C ATOM 708 CD2 TRP A 444 16.142 1.816 1.489 1.00 39.41 C ATOM 709 NE1 TRP A 444 16.443 2.614 -0.586 1.00 44.58 N ATOM 710 CE2 TRP A 444 17.114 2.177 0.527 1.00 45.34 C ATOM 711 CE3 TRP A 444 16.571 1.299 2.724 1.00 40.29 C ATOM 712 CZ2 TRP A 444 18.488 2.053 0.769 1.00 45.16 C ATOM 713 CZ3 TRP A 444 17.931 1.183 2.964 1.00 42.46 C ATOM 714 CH2 TRP A 444 18.873 1.558 1.996 1.00 44.22 C ATOM 715 HE1 TRP A 444 16.886 2.941 -1.468 1.00 0.00 H ATOM 716 H TRP A 444 11.926 0.753 -0.268 1.00 0.00 H ATOM 717 N MET A 445 12.704 -0.642 3.736 1.00 26.26 N ATOM 718 CA MET A 445 11.907 -1.036 4.895 1.00 24.09 C ATOM 719 C MET A 445 12.545 -0.605 6.196 1.00 25.52 C ATOM 720 O MET A 445 13.742 -0.785 6.392 1.00 26.82 O ATOM 721 CB MET A 445 11.732 -2.575 4.932 1.00 27.69 C ATOM 722 CG MET A 445 11.035 -3.161 3.724 1.00 33.70 C ATOM 723 SD MET A 445 10.961 -4.967 3.852 1.00 39.85 S ATOM 724 CE MET A 445 12.505 -5.364 3.215 1.00 38.72 C ATOM 725 H MET A 445 13.719 -0.868 3.724 1.00 0.00 H ATOM 726 N LEU A 446 11.735 -0.089 7.096 1.00 21.28 N ATOM 727 CA LEU A 446 12.145 0.362 8.410 1.00 20.95 C ATOM 728 C LEU A 446 11.531 -0.633 9.390 1.00 23.97 C ATOM 729 O LEU A 446 10.307 -0.714 9.511 1.00 23.08 O ATOM 730 CB LEU A 446 11.664 1.811 8.644 1.00 21.67 C ATOM 731 CG LEU A 446 11.764 2.362 10.078 1.00 27.82 C ATOM 732 CD1 LEU A 446 13.184 2.343 10.552 1.00 29.29 C ATOM 733 CD2 LEU A 446 11.269 3.807 10.138 1.00 31.08 C ATOM 734 H LEU A 446 10.730 0.001 6.846 1.00 0.00 H ATOM 735 N VAL A 447 12.395 -1.455 10.013 1.00 20.47 N ATOM 736 CA VAL A 447 12.004 -2.529 10.912 1.00 20.55 C ATOM 737 C VAL A 447 12.108 -2.076 12.354 1.00 20.86 C ATOM 738 O VAL A 447 13.169 -1.637 12.799 1.00 19.61 O ATOM 739 CB VAL A 447 12.859 -3.802 10.646 1.00 24.24 C ATOM 740 CG1 VAL A 447 12.480 -4.927 11.607 1.00 23.42 C ATOM 741 CG2 VAL A 447 12.715 -4.271 9.194 1.00 25.48 C ATOM 742 H VAL A 447 13.411 -1.313 9.840 1.00 0.00 H ATOM 743 N MET A 448 11.013 -2.220 13.091 1.00 18.40 N ATOM 744 CA MET A 448 10.896 -1.774 14.491 1.00 16.32 C ATOM 745 C MET A 448 10.367 -2.886 15.365 1.00 22.05 C ATOM 746 O MET A 448 9.718 -3.791 14.873 1.00 22.12 O ATOM 747 CB MET A 448 9.852 -0.645 14.570 1.00 17.06 C ATOM 748 CG MET A 448 10.251 0.609 13.826 1.00 21.03 C ATOM 749 SD MET A 448 8.846 1.739 13.694 1.00 24.11 S ATOM 750 CE MET A 448 7.921 0.999 12.319 1.00 22.22 C ATOM 751 H MET A 448 10.187 -2.676 12.653 1.00 0.00 H ATOM 752 N GLU A 449 10.519 -2.753 16.678 1.00 18.86 N ATOM 753 CA GLU A 449 9.860 -3.673 17.598 1.00 19.46 C ATOM 754 C GLU A 449 8.343 -3.449 17.421 1.00 21.30 C ATOM 755 O GLU A 449 7.897 -2.339 17.062 1.00 17.95 O ATOM 756 CB GLU A 449 10.287 -3.388 19.048 1.00 21.22 C ATOM 757 CG GLU A 449 9.939 -1.999 19.569 1.00 32.56 C ATOM 758 CD GLU A 449 10.267 -1.744 21.028 1.00 45.61 C ATOM 759 OE1 GLU A 449 10.468 -2.711 21.798 1.00 54.25 O ATOM 760 OE2 GLU A 449 10.396 -0.555 21.382 1.00 26.86 O ATOM 761 H GLU A 449 11.113 -1.986 17.053 1.00 0.00 H ATOM 762 N MET A 450 7.576 -4.506 17.574 1.00 19.89 N ATOM 763 CA MET A 450 6.134 -4.453 17.403 1.00 20.15 C ATOM 764 C MET A 450 5.413 -3.965 18.666 1.00 23.46 C ATOM 765 O MET A 450 5.692 -4.452 19.760 1.00 23.83 O ATOM 766 CB MET A 450 5.638 -5.868 16.996 1.00 23.54 C ATOM 767 CG MET A 450 4.135 -6.002 16.938 1.00 27.04 C ATOM 768 SD MET A 450 3.287 -4.927 15.757 1.00 29.83 S ATOM 769 CE MET A 450 3.532 -5.793 14.349 1.00 27.88 C ATOM 770 H MET A 450 8.018 -5.413 17.827 1.00 0.00 H ATOM 771 N ALA A 451 4.468 -3.016 18.509 1.00 19.19 N ATOM 772 CA ALA A 451 3.574 -2.599 19.607 1.00 19.54 C ATOM 773 C ALA A 451 2.241 -3.193 19.159 1.00 23.19 C ATOM 774 O ALA A 451 1.495 -2.575 18.397 1.00 23.51 O ATOM 775 CB ALA A 451 3.514 -1.074 19.698 1.00 20.18 C ATOM 776 H ALA A 451 4.365 -2.561 17.580 1.00 0.00 H ATOM 777 N GLU A 452 2.020 -4.452 19.587 1.00 23.23 N ATOM 778 CA GLU A 452 0.890 -5.317 19.228 1.00 24.61 C ATOM 779 C GLU A 452 -0.495 -4.661 19.287 1.00 28.49 C ATOM 780 O GLU A 452 -1.303 -4.876 18.374 1.00 30.34 O ATOM 781 CB GLU A 452 0.890 -6.610 20.076 1.00 26.93 C ATOM 782 CG GLU A 452 2.151 -7.459 19.937 1.00 34.05 C ATOM 783 CD GLU A 452 2.252 -8.391 18.741 1.00 42.76 C ATOM 784 OE1 GLU A 452 3.248 -9.142 18.672 1.00 31.97 O ATOM 785 OE2 GLU A 452 1.354 -8.374 17.873 1.00 31.81 O ATOM 786 H GLU A 452 2.724 -4.852 20.240 1.00 0.00 H ATOM 787 N LEU A 453 -0.792 -3.908 20.342 1.00 22.74 N ATOM 788 CA LEU A 453 -2.127 -3.291 20.522 1.00 23.66 C ATOM 789 C LEU A 453 -2.422 -2.061 19.624 1.00 26.06 C ATOM 790 O LEU A 453 -3.573 -1.636 19.540 1.00 25.79 O ATOM 791 CB LEU A 453 -2.374 -2.964 21.994 1.00 24.16 C ATOM 792 CG LEU A 453 -2.863 -4.105 22.902 1.00 31.47 C ATOM 793 CD1 LEU A 453 -1.850 -5.226 23.016 1.00 32.57 C ATOM 794 CD2 LEU A 453 -3.149 -3.590 24.284 1.00 32.33 C ATOM 795 H LEU A 453 -0.062 -3.747 21.065 1.00 0.00 H ATOM 796 N GLY A 454 -1.408 -1.546 18.940 1.00 21.84 N ATOM 797 CA GLY A 454 -1.576 -0.495 17.950 1.00 20.93 C ATOM 798 C GLY A 454 -1.742 0.921 18.463 1.00 20.07 C ATOM 799 O GLY A 454 -1.497 1.184 19.648 1.00 18.17 O ATOM 800 H GLY A 454 -0.451 -1.911 19.120 1.00 0.00 H ATOM 801 N PRO A 455 -2.180 1.844 17.574 1.00 19.34 N ATOM 802 CA PRO A 455 -2.293 3.273 17.984 1.00 18.48 C ATOM 803 C PRO A 455 -3.309 3.540 19.086 1.00 21.65 C ATOM 804 O PRO A 455 -4.362 2.877 19.180 1.00 20.13 O ATOM 805 CB PRO A 455 -2.621 4.033 16.700 1.00 20.21 C ATOM 806 CG PRO A 455 -2.800 3.019 15.653 1.00 27.09 C ATOM 807 CD PRO A 455 -2.506 1.649 16.149 1.00 22.44 C ATOM 808 N LEU A 456 -2.921 4.450 19.978 1.00 18.02 N ATOM 809 CA LEU A 456 -3.670 4.796 21.184 1.00 18.06 C ATOM 810 C LEU A 456 -5.066 5.344 20.860 1.00 21.56 C ATOM 811 O LEU A 456 -6.009 5.007 21.577 1.00 22.16 O ATOM 812 CB LEU A 456 -2.874 5.833 22.016 1.00 17.14 C ATOM 813 CG LEU A 456 -3.541 6.388 23.320 1.00 20.60 C ATOM 814 CD1 LEU A 456 -3.776 5.270 24.342 1.00 20.49 C ATOM 815 CD2 LEU A 456 -2.698 7.506 23.915 1.00 20.81 C ATOM 816 H LEU A 456 -2.025 4.948 19.804 1.00 0.00 H ATOM 817 N ASN A 457 -5.199 6.180 19.802 1.00 17.47 N ATOM 818 CA ASN A 457 -6.508 6.757 19.460 1.00 17.50 C ATOM 819 C ASN A 457 -7.466 5.647 19.045 1.00 22.11 C ATOM 820 O ASN A 457 -8.573 5.601 19.576 1.00 22.31 O ATOM 821 CB ASN A 457 -6.421 7.864 18.405 1.00 17.19 C ATOM 822 CG ASN A 457 -5.892 7.457 17.060 1.00 21.84 C ATOM 823 OD1 ASN A 457 -5.083 6.543 16.933 1.00 21.89 O ATOM 824 ND2 ASN A 457 -6.257 8.204 16.037 1.00 21.75 N ATOM 825 HD22 ASN A 457 -6.945 8.972 16.173 1.00 0.00 H ATOM 826 HD21 ASN A 457 -5.857 8.025 15.094 1.00 0.00 H ATOM 827 H ASN A 457 -4.366 6.416 19.225 1.00 0.00 H ATOM 828 N LYS A 458 -7.012 4.710 18.174 1.00 20.45 N ATOM 829 CA LYS A 458 -7.858 3.584 17.728 1.00 21.36 C ATOM 830 C LYS A 458 -8.184 2.657 18.896 1.00 25.13 C ATOM 831 O LYS A 458 -9.323 2.169 19.002 1.00 24.71 O ATOM 832 CB LYS A 458 -7.206 2.802 16.566 1.00 25.08 C ATOM 833 CG LYS A 458 -7.016 3.650 15.312 1.00 42.26 C ATOM 834 CD LYS A 458 -6.588 2.808 14.124 1.00 57.60 C ATOM 835 H LYS A 458 -6.041 4.787 17.810 1.00 0.00 H ATOM 836 N TYR A 459 -7.198 2.418 19.783 1.00 22.10 N ATOM 837 CA TYR A 459 -7.413 1.546 20.947 1.00 22.18 C ATOM 838 C TYR A 459 -8.531 2.072 21.872 1.00 22.25 C ATOM 839 O TYR A 459 -9.408 1.315 22.263 1.00 22.98 O ATOM 840 CB TYR A 459 -6.123 1.327 21.760 1.00 22.35 C ATOM 841 CG TYR A 459 -6.286 0.230 22.797 1.00 24.52 C ATOM 842 CD1 TYR A 459 -6.073 -1.106 22.466 1.00 27.48 C ATOM 843 CD2 TYR A 459 -6.641 0.528 24.112 1.00 25.78 C ATOM 844 CE1 TYR A 459 -6.255 -2.121 23.403 1.00 29.65 C ATOM 845 CE2 TYR A 459 -6.828 -0.483 25.059 1.00 27.88 C ATOM 846 CZ TYR A 459 -6.604 -1.803 24.704 1.00 37.27 C ATOM 847 OH TYR A 459 -6.763 -2.810 25.621 1.00 40.84 O ATOM 848 HH TYR A 459 -6.561 -3.680 25.193 1.00 0.00 H ATOM 849 H TYR A 459 -6.267 2.859 19.641 1.00 0.00 H ATOM 850 N LEU A 460 -8.488 3.360 22.199 1.00 20.32 N ATOM 851 CA LEU A 460 -9.462 3.998 23.089 1.00 19.02 C ATOM 852 C LEU A 460 -10.835 4.106 22.440 1.00 24.02 C ATOM 853 O LEU A 460 -11.833 3.983 23.152 1.00 25.01 O ATOM 854 CB LEU A 460 -8.917 5.386 23.542 1.00 17.33 C ATOM 855 CG LEU A 460 -7.683 5.339 24.482 1.00 21.13 C ATOM 856 CD1 LEU A 460 -7.116 6.736 24.732 1.00 20.10 C ATOM 857 CD2 LEU A 460 -7.993 4.648 25.836 1.00 24.42 C ATOM 858 H LEU A 460 -7.724 3.944 21.803 1.00 0.00 H ATOM 859 N GLN A 461 -10.906 4.283 21.085 1.00 20.69 N ATOM 860 CA GLN A 461 -12.199 4.309 20.377 1.00 21.34 C ATOM 861 C GLN A 461 -12.876 2.923 20.522 1.00 27.26 C ATOM 862 O GLN A 461 -14.101 2.854 20.650 1.00 26.43 O ATOM 863 CB GLN A 461 -12.017 4.592 18.873 1.00 22.24 C ATOM 864 CG GLN A 461 -11.627 6.026 18.505 1.00 27.57 C ATOM 865 CD GLN A 461 -10.934 6.091 17.154 1.00 41.82 C ATOM 866 OE1 GLN A 461 -10.874 5.108 16.398 1.00 37.32 O ATOM 867 NE2 GLN A 461 -10.346 7.238 16.840 1.00 34.99 N ATOM 868 HE22 GLN A 461 -10.409 8.049 17.488 1.00 0.00 H ATOM 869 HE21 GLN A 461 -9.822 7.326 15.946 1.00 0.00 H ATOM 870 H GLN A 461 -10.027 4.402 20.542 1.00 0.00 H ATOM 871 N GLN A 462 -12.070 1.824 20.529 1.00 24.85 N ATOM 872 CA GLN A 462 -12.567 0.441 20.622 1.00 26.32 C ATOM 873 C GLN A 462 -12.706 -0.078 22.058 1.00 31.79 C ATOM 874 O GLN A 462 -13.262 -1.162 22.247 1.00 33.14 O ATOM 875 CB GLN A 462 -11.639 -0.521 19.846 1.00 27.91 C ATOM 876 CG GLN A 462 -11.564 -0.264 18.334 1.00 42.30 C ATOM 877 H GLN A 462 -11.042 1.971 20.465 1.00 0.00 H ATOM 878 N ASN A 463 -12.147 0.632 23.058 1.00 26.56 N ATOM 879 CA ASN A 463 -12.175 0.163 24.456 1.00 26.20 C ATOM 880 C ASN A 463 -12.561 1.331 25.329 1.00 30.39 C ATOM 881 O ASN A 463 -11.722 1.908 26.038 1.00 29.09 O ATOM 882 CB ASN A 463 -10.801 -0.418 24.858 1.00 25.40 C ATOM 883 CG ASN A 463 -10.401 -1.631 24.068 1.00 36.89 C ATOM 884 OD1 ASN A 463 -10.782 -2.744 24.399 1.00 31.68 O ATOM 885 ND2 ASN A 463 -9.691 -1.434 22.972 1.00 26.46 N ATOM 886 HD22 ASN A 463 -9.382 -0.474 22.718 1.00 0.00 H ATOM 887 HD21 ASN A 463 -9.441 -2.239 22.363 1.00 0.00 H ATOM 888 H ASN A 463 -11.683 1.536 22.838 1.00 0.00 H ATOM 889 N ARG A 464 -13.837 1.735 25.212 1.00 28.63 N ATOM 890 CA ARG A 464 -14.382 2.944 25.842 1.00 30.50 C ATOM 891 C ARG A 464 -14.516 2.844 27.362 1.00 37.56 C ATOM 892 O ARG A 464 -14.935 3.812 27.990 1.00 38.69 O ATOM 893 CB ARG A 464 -15.724 3.335 25.184 1.00 34.14 C ATOM 894 CG ARG A 464 -15.596 3.694 23.700 1.00 43.80 C ATOM 895 H ARG A 464 -14.480 1.154 24.638 1.00 0.00 H ATOM 896 N HIS A 465 -14.125 1.704 27.939 1.00 36.60 N ATOM 897 CA HIS A 465 -14.191 1.434 29.373 1.00 38.88 C ATOM 898 C HIS A 465 -12.812 1.442 30.062 1.00 36.87 C ATOM 899 O HIS A 465 -12.731 1.177 31.266 1.00 36.17 O ATOM 900 CB HIS A 465 -14.972 0.135 29.660 1.00 43.10 C ATOM 901 CG HIS A 465 -16.367 0.145 29.114 1.00 49.26 C ATOM 902 ND1 HIS A 465 -17.174 1.279 29.194 1.00 51.88 N ATOM 903 CD2 HIS A 465 -17.066 -0.844 28.511 1.00 53.42 C ATOM 904 CE1 HIS A 465 -18.319 0.947 28.619 1.00 52.96 C ATOM 905 NE2 HIS A 465 -18.307 -0.323 28.201 1.00 54.13 N ATOM 906 H HIS A 465 -13.747 0.956 27.323 1.00 0.00 H ATOM 907 N VAL A 466 -11.743 1.836 29.332 1.00 28.43 N ATOM 908 CA VAL A 466 -10.409 2.003 29.934 1.00 26.23 C ATOM 909 C VAL A 466 -10.608 3.059 31.033 1.00 27.38 C ATOM 910 O VAL A 466 -11.312 4.032 30.781 1.00 28.21 O ATOM 911 CB VAL A 466 -9.354 2.421 28.868 1.00 27.98 C ATOM 912 CG1 VAL A 466 -8.065 2.888 29.527 1.00 26.75 C ATOM 913 CG2 VAL A 466 -9.069 1.258 27.903 1.00 28.14 C ATOM 914 H VAL A 466 -11.867 2.026 28.317 1.00 0.00 H ATOM 915 N THR A 467 -10.107 2.835 32.257 1.00 23.18 N ATOM 916 CA THR A 467 -10.382 3.768 33.372 1.00 23.76 C ATOM 917 C THR A 467 -9.599 5.067 33.253 1.00 26.65 C ATOM 918 O THR A 467 -8.590 5.093 32.556 1.00 23.17 O ATOM 919 CB THR A 467 -10.046 3.134 34.741 1.00 28.72 C ATOM 920 OG1 THR A 467 -8.635 2.879 34.793 1.00 26.59 O ATOM 921 CG2 THR A 467 -10.865 1.866 35.053 1.00 28.32 C ATOM 922 HG1 THR A 467 -8.406 2.472 35.666 1.00 0.00 H ATOM 923 H THR A 467 -9.518 1.995 32.424 1.00 0.00 H ATOM 924 N ASP A 468 -10.001 6.111 34.012 1.00 25.27 N ATOM 925 CA ASP A 468 -9.251 7.376 34.023 1.00 25.03 C ATOM 926 C ASP A 468 -7.831 7.137 34.566 1.00 27.56 C ATOM 927 O ASP A 468 -6.882 7.707 34.037 1.00 25.89 O ATOM 928 CB ASP A 468 -9.998 8.504 34.802 1.00 27.94 C ATOM 929 CG ASP A 468 -10.424 8.155 36.226 1.00 46.50 C ATOM 930 OD1 ASP A 468 -10.120 7.027 36.685 1.00 48.43 O ATOM 931 OD2 ASP A 468 -11.101 8.995 36.868 1.00 53.89 O ATOM 932 H ASP A 468 -10.855 6.018 34.598 1.00 0.00 H ATOM 933 N LYS A 469 -7.686 6.219 35.555 1.00 26.43 N ATOM 934 CA LYS A 469 -6.395 5.862 36.152 1.00 26.79 C ATOM 935 C LYS A 469 -5.461 5.289 35.083 1.00 27.07 C ATOM 936 O LYS A 469 -4.286 5.645 35.026 1.00 23.80 O ATOM 937 CB LYS A 469 -6.598 4.857 37.298 1.00 31.56 C ATOM 938 CG LYS A 469 -5.313 4.403 38.009 1.00 38.68 C ATOM 939 CD LYS A 469 -5.638 3.289 39.021 1.00 44.46 C ATOM 940 CE LYS A 469 -4.430 2.675 39.683 1.00 54.97 C ATOM 941 NZ LYS A 469 -3.611 1.876 38.732 1.00 65.85 N ATOM 942 HZ1 LYS A 469 -4.190 1.107 38.339 1.00 0.00 H ATOM 943 HZ2 LYS A 469 -3.280 2.490 37.961 1.00 0.00 H ATOM 944 HZ3 LYS A 469 -2.793 1.475 39.233 1.00 0.00 H ATOM 945 H LYS A 469 -8.539 5.741 35.910 1.00 0.00 H ATOM 946 N ASN A 470 -5.993 4.390 34.246 1.00 23.29 N ATOM 947 CA ASN A 470 -5.231 3.753 33.181 1.00 20.82 C ATOM 948 C ASN A 470 -4.818 4.773 32.106 1.00 21.13 C ATOM 949 O ASN A 470 -3.705 4.688 31.584 1.00 17.40 O ATOM 950 CB ASN A 470 -6.056 2.612 32.600 1.00 19.97 C ATOM 951 CG ASN A 470 -5.324 1.679 31.659 1.00 33.74 C ATOM 952 OD1 ASN A 470 -4.206 1.926 31.167 1.00 27.71 O ATOM 953 ND2 ASN A 470 -5.982 0.599 31.347 1.00 22.45 N ATOM 954 HD22 ASN A 470 -6.914 0.417 31.772 1.00 0.00 H ATOM 955 HD21 ASN A 470 -5.576 -0.081 30.673 1.00 0.00 H ATOM 956 H ASN A 470 -6.995 4.135 34.361 1.00 0.00 H ATOM 957 N ILE A 471 -5.676 5.759 31.807 1.00 17.48 N ATOM 958 CA ILE A 471 -5.322 6.785 30.809 1.00 15.52 C ATOM 959 C ILE A 471 -4.199 7.657 31.360 1.00 18.62 C ATOM 960 O ILE A 471 -3.274 7.970 30.627 1.00 17.81 O ATOM 961 CB ILE A 471 -6.564 7.614 30.396 1.00 17.74 C ATOM 962 CG1 ILE A 471 -7.563 6.723 29.614 1.00 18.03 C ATOM 963 CG2 ILE A 471 -6.127 8.830 29.565 1.00 17.84 C ATOM 964 CD1 ILE A 471 -8.956 7.322 29.494 1.00 24.38 C ATOM 965 H ILE A 471 -6.600 5.800 32.283 1.00 0.00 H ATOM 966 N ILE A 472 -4.255 8.012 32.660 1.00 16.95 N ATOM 967 CA ILE A 472 -3.214 8.847 33.287 1.00 16.78 C ATOM 968 C ILE A 472 -1.893 8.093 33.236 1.00 18.91 C ATOM 969 O ILE A 472 -0.855 8.697 32.966 1.00 19.49 O ATOM 970 CB ILE A 472 -3.598 9.245 34.750 1.00 20.73 C ATOM 971 CG1 ILE A 472 -4.847 10.176 34.753 1.00 20.42 C ATOM 972 CG2 ILE A 472 -2.397 9.934 35.485 1.00 21.21 C ATOM 973 CD1 ILE A 472 -5.685 10.144 36.105 1.00 26.71 C ATOM 974 H ILE A 472 -5.057 7.687 33.238 1.00 0.00 H ATOM 975 N GLU A 473 -1.920 6.774 33.524 1.00 16.13 N ATOM 976 CA GLU A 473 -0.706 5.944 33.469 1.00 15.69 C ATOM 977 C GLU A 473 -0.052 6.014 32.088 1.00 19.59 C ATOM 978 O GLU A 473 1.163 6.211 31.999 1.00 19.87 O ATOM 979 CB GLU A 473 -1.095 4.483 33.797 1.00 17.43 C ATOM 980 CG GLU A 473 0.051 3.487 33.630 1.00 24.62 C ATOM 981 CD GLU A 473 -0.446 2.065 33.784 1.00 36.86 C ATOM 982 OE1 GLU A 473 -1.629 1.811 33.465 1.00 31.95 O ATOM 983 OE2 GLU A 473 0.341 1.208 34.239 1.00 32.98 O ATOM 984 H GLU A 473 -2.823 6.333 33.792 1.00 0.00 H ATOM 985 N LEU A 474 -0.850 5.893 31.017 1.00 15.72 N ATOM 986 CA LEU A 474 -0.332 5.908 29.637 1.00 15.09 C ATOM 987 C LEU A 474 0.193 7.259 29.202 1.00 18.15 C ATOM 988 O LEU A 474 1.264 7.333 28.583 1.00 16.25 O ATOM 989 CB LEU A 474 -1.405 5.414 28.674 1.00 15.42 C ATOM 990 CG LEU A 474 -1.879 3.951 28.875 1.00 20.15 C ATOM 991 CD1 LEU A 474 -3.164 3.672 28.029 1.00 21.25 C ATOM 992 CD2 LEU A 474 -0.733 2.923 28.538 1.00 19.38 C ATOM 993 H LEU A 474 -1.874 5.784 31.166 1.00 0.00 H ATOM 994 N VAL A 475 -0.567 8.341 29.521 1.00 15.23 N ATOM 995 CA VAL A 475 -0.103 9.681 29.140 1.00 14.15 C ATOM 996 C VAL A 475 1.117 10.060 29.954 1.00 18.10 C ATOM 997 O VAL A 475 1.985 10.751 29.435 1.00 15.89 O ATOM 998 CB VAL A 475 -1.178 10.797 29.120 1.00 15.89 C ATOM 999 CG1 VAL A 475 -2.249 10.503 28.079 1.00 15.28 C ATOM 1000 CG2 VAL A 475 -1.791 11.020 30.494 1.00 15.50 C ATOM 1001 H VAL A 475 -1.466 8.221 30.029 1.00 0.00 H ATOM 1002 N HIS A 476 1.225 9.586 31.222 1.00 16.17 N ATOM 1003 CA HIS A 476 2.438 9.846 31.997 1.00 16.66 C ATOM 1004 C HIS A 476 3.632 9.105 31.318 1.00 20.39 C ATOM 1005 O HIS A 476 4.725 9.651 31.275 1.00 19.03 O ATOM 1006 CB HIS A 476 2.284 9.404 33.477 1.00 18.60 C ATOM 1007 CG HIS A 476 3.561 9.498 34.240 1.00 23.15 C ATOM 1008 ND1 HIS A 476 4.088 8.404 34.892 1.00 26.22 N ATOM 1009 CD2 HIS A 476 4.405 10.545 34.385 1.00 25.32 C ATOM 1010 CE1 HIS A 476 5.227 8.814 35.423 1.00 26.57 C ATOM 1011 NE2 HIS A 476 5.461 10.094 35.146 1.00 26.41 N ATOM 1012 H HIS A 476 0.446 9.039 31.641 1.00 0.00 H ATOM 1013 N GLN A 477 3.429 7.890 30.779 1.00 19.46 N ATOM 1014 CA GLN A 477 4.523 7.174 30.086 1.00 18.43 C ATOM 1015 C GLN A 477 4.974 7.952 28.853 1.00 19.63 C ATOM 1016 O GLN A 477 6.175 8.090 28.610 1.00 17.42 O ATOM 1017 CB GLN A 477 4.110 5.749 29.692 1.00 19.92 C ATOM 1018 CG GLN A 477 3.943 4.852 30.951 1.00 22.14 C ATOM 1019 CD GLN A 477 3.255 3.546 30.652 1.00 28.55 C ATOM 1020 OE1 GLN A 477 2.710 3.319 29.565 1.00 20.25 O ATOM 1021 NE2 GLN A 477 3.196 2.697 31.646 1.00 21.86 N ATOM 1022 HE22 GLN A 477 3.665 2.918 32.547 1.00 0.00 H ATOM 1023 HE21 GLN A 477 2.680 1.801 31.535 1.00 0.00 H ATOM 1024 H GLN A 477 2.491 7.448 30.850 1.00 0.00 H ATOM 1025 N VAL A 478 4.018 8.550 28.137 1.00 16.33 N ATOM 1026 CA VAL A 478 4.370 9.377 26.979 1.00 14.51 C ATOM 1027 C VAL A 478 5.182 10.600 27.482 1.00 16.62 C ATOM 1028 O VAL A 478 6.177 10.947 26.857 1.00 16.45 O ATOM 1029 CB VAL A 478 3.097 9.806 26.211 1.00 16.84 C ATOM 1030 CG1 VAL A 478 3.436 10.783 25.072 1.00 15.53 C ATOM 1031 CG2 VAL A 478 2.372 8.581 25.675 1.00 16.73 C ATOM 1032 H VAL A 478 3.020 8.428 28.402 1.00 0.00 H ATOM 1033 N SER A 479 4.783 11.218 28.630 1.00 16.66 N ATOM 1034 CA SER A 479 5.520 12.386 29.159 1.00 16.52 C ATOM 1035 C SER A 479 6.951 11.982 29.544 1.00 19.74 C ATOM 1036 O SER A 479 7.855 12.800 29.416 1.00 19.80 O ATOM 1037 CB SER A 479 4.795 13.054 30.325 1.00 19.12 C ATOM 1038 OG SER A 479 4.889 12.316 31.533 1.00 18.93 O ATOM 1039 HG SER A 479 4.488 11.420 31.403 1.00 0.00 H ATOM 1040 H SER A 479 3.949 10.863 29.140 1.00 0.00 H ATOM 1041 N MET A 480 7.164 10.727 29.985 1.00 15.42 N ATOM 1042 CA MET A 480 8.520 10.234 30.326 1.00 15.77 C ATOM 1043 C MET A 480 9.375 10.092 29.057 1.00 20.48 C ATOM 1044 O MET A 480 10.519 10.562 29.007 1.00 20.17 O ATOM 1045 CB MET A 480 8.476 8.919 31.128 1.00 17.90 C ATOM 1046 CG MET A 480 7.973 9.120 32.550 1.00 21.57 C ATOM 1047 SD MET A 480 8.132 7.643 33.568 1.00 26.85 S ATOM 1048 CE MET A 480 6.916 6.652 32.913 1.00 22.46 C ATOM 1049 H MET A 480 6.353 10.085 30.089 1.00 0.00 H ATOM 1050 N GLY A 481 8.796 9.492 28.026 1.00 18.88 N ATOM 1051 CA GLY A 481 9.445 9.393 26.722 1.00 17.86 C ATOM 1052 C GLY A 481 9.797 10.767 26.172 1.00 19.69 C ATOM 1053 O GLY A 481 10.922 10.994 25.706 1.00 19.05 O ATOM 1054 H GLY A 481 7.850 9.079 28.150 1.00 0.00 H ATOM 1055 N MET A 482 8.853 11.722 26.270 1.00 14.59 N ATOM 1056 CA MET A 482 9.097 13.095 25.787 1.00 14.38 C ATOM 1057 C MET A 482 10.108 13.874 26.622 1.00 18.01 C ATOM 1058 O MET A 482 10.892 14.642 26.056 1.00 17.44 O ATOM 1059 CB MET A 482 7.782 13.872 25.653 1.00 14.91 C ATOM 1060 CG MET A 482 6.886 13.404 24.518 1.00 15.92 C ATOM 1061 SD MET A 482 7.688 13.295 22.880 1.00 17.73 S ATOM 1062 CE MET A 482 8.249 14.978 22.604 1.00 14.15 C ATOM 1063 H MET A 482 7.933 11.487 26.695 1.00 0.00 H ATOM 1064 N LYS A 483 10.116 13.681 27.969 1.00 15.59 N ATOM 1065 CA LYS A 483 11.121 14.316 28.829 1.00 15.96 C ATOM 1066 C LYS A 483 12.538 13.859 28.337 1.00 20.33 C ATOM 1067 O LYS A 483 13.476 14.654 28.241 1.00 19.63 O ATOM 1068 CB LYS A 483 10.894 13.904 30.298 1.00 19.43 C ATOM 1069 CG LYS A 483 11.954 14.433 31.276 1.00 21.96 C ATOM 1070 CD LYS A 483 11.681 13.958 32.714 1.00 25.56 C ATOM 1071 CE LYS A 483 12.747 14.478 33.655 1.00 34.36 C ATOM 1072 NZ LYS A 483 12.524 13.991 35.034 1.00 43.17 N ATOM 1073 HZ1 LYS A 483 11.595 14.317 35.370 1.00 0.00 H ATOM 1074 HZ2 LYS A 483 12.551 12.951 35.042 1.00 0.00 H ATOM 1075 HZ3 LYS A 483 13.269 14.363 35.657 1.00 0.00 H ATOM 1076 H LYS A 483 9.393 13.069 28.399 1.00 0.00 H ATOM 1077 N TYR A 484 12.657 12.570 27.986 1.00 16.69 N ATOM 1078 CA TYR A 484 13.896 11.996 27.481 1.00 17.78 C ATOM 1079 C TYR A 484 14.232 12.602 26.098 1.00 20.29 C ATOM 1080 O TYR A 484 15.400 12.927 25.856 1.00 18.57 O ATOM 1081 CB TYR A 484 13.810 10.447 27.425 1.00 19.19 C ATOM 1082 CG TYR A 484 14.896 9.827 26.565 1.00 20.48 C ATOM 1083 CD1 TYR A 484 16.152 9.539 27.093 1.00 24.17 C ATOM 1084 CD2 TYR A 484 14.701 9.627 25.199 1.00 19.66 C ATOM 1085 CE1 TYR A 484 17.175 9.026 26.290 1.00 25.26 C ATOM 1086 CE2 TYR A 484 15.712 9.102 24.392 1.00 20.68 C ATOM 1087 CZ TYR A 484 16.953 8.825 24.936 1.00 24.40 C ATOM 1088 OH TYR A 484 17.930 8.268 24.139 1.00 24.43 O ATOM 1089 HH TYR A 484 18.752 8.132 24.673 1.00 0.00 H ATOM 1090 H TYR A 484 11.826 11.952 28.079 1.00 0.00 H ATOM 1091 N LEU A 485 13.223 12.758 25.206 1.00 16.79 N ATOM 1092 CA LEU A 485 13.458 13.344 23.878 1.00 17.65 C ATOM 1093 C LEU A 485 13.942 14.792 24.022 1.00 21.10 C ATOM 1094 O LEU A 485 14.896 15.208 23.352 1.00 21.61 O ATOM 1095 CB LEU A 485 12.182 13.280 23.023 1.00 18.16 C ATOM 1096 CG LEU A 485 12.418 13.295 21.514 1.00 23.92 C ATOM 1097 CD1 LEU A 485 13.041 11.968 21.048 1.00 23.85 C ATOM 1098 CD2 LEU A 485 11.116 13.576 20.758 1.00 25.00 C ATOM 1099 H LEU A 485 12.262 12.457 25.467 1.00 0.00 H ATOM 1100 N GLU A 486 13.320 15.550 24.945 1.00 18.40 N ATOM 1101 CA GLU A 486 13.703 16.946 25.194 1.00 19.16 C ATOM 1102 C GLU A 486 15.153 17.025 25.714 1.00 25.08 C ATOM 1103 O GLU A 486 15.937 17.879 25.274 1.00 23.33 O ATOM 1104 CB GLU A 486 12.724 17.540 26.219 1.00 20.85 C ATOM 1105 CG GLU A 486 13.087 18.927 26.721 1.00 26.13 C ATOM 1106 CD GLU A 486 12.007 19.410 27.662 1.00 41.97 C ATOM 1107 OE1 GLU A 486 12.076 19.071 28.865 1.00 37.06 O ATOM 1108 OE2 GLU A 486 11.003 19.959 27.159 1.00 29.47 O ATOM 1109 H GLU A 486 12.544 15.134 25.499 1.00 0.00 H ATOM 1110 N GLU A 487 15.500 16.131 26.662 1.00 22.90 N ATOM 1111 CA GLU A 487 16.854 16.047 27.218 1.00 23.91 C ATOM 1112 C GLU A 487 17.848 15.700 26.093 1.00 27.47 C ATOM 1113 O GLU A 487 19.004 16.115 26.160 1.00 27.63 O ATOM 1114 CB GLU A 487 16.924 14.955 28.289 1.00 25.53 C ATOM 1115 CG GLU A 487 16.361 15.357 29.645 1.00 33.35 C ATOM 1116 CD GLU A 487 16.085 14.205 30.597 1.00 48.44 C ATOM 1117 OE1 GLU A 487 15.725 14.468 31.768 1.00 44.56 O ATOM 1118 OE2 GLU A 487 16.210 13.036 30.170 1.00 34.22 O ATOM 1119 H GLU A 487 14.776 15.473 27.014 1.00 0.00 H ATOM 1120 N SER A 488 17.402 14.931 25.086 1.00 23.51 N ATOM 1121 CA SER A 488 18.240 14.497 23.951 1.00 23.18 C ATOM 1122 C SER A 488 18.316 15.540 22.831 1.00 23.53 C ATOM 1123 O SER A 488 19.024 15.338 21.845 1.00 22.33 O ATOM 1124 CB SER A 488 17.766 13.150 23.405 1.00 24.32 C ATOM 1125 OG SER A 488 17.807 12.143 24.407 1.00 26.77 O ATOM 1126 HG SER A 488 17.218 12.403 25.159 1.00 0.00 H ATOM 1127 H SER A 488 16.409 14.624 25.107 1.00 0.00 H ATOM 1128 N ASN A 489 17.567 16.645 22.976 1.00 20.14 N ATOM 1129 CA ASN A 489 17.504 17.739 22.016 1.00 18.89 C ATOM 1130 C ASN A 489 17.004 17.295 20.630 1.00 22.30 C ATOM 1131 O ASN A 489 17.520 17.732 19.598 1.00 21.94 O ATOM 1132 CB ASN A 489 18.829 18.532 21.951 1.00 23.81 C ATOM 1133 CG ASN A 489 19.037 19.334 23.208 1.00 36.52 C ATOM 1134 OD1 ASN A 489 20.014 19.164 23.918 1.00 35.47 O ATOM 1135 ND2 ASN A 489 18.045 20.107 23.589 1.00 33.39 N ATOM 1136 HD22 ASN A 489 17.221 20.239 22.969 1.00 0.00 H ATOM 1137 HD21 ASN A 489 18.084 20.587 24.511 1.00 0.00 H ATOM 1138 H ASN A 489 16.989 16.726 23.837 1.00 0.00 H ATOM 1139 N PHE A 490 15.955 16.442 20.628 1.00 17.46 N ATOM 1140 CA PHE A 490 15.233 16.082 19.428 1.00 15.83 C ATOM 1141 C PHE A 490 13.833 16.685 19.561 1.00 20.13 C ATOM 1142 O PHE A 490 13.273 16.690 20.657 1.00 20.91 O ATOM 1143 CB PHE A 490 15.082 14.568 19.309 1.00 16.41 C ATOM 1144 CG PHE A 490 16.341 13.911 18.806 1.00 17.75 C ATOM 1145 CD1 PHE A 490 17.311 13.481 19.688 1.00 21.90 C ATOM 1146 CD2 PHE A 490 16.554 13.732 17.441 1.00 19.98 C ATOM 1147 CE1 PHE A 490 18.469 12.847 19.223 1.00 23.14 C ATOM 1148 CE2 PHE A 490 17.721 13.118 16.976 1.00 22.28 C ATOM 1149 CZ PHE A 490 18.678 12.710 17.866 1.00 21.58 C ATOM 1150 H PHE A 490 15.653 16.025 21.532 1.00 0.00 H ATOM 1151 N VAL A 491 13.269 17.137 18.456 1.00 15.64 N ATOM 1152 CA VAL A 491 11.865 17.609 18.418 1.00 15.95 C ATOM 1153 C VAL A 491 11.076 16.586 17.599 1.00 19.53 C ATOM 1154 O VAL A 491 11.553 16.154 16.539 1.00 19.40 O ATOM 1155 CB VAL A 491 11.678 19.073 17.926 1.00 18.94 C ATOM 1156 CG1 VAL A 491 12.356 20.044 18.895 1.00 19.35 C ATOM 1157 CG2 VAL A 491 12.245 19.270 16.506 1.00 19.39 C ATOM 1158 H VAL A 491 13.830 17.163 17.581 1.00 0.00 H ATOM 1159 N HIS A 492 9.925 16.124 18.124 1.00 14.48 N ATOM 1160 CA HIS A 492 9.125 15.074 17.466 1.00 13.49 C ATOM 1161 C HIS A 492 8.380 15.615 16.236 1.00 17.32 C ATOM 1162 O HIS A 492 8.505 15.057 15.144 1.00 15.92 O ATOM 1163 CB HIS A 492 8.169 14.426 18.464 1.00 13.50 C ATOM 1164 CG HIS A 492 7.516 13.200 17.931 1.00 15.92 C ATOM 1165 ND1 HIS A 492 6.456 13.277 17.053 1.00 17.42 N ATOM 1166 CD2 HIS A 492 7.843 11.900 18.110 1.00 16.98 C ATOM 1167 CE1 HIS A 492 6.141 12.020 16.769 1.00 16.74 C ATOM 1168 NE2 HIS A 492 6.922 11.164 17.415 1.00 16.84 N ATOM 1169 H HIS A 492 9.589 16.521 19.024 1.00 0.00 H ATOM 1170 N ARG A 493 7.638 16.683 16.422 1.00 15.58 N ATOM 1171 CA ARG A 493 6.898 17.364 15.398 1.00 15.20 C ATOM 1172 C ARG A 493 5.651 16.676 14.872 1.00 18.44 C ATOM 1173 O ARG A 493 5.052 17.159 13.986 1.00 19.03 O ATOM 1174 CB ARG A 493 7.781 17.802 14.238 1.00 14.11 C ATOM 1175 CG ARG A 493 8.824 18.821 14.640 1.00 20.29 C ATOM 1176 CD ARG A 493 9.701 19.231 13.485 1.00 22.12 C ATOM 1177 NE ARG A 493 8.989 20.092 12.590 1.00 25.49 N ATOM 1178 CZ ARG A 493 8.857 19.888 11.293 1.00 36.34 C ATOM 1179 NH1 ARG A 493 9.408 18.860 10.708 1.00 19.84 N ATOM 1180 NH2 ARG A 493 8.190 20.751 10.579 1.00 25.27 N ATOM 1181 HE ARG A 493 8.543 20.941 12.992 1.00 0.00 H ATOM 1182 HH12 ARG A 493 9.290 18.720 9.684 1.00 0.00 H ATOM 1183 HH11 ARG A 493 9.965 18.181 11.265 1.00 0.00 H ATOM 1184 HH22 ARG A 493 8.078 20.603 9.556 1.00 0.00 H ATOM 1185 HH21 ARG A 493 7.770 21.587 11.033 1.00 0.00 H ATOM 1186 H ARG A 493 7.582 17.065 17.388 1.00 0.00 H ATOM 1187 N ASP A 494 5.289 15.563 15.454 1.00 14.68 N ATOM 1188 CA ASP A 494 4.074 14.876 15.055 1.00 14.45 C ATOM 1189 C ASP A 494 3.493 14.121 16.250 1.00 15.92 C ATOM 1190 O ASP A 494 3.044 13.046 16.128 1.00 16.28 O ATOM 1191 CB ASP A 494 4.354 13.962 13.873 1.00 16.77 C ATOM 1192 CG ASP A 494 3.101 13.620 13.053 1.00 22.99 C ATOM 1193 OD1 ASP A 494 2.070 14.176 13.304 1.00 22.77 O ATOM 1194 OD2 ASP A 494 3.197 12.828 12.149 1.00 23.12 O ATOM 1195 H ASP A 494 5.879 15.165 16.212 1.00 0.00 H ATOM 1196 N LEU A 495 3.530 14.750 17.396 1.00 12.80 N ATOM 1197 CA LEU A 495 3.118 14.108 18.613 1.00 12.87 C ATOM 1198 C LEU A 495 1.598 14.162 18.724 1.00 17.62 C ATOM 1199 O LEU A 495 1.065 15.180 18.938 1.00 19.90 O ATOM 1200 CB LEU A 495 3.791 14.734 19.826 1.00 12.64 C ATOM 1201 CG LEU A 495 3.532 14.075 21.150 1.00 17.86 C ATOM 1202 CD1 LEU A 495 3.932 12.611 21.169 1.00 18.57 C ATOM 1203 CD2 LEU A 495 4.125 14.867 22.286 1.00 17.67 C ATOM 1204 H LEU A 495 3.864 15.734 17.427 1.00 0.00 H ATOM 1205 N ALA A 496 0.936 13.032 18.595 1.00 13.32 N ATOM 1206 CA ALA A 496 -0.515 12.929 18.527 1.00 13.93 C ATOM 1207 C ALA A 496 -0.861 11.523 18.988 1.00 15.98 C ATOM 1208 O ALA A 496 -0.001 10.646 18.935 1.00 14.91 O ATOM 1209 CB ALA A 496 -0.960 13.108 17.056 1.00 15.36 C ATOM 1210 H ALA A 496 1.487 12.152 18.538 1.00 0.00 H ATOM 1211 N ALA A 497 -2.107 11.273 19.407 1.00 13.71 N ATOM 1212 CA ALA A 497 -2.464 9.929 19.895 1.00 13.06 C ATOM 1213 C ALA A 497 -2.266 8.815 18.859 1.00 17.89 C ATOM 1214 O ALA A 497 -1.998 7.680 19.248 1.00 19.62 O ATOM 1215 CB ALA A 497 -3.893 9.923 20.446 1.00 13.67 C ATOM 1216 H ALA A 497 -2.823 12.027 19.388 1.00 0.00 H ATOM 1217 N ARG A 498 -2.349 9.139 17.546 1.00 15.05 N ATOM 1218 CA ARG A 498 -2.170 8.125 16.483 1.00 15.70 C ATOM 1219 C ARG A 498 -0.725 7.627 16.450 1.00 18.27 C ATOM 1220 O ARG A 498 -0.454 6.582 15.856 1.00 16.94 O ATOM 1221 CB ARG A 498 -2.541 8.697 15.087 1.00 14.63 C ATOM 1222 CG ARG A 498 -1.698 9.933 14.683 1.00 17.08 C ATOM 1223 CD ARG A 498 -1.993 10.457 13.274 1.00 20.49 C ATOM 1224 NE ARG A 498 -1.283 11.725 13.055 1.00 20.11 N ATOM 1225 CZ ARG A 498 -1.685 12.920 13.483 1.00 25.78 C ATOM 1226 NH1 ARG A 498 -2.872 13.062 14.066 1.00 23.81 N ATOM 1227 NH2 ARG A 498 -0.930 13.990 13.284 1.00 18.44 N ATOM 1228 HE ARG A 498 -0.392 11.686 12.521 1.00 0.00 H ATOM 1229 HH12 ARG A 498 -3.180 13.998 14.398 1.00 0.00 H ATOM 1230 HH11 ARG A 498 -3.493 12.237 14.190 1.00 0.00 H ATOM 1231 HH22 ARG A 498 -1.249 14.921 13.620 1.00 0.00 H ATOM 1232 HH21 ARG A 498 -0.019 13.899 12.791 1.00 0.00 H ATOM 1233 H ARG A 498 -2.543 10.125 17.278 1.00 0.00 H ATOM 1234 N ASN A 499 0.206 8.416 17.040 1.00 14.61 N ATOM 1235 CA ASN A 499 1.638 8.131 17.062 1.00 14.52 C ATOM 1236 C ASN A 499 2.139 7.657 18.442 1.00 19.64 C ATOM 1237 O ASN A 499 3.345 7.652 18.719 1.00 21.47 O ATOM 1238 CB ASN A 499 2.378 9.344 16.546 1.00 12.92 C ATOM 1239 CG ASN A 499 2.094 9.564 15.082 1.00 20.89 C ATOM 1240 OD1 ASN A 499 1.617 8.659 14.378 1.00 14.55 O ATOM 1241 ND2 ASN A 499 2.236 10.794 14.630 1.00 14.02 N ATOM 1242 HD22 ASN A 499 2.639 11.530 15.244 1.00 0.00 H ATOM 1243 HD21 ASN A 499 1.945 11.028 13.659 1.00 0.00 H ATOM 1244 H ASN A 499 -0.122 9.284 17.509 1.00 0.00 H ATOM 1245 N VAL A 500 1.190 7.240 19.298 1.00 15.26 N ATOM 1246 CA VAL A 500 1.466 6.613 20.583 1.00 12.73 C ATOM 1247 C VAL A 500 0.972 5.174 20.368 1.00 17.91 C ATOM 1248 O VAL A 500 -0.187 4.967 20.034 1.00 18.66 O ATOM 1249 CB VAL A 500 0.796 7.288 21.785 1.00 16.97 C ATOM 1250 CG1 VAL A 500 1.052 6.476 23.056 1.00 16.15 C ATOM 1251 CG2 VAL A 500 1.331 8.690 21.956 1.00 17.45 C ATOM 1252 H VAL A 500 0.195 7.374 19.025 1.00 0.00 H ATOM 1253 N LEU A 501 1.875 4.210 20.483 1.00 13.27 N ATOM 1254 CA LEU A 501 1.608 2.787 20.191 1.00 16.29 C ATOM 1255 C LEU A 501 1.607 1.958 21.451 1.00 20.71 C ATOM 1256 O LEU A 501 2.449 2.155 22.317 1.00 20.95 O ATOM 1257 CB LEU A 501 2.709 2.292 19.223 1.00 17.66 C ATOM 1258 CG LEU A 501 2.506 2.550 17.691 1.00 23.73 C ATOM 1259 CD1 LEU A 501 1.378 1.678 17.118 1.00 24.44 C ATOM 1260 CD2 LEU A 501 2.147 3.978 17.384 1.00 22.94 C ATOM 1261 H LEU A 501 2.831 4.472 20.798 1.00 0.00 H ATOM 1262 N LEU A 502 0.644 1.041 21.575 1.00 19.26 N ATOM 1263 CA LEU A 502 0.561 0.282 22.797 1.00 18.74 C ATOM 1264 C LEU A 502 1.187 -1.102 22.671 1.00 22.85 C ATOM 1265 O LEU A 502 0.827 -1.865 21.780 1.00 23.01 O ATOM 1266 CB LEU A 502 -0.904 0.165 23.245 1.00 19.72 C ATOM 1267 CG LEU A 502 -1.645 1.479 23.563 1.00 23.56 C ATOM 1268 CD1 LEU A 502 -3.091 1.176 23.886 1.00 25.62 C ATOM 1269 CD2 LEU A 502 -1.033 2.158 24.770 1.00 25.57 C ATOM 1270 H LEU A 502 -0.034 0.878 20.803 1.00 0.00 H ATOM 1271 N VAL A 503 2.125 -1.399 23.571 1.00 19.24 N ATOM 1272 CA VAL A 503 2.750 -2.729 23.720 1.00 19.77 C ATOM 1273 C VAL A 503 1.738 -3.576 24.522 1.00 25.10 C ATOM 1274 O VAL A 503 1.496 -4.741 24.191 1.00 26.07 O ATOM 1275 CB VAL A 503 4.137 -2.660 24.411 1.00 23.53 C ATOM 1276 CG1 VAL A 503 4.691 -4.072 24.673 1.00 23.25 C ATOM 1277 CG2 VAL A 503 5.115 -1.857 23.555 1.00 23.66 C ATOM 1278 H VAL A 503 2.438 -0.642 24.212 1.00 0.00 H ATOM 1279 N THR A 504 1.177 -2.998 25.612 1.00 22.02 N ATOM 1280 CA THR A 504 0.080 -3.606 26.405 1.00 21.94 C ATOM 1281 C THR A 504 -0.913 -2.492 26.739 1.00 24.85 C ATOM 1282 O THR A 504 -0.641 -1.320 26.457 1.00 21.82 O ATOM 1283 CB THR A 504 0.538 -4.281 27.723 1.00 27.84 C ATOM 1284 OG1 THR A 504 0.869 -3.275 28.699 1.00 24.95 O ATOM 1285 CG2 THR A 504 1.661 -5.282 27.523 1.00 23.97 C ATOM 1286 HG1 THR A 504 1.160 -3.713 29.537 1.00 0.00 H ATOM 1287 H THR A 504 1.538 -2.070 25.912 1.00 0.00 H ATOM 1288 N GLN A 505 -2.020 -2.841 27.421 1.00 23.31 N ATOM 1289 CA GLN A 505 -3.006 -1.846 27.853 1.00 22.35 C ATOM 1290 C GLN A 505 -2.390 -0.877 28.900 1.00 23.82 C ATOM 1291 O GLN A 505 -2.955 0.184 29.152 1.00 23.49 O ATOM 1292 CB GLN A 505 -4.226 -2.582 28.450 1.00 25.61 C ATOM 1293 CG GLN A 505 -5.492 -1.733 28.521 1.00 39.79 C ATOM 1294 CD GLN A 505 -6.554 -2.422 29.344 1.00 49.91 C ATOM 1295 OE1 GLN A 505 -6.840 -3.609 29.179 1.00 48.14 O ATOM 1296 NE2 GLN A 505 -7.132 -1.707 30.280 1.00 34.11 N ATOM 1297 HE22 GLN A 505 -6.876 -0.706 30.403 1.00 0.00 H ATOM 1298 HE21 GLN A 505 -7.846 -2.141 30.899 1.00 0.00 H ATOM 1299 H GLN A 505 -2.180 -3.843 27.647 1.00 0.00 H ATOM 1300 N HIS A 506 -1.227 -1.237 29.468 1.00 20.26 N ATOM 1301 CA HIS A 506 -0.500 -0.465 30.475 1.00 20.68 C ATOM 1302 C HIS A 506 0.930 -0.090 30.064 1.00 22.50 C ATOM 1303 O HIS A 506 1.754 0.181 30.939 1.00 23.09 O ATOM 1304 CB HIS A 506 -0.467 -1.248 31.808 1.00 21.43 C ATOM 1305 CG HIS A 506 -1.815 -1.607 32.321 1.00 25.04 C ATOM 1306 ND1 HIS A 506 -2.619 -0.674 32.928 1.00 26.11 N ATOM 1307 CD2 HIS A 506 -2.456 -2.799 32.305 1.00 26.93 C ATOM 1308 CE1 HIS A 506 -3.726 -1.314 33.256 1.00 26.79 C ATOM 1309 NE2 HIS A 506 -3.669 -2.598 32.912 1.00 27.51 N ATOM 1310 H HIS A 506 -0.809 -2.140 29.166 1.00 0.00 H ATOM 1311 N TYR A 507 1.238 -0.062 28.755 1.00 17.30 N ATOM 1312 CA TYR A 507 2.602 0.261 28.320 1.00 17.92 C ATOM 1313 C TYR A 507 2.545 0.916 26.963 1.00 21.70 C ATOM 1314 O TYR A 507 2.360 0.224 25.960 1.00 20.72 O ATOM 1315 CB TYR A 507 3.472 -1.033 28.269 1.00 21.63 C ATOM 1316 CG TYR A 507 4.962 -0.851 28.017 1.00 22.55 C ATOM 1317 CD1 TYR A 507 5.802 -1.953 27.865 1.00 25.60 C ATOM 1318 CD2 TYR A 507 5.538 0.420 27.973 1.00 22.42 C ATOM 1319 CE1 TYR A 507 7.173 -1.795 27.643 1.00 26.20 C ATOM 1320 CE2 TYR A 507 6.906 0.589 27.767 1.00 22.36 C ATOM 1321 CZ TYR A 507 7.722 -0.523 27.609 1.00 29.72 C ATOM 1322 OH TYR A 507 9.073 -0.362 27.392 1.00 26.49 O ATOM 1323 HH TYR A 507 9.213 0.158 26.561 1.00 0.00 H ATOM 1324 H TYR A 507 0.505 -0.270 28.047 1.00 0.00 H ATOM 1325 N ALA A 508 2.701 2.265 26.936 1.00 17.85 N ATOM 1326 CA ALA A 508 2.707 3.040 25.719 1.00 16.88 C ATOM 1327 C ALA A 508 4.146 3.409 25.333 1.00 19.41 C ATOM 1328 O ALA A 508 5.007 3.603 26.197 1.00 17.83 O ATOM 1329 CB ALA A 508 1.905 4.337 25.927 1.00 16.77 C ATOM 1330 H ALA A 508 2.822 2.765 27.840 1.00 0.00 H ATOM 1331 N LYS A 509 4.365 3.589 24.025 1.00 17.12 N ATOM 1332 CA LYS A 509 5.643 4.000 23.436 1.00 16.51 C ATOM 1333 C LYS A 509 5.360 4.998 22.320 1.00 20.29 C ATOM 1334 O LYS A 509 4.373 4.869 21.613 1.00 20.67 O ATOM 1335 CB LYS A 509 6.427 2.811 22.846 1.00 17.94 C ATOM 1336 CG LYS A 509 6.922 1.793 23.879 1.00 21.57 C ATOM 1337 CD LYS A 509 7.798 0.771 23.198 1.00 26.26 C ATOM 1338 CE LYS A 509 8.233 -0.319 24.127 1.00 29.23 C ATOM 1339 NZ LYS A 509 9.686 -0.575 24.067 1.00 37.08 N ATOM 1340 HZ1 LYS A 509 9.948 -0.857 23.101 1.00 0.00 H ATOM 1341 HZ2 LYS A 509 10.200 0.290 24.328 1.00 0.00 H ATOM 1342 HZ3 LYS A 509 9.930 -1.338 24.730 1.00 0.00 H ATOM 1343 H LYS A 509 3.568 3.425 23.377 1.00 0.00 H ATOM 1344 N ILE A 510 6.257 5.953 22.139 1.00 15.50 N ATOM 1345 CA ILE A 510 6.111 6.950 21.094 1.00 14.33 C ATOM 1346 C ILE A 510 6.739 6.431 19.827 1.00 16.63 C ATOM 1347 O ILE A 510 7.832 5.856 19.882 1.00 15.89 O ATOM 1348 CB ILE A 510 6.787 8.269 21.547 1.00 16.21 C ATOM 1349 CG1 ILE A 510 6.183 8.796 22.895 1.00 15.51 C ATOM 1350 CG2 ILE A 510 6.731 9.312 20.437 1.00 16.39 C ATOM 1351 CD1 ILE A 510 7.098 9.765 23.667 1.00 21.06 C ATOM 1352 H ILE A 510 7.089 5.991 22.762 1.00 0.00 H ATOM 1353 N SER A 511 6.106 6.686 18.686 1.00 14.71 N ATOM 1354 CA SER A 511 6.690 6.239 17.423 1.00 15.54 C ATOM 1355 C SER A 511 6.533 7.314 16.370 1.00 18.28 C ATOM 1356 O SER A 511 6.248 8.466 16.720 1.00 18.30 O ATOM 1357 CB SER A 511 6.030 4.943 16.975 1.00 21.09 C ATOM 1358 OG SER A 511 4.658 5.177 16.738 1.00 28.49 O ATOM 1359 HG SER A 511 4.559 5.862 16.031 1.00 0.00 H ATOM 1360 H SER A 511 5.202 7.200 18.692 1.00 0.00 H ATOM 1361 N ASP A 512 6.612 6.957 15.082 1.00 14.43 N ATOM 1362 CA ASP A 512 6.445 7.896 13.939 1.00 13.24 C ATOM 1363 C ASP A 512 7.342 9.160 13.783 1.00 16.49 C ATOM 1364 O ASP A 512 6.835 10.274 13.654 1.00 17.02 O ATOM 1365 CB ASP A 512 4.967 8.272 13.785 1.00 13.86 C ATOM 1366 CG ASP A 512 4.081 7.059 13.583 1.00 20.90 C ATOM 1367 OD1 ASP A 512 3.938 6.606 12.428 1.00 21.42 O ATOM 1368 OD2 ASP A 512 3.533 6.549 14.582 1.00 20.78 O ATOM 1369 H ASP A 512 6.803 5.958 14.866 1.00 0.00 H ATOM 1370 N PHE A 513 8.660 8.962 13.795 1.00 15.04 N ATOM 1371 CA PHE A 513 9.674 10.022 13.828 1.00 15.03 C ATOM 1372 C PHE A 513 9.979 10.585 12.427 1.00 17.64 C ATOM 1373 O PHE A 513 10.981 11.261 12.276 1.00 18.03 O ATOM 1374 CB PHE A 513 10.963 9.501 14.550 1.00 16.80 C ATOM 1375 CG PHE A 513 10.775 9.287 16.045 1.00 17.65 C ATOM 1376 CD1 PHE A 513 11.071 10.299 16.949 1.00 18.09 C ATOM 1377 CD2 PHE A 513 10.198 8.113 16.532 1.00 19.51 C ATOM 1378 CE1 PHE A 513 10.900 10.105 18.323 1.00 20.30 C ATOM 1379 CE2 PHE A 513 9.990 7.934 17.909 1.00 20.56 C ATOM 1380 CZ PHE A 513 10.338 8.935 18.791 1.00 19.36 C ATOM 1381 H PHE A 513 8.996 7.978 13.780 1.00 0.00 H ATOM 1382 N GLY A 514 9.086 10.390 11.449 1.00 17.42 N ATOM 1383 CA GLY A 514 9.243 10.917 10.083 1.00 17.65 C ATOM 1384 C GLY A 514 9.378 12.443 9.993 1.00 21.49 C ATOM 1385 O GLY A 514 9.988 12.949 9.052 1.00 21.11 O ATOM 1386 H GLY A 514 8.234 9.835 11.666 1.00 0.00 H ATOM 1387 N LEU A 515 8.835 13.201 10.960 1.00 17.99 N ATOM 1388 CA LEU A 515 8.986 14.682 10.914 1.00 18.38 C ATOM 1389 C LEU A 515 10.004 15.180 11.961 1.00 21.53 C ATOM 1390 O LEU A 515 10.225 16.389 12.081 1.00 19.82 O ATOM 1391 CB LEU A 515 7.614 15.373 11.122 1.00 18.21 C ATOM 1392 CG LEU A 515 6.527 15.089 10.032 1.00 25.55 C ATOM 1393 CD1 LEU A 515 5.223 15.850 10.323 1.00 25.99 C ATOM 1394 CD2 LEU A 515 7.029 15.430 8.618 1.00 29.07 C ATOM 1395 H LEU A 515 8.310 12.755 11.739 1.00 0.00 H ATOM 1396 N SER A 516 10.618 14.247 12.713 1.00 17.20 N ATOM 1397 CA SER A 516 11.511 14.603 13.798 1.00 17.27 C ATOM 1398 C SER A 516 12.803 15.231 13.344 1.00 19.59 C ATOM 1399 O SER A 516 13.249 14.975 12.217 1.00 19.41 O ATOM 1400 CB SER A 516 11.749 13.409 14.713 1.00 19.07 C ATOM 1401 OG SER A 516 10.490 12.969 15.197 1.00 25.46 O ATOM 1402 HG SER A 516 10.056 13.704 15.699 1.00 0.00 H ATOM 1403 H SER A 516 10.447 13.242 12.509 1.00 0.00 H ATOM 1404 N LYS A 517 13.370 16.092 14.192 1.00 15.83 N ATOM 1405 CA LYS A 517 14.621 16.781 13.861 1.00 16.60 C ATOM 1406 C LYS A 517 15.554 16.785 15.049 1.00 20.76 C ATOM 1407 O LYS A 517 15.111 16.975 16.184 1.00 18.33 O ATOM 1408 CB LYS A 517 14.337 18.241 13.450 1.00 20.07 C ATOM 1409 CG LYS A 517 13.423 18.403 12.217 1.00 24.86 C ATOM 1410 CD LYS A 517 14.108 18.052 10.908 1.00 27.99 C ATOM 1411 CE LYS A 517 13.065 18.020 9.811 1.00 33.46 C ATOM 1412 NZ LYS A 517 13.633 17.565 8.518 1.00 43.20 N ATOM 1413 HZ1 LYS A 517 14.392 18.214 8.227 1.00 0.00 H ATOM 1414 HZ2 LYS A 517 14.019 16.606 8.629 1.00 0.00 H ATOM 1415 HZ3 LYS A 517 12.885 17.558 7.795 1.00 0.00 H ATOM 1416 H LYS A 517 12.914 16.278 15.108 1.00 0.00 H ATOM 1417 N ALA A 518 16.851 16.571 14.791 1.00 18.19 N ATOM 1418 CA ALA A 518 17.881 16.676 15.821 1.00 18.62 C ATOM 1419 C ALA A 518 18.212 18.167 15.873 1.00 21.07 C ATOM 1420 O ALA A 518 18.571 18.750 14.847 1.00 19.55 O ATOM 1421 CB ALA A 518 19.128 15.895 15.402 1.00 19.59 C ATOM 1422 H ALA A 518 17.135 16.321 13.822 1.00 0.00 H ATOM 1423 N LEU A 519 18.093 18.796 17.045 1.00 18.68 N ATOM 1424 CA LEU A 519 18.402 20.230 17.114 1.00 19.57 C ATOM 1425 C LEU A 519 19.883 20.506 16.942 1.00 21.24 C ATOM 1426 O LEU A 519 20.713 19.709 17.383 1.00 20.07 O ATOM 1427 CB LEU A 519 17.922 20.819 18.442 1.00 20.40 C ATOM 1428 CG LEU A 519 16.386 20.755 18.669 1.00 23.46 C ATOM 1429 CD1 LEU A 519 16.028 21.224 20.078 1.00 26.14 C ATOM 1430 CD2 LEU A 519 15.645 21.617 17.673 1.00 24.04 C ATOM 1431 H LEU A 519 17.787 18.279 17.894 1.00 0.00 H ATOM 1432 N ARG A 520 20.230 21.643 16.328 1.00 19.21 N ATOM 1433 CA ARG A 520 21.616 22.060 16.206 1.00 20.14 C ATOM 1434 C ARG A 520 22.170 22.320 17.616 1.00 23.32 C ATOM 1435 O ARG A 520 21.419 22.725 18.507 1.00 24.05 O ATOM 1436 CB ARG A 520 21.679 23.378 15.421 1.00 23.88 C ATOM 1437 CG ARG A 520 21.468 23.267 13.918 1.00 34.34 C ATOM 1438 CD ARG A 520 21.265 24.651 13.320 1.00 36.40 C ATOM 1439 NE ARG A 520 22.372 25.565 13.657 1.00 38.47 N ATOM 1440 CZ ARG A 520 23.168 26.143 12.773 1.00 49.43 C ATOM 1441 NH1 ARG A 520 24.123 26.974 13.175 1.00 40.76 N ATOM 1442 NH2 ARG A 520 23.016 25.902 11.478 1.00 43.75 N ATOM 1443 HE ARG A 520 22.539 25.770 14.663 1.00 0.00 H ATOM 1444 HH12 ARG A 520 24.747 27.426 12.476 1.00 0.00 H ATOM 1445 HH11 ARG A 520 24.247 27.172 14.188 1.00 0.00 H ATOM 1446 HH22 ARG A 520 23.644 26.359 10.787 1.00 0.00 H ATOM 1447 HH21 ARG A 520 22.268 25.256 11.154 1.00 0.00 H ATOM 1448 H ARG A 520 19.485 22.247 15.926 1.00 0.00 H ATOM 1449 N ALA A 521 23.471 22.116 17.810 1.00 21.48 N ATOM 1450 CA ALA A 521 24.143 22.365 19.094 1.00 23.69 C ATOM 1451 C ALA A 521 23.978 23.796 19.624 1.00 28.64 C ATOM 1452 O ALA A 521 24.003 23.996 20.846 1.00 28.53 O ATOM 1453 CB ALA A 521 25.627 22.001 18.999 1.00 26.00 C ATOM 1454 H ALA A 521 24.040 21.763 17.014 1.00 0.00 H ATOM 1455 N ASP A 522 23.750 24.781 18.713 1.00 25.64 N ATOM 1456 CA ASP A 522 23.621 26.206 19.055 1.00 26.76 C ATOM 1457 C ASP A 522 22.190 26.780 19.059 1.00 31.98 C ATOM 1458 O ASP A 522 22.033 27.995 19.219 1.00 32.35 O ATOM 1459 CB ASP A 522 24.503 27.039 18.110 1.00 29.45 C ATOM 1460 CG ASP A 522 24.086 27.014 16.638 1.00 30.75 C ATOM 1461 OD1 ASP A 522 23.266 26.146 16.258 1.00 29.95 O ATOM 1462 OD2 ASP A 522 24.622 27.817 15.864 1.00 33.80 O ATOM 1463 H ASP A 522 23.661 24.509 17.713 1.00 0.00 H ATOM 1464 N GLU A 523 21.161 25.952 18.836 1.00 29.28 N ATOM 1465 CA GLU A 523 19.767 26.424 18.816 1.00 28.15 C ATOM 1466 C GLU A 523 18.825 25.539 19.604 1.00 28.86 C ATOM 1467 O GLU A 523 19.019 24.334 19.631 1.00 25.32 O ATOM 1468 CB GLU A 523 19.252 26.564 17.370 1.00 29.29 C ATOM 1469 CG GLU A 523 19.882 27.695 16.567 1.00 35.69 C ATOM 1470 CD GLU A 523 19.739 29.119 17.080 1.00 51.99 C ATOM 1471 OE1 GLU A 523 18.738 29.436 17.765 1.00 50.24 O ATOM 1472 OE2 GLU A 523 20.621 29.940 16.743 1.00 43.53 O ATOM 1473 H GLU A 523 21.353 24.943 18.672 1.00 0.00 H ATOM 1474 N ASN A 524 17.741 26.128 20.169 1.00 27.65 N ATOM 1475 CA ASN A 524 16.706 25.403 20.925 1.00 27.60 C ATOM 1476 C ASN A 524 15.480 25.120 20.057 1.00 28.16 C ATOM 1477 O ASN A 524 14.464 24.650 20.569 1.00 28.12 O ATOM 1478 CB ASN A 524 16.279 26.224 22.165 1.00 36.79 C ATOM 1479 CG ASN A 524 15.864 25.373 23.338 1.00 62.04 C ATOM 1480 H ASN A 524 17.634 27.157 20.061 1.00 0.00 H ATOM 1481 N TYR A 525 15.551 25.426 18.755 1.00 23.33 N ATOM 1482 CA TYR A 525 14.421 25.198 17.865 1.00 22.70 C ATOM 1483 C TYR A 525 14.892 24.878 16.461 1.00 26.46 C ATOM 1484 O TYR A 525 16.014 25.224 16.078 1.00 27.38 O ATOM 1485 CB TYR A 525 13.450 26.440 17.830 1.00 24.92 C ATOM 1486 CG TYR A 525 14.062 27.674 17.189 1.00 30.65 C ATOM 1487 CD1 TYR A 525 13.952 27.901 15.818 1.00 33.51 C ATOM 1488 CD2 TYR A 525 14.821 28.570 17.939 1.00 33.61 C ATOM 1489 CE1 TYR A 525 14.569 29.003 15.212 1.00 37.31 C ATOM 1490 CE2 TYR A 525 15.451 29.664 17.343 1.00 36.03 C ATOM 1491 CZ TYR A 525 15.322 29.876 15.979 1.00 44.99 C ATOM 1492 OH TYR A 525 15.931 30.959 15.388 1.00 51.47 O ATOM 1493 HH TYR A 525 15.736 30.957 14.417 1.00 0.00 H ATOM 1494 H TYR A 525 16.428 25.833 18.373 1.00 0.00 H ATOM 1495 N TYR A 526 14.005 24.252 15.691 1.00 22.33 N ATOM 1496 CA TYR A 526 14.192 23.917 14.283 1.00 22.18 C ATOM 1497 C TYR A 526 13.306 24.893 13.496 1.00 26.38 C ATOM 1498 O TYR A 526 12.107 25.047 13.791 1.00 24.60 O ATOM 1499 CB TYR A 526 13.754 22.454 14.011 1.00 21.85 C ATOM 1500 CG TYR A 526 13.565 22.161 12.541 1.00 23.46 C ATOM 1501 CD1 TYR A 526 12.294 22.123 11.976 1.00 24.93 C ATOM 1502 CD2 TYR A 526 14.656 21.926 11.709 1.00 25.82 C ATOM 1503 CE1 TYR A 526 12.115 21.865 10.614 1.00 25.21 C ATOM 1504 CE2 TYR A 526 14.492 21.716 10.340 1.00 27.09 C ATOM 1505 CZ TYR A 526 13.217 21.658 9.803 1.00 31.17 C ATOM 1506 OH TYR A 526 13.049 21.400 8.465 1.00 35.56 O ATOM 1507 HH TYR A 526 12.083 21.394 8.250 1.00 0.00 H ATOM 1508 H TYR A 526 13.103 23.979 16.130 1.00 0.00 H ATOM 1509 N LYS A 527 13.905 25.555 12.503 1.00 25.55 N ATOM 1510 CA LYS A 527 13.187 26.499 11.664 1.00 25.97 C ATOM 1511 C LYS A 527 12.839 25.765 10.364 1.00 32.89 C ATOM 1512 O LYS A 527 13.748 25.363 9.635 1.00 33.17 O ATOM 1513 CB LYS A 527 14.066 27.751 11.413 1.00 29.75 C ATOM 1514 CG LYS A 527 13.488 28.754 10.401 1.00 34.68 C ATOM 1515 CD LYS A 527 12.205 29.454 10.878 1.00 34.80 C ATOM 1516 CE LYS A 527 11.875 30.623 9.972 1.00 48.26 C ATOM 1517 NZ LYS A 527 11.526 30.187 8.585 1.00 59.98 N ATOM 1518 HZ1 LYS A 527 12.331 29.676 8.171 1.00 0.00 H ATOM 1519 HZ2 LYS A 527 10.696 29.561 8.618 1.00 0.00 H ATOM 1520 HZ3 LYS A 527 11.309 31.022 8.005 1.00 0.00 H ATOM 1521 H LYS A 527 14.916 25.390 12.325 1.00 0.00 H ATOM 1522 N ALA A 528 11.545 25.507 10.117 1.00 30.05 N ATOM 1523 CA ALA A 528 11.159 24.831 8.872 1.00 31.16 C ATOM 1524 C ALA A 528 11.264 25.812 7.701 1.00 41.18 C ATOM 1525 O ALA A 528 11.008 27.010 7.875 1.00 38.73 O ATOM 1526 CB ALA A 528 9.753 24.260 8.974 1.00 30.94 C ATOM 1527 H ALA A 528 10.817 25.785 10.806 1.00 0.00 H ATOM 1528 N GLN A 529 11.704 25.315 6.531 1.00 44.75 N ATOM 1529 CA GLN A 529 11.843 26.139 5.328 1.00 48.73 C ATOM 1530 C GLN A 529 10.495 26.207 4.605 1.00 59.25 C ATOM 1531 O GLN A 529 9.973 27.300 4.389 1.00 60.67 O ATOM 1532 CB GLN A 529 12.956 25.606 4.421 1.00 50.90 C ATOM 1533 H GLN A 529 11.955 24.307 6.479 1.00 0.00 H ATOM 1534 N THR A 530 9.915 25.035 4.287 1.00 58.73 N ATOM 1535 CA THR A 530 8.606 24.875 3.639 1.00 60.22 C ATOM 1536 C THR A 530 7.565 24.488 4.711 1.00 65.88 C ATOM 1537 O THR A 530 7.958 24.195 5.848 1.00 64.68 O ATOM 1538 CB THR A 530 8.700 23.844 2.507 1.00 71.26 C ATOM 1539 OG1 THR A 530 9.198 22.611 3.033 1.00 69.99 O ATOM 1540 CG2 THR A 530 9.577 24.321 1.348 1.00 72.38 C ATOM 1541 HG1 THR A 530 9.260 21.944 2.304 1.00 0.00 H ATOM 1542 H THR A 530 10.439 24.167 4.520 1.00 0.00 H ATOM 1543 N HIS A 531 6.247 24.496 4.367 1.00 63.86 N ATOM 1544 CA HIS A 531 5.188 24.194 5.342 1.00 62.71 C ATOM 1545 C HIS A 531 4.006 23.380 4.813 1.00 67.02 C ATOM 1546 O HIS A 531 2.964 23.958 4.479 1.00 68.86 O ATOM 1547 CB HIS A 531 4.672 25.494 5.972 1.00 63.62 C ATOM 1548 H HIS A 531 5.982 24.722 3.387 1.00 0.00 H ATOM 1549 N GLY A 532 4.139 22.057 4.800 1.00 61.27 N ATOM 1550 CA GLY A 532 3.055 21.184 4.353 1.00 60.11 C ATOM 1551 C GLY A 532 3.474 19.822 3.828 1.00 61.11 C ATOM 1552 O GLY A 532 4.538 19.706 3.211 1.00 61.59 O ATOM 1553 H GLY A 532 5.035 21.633 5.115 1.00 0.00 H ATOM 1554 N LYS A 533 2.642 18.764 4.029 1.00 53.45 N ATOM 1555 CA LYS A 533 1.358 18.775 4.744 1.00 50.35 C ATOM 1556 C LYS A 533 1.595 18.667 6.258 1.00 45.91 C ATOM 1557 O LYS A 533 2.281 17.747 6.711 1.00 44.94 O ATOM 1558 CB LYS A 533 0.457 17.631 4.245 1.00 53.67 C ATOM 1559 H LYS A 533 2.947 17.851 3.635 1.00 0.00 H ATOM 1560 N TRP A 534 1.060 19.626 7.031 1.00 36.93 N ATOM 1561 CA TRP A 534 1.274 19.681 8.485 1.00 33.07 C ATOM 1562 C TRP A 534 0.042 19.301 9.311 1.00 32.99 C ATOM 1563 O TRP A 534 -1.058 19.765 8.991 1.00 32.67 O ATOM 1564 CB TRP A 534 1.715 21.102 8.891 1.00 31.28 C ATOM 1565 CG TRP A 534 3.175 21.426 8.712 1.00 32.18 C ATOM 1566 CD1 TRP A 534 4.168 20.587 8.287 1.00 34.98 C ATOM 1567 CD2 TRP A 534 3.805 22.691 8.982 1.00 31.99 C ATOM 1568 NE1 TRP A 534 5.375 21.252 8.271 1.00 34.60 N ATOM 1569 CE2 TRP A 534 5.181 22.545 8.690 1.00 36.04 C ATOM 1570 CE3 TRP A 534 3.341 23.928 9.466 1.00 33.12 C ATOM 1571 CZ2 TRP A 534 6.097 23.588 8.867 1.00 35.76 C ATOM 1572 CZ3 TRP A 534 4.246 24.964 9.634 1.00 34.89 C ATOM 1573 CH2 TRP A 534 5.606 24.793 9.338 1.00 35.76 C ATOM 1574 HE1 TRP A 534 6.287 20.840 7.987 1.00 0.00 H ATOM 1575 H TRP A 534 0.472 20.358 6.584 1.00 0.00 H ATOM 1576 N PRO A 535 0.222 18.585 10.456 1.00 27.36 N ATOM 1577 CA PRO A 535 -0.938 18.276 11.314 1.00 25.33 C ATOM 1578 C PRO A 535 -1.204 19.486 12.207 1.00 26.03 C ATOM 1579 O PRO A 535 -0.941 19.464 13.411 1.00 24.97 O ATOM 1580 CB PRO A 535 -0.469 17.069 12.114 1.00 26.26 C ATOM 1581 CG PRO A 535 1.033 17.271 12.250 1.00 30.88 C ATOM 1582 CD PRO A 535 1.471 17.983 10.987 1.00 26.57 C ATOM 1583 N VAL A 536 -1.731 20.533 11.601 1.00 22.32 N ATOM 1584 CA VAL A 536 -2.007 21.853 12.171 1.00 23.06 C ATOM 1585 C VAL A 536 -2.753 21.829 13.532 1.00 23.22 C ATOM 1586 O VAL A 536 -2.460 22.658 14.398 1.00 20.04 O ATOM 1587 CB VAL A 536 -2.748 22.689 11.100 1.00 30.92 C ATOM 1588 CG1 VAL A 536 -3.538 23.841 11.707 1.00 32.75 C ATOM 1589 CG2 VAL A 536 -1.770 23.191 10.037 1.00 32.15 C ATOM 1590 H VAL A 536 -1.980 20.405 10.599 1.00 0.00 H ATOM 1591 N LYS A 537 -3.699 20.888 13.713 1.00 17.68 N ATOM 1592 CA LYS A 537 -4.483 20.815 14.938 1.00 16.64 C ATOM 1593 C LYS A 537 -3.637 20.488 16.156 1.00 17.66 C ATOM 1594 O LYS A 537 -4.100 20.717 17.259 1.00 17.79 O ATOM 1595 CB LYS A 537 -5.687 19.843 14.793 1.00 17.92 C ATOM 1596 CG LYS A 537 -6.788 20.519 13.960 1.00 18.17 C ATOM 1597 CD LYS A 537 -7.954 19.612 13.609 1.00 22.67 C ATOM 1598 CE LYS A 537 -8.895 20.430 12.767 1.00 31.00 C ATOM 1599 NZ LYS A 537 -10.059 19.640 12.283 1.00 38.46 N ATOM 1600 HZ1 LYS A 537 -9.720 18.844 11.705 1.00 0.00 H ATOM 1601 HZ2 LYS A 537 -10.592 19.276 13.098 1.00 0.00 H ATOM 1602 HZ3 LYS A 537 -10.675 20.250 11.709 1.00 0.00 H ATOM 1603 H LYS A 537 -3.874 20.195 12.958 1.00 0.00 H ATOM 1604 N TRP A 538 -2.427 19.914 15.954 1.00 14.50 N ATOM 1605 CA TRP A 538 -1.534 19.543 17.052 1.00 14.86 C ATOM 1606 C TRP A 538 -0.419 20.592 17.209 1.00 19.04 C ATOM 1607 O TRP A 538 0.388 20.484 18.129 1.00 18.41 O ATOM 1608 CB TRP A 538 -0.899 18.154 16.776 1.00 13.71 C ATOM 1609 CG TRP A 538 -1.879 17.032 17.031 1.00 13.79 C ATOM 1610 CD1 TRP A 538 -2.048 16.347 18.197 1.00 15.56 C ATOM 1611 CD2 TRP A 538 -2.916 16.580 16.144 1.00 14.44 C ATOM 1612 NE1 TRP A 538 -3.100 15.453 18.075 1.00 14.85 N ATOM 1613 CE2 TRP A 538 -3.661 15.594 16.833 1.00 17.61 C ATOM 1614 CE3 TRP A 538 -3.299 16.921 14.828 1.00 16.58 C ATOM 1615 CZ2 TRP A 538 -4.759 14.942 16.252 1.00 17.94 C ATOM 1616 CZ3 TRP A 538 -4.367 16.250 14.239 1.00 18.57 C ATOM 1617 CH2 TRP A 538 -5.107 15.301 14.959 1.00 19.20 C ATOM 1618 HE1 TRP A 538 -3.413 14.784 18.807 1.00 0.00 H ATOM 1619 H TRP A 538 -2.120 19.729 14.978 1.00 0.00 H ATOM 1620 N TYR A 539 -0.367 21.579 16.311 1.00 15.59 N ATOM 1621 CA TYR A 539 0.733 22.548 16.294 1.00 16.30 C ATOM 1622 C TYR A 539 0.522 23.803 17.112 1.00 21.01 C ATOM 1623 O TYR A 539 -0.553 24.401 17.080 1.00 19.09 O ATOM 1624 CB TYR A 539 1.077 22.927 14.828 1.00 17.92 C ATOM 1625 CG TYR A 539 1.947 21.909 14.114 1.00 18.90 C ATOM 1626 CD1 TYR A 539 2.433 22.156 12.830 1.00 20.62 C ATOM 1627 CD2 TYR A 539 2.359 20.739 14.753 1.00 20.56 C ATOM 1628 CE1 TYR A 539 3.287 21.252 12.192 1.00 19.89 C ATOM 1629 CE2 TYR A 539 3.224 19.834 14.129 1.00 22.46 C ATOM 1630 CZ TYR A 539 3.687 20.096 12.849 1.00 28.44 C ATOM 1631 OH TYR A 539 4.522 19.190 12.230 1.00 23.39 O ATOM 1632 HH TYR A 539 5.345 19.079 12.769 1.00 0.00 H ATOM 1633 H TYR A 539 -1.126 21.662 15.605 1.00 0.00 H ATOM 1634 N ALA A 540 1.606 24.247 17.802 1.00 18.80 N ATOM 1635 CA ALA A 540 1.574 25.461 18.622 1.00 19.09 C ATOM 1636 C ALA A 540 1.503 26.688 17.735 1.00 22.02 C ATOM 1637 O ALA A 540 1.890 26.624 16.561 1.00 20.10 O ATOM 1638 CB ALA A 540 2.838 25.526 19.486 1.00 19.87 C ATOM 1639 H ALA A 540 2.491 23.704 17.746 1.00 0.00 H ATOM 1640 N PRO A 541 1.036 27.837 18.266 1.00 20.40 N ATOM 1641 CA PRO A 541 0.960 29.048 17.438 1.00 21.16 C ATOM 1642 C PRO A 541 2.301 29.492 16.855 1.00 24.70 C ATOM 1643 O PRO A 541 2.316 29.955 15.705 1.00 24.48 O ATOM 1644 CB PRO A 541 0.393 30.094 18.397 1.00 23.46 C ATOM 1645 CG PRO A 541 -0.386 29.311 19.418 1.00 26.20 C ATOM 1646 CD PRO A 541 0.503 28.090 19.623 1.00 22.58 C ATOM 1647 N GLU A 542 3.432 29.307 17.597 1.00 19.82 N ATOM 1648 CA GLU A 542 4.752 29.714 17.049 1.00 21.00 C ATOM 1649 C GLU A 542 5.140 28.830 15.835 1.00 22.87 C ATOM 1650 O GLU A 542 5.935 29.279 15.005 1.00 21.80 O ATOM 1651 CB GLU A 542 5.874 29.736 18.117 1.00 21.68 C ATOM 1652 CG GLU A 542 6.265 28.364 18.634 1.00 25.23 C ATOM 1653 CD GLU A 542 5.413 27.768 19.737 1.00 26.64 C ATOM 1654 OE1 GLU A 542 4.369 28.368 20.102 1.00 19.51 O ATOM 1655 OE2 GLU A 542 5.803 26.691 20.246 1.00 19.59 O ATOM 1656 H GLU A 542 3.370 28.882 18.544 1.00 0.00 H ATOM 1657 N CYS A 543 4.571 27.573 15.739 1.00 19.01 N ATOM 1658 CA CYS A 543 4.868 26.709 14.585 1.00 18.58 C ATOM 1659 C CYS A 543 4.156 27.259 13.367 1.00 23.50 C ATOM 1660 O CYS A 543 4.720 27.281 12.291 1.00 23.78 O ATOM 1661 CB CYS A 543 4.436 25.270 14.854 1.00 18.22 C ATOM 1662 SG CYS A 543 5.059 24.623 16.409 1.00 21.36 S ATOM 1663 H CYS A 543 3.930 27.237 16.486 1.00 0.00 H ATOM 1664 N ILE A 544 2.874 27.604 13.526 1.00 24.02 N ATOM 1665 CA ILE A 544 2.045 28.162 12.455 1.00 25.55 C ATOM 1666 C ILE A 544 2.521 29.546 12.043 1.00 29.45 C ATOM 1667 O ILE A 544 2.669 29.812 10.846 1.00 31.35 O ATOM 1668 CB ILE A 544 0.528 28.163 12.873 1.00 28.84 C ATOM 1669 CG1 ILE A 544 0.040 26.739 13.304 1.00 28.05 C ATOM 1670 CG2 ILE A 544 -0.378 28.796 11.778 1.00 30.38 C ATOM 1671 CD1 ILE A 544 0.277 25.561 12.270 1.00 31.52 C ATOM 1672 H ILE A 544 2.441 27.469 14.462 1.00 0.00 H ATOM 1673 N ASN A 545 2.797 30.415 13.024 1.00 25.09 N ATOM 1674 CA ASN A 545 3.164 31.824 12.763 1.00 26.45 C ATOM 1675 C ASN A 545 4.624 32.104 12.407 1.00 31.85 C ATOM 1676 O ASN A 545 4.884 33.061 11.672 1.00 34.27 O ATOM 1677 CB ASN A 545 2.766 32.706 13.953 1.00 28.99 C ATOM 1678 CG ASN A 545 1.271 32.759 14.212 1.00 41.12 C ATOM 1679 OD1 ASN A 545 0.453 32.593 13.308 1.00 38.14 O ATOM 1680 ND2 ASN A 545 0.883 32.903 15.464 1.00 29.56 N ATOM 1681 HD22 ASN A 545 1.589 33.042 16.215 1.00 0.00 H ATOM 1682 HD21 ASN A 545 -0.129 32.877 15.701 1.00 0.00 H ATOM 1683 H ASN A 545 2.751 30.086 14.009 1.00 0.00 H ATOM 1684 N TYR A 546 5.583 31.368 12.991 1.00 27.06 N ATOM 1685 CA TYR A 546 7.002 31.629 12.779 1.00 26.74 C ATOM 1686 C TYR A 546 7.769 30.409 12.238 1.00 27.80 C ATOM 1687 O TYR A 546 8.972 30.521 12.022 1.00 25.44 O ATOM 1688 CB TYR A 546 7.668 32.103 14.092 1.00 28.50 C ATOM 1689 CG TYR A 546 7.089 33.376 14.672 1.00 31.71 C ATOM 1690 CD1 TYR A 546 6.103 33.332 15.651 1.00 32.57 C ATOM 1691 CD2 TYR A 546 7.596 34.622 14.315 1.00 34.70 C ATOM 1692 CE1 TYR A 546 5.556 34.503 16.178 1.00 35.44 C ATOM 1693 CE2 TYR A 546 7.047 35.801 14.825 1.00 36.54 C ATOM 1694 CZ TYR A 546 6.040 35.734 15.770 1.00 40.14 C ATOM 1695 OH TYR A 546 5.519 36.884 16.312 1.00 40.91 O ATOM 1696 HH TYR A 546 4.814 36.649 16.966 1.00 0.00 H ATOM 1697 H TYR A 546 5.304 30.585 13.616 1.00 0.00 H ATOM 1698 N TYR A 547 7.090 29.245 12.062 1.00 24.65 N ATOM 1699 CA TYR A 547 7.718 27.983 11.584 1.00 24.78 C ATOM 1700 C TYR A 547 8.826 27.509 12.529 1.00 26.46 C ATOM 1701 O TYR A 547 9.795 26.863 12.094 1.00 25.96 O ATOM 1702 CB TYR A 547 8.267 28.099 10.144 1.00 28.88 C ATOM 1703 CG TYR A 547 7.280 28.254 9.005 1.00 35.00 C ATOM 1704 CD1 TYR A 547 5.965 28.646 9.237 1.00 37.17 C ATOM 1705 CD2 TYR A 547 7.685 28.088 7.684 1.00 38.64 C ATOM 1706 CE1 TYR A 547 5.071 28.848 8.186 1.00 40.67 C ATOM 1707 CE2 TYR A 547 6.804 28.286 6.623 1.00 41.44 C ATOM 1708 CZ TYR A 547 5.500 28.680 6.878 1.00 53.54 C ATOM 1709 OH TYR A 547 4.634 28.872 5.827 1.00 59.37 O ATOM 1710 HH TYR A 547 3.750 29.149 6.176 1.00 0.00 H ATOM 1711 H TYR A 547 6.072 29.235 12.274 1.00 0.00 H ATOM 1712 N LYS A 548 8.675 27.800 13.827 1.00 22.70 N ATOM 1713 CA LYS A 548 9.681 27.433 14.827 1.00 22.95 C ATOM 1714 C LYS A 548 9.195 26.288 15.672 1.00 22.22 C ATOM 1715 O LYS A 548 8.117 26.368 16.262 1.00 21.24 O ATOM 1716 CB LYS A 548 10.082 28.639 15.687 1.00 25.03 C ATOM 1717 CG LYS A 548 10.906 29.671 14.917 1.00 36.67 C ATOM 1718 CD LYS A 548 10.948 31.024 15.618 1.00 41.52 C ATOM 1719 CE LYS A 548 11.929 31.108 16.760 1.00 52.36 C ATOM 1720 NZ LYS A 548 12.785 32.318 16.635 1.00 65.47 N ATOM 1721 HZ1 LYS A 548 13.314 32.276 15.741 1.00 0.00 H ATOM 1722 HZ2 LYS A 548 12.186 33.168 16.645 1.00 0.00 H ATOM 1723 HZ3 LYS A 548 13.452 32.353 17.432 1.00 0.00 H ATOM 1724 H LYS A 548 7.818 28.302 14.135 1.00 0.00 H ATOM 1725 N PHE A 549 9.996 25.224 15.731 1.00 18.38 N ATOM 1726 CA PHE A 549 9.644 23.976 16.417 1.00 17.79 C ATOM 1727 C PHE A 549 10.655 23.637 17.483 1.00 23.24 C ATOM 1728 O PHE A 549 11.820 23.395 17.182 1.00 23.95 O ATOM 1729 CB PHE A 549 9.575 22.835 15.395 1.00 19.55 C ATOM 1730 CG PHE A 549 8.459 22.989 14.390 1.00 20.07 C ATOM 1731 CD1 PHE A 549 7.244 22.343 14.576 1.00 18.92 C ATOM 1732 CD2 PHE A 549 8.653 23.714 13.218 1.00 21.36 C ATOM 1733 CE1 PHE A 549 6.227 22.457 13.627 1.00 20.42 C ATOM 1734 CE2 PHE A 549 7.639 23.820 12.266 1.00 23.57 C ATOM 1735 CZ PHE A 549 6.442 23.169 12.464 1.00 21.34 C ATOM 1736 H PHE A 549 10.923 25.282 15.264 1.00 0.00 H ATOM 1737 N SER A 550 10.202 23.613 18.729 1.00 20.54 N ATOM 1738 CA SER A 550 11.026 23.343 19.901 1.00 19.97 C ATOM 1739 C SER A 550 10.410 22.232 20.744 1.00 20.51 C ATOM 1740 O SER A 550 9.334 21.728 20.414 1.00 18.55 O ATOM 1741 CB SER A 550 11.126 24.615 20.736 1.00 21.90 C ATOM 1742 OG SER A 550 9.818 25.030 21.109 1.00 21.37 O ATOM 1743 HG SER A 550 9.284 25.207 20.294 1.00 0.00 H ATOM 1744 H SER A 550 9.190 23.799 18.880 1.00 0.00 H ATOM 1745 N SER A 551 11.066 21.857 21.850 1.00 17.79 N ATOM 1746 CA SER A 551 10.458 20.859 22.749 1.00 18.45 C ATOM 1747 C SER A 551 9.179 21.474 23.359 1.00 18.47 C ATOM 1748 O SER A 551 8.194 20.760 23.561 1.00 16.36 O ATOM 1749 CB SER A 551 11.439 20.432 23.829 1.00 21.29 C ATOM 1750 OG SER A 551 12.391 19.544 23.267 1.00 23.68 O ATOM 1751 HG SER A 551 11.926 18.748 22.906 1.00 0.00 H ATOM 1752 H SER A 551 11.996 22.266 22.073 1.00 0.00 H ATOM 1753 N LYS A 552 9.169 22.809 23.543 1.00 16.10 N ATOM 1754 CA LYS A 552 7.972 23.537 24.010 1.00 15.96 C ATOM 1755 C LYS A 552 6.821 23.417 23.023 1.00 17.17 C ATOM 1756 O LYS A 552 5.681 23.332 23.459 1.00 15.58 O ATOM 1757 CB LYS A 552 8.280 24.992 24.383 1.00 20.18 C ATOM 1758 CG LYS A 552 8.827 25.010 25.812 1.00 24.70 C ATOM 1759 CD LYS A 552 9.292 26.288 26.298 1.00 33.14 C ATOM 1760 CE LYS A 552 9.789 26.092 27.711 1.00 29.15 C ATOM 1761 NZ LYS A 552 9.602 27.319 28.504 1.00 38.76 N ATOM 1762 HZ1 LYS A 552 10.133 28.098 28.065 1.00 0.00 H ATOM 1763 HZ2 LYS A 552 8.591 27.561 28.533 1.00 0.00 H ATOM 1764 HZ3 LYS A 552 9.950 27.162 29.471 1.00 0.00 H ATOM 1765 H LYS A 552 10.037 23.347 23.349 1.00 0.00 H ATOM 1766 N SER A 553 7.079 23.390 21.695 1.00 14.07 N ATOM 1767 CA SER A 553 5.949 23.172 20.768 1.00 13.54 C ATOM 1768 C SER A 553 5.491 21.701 20.840 1.00 17.01 C ATOM 1769 O SER A 553 4.293 21.434 20.719 1.00 14.90 O ATOM 1770 CB SER A 553 6.300 23.575 19.342 1.00 16.52 C ATOM 1771 OG SER A 553 7.446 22.894 18.866 1.00 22.25 O ATOM 1772 HG SER A 553 7.278 21.918 18.880 1.00 0.00 H ATOM 1773 H SER A 553 8.047 23.519 21.336 1.00 0.00 H ATOM 1774 N ASP A 554 6.416 20.744 21.104 1.00 13.32 N ATOM 1775 CA ASP A 554 5.950 19.368 21.319 1.00 12.99 C ATOM 1776 C ASP A 554 5.083 19.309 22.615 1.00 16.49 C ATOM 1777 O ASP A 554 4.153 18.476 22.697 1.00 12.94 O ATOM 1778 CB ASP A 554 7.134 18.390 21.481 1.00 13.73 C ATOM 1779 CG ASP A 554 7.853 17.999 20.203 1.00 17.74 C ATOM 1780 OD1 ASP A 554 7.222 18.062 19.108 1.00 16.77 O ATOM 1781 OD2 ASP A 554 8.984 17.480 20.304 1.00 17.64 O ATOM 1782 H ASP A 554 7.428 20.979 21.153 1.00 0.00 H ATOM 1783 N VAL A 555 5.374 20.197 23.612 1.00 14.70 N ATOM 1784 CA VAL A 555 4.532 20.250 24.845 1.00 14.67 C ATOM 1785 C VAL A 555 3.080 20.637 24.453 1.00 17.01 C ATOM 1786 O VAL A 555 2.123 19.997 24.919 1.00 13.78 O ATOM 1787 CB VAL A 555 5.110 21.174 25.949 1.00 17.27 C ATOM 1788 CG1 VAL A 555 4.065 21.468 27.042 1.00 16.70 C ATOM 1789 CG2 VAL A 555 6.382 20.567 26.572 1.00 16.65 C ATOM 1790 H VAL A 555 6.186 20.839 23.512 1.00 0.00 H ATOM 1791 N TRP A 556 2.925 21.661 23.573 1.00 14.27 N ATOM 1792 CA TRP A 556 1.591 22.043 23.082 1.00 14.50 C ATOM 1793 C TRP A 556 0.906 20.808 22.474 1.00 17.20 C ATOM 1794 O TRP A 556 -0.245 20.507 22.821 1.00 15.59 O ATOM 1795 CB TRP A 556 1.694 23.143 22.014 1.00 13.85 C ATOM 1796 CG TRP A 556 0.349 23.575 21.513 1.00 14.57 C ATOM 1797 CD1 TRP A 556 -0.497 22.870 20.712 1.00 16.41 C ATOM 1798 CD2 TRP A 556 -0.323 24.808 21.826 1.00 15.46 C ATOM 1799 NE1 TRP A 556 -1.660 23.581 20.514 1.00 16.86 N ATOM 1800 CE2 TRP A 556 -1.581 24.771 21.189 1.00 18.59 C ATOM 1801 CE3 TRP A 556 0.034 25.956 22.567 1.00 18.29 C ATOM 1802 CZ2 TRP A 556 -2.510 25.820 21.292 1.00 19.13 C ATOM 1803 CZ3 TRP A 556 -0.887 26.994 22.671 1.00 20.59 C ATOM 1804 CH2 TRP A 556 -2.130 26.929 22.017 1.00 20.97 C ATOM 1805 HE1 TRP A 556 -2.470 23.265 19.943 1.00 0.00 H ATOM 1806 H TRP A 556 3.761 22.183 23.242 1.00 0.00 H ATOM 1807 N SER A 557 1.610 20.091 21.555 1.00 14.51 N ATOM 1808 CA SER A 557 1.065 18.860 20.930 1.00 13.73 C ATOM 1809 C SER A 557 0.657 17.869 21.988 1.00 16.72 C ATOM 1810 O SER A 557 -0.363 17.213 21.829 1.00 15.24 O ATOM 1811 CB SER A 557 2.066 18.216 19.981 1.00 14.96 C ATOM 1812 OG SER A 557 2.559 19.211 19.101 1.00 14.68 O ATOM 1813 HG SER A 557 1.806 19.597 18.587 1.00 0.00 H ATOM 1814 H SER A 557 2.560 20.416 21.282 1.00 0.00 H ATOM 1815 N PHE A 558 1.486 17.723 23.051 1.00 15.44 N ATOM 1816 CA PHE A 558 1.213 16.796 24.157 1.00 13.78 C ATOM 1817 C PHE A 558 -0.117 17.157 24.842 1.00 15.15 C ATOM 1818 O PHE A 558 -0.835 16.266 25.271 1.00 15.05 O ATOM 1819 CB PHE A 558 2.384 16.737 25.164 1.00 14.46 C ATOM 1820 CG PHE A 558 2.132 15.774 26.300 1.00 15.03 C ATOM 1821 CD1 PHE A 558 2.216 14.393 26.100 1.00 17.02 C ATOM 1822 CD2 PHE A 558 1.774 16.242 27.566 1.00 16.14 C ATOM 1823 CE1 PHE A 558 1.991 13.501 27.158 1.00 18.23 C ATOM 1824 CE2 PHE A 558 1.519 15.352 28.611 1.00 18.83 C ATOM 1825 CZ PHE A 558 1.639 13.985 28.408 1.00 16.77 C ATOM 1826 H PHE A 558 2.355 18.294 23.085 1.00 0.00 H ATOM 1827 N GLY A 559 -0.423 18.443 24.949 1.00 15.43 N ATOM 1828 CA GLY A 559 -1.714 18.871 25.504 1.00 14.43 C ATOM 1829 C GLY A 559 -2.866 18.369 24.654 1.00 16.49 C ATOM 1830 O GLY A 559 -3.866 17.859 25.181 1.00 16.17 O ATOM 1831 H GLY A 559 0.262 19.160 24.635 1.00 0.00 H ATOM 1832 N VAL A 560 -2.736 18.489 23.311 1.00 12.69 N ATOM 1833 CA VAL A 560 -3.754 17.984 22.379 1.00 12.35 C ATOM 1834 C VAL A 560 -3.868 16.454 22.494 1.00 15.20 C ATOM 1835 O VAL A 560 -4.977 15.913 22.509 1.00 15.34 O ATOM 1836 CB VAL A 560 -3.493 18.433 20.904 1.00 15.22 C ATOM 1837 CG1 VAL A 560 -4.654 17.999 20.015 1.00 15.70 C ATOM 1838 CG2 VAL A 560 -3.266 19.946 20.787 1.00 15.28 C ATOM 1839 H VAL A 560 -1.888 18.954 22.927 1.00 0.00 H ATOM 1840 N LEU A 561 -2.723 15.759 22.618 1.00 12.09 N ATOM 1841 CA LEU A 561 -2.705 14.308 22.799 1.00 11.68 C ATOM 1842 C LEU A 561 -3.462 13.901 24.078 1.00 15.46 C ATOM 1843 O LEU A 561 -4.244 12.931 24.059 1.00 14.95 O ATOM 1844 CB LEU A 561 -1.224 13.846 22.802 1.00 12.03 C ATOM 1845 CG LEU A 561 -0.903 12.344 22.905 1.00 17.45 C ATOM 1846 CD1 LEU A 561 0.579 12.127 22.509 1.00 18.04 C ATOM 1847 CD2 LEU A 561 -1.070 11.855 24.357 1.00 19.94 C ATOM 1848 H LEU A 561 -1.819 16.272 22.584 1.00 0.00 H ATOM 1849 N MET A 562 -3.228 14.635 25.192 1.00 12.24 N ATOM 1850 CA MET A 562 -3.959 14.366 26.431 1.00 12.87 C ATOM 1851 C MET A 562 -5.457 14.532 26.212 1.00 17.36 C ATOM 1852 O MET A 562 -6.223 13.659 26.625 1.00 18.05 O ATOM 1853 CB MET A 562 -3.531 15.318 27.540 1.00 14.28 C ATOM 1854 CG MET A 562 -2.131 15.090 28.014 1.00 15.27 C ATOM 1855 SD MET A 562 -1.808 16.329 29.343 1.00 17.60 S ATOM 1856 CE MET A 562 -2.806 15.582 30.724 1.00 16.11 C ATOM 1857 H MET A 562 -2.521 15.398 25.167 1.00 0.00 H ATOM 1858 N TRP A 563 -5.875 15.623 25.530 1.00 14.36 N ATOM 1859 CA TRP A 563 -7.278 15.823 25.235 1.00 14.82 C ATOM 1860 C TRP A 563 -7.825 14.606 24.464 1.00 17.10 C ATOM 1861 O TRP A 563 -8.852 14.062 24.844 1.00 15.58 O ATOM 1862 CB TRP A 563 -7.499 17.153 24.495 1.00 14.64 C ATOM 1863 CG TRP A 563 -8.954 17.439 24.270 1.00 16.72 C ATOM 1864 CD1 TRP A 563 -9.772 18.222 25.041 1.00 19.56 C ATOM 1865 CD2 TRP A 563 -9.766 16.933 23.201 1.00 17.37 C ATOM 1866 NE1 TRP A 563 -11.060 18.182 24.551 1.00 18.90 N ATOM 1867 CE2 TRP A 563 -11.082 17.412 23.413 1.00 21.35 C ATOM 1868 CE3 TRP A 563 -9.509 16.116 22.076 1.00 18.93 C ATOM 1869 CZ2 TRP A 563 -12.135 17.108 22.542 1.00 22.21 C ATOM 1870 CZ3 TRP A 563 -10.570 15.756 21.256 1.00 21.08 C ATOM 1871 CH2 TRP A 563 -11.857 16.283 21.466 1.00 22.81 C ATOM 1872 HE1 TRP A 563 -11.882 18.658 24.974 1.00 0.00 H ATOM 1873 H TRP A 563 -5.179 16.328 25.213 1.00 0.00 H ATOM 1874 N GLU A 564 -7.098 14.134 23.418 1.00 15.38 N ATOM 1875 CA GLU A 564 -7.517 12.957 22.632 1.00 15.65 C ATOM 1876 C GLU A 564 -7.681 11.720 23.492 1.00 19.82 C ATOM 1877 O GLU A 564 -8.684 11.016 23.363 1.00 18.01 O ATOM 1878 CB GLU A 564 -6.462 12.630 21.557 1.00 15.65 C ATOM 1879 CG GLU A 564 -6.315 13.665 20.467 1.00 16.33 C ATOM 1880 CD GLU A 564 -5.278 13.153 19.491 1.00 19.96 C ATOM 1881 OE1 GLU A 564 -4.062 13.321 19.749 1.00 18.46 O ATOM 1882 OE2 GLU A 564 -5.682 12.487 18.516 1.00 16.63 O ATOM 1883 H GLU A 564 -6.215 14.619 23.162 1.00 0.00 H ATOM 1884 N ALA A 565 -6.714 11.477 24.394 1.00 18.46 N ATOM 1885 CA ALA A 565 -6.709 10.314 25.288 1.00 18.02 C ATOM 1886 C ALA A 565 -7.895 10.335 26.231 1.00 20.62 C ATOM 1887 O ALA A 565 -8.575 9.311 26.359 1.00 19.27 O ATOM 1888 CB ALA A 565 -5.395 10.226 26.070 1.00 18.66 C ATOM 1889 H ALA A 565 -5.925 12.151 24.462 1.00 0.00 H ATOM 1890 N PHE A 566 -8.182 11.493 26.851 1.00 16.66 N ATOM 1891 CA PHE A 566 -9.335 11.574 27.754 1.00 17.61 C ATOM 1892 C PHE A 566 -10.663 11.665 27.004 1.00 21.10 C ATOM 1893 O PHE A 566 -11.709 11.493 27.616 1.00 23.10 O ATOM 1894 CB PHE A 566 -9.172 12.692 28.780 1.00 20.58 C ATOM 1895 CG PHE A 566 -8.151 12.346 29.834 1.00 22.21 C ATOM 1896 CD1 PHE A 566 -8.502 11.572 30.939 1.00 24.54 C ATOM 1897 CD2 PHE A 566 -6.848 12.823 29.744 1.00 21.40 C ATOM 1898 CE1 PHE A 566 -7.549 11.239 31.905 1.00 25.97 C ATOM 1899 CE2 PHE A 566 -5.899 12.491 30.706 1.00 25.02 C ATOM 1900 CZ PHE A 566 -6.261 11.722 31.795 1.00 24.37 C ATOM 1901 H PHE A 566 -7.587 12.331 26.690 1.00 0.00 H ATOM 1902 N SER A 567 -10.623 11.891 25.674 1.00 17.20 N ATOM 1903 CA SER A 567 -11.838 11.935 24.857 1.00 18.42 C ATOM 1904 C SER A 567 -12.030 10.613 24.130 1.00 24.29 C ATOM 1905 O SER A 567 -12.787 10.544 23.163 1.00 23.27 O ATOM 1906 CB SER A 567 -11.782 13.079 23.862 1.00 17.52 C ATOM 1907 OG SER A 567 -11.703 14.335 24.522 1.00 17.49 O ATOM 1908 HG SER A 567 -12.500 14.455 25.096 1.00 0.00 H ATOM 1909 H SER A 567 -9.701 12.038 25.215 1.00 0.00 H ATOM 1910 N TYR A 568 -11.281 9.585 24.564 1.00 21.64 N ATOM 1911 CA TYR A 568 -11.292 8.231 24.037 1.00 22.07 C ATOM 1912 C TYR A 568 -11.072 8.196 22.521 1.00 25.04 C ATOM 1913 O TYR A 568 -11.777 7.521 21.772 1.00 23.45 O ATOM 1914 CB TYR A 568 -12.546 7.485 24.501 1.00 24.53 C ATOM 1915 CG TYR A 568 -12.494 7.181 25.984 1.00 25.76 C ATOM 1916 CD1 TYR A 568 -11.979 5.976 26.449 1.00 27.15 C ATOM 1917 CD2 TYR A 568 -12.922 8.116 26.924 1.00 26.32 C ATOM 1918 CE1 TYR A 568 -11.914 5.695 27.815 1.00 28.50 C ATOM 1919 CE2 TYR A 568 -12.839 7.856 28.294 1.00 27.43 C ATOM 1920 CZ TYR A 568 -12.349 6.635 28.731 1.00 30.83 C ATOM 1921 OH TYR A 568 -12.281 6.356 30.071 1.00 32.03 O ATOM 1922 HH TYR A 568 -11.909 5.447 30.199 1.00 0.00 H ATOM 1923 H TYR A 568 -10.631 9.777 25.353 1.00 0.00 H ATOM 1924 N GLY A 569 -10.041 8.912 22.089 1.00 20.77 N ATOM 1925 CA GLY A 569 -9.621 8.904 20.694 1.00 20.65 C ATOM 1926 C GLY A 569 -10.425 9.720 19.711 1.00 27.31 C ATOM 1927 O GLY A 569 -10.278 9.523 18.499 1.00 28.88 O ATOM 1928 H GLY A 569 -9.516 9.498 22.769 1.00 0.00 H ATOM 1929 N GLN A 570 -11.251 10.665 20.203 1.00 24.45 N ATOM 1930 CA GLN A 570 -11.995 11.581 19.328 1.00 24.99 C ATOM 1931 C GLN A 570 -11.006 12.540 18.666 1.00 26.26 C ATOM 1932 O GLN A 570 -9.990 12.879 19.266 1.00 23.75 O ATOM 1933 CB GLN A 570 -12.991 12.432 20.125 1.00 26.72 C ATOM 1934 CG GLN A 570 -14.245 11.676 20.572 1.00 49.65 C ATOM 1935 CD GLN A 570 -15.363 11.612 19.559 1.00 66.56 C ATOM 1936 OE1 GLN A 570 -15.524 12.477 18.687 1.00 62.71 O ATOM 1937 NE2 GLN A 570 -16.203 10.600 19.699 1.00 52.48 N ATOM 1938 HE22 GLN A 570 -16.042 9.889 20.441 1.00 0.00 H ATOM 1939 HE21 GLN A 570 -17.025 10.515 19.067 1.00 0.00 H ATOM 1940 H GLN A 570 -11.365 10.748 21.233 1.00 0.00 H ATOM 1941 N LYS A 571 -11.338 13.015 17.459 1.00 23.72 N ATOM 1942 CA LYS A 571 -10.518 14.001 16.749 1.00 23.11 C ATOM 1943 C LYS A 571 -10.600 15.341 17.500 1.00 22.61 C ATOM 1944 O LYS A 571 -11.695 15.761 17.888 1.00 23.23 O ATOM 1945 CB LYS A 571 -11.065 14.231 15.318 1.00 28.19 C ATOM 1946 CG LYS A 571 -11.228 12.963 14.481 1.00 45.75 C ATOM 1947 H LYS A 571 -12.210 12.672 17.008 1.00 0.00 H ATOM 1948 N PRO A 572 -9.490 16.074 17.655 1.00 18.01 N ATOM 1949 CA PRO A 572 -9.587 17.395 18.308 1.00 18.32 C ATOM 1950 C PRO A 572 -10.210 18.436 17.381 1.00 20.49 C ATOM 1951 O PRO A 572 -10.141 18.259 16.167 1.00 19.94 O ATOM 1952 CB PRO A 572 -8.127 17.717 18.626 1.00 19.02 C ATOM 1953 CG PRO A 572 -7.338 17.016 17.567 1.00 21.63 C ATOM 1954 CD PRO A 572 -8.096 15.756 17.267 1.00 17.59 C ATOM 1955 N TYR A 573 -10.784 19.530 17.942 1.00 15.95 N ATOM 1956 CA TYR A 573 -11.365 20.643 17.202 1.00 15.35 C ATOM 1957 C TYR A 573 -12.318 20.137 16.124 1.00 22.14 C ATOM 1958 O TYR A 573 -12.204 20.510 14.945 1.00 19.55 O ATOM 1959 CB TYR A 573 -10.273 21.526 16.561 1.00 16.31 C ATOM 1960 CG TYR A 573 -9.232 22.016 17.535 1.00 16.72 C ATOM 1961 CD1 TYR A 573 -7.973 21.415 17.604 1.00 17.77 C ATOM 1962 CD2 TYR A 573 -9.494 23.095 18.383 1.00 18.16 C ATOM 1963 CE1 TYR A 573 -6.997 21.884 18.484 1.00 17.36 C ATOM 1964 CE2 TYR A 573 -8.512 23.588 19.250 1.00 17.64 C ATOM 1965 CZ TYR A 573 -7.277 22.955 19.318 1.00 18.83 C ATOM 1966 OH TYR A 573 -6.321 23.389 20.209 1.00 18.54 O ATOM 1967 HH TYR A 573 -6.675 23.318 21.131 1.00 0.00 H ATOM 1968 H TYR A 573 -10.811 19.578 18.981 1.00 0.00 H ATOM 1969 N ARG A 574 -13.238 19.251 16.537 1.00 20.15 N ATOM 1970 CA ARG A 574 -14.218 18.641 15.657 1.00 20.56 C ATOM 1971 C ARG A 574 -14.903 19.674 14.778 1.00 23.38 C ATOM 1972 O ARG A 574 -15.364 20.707 15.269 1.00 23.01 O ATOM 1973 CB ARG A 574 -15.270 17.918 16.531 1.00 25.00 C ATOM 1974 CG ARG A 574 -16.480 17.376 15.825 1.00 35.68 C ATOM 1975 CD ARG A 574 -17.131 16.338 16.715 1.00 30.70 C ATOM 1976 NE ARG A 574 -18.004 16.915 17.734 1.00 28.57 N ATOM 1977 CZ ARG A 574 -18.547 16.202 18.717 1.00 42.09 C ATOM 1978 NH1 ARG A 574 -19.365 16.774 19.585 1.00 27.74 N ATOM 1979 NH2 ARG A 574 -18.260 14.913 18.847 1.00 29.66 N ATOM 1980 HE ARG A 574 -18.211 17.933 17.689 1.00 0.00 H ATOM 1981 HH12 ARG A 574 -19.786 16.211 20.351 1.00 0.00 H ATOM 1982 HH11 ARG A 574 -19.587 17.787 19.501 1.00 0.00 H ATOM 1983 HH22 ARG A 574 -18.687 14.360 19.617 1.00 0.00 H ATOM 1984 HH21 ARG A 574 -17.608 14.456 18.179 1.00 0.00 H ATOM 1985 H ARG A 574 -13.249 18.987 17.543 1.00 0.00 H ATOM 1986 N GLY A 575 -14.977 19.370 13.489 1.00 22.88 N ATOM 1987 CA GLY A 575 -15.683 20.172 12.493 1.00 24.31 C ATOM 1988 C GLY A 575 -15.050 21.494 12.109 1.00 29.44 C ATOM 1989 O GLY A 575 -15.669 22.270 11.373 1.00 30.66 O ATOM 1990 H GLY A 575 -14.501 18.504 13.166 1.00 0.00 H ATOM 1991 N MET A 576 -13.819 21.752 12.571 1.00 24.27 N ATOM 1992 CA MET A 576 -13.140 23.022 12.277 1.00 23.33 C ATOM 1993 C MET A 576 -12.041 22.884 11.265 1.00 27.53 C ATOM 1994 O MET A 576 -11.335 21.882 11.259 1.00 25.94 O ATOM 1995 CB MET A 576 -12.566 23.674 13.547 1.00 23.21 C ATOM 1996 CG MET A 576 -13.601 23.957 14.597 1.00 25.12 C ATOM 1997 SD MET A 576 -12.912 24.469 16.181 1.00 26.17 S ATOM 1998 CE MET A 576 -12.262 26.186 15.750 1.00 22.82 C ATOM 1999 H MET A 576 -13.333 21.038 13.150 1.00 0.00 H ATOM 2000 N LYS A 577 -11.906 23.887 10.397 1.00 26.68 N ATOM 2001 CA LYS A 577 -10.774 23.942 9.460 1.00 28.22 C ATOM 2002 C LYS A 577 -9.557 24.427 10.284 1.00 31.06 C ATOM 2003 O LYS A 577 -9.738 25.093 11.314 1.00 30.00 O ATOM 2004 CB LYS A 577 -11.062 24.947 8.315 1.00 31.65 C ATOM 2005 CG LYS A 577 -12.079 24.451 7.286 1.00 37.87 C ATOM 2006 CD LYS A 577 -12.421 25.525 6.253 1.00 49.68 C ATOM 2007 H LYS A 577 -12.616 24.647 10.382 1.00 0.00 H ATOM 2008 N GLY A 578 -8.353 24.121 9.807 1.00 28.85 N ATOM 2009 CA GLY A 578 -7.088 24.544 10.414 1.00 27.48 C ATOM 2010 C GLY A 578 -7.049 26.033 10.693 1.00 30.18 C ATOM 2011 O GLY A 578 -6.673 26.430 11.788 1.00 28.83 O ATOM 2012 H GLY A 578 -8.307 23.542 8.944 1.00 0.00 H ATOM 2013 N SER A 579 -7.537 26.861 9.748 1.00 28.26 N ATOM 2014 CA SER A 579 -7.555 28.331 9.882 1.00 28.60 C ATOM 2015 C SER A 579 -8.498 28.818 10.983 1.00 30.82 C ATOM 2016 O SER A 579 -8.187 29.785 11.690 1.00 29.56 O ATOM 2017 CB SER A 579 -7.875 29.003 8.548 1.00 34.26 C ATOM 2018 OG SER A 579 -9.185 28.702 8.101 1.00 42.14 O ATOM 2019 HG SER A 579 -9.842 29.017 8.771 1.00 0.00 H ATOM 2020 H SER A 579 -7.922 26.442 8.877 1.00 0.00 H ATOM 2021 N GLU A 580 -9.628 28.111 11.176 1.00 26.35 N ATOM 2022 CA GLU A 580 -10.576 28.426 12.243 1.00 24.28 C ATOM 2023 C GLU A 580 -9.961 28.042 13.597 1.00 24.91 C ATOM 2024 O GLU A 580 -10.212 28.728 14.594 1.00 24.77 O ATOM 2025 CB GLU A 580 -11.894 27.670 12.030 1.00 25.83 C ATOM 2026 CG GLU A 580 -12.660 28.156 10.811 1.00 35.79 C ATOM 2027 CD GLU A 580 -13.777 27.264 10.297 1.00 48.46 C ATOM 2028 OE1 GLU A 580 -13.738 26.037 10.537 1.00 36.27 O ATOM 2029 OE2 GLU A 580 -14.642 27.786 9.562 1.00 41.02 O ATOM 2030 H GLU A 580 -9.833 27.312 10.543 1.00 0.00 H ATOM 2031 N VAL A 581 -9.157 26.958 13.633 1.00 21.03 N ATOM 2032 CA VAL A 581 -8.462 26.528 14.863 1.00 19.86 C ATOM 2033 C VAL A 581 -7.461 27.646 15.274 1.00 22.89 C ATOM 2034 O VAL A 581 -7.457 28.070 16.419 1.00 20.99 O ATOM 2035 CB VAL A 581 -7.803 25.142 14.718 1.00 23.35 C ATOM 2036 CG1 VAL A 581 -6.989 24.770 15.967 1.00 21.96 C ATOM 2037 CG2 VAL A 581 -8.877 24.078 14.452 1.00 22.98 C ATOM 2038 H VAL A 581 -9.022 26.405 12.762 1.00 0.00 H ATOM 2039 N THR A 582 -6.676 28.150 14.332 1.00 20.91 N ATOM 2040 CA THR A 582 -5.745 29.264 14.584 1.00 21.56 C ATOM 2041 C THR A 582 -6.508 30.496 15.115 1.00 25.97 C ATOM 2042 O THR A 582 -6.097 31.096 16.117 1.00 26.39 O ATOM 2043 CB THR A 582 -4.920 29.556 13.307 1.00 30.35 C ATOM 2044 OG1 THR A 582 -4.188 28.377 13.004 1.00 32.05 O ATOM 2045 CG2 THR A 582 -3.912 30.704 13.495 1.00 35.54 C ATOM 2046 HG1 THR A 582 -3.646 28.527 12.189 1.00 0.00 H ATOM 2047 H THR A 582 -6.719 27.742 13.376 1.00 0.00 H ATOM 2048 N ALA A 583 -7.624 30.861 14.457 1.00 23.93 N ATOM 2049 CA ALA A 583 -8.462 31.998 14.853 1.00 25.77 C ATOM 2050 C ALA A 583 -8.984 31.799 16.292 1.00 29.79 C ATOM 2051 O ALA A 583 -8.865 32.711 17.105 1.00 30.41 O ATOM 2052 CB ALA A 583 -9.624 32.149 13.877 1.00 27.81 C ATOM 2053 H ALA A 583 -7.907 30.307 13.623 1.00 0.00 H ATOM 2054 N MET A 584 -9.473 30.571 16.621 1.00 24.77 N ATOM 2055 CA MET A 584 -9.974 30.199 17.949 1.00 22.86 C ATOM 2056 C MET A 584 -8.904 30.403 19.017 1.00 24.74 C ATOM 2057 O MET A 584 -9.181 30.991 20.048 1.00 24.88 O ATOM 2058 CB MET A 584 -10.413 28.722 17.945 1.00 23.80 C ATOM 2059 CG MET A 584 -10.974 28.254 19.276 1.00 27.32 C ATOM 2060 SD MET A 584 -11.394 26.513 19.218 1.00 30.24 S ATOM 2061 CE MET A 584 -11.581 26.187 20.916 1.00 26.81 C ATOM 2062 H MET A 584 -9.493 29.844 15.877 1.00 0.00 H ATOM 2063 N LEU A 585 -7.699 29.836 18.796 1.00 23.03 N ATOM 2064 CA LEU A 585 -6.590 29.911 19.748 1.00 21.84 C ATOM 2065 C LEU A 585 -6.144 31.354 19.943 1.00 26.77 C ATOM 2066 O LEU A 585 -5.852 31.756 21.070 1.00 24.20 O ATOM 2067 CB LEU A 585 -5.416 29.049 19.253 1.00 20.37 C ATOM 2068 CG LEU A 585 -5.754 27.553 19.145 1.00 22.17 C ATOM 2069 CD1 LEU A 585 -4.634 26.799 18.384 1.00 22.54 C ATOM 2070 CD2 LEU A 585 -6.048 26.942 20.537 1.00 20.61 C ATOM 2071 H LEU A 585 -7.551 29.320 17.905 1.00 0.00 H ATOM 2072 N GLU A 586 -6.072 32.120 18.847 1.00 25.03 N ATOM 2073 CA GLU A 586 -5.659 33.530 18.925 1.00 26.96 C ATOM 2074 C GLU A 586 -6.584 34.372 19.854 1.00 32.45 C ATOM 2075 O GLU A 586 -6.084 35.266 20.549 1.00 35.01 O ATOM 2076 CB GLU A 586 -5.607 34.130 17.526 1.00 28.74 C ATOM 2077 CG GLU A 586 -4.828 35.422 17.469 1.00 38.64 C ATOM 2078 CD GLU A 586 -4.533 35.830 16.047 1.00 43.50 C ATOM 2079 OE1 GLU A 586 -3.753 35.122 15.368 1.00 38.88 O ATOM 2080 OE2 GLU A 586 -5.043 36.892 15.632 1.00 43.32 O ATOM 2081 H GLU A 586 -6.313 31.710 17.922 1.00 0.00 H ATOM 2082 N LYS A 587 -7.904 34.061 19.881 1.00 29.87 N ATOM 2083 CA LYS A 587 -8.937 34.680 20.746 1.00 30.01 C ATOM 2084 C LYS A 587 -8.790 34.186 22.223 1.00 34.83 C ATOM 2085 O LYS A 587 -9.632 34.521 23.066 1.00 35.44 O ATOM 2086 CB LYS A 587 -10.347 34.248 20.279 1.00 30.50 C ATOM 2087 CG LYS A 587 -10.887 34.881 19.008 1.00 41.83 C ATOM 2088 CD LYS A 587 -12.330 34.391 18.780 1.00 55.78 C ATOM 2089 CE LYS A 587 -12.909 34.778 17.439 1.00 72.37 C ATOM 2090 NZ LYS A 587 -12.417 33.908 16.336 1.00 79.59 N ATOM 2091 HZ1 LYS A 587 -11.382 33.982 16.273 1.00 0.00 H ATOM 2092 HZ2 LYS A 587 -12.684 32.921 16.529 1.00 0.00 H ATOM 2093 HZ3 LYS A 587 -12.843 34.214 15.438 1.00 0.00 H ATOM 2094 H LYS A 587 -8.223 33.315 19.231 1.00 0.00 H ATOM 2095 N GLY A 588 -7.780 33.348 22.493 1.00 29.40 N ATOM 2096 CA GLY A 588 -7.556 32.742 23.806 1.00 28.10 C ATOM 2097 C GLY A 588 -8.485 31.588 24.152 1.00 28.05 C ATOM 2098 O GLY A 588 -8.516 31.153 25.314 1.00 26.66 O ATOM 2099 H GLY A 588 -7.118 33.115 21.726 1.00 0.00 H ATOM 2100 N GLU A 589 -9.271 31.085 23.164 1.00 22.54 N ATOM 2101 CA GLU A 589 -10.220 29.996 23.414 1.00 22.47 C ATOM 2102 C GLU A 589 -9.528 28.661 23.347 1.00 23.32 C ATOM 2103 O GLU A 589 -8.582 28.510 22.576 1.00 21.16 O ATOM 2104 CB GLU A 589 -11.396 29.994 22.415 1.00 24.70 C ATOM 2105 CG GLU A 589 -12.339 31.188 22.501 1.00 34.75 C ATOM 2106 CD GLU A 589 -13.424 31.257 21.437 1.00 51.00 C ATOM 2107 OE1 GLU A 589 -13.719 30.229 20.778 1.00 38.81 O ATOM 2108 OE2 GLU A 589 -14.020 32.346 21.295 1.00 54.44 O ATOM 2109 H GLU A 589 -9.197 31.483 22.206 1.00 0.00 H ATOM 2110 N ARG A 590 -10.015 27.691 24.119 1.00 21.43 N ATOM 2111 CA ARG A 590 -9.433 26.336 24.154 1.00 20.23 C ATOM 2112 C ARG A 590 -10.545 25.307 24.191 1.00 23.49 C ATOM 2113 O ARG A 590 -11.657 25.606 24.643 1.00 24.22 O ATOM 2114 CB ARG A 590 -8.501 26.161 25.370 1.00 19.82 C ATOM 2115 CG ARG A 590 -7.355 27.212 25.483 1.00 25.61 C ATOM 2116 CD ARG A 590 -6.274 26.998 24.425 1.00 16.60 C ATOM 2117 NE ARG A 590 -5.102 27.852 24.603 1.00 19.62 N ATOM 2118 CZ ARG A 590 -4.931 29.040 24.021 1.00 26.14 C ATOM 2119 NH1 ARG A 590 -5.893 29.565 23.265 1.00 19.99 N ATOM 2120 NH2 ARG A 590 -3.821 29.735 24.235 1.00 22.73 N ATOM 2121 HE ARG A 590 -4.346 27.509 25.229 1.00 0.00 H ATOM 2122 HH12 ARG A 590 -5.753 30.492 22.814 1.00 0.00 H ATOM 2123 HH11 ARG A 590 -6.785 29.048 23.125 1.00 0.00 H ATOM 2124 HH22 ARG A 590 -3.691 30.661 23.779 1.00 0.00 H ATOM 2125 HH21 ARG A 590 -3.081 29.354 24.858 1.00 0.00 H ATOM 2126 H ARG A 590 -10.838 27.897 24.721 1.00 0.00 H ATOM 2127 N MET A 591 -10.241 24.073 23.756 1.00 17.69 N ATOM 2128 CA MET A 591 -11.222 22.994 23.803 1.00 17.86 C ATOM 2129 C MET A 591 -11.655 22.789 25.269 1.00 24.47 C ATOM 2130 O MET A 591 -10.839 22.976 26.171 1.00 23.64 O ATOM 2131 CB MET A 591 -10.596 21.683 23.280 1.00 18.78 C ATOM 2132 CG MET A 591 -10.354 21.672 21.764 1.00 21.31 C ATOM 2133 SD MET A 591 -9.795 20.024 21.188 1.00 23.25 S ATOM 2134 CE MET A 591 -8.160 20.020 21.695 1.00 19.39 C ATOM 2135 H MET A 591 -9.290 23.884 23.379 1.00 0.00 H ATOM 2136 N GLY A 592 -12.902 22.390 25.467 1.00 25.05 N ATOM 2137 CA GLY A 592 -13.469 22.102 26.781 1.00 24.73 C ATOM 2138 C GLY A 592 -12.926 20.833 27.403 1.00 26.65 C ATOM 2139 O GLY A 592 -12.224 20.046 26.758 1.00 25.31 O ATOM 2140 H GLY A 592 -13.515 22.275 24.635 1.00 0.00 H ATOM 2141 N CYS A 593 -13.249 20.635 28.675 1.00 22.62 N ATOM 2142 CA CYS A 593 -12.841 19.481 29.449 1.00 22.71 C ATOM 2143 C CYS A 593 -13.583 18.233 28.961 1.00 25.40 C ATOM 2144 O CYS A 593 -14.804 18.249 29.000 1.00 25.85 O ATOM 2145 CB CYS A 593 -13.111 19.738 30.935 1.00 23.86 C ATOM 2146 SG CYS A 593 -12.535 18.402 32.002 1.00 27.25 S ATOM 2147 H CYS A 593 -13.833 21.355 29.146 1.00 0.00 H ATOM 2148 N PRO A 594 -12.910 17.134 28.522 1.00 22.80 N ATOM 2149 CA PRO A 594 -13.668 15.916 28.119 1.00 21.92 C ATOM 2150 C PRO A 594 -14.515 15.354 29.264 1.00 26.62 C ATOM 2151 O PRO A 594 -14.168 15.524 30.434 1.00 25.33 O ATOM 2152 CB PRO A 594 -12.554 14.905 27.766 1.00 21.18 C ATOM 2153 CG PRO A 594 -11.348 15.773 27.447 1.00 25.07 C ATOM 2154 CD PRO A 594 -11.453 16.945 28.364 1.00 22.31 C ATOM 2155 N ALA A 595 -15.613 14.663 28.931 1.00 26.29 N ATOM 2156 CA ALA A 595 -16.485 14.044 29.945 1.00 27.44 C ATOM 2157 C ALA A 595 -15.681 13.068 30.785 1.00 31.30 C ATOM 2158 O ALA A 595 -14.927 12.264 30.239 1.00 30.04 O ATOM 2159 CB ALA A 595 -17.634 13.313 29.266 1.00 29.00 C ATOM 2160 H ALA A 595 -15.858 14.560 27.925 1.00 0.00 H ATOM 2161 N GLY A 596 -15.778 13.207 32.104 1.00 30.26 N ATOM 2162 CA GLY A 596 -15.095 12.324 33.045 1.00 30.00 C ATOM 2163 C GLY A 596 -13.615 12.579 33.208 1.00 32.49 C ATOM 2164 O GLY A 596 -12.935 11.852 33.937 1.00 31.78 O ATOM 2165 H GLY A 596 -16.366 13.978 32.481 1.00 0.00 H ATOM 2166 N CYS A 597 -13.094 13.622 32.543 1.00 27.12 N ATOM 2167 CA CYS A 597 -11.677 13.934 32.668 1.00 24.86 C ATOM 2168 C CYS A 597 -11.438 14.656 34.002 1.00 28.38 C ATOM 2169 O CYS A 597 -12.100 15.663 34.245 1.00 26.77 O ATOM 2170 CB CYS A 597 -11.201 14.773 31.489 1.00 23.49 C ATOM 2171 SG CYS A 597 -9.480 15.292 31.633 1.00 25.98 S ATOM 2172 H CYS A 597 -13.703 14.208 31.937 1.00 0.00 H ATOM 2173 N PRO A 598 -10.495 14.196 34.864 1.00 27.20 N ATOM 2174 CA PRO A 598 -10.262 14.906 36.140 1.00 28.26 C ATOM 2175 C PRO A 598 -9.816 16.346 35.911 1.00 31.02 C ATOM 2176 O PRO A 598 -9.111 16.644 34.933 1.00 29.15 O ATOM 2177 CB PRO A 598 -9.145 14.088 36.804 1.00 30.59 C ATOM 2178 CG PRO A 598 -9.206 12.753 36.155 1.00 33.51 C ATOM 2179 CD PRO A 598 -9.631 12.999 34.749 1.00 28.13 C ATOM 2180 N ARG A 599 -10.268 17.244 36.786 1.00 27.67 N ATOM 2181 CA ARG A 599 -9.952 18.678 36.723 1.00 27.79 C ATOM 2182 C ARG A 599 -8.435 18.936 36.647 1.00 30.87 C ATOM 2183 O ARG A 599 -8.003 19.815 35.903 1.00 29.53 O ATOM 2184 CB ARG A 599 -10.563 19.410 37.940 1.00 30.05 C ATOM 2185 H ARG A 599 -10.880 16.911 37.558 1.00 0.00 H ATOM 2186 N GLU A 600 -7.636 18.159 37.404 1.00 28.14 N ATOM 2187 CA GLU A 600 -6.182 18.309 37.428 1.00 27.54 C ATOM 2188 C GLU A 600 -5.580 18.035 36.041 1.00 26.49 C ATOM 2189 O GLU A 600 -4.617 18.686 35.662 1.00 23.74 O ATOM 2190 CB GLU A 600 -5.549 17.396 38.480 1.00 29.87 C ATOM 2191 CG GLU A 600 -5.877 17.810 39.911 1.00 39.46 C ATOM 2192 CD GLU A 600 -7.170 17.263 40.497 1.00 61.52 C ATOM 2193 OE1 GLU A 600 -7.944 16.599 39.765 1.00 42.94 O ATOM 2194 OE2 GLU A 600 -7.395 17.482 41.710 1.00 58.24 O ATOM 2195 H GLU A 600 -8.071 17.423 37.995 1.00 0.00 H ATOM 2196 N MET A 601 -6.169 17.092 35.292 1.00 21.05 N ATOM 2197 CA MET A 601 -5.676 16.720 33.960 1.00 19.51 C ATOM 2198 C MET A 601 -6.075 17.778 32.943 1.00 21.91 C ATOM 2199 O MET A 601 -5.264 18.164 32.106 1.00 20.70 O ATOM 2200 CB MET A 601 -6.111 15.299 33.584 1.00 20.92 C ATOM 2201 CG MET A 601 -5.483 14.231 34.474 1.00 24.32 C ATOM 2202 SD MET A 601 -3.679 14.111 34.284 1.00 26.20 S ATOM 2203 CE MET A 601 -3.108 15.119 35.604 1.00 24.75 C ATOM 2204 H MET A 601 -7.007 16.605 35.669 1.00 0.00 H ATOM 2205 N TYR A 602 -7.281 18.339 33.090 1.00 20.40 N ATOM 2206 CA TYR A 602 -7.700 19.436 32.216 1.00 19.49 C ATOM 2207 C TYR A 602 -6.830 20.654 32.482 1.00 22.25 C ATOM 2208 O TYR A 602 -6.439 21.347 31.545 1.00 19.53 O ATOM 2209 CB TYR A 602 -9.177 19.783 32.403 1.00 21.16 C ATOM 2210 CG TYR A 602 -9.665 20.810 31.406 1.00 21.60 C ATOM 2211 CD1 TYR A 602 -9.477 20.626 30.039 1.00 22.04 C ATOM 2212 CD2 TYR A 602 -10.311 21.966 31.828 1.00 25.19 C ATOM 2213 CE1 TYR A 602 -9.880 21.586 29.118 1.00 21.86 C ATOM 2214 CE2 TYR A 602 -10.780 22.904 30.913 1.00 26.47 C ATOM 2215 CZ TYR A 602 -10.566 22.705 29.558 1.00 31.42 C ATOM 2216 OH TYR A 602 -10.997 23.626 28.653 1.00 29.23 O ATOM 2217 HH TYR A 602 -10.762 23.325 27.740 1.00 0.00 H ATOM 2218 H TYR A 602 -7.925 17.993 33.830 1.00 0.00 H ATOM 2219 N ASP A 603 -6.500 20.902 33.752 1.00 19.87 N ATOM 2220 CA ASP A 603 -5.631 22.015 34.117 1.00 20.47 C ATOM 2221 C ASP A 603 -4.255 21.882 33.448 1.00 23.87 C ATOM 2222 O ASP A 603 -3.733 22.869 32.940 1.00 23.82 O ATOM 2223 CB ASP A 603 -5.494 22.098 35.647 1.00 23.60 C ATOM 2224 CG ASP A 603 -6.771 22.564 36.344 1.00 33.57 C ATOM 2225 OD1 ASP A 603 -7.725 22.989 35.636 1.00 34.78 O ATOM 2226 OD2 ASP A 603 -6.826 22.491 37.585 1.00 35.75 O ATOM 2227 H ASP A 603 -6.873 20.285 34.501 1.00 0.00 H ATOM 2228 N LEU A 604 -3.692 20.660 33.427 1.00 21.55 N ATOM 2229 CA LEU A 604 -2.411 20.391 32.782 1.00 21.22 C ATOM 2230 C LEU A 604 -2.491 20.625 31.260 1.00 21.03 C ATOM 2231 O LEU A 604 -1.568 21.220 30.691 1.00 18.88 O ATOM 2232 CB LEU A 604 -1.918 18.966 33.109 1.00 21.45 C ATOM 2233 CG LEU A 604 -0.510 18.610 32.612 1.00 24.92 C ATOM 2234 CD1 LEU A 604 0.545 19.575 33.147 1.00 25.63 C ATOM 2235 CD2 LEU A 604 -0.176 17.183 32.943 1.00 26.31 C ATOM 2236 H LEU A 604 -4.191 19.874 33.890 1.00 0.00 H ATOM 2237 N MET A 605 -3.596 20.195 30.611 1.00 16.79 N ATOM 2238 CA MET A 605 -3.831 20.440 29.166 1.00 16.20 C ATOM 2239 C MET A 605 -3.771 21.938 28.896 1.00 20.46 C ATOM 2240 O MET A 605 -3.069 22.369 27.985 1.00 19.75 O ATOM 2241 CB MET A 605 -5.233 19.955 28.754 1.00 18.82 C ATOM 2242 CG MET A 605 -5.358 18.490 28.628 1.00 21.12 C ATOM 2243 SD MET A 605 -7.096 18.108 28.247 1.00 22.03 S ATOM 2244 CE MET A 605 -7.218 16.507 29.021 1.00 20.48 C ATOM 2245 H MET A 605 -4.314 19.669 31.148 1.00 0.00 H ATOM 2246 N ASN A 606 -4.515 22.731 29.681 1.00 17.57 N ATOM 2247 CA ASN A 606 -4.502 24.186 29.517 1.00 18.05 C ATOM 2248 C ASN A 606 -3.104 24.776 29.708 1.00 22.98 C ATOM 2249 O ASN A 606 -2.743 25.715 29.005 1.00 24.65 O ATOM 2250 CB ASN A 606 -5.527 24.855 30.431 1.00 19.10 C ATOM 2251 CG ASN A 606 -6.851 24.985 29.742 1.00 38.22 C ATOM 2252 OD1 ASN A 606 -6.964 25.631 28.704 1.00 23.64 O ATOM 2253 ND2 ASN A 606 -7.859 24.286 30.235 1.00 34.76 N ATOM 2254 HD22 ASN A 606 -7.737 23.747 31.116 1.00 0.00 H ATOM 2255 HD21 ASN A 606 -8.774 24.275 29.742 1.00 0.00 H ATOM 2256 H ASN A 606 -5.111 22.305 30.419 1.00 0.00 H ATOM 2257 N LEU A 607 -2.315 24.236 30.647 1.00 21.00 N ATOM 2258 CA LEU A 607 -0.932 24.711 30.858 1.00 22.93 C ATOM 2259 C LEU A 607 -0.076 24.405 29.608 1.00 22.97 C ATOM 2260 O LEU A 607 0.721 25.243 29.205 1.00 21.50 O ATOM 2261 CB LEU A 607 -0.321 24.089 32.132 1.00 24.81 C ATOM 2262 CG LEU A 607 1.031 24.629 32.637 1.00 32.91 C ATOM 2263 CD1 LEU A 607 0.926 26.076 33.130 1.00 35.84 C ATOM 2264 CD2 LEU A 607 1.562 23.764 33.764 1.00 37.05 C ATOM 2265 H LEU A 607 -2.684 23.466 31.240 1.00 0.00 H ATOM 2266 N CYS A 608 -0.248 23.246 29.012 1.00 18.10 N ATOM 2267 CA CYS A 608 0.449 22.872 27.782 1.00 16.95 C ATOM 2268 C CYS A 608 0.089 23.825 26.678 1.00 19.50 C ATOM 2269 O CYS A 608 0.858 24.104 25.831 1.00 20.67 O ATOM 2270 CB CYS A 608 0.127 21.416 27.374 1.00 15.47 C ATOM 2271 SG CYS A 608 0.823 20.167 28.459 1.00 18.54 S ATOM 2272 H CYS A 608 -0.910 22.564 29.434 1.00 0.00 H ATOM 2273 N TRP A 609 -1.119 24.338 26.742 1.00 16.76 N ATOM 2274 CA TRP A 609 -1.670 25.201 25.718 1.00 16.54 C ATOM 2275 C TRP A 609 -1.404 26.685 26.014 1.00 21.89 C ATOM 2276 O TRP A 609 -2.202 27.513 25.718 1.00 20.16 O ATOM 2277 CB TRP A 609 -3.171 24.957 25.507 1.00 16.14 C ATOM 2278 CG TRP A 609 -3.527 23.608 25.022 1.00 15.93 C ATOM 2279 CD1 TRP A 609 -2.768 22.777 24.318 1.00 17.86 C ATOM 2280 CD2 TRP A 609 -4.761 22.943 25.217 1.00 15.83 C ATOM 2281 NE1 TRP A 609 -3.423 21.624 24.048 1.00 16.68 N ATOM 2282 CE2 TRP A 609 -4.657 21.695 24.612 1.00 18.03 C ATOM 2283 CE3 TRP A 609 -5.941 23.270 25.874 1.00 17.50 C ATOM 2284 CZ2 TRP A 609 -5.691 20.777 24.635 1.00 16.82 C ATOM 2285 CZ3 TRP A 609 -6.941 22.364 25.890 1.00 19.38 C ATOM 2286 CH2 TRP A 609 -6.823 21.148 25.270 1.00 19.10 C ATOM 2287 HE1 TRP A 609 -3.047 20.822 23.503 1.00 0.00 H ATOM 2288 H TRP A 609 -1.708 24.113 27.569 1.00 0.00 H ATOM 2289 N THR A 610 -0.275 26.973 26.626 1.00 20.41 N ATOM 2290 CA THR A 610 0.115 28.345 26.884 1.00 20.27 C ATOM 2291 C THR A 610 0.577 28.970 25.573 1.00 21.93 C ATOM 2292 O THR A 610 1.457 28.470 24.935 1.00 19.42 O ATOM 2293 CB THR A 610 1.233 28.416 27.919 1.00 23.61 C ATOM 2294 OG1 THR A 610 0.831 27.847 29.128 1.00 22.72 O ATOM 2295 CG2 THR A 610 1.695 29.809 28.159 1.00 22.05 C ATOM 2296 HG1 THR A 610 0.593 26.897 28.981 1.00 0.00 H ATOM 2297 H THR A 610 0.350 26.200 26.931 1.00 0.00 H ATOM 2298 N TYR A 611 -0.052 30.074 25.206 1.00 21.12 N ATOM 2299 CA TYR A 611 0.215 30.763 23.954 1.00 21.95 C ATOM 2300 C TYR A 611 1.674 31.202 23.860 1.00 28.42 C ATOM 2301 O TYR A 611 2.323 30.910 22.864 1.00 25.72 O ATOM 2302 CB TYR A 611 -0.751 31.955 23.772 1.00 22.49 C ATOM 2303 CG TYR A 611 -0.694 32.552 22.376 1.00 23.25 C ATOM 2304 CD1 TYR A 611 -1.543 32.105 21.369 1.00 23.88 C ATOM 2305 CD2 TYR A 611 0.238 33.532 22.055 1.00 25.32 C ATOM 2306 CE1 TYR A 611 -1.472 32.628 20.077 1.00 22.78 C ATOM 2307 CE2 TYR A 611 0.319 34.060 20.767 1.00 26.14 C ATOM 2308 CZ TYR A 611 -0.552 33.622 19.788 1.00 25.68 C ATOM 2309 OH TYR A 611 -0.497 34.170 18.531 1.00 29.37 O ATOM 2310 HH TYR A 611 -1.184 33.746 17.957 1.00 0.00 H ATOM 2311 H TYR A 611 -0.773 30.468 25.844 1.00 0.00 H ATOM 2312 N ASP A 612 2.209 31.786 24.915 1.00 28.96 N ATOM 2313 CA ASP A 612 3.574 32.265 24.863 1.00 30.10 C ATOM 2314 C ASP A 612 4.525 31.156 25.223 1.00 32.46 C ATOM 2315 O ASP A 612 4.513 30.682 26.303 1.00 30.83 O ATOM 2316 CB ASP A 612 3.770 33.453 25.789 1.00 33.40 C ATOM 2317 CG ASP A 612 5.126 34.129 25.616 1.00 50.20 C ATOM 2318 OD1 ASP A 612 5.782 33.912 24.593 1.00 51.14 O ATOM 2319 OD2 ASP A 612 5.509 34.890 26.514 1.00 57.08 O ATOM 2320 H ASP A 612 1.650 31.902 25.784 1.00 0.00 H ATOM 2321 N VAL A 613 5.399 30.842 24.289 1.00 30.00 N ATOM 2322 CA VAL A 613 6.347 29.743 24.407 1.00 30.44 C ATOM 2323 C VAL A 613 7.235 29.879 25.605 1.00 33.69 C ATOM 2324 O VAL A 613 7.551 28.927 26.227 1.00 33.27 O ATOM 2325 CB VAL A 613 7.257 29.644 23.182 1.00 36.18 C ATOM 2326 CG1 VAL A 613 7.847 28.270 23.079 1.00 35.11 C ATOM 2327 CG2 VAL A 613 6.538 30.005 21.931 1.00 36.35 C ATOM 2328 H VAL A 613 5.413 31.411 23.418 1.00 0.00 H ATOM 2329 N GLU A 614 7.645 31.097 25.923 1.00 32.06 N ATOM 2330 CA GLU A 614 8.500 31.308 27.076 1.00 33.83 C ATOM 2331 C GLU A 614 7.875 30.881 28.381 1.00 38.01 C ATOM 2332 O GLU A 614 8.499 30.257 29.186 1.00 39.36 O ATOM 2333 CB GLU A 614 8.959 32.772 27.144 1.00 37.22 C ATOM 2334 H GLU A 614 7.352 31.908 25.342 1.00 0.00 H ATOM 2335 N ASN A 615 6.610 31.188 28.550 1.00 32.19 N ATOM 2336 CA ASN A 615 5.839 30.821 29.744 1.00 31.86 C ATOM 2337 C ASN A 615 5.295 29.379 29.735 1.00 31.64 C ATOM 2338 O ASN A 615 4.777 28.925 30.752 1.00 31.77 O ATOM 2339 CB ASN A 615 4.723 31.822 29.972 1.00 32.24 C ATOM 2340 CG ASN A 615 5.263 33.198 30.322 1.00 60.08 C ATOM 2341 OD1 ASN A 615 6.017 33.368 31.290 1.00 56.27 O ATOM 2342 ND2 ASN A 615 4.941 34.200 29.513 1.00 48.58 N ATOM 2343 HD22 ASN A 615 4.306 34.034 28.706 1.00 0.00 H ATOM 2344 HD21 ASN A 615 5.324 35.151 29.686 1.00 0.00 H ATOM 2345 H ASN A 615 6.128 31.720 27.797 1.00 0.00 H ATOM 2346 N ARG A 616 5.370 28.687 28.590 1.00 24.83 N ATOM 2347 CA ARG A 616 4.870 27.317 28.489 1.00 22.41 C ATOM 2348 C ARG A 616 5.815 26.381 29.247 1.00 25.91 C ATOM 2349 O ARG A 616 7.022 26.584 29.151 1.00 27.62 O ATOM 2350 CB ARG A 616 4.816 26.900 27.011 1.00 20.14 C ATOM 2351 CG ARG A 616 3.929 25.683 26.766 1.00 19.16 C ATOM 2352 CD ARG A 616 3.888 25.322 25.286 1.00 18.88 C ATOM 2353 NE ARG A 616 3.398 26.444 24.484 1.00 20.35 N ATOM 2354 CZ ARG A 616 3.800 26.727 23.251 1.00 27.26 C ATOM 2355 NH1 ARG A 616 4.681 25.947 22.640 1.00 15.67 N ATOM 2356 NH2 ARG A 616 3.337 27.805 22.625 1.00 20.31 N ATOM 2357 HE ARG A 616 2.682 27.065 24.912 1.00 0.00 H ATOM 2358 HH12 ARG A 616 4.993 26.172 21.674 1.00 0.00 H ATOM 2359 HH11 ARG A 616 5.060 25.110 23.127 1.00 0.00 H ATOM 2360 HH22 ARG A 616 3.655 28.022 21.659 1.00 0.00 H ATOM 2361 HH21 ARG A 616 2.657 28.431 23.101 1.00 0.00 H ATOM 2362 H ARG A 616 5.794 29.135 27.753 1.00 0.00 H ATOM 2363 N PRO A 617 5.344 25.373 30.012 1.00 22.74 N ATOM 2364 CA PRO A 617 6.300 24.478 30.693 1.00 23.75 C ATOM 2365 C PRO A 617 7.027 23.567 29.699 1.00 24.33 C ATOM 2366 O PRO A 617 6.534 23.322 28.585 1.00 21.08 O ATOM 2367 CB PRO A 617 5.382 23.613 31.579 1.00 25.48 C ATOM 2368 CG PRO A 617 4.102 23.552 30.821 1.00 26.62 C ATOM 2369 CD PRO A 617 3.948 24.959 30.293 1.00 23.12 C ATOM 2370 N GLY A 618 8.160 23.051 30.147 1.00 21.74 N ATOM 2371 CA GLY A 618 8.945 22.049 29.438 1.00 20.15 C ATOM 2372 C GLY A 618 8.473 20.666 29.857 1.00 22.60 C ATOM 2373 O GLY A 618 7.667 20.536 30.792 1.00 22.29 O ATOM 2374 H GLY A 618 8.514 23.383 31.067 1.00 0.00 H ATOM 2375 N PHE A 619 9.024 19.608 29.241 1.00 19.46 N ATOM 2376 CA PHE A 619 8.588 18.250 29.605 1.00 18.55 C ATOM 2377 C PHE A 619 9.019 17.838 31.019 1.00 25.60 C ATOM 2378 O PHE A 619 8.327 17.023 31.617 1.00 23.79 O ATOM 2379 CB PHE A 619 8.962 17.197 28.575 1.00 17.84 C ATOM 2380 CG PHE A 619 8.015 17.169 27.392 1.00 16.22 C ATOM 2381 CD1 PHE A 619 8.430 17.604 26.145 1.00 16.10 C ATOM 2382 CD2 PHE A 619 6.717 16.677 27.527 1.00 15.39 C ATOM 2383 CE1 PHE A 619 7.562 17.582 25.050 1.00 15.24 C ATOM 2384 CE2 PHE A 619 5.853 16.611 26.419 1.00 17.00 C ATOM 2385 CZ PHE A 619 6.285 17.047 25.181 1.00 14.15 C ATOM 2386 H PHE A 619 9.753 19.747 28.512 1.00 0.00 H ATOM 2387 N ALA A 620 10.082 18.445 31.585 1.00 25.18 N ATOM 2388 CA ALA A 620 10.463 18.133 32.973 1.00 26.97 C ATOM 2389 C ALA A 620 9.313 18.526 33.938 1.00 28.48 C ATOM 2390 O ALA A 620 8.886 17.685 34.728 1.00 28.53 O ATOM 2391 CB ALA A 620 11.761 18.831 33.360 1.00 29.55 C ATOM 2392 H ALA A 620 10.635 19.136 31.039 1.00 0.00 H ATOM 2393 N ALA A 621 8.737 19.735 33.782 1.00 23.96 N ATOM 2394 CA ALA A 621 7.619 20.194 34.603 1.00 24.57 C ATOM 2395 C ALA A 621 6.362 19.367 34.342 1.00 27.94 C ATOM 2396 O ALA A 621 5.700 18.974 35.294 1.00 27.87 O ATOM 2397 CB ALA A 621 7.345 21.671 34.371 1.00 25.80 C ATOM 2398 H ALA A 621 9.105 20.369 33.044 1.00 0.00 H ATOM 2399 N VAL A 622 6.056 19.067 33.063 1.00 22.34 N ATOM 2400 CA VAL A 622 4.869 18.303 32.674 1.00 20.73 C ATOM 2401 C VAL A 622 4.893 16.880 33.254 1.00 22.89 C ATOM 2402 O VAL A 622 3.893 16.455 33.844 1.00 24.00 O ATOM 2403 CB VAL A 622 4.642 18.302 31.130 1.00 22.29 C ATOM 2404 CG1 VAL A 622 3.508 17.338 30.748 1.00 20.40 C ATOM 2405 CG2 VAL A 622 4.334 19.711 30.626 1.00 22.09 C ATOM 2406 H VAL A 622 6.697 19.396 32.313 1.00 0.00 H ATOM 2407 N GLU A 623 6.017 16.143 33.058 1.00 18.43 N ATOM 2408 CA GLU A 623 6.188 14.771 33.555 1.00 18.34 C ATOM 2409 C GLU A 623 6.087 14.786 35.102 1.00 23.85 C ATOM 2410 O GLU A 623 5.476 13.879 35.670 1.00 24.39 O ATOM 2411 CB GLU A 623 7.559 14.199 33.096 1.00 18.92 C ATOM 2412 CG GLU A 623 7.810 12.741 33.488 1.00 21.81 C ATOM 2413 CD GLU A 623 8.215 12.470 34.928 1.00 36.70 C ATOM 2414 OE1 GLU A 623 8.974 13.286 35.491 1.00 31.36 O ATOM 2415 OE2 GLU A 623 7.765 11.455 35.504 1.00 27.34 O ATOM 2416 H GLU A 623 6.800 16.574 32.526 1.00 0.00 H ATOM 2417 N LEU A 624 6.645 15.809 35.771 1.00 22.83 N ATOM 2418 CA LEU A 624 6.566 15.861 37.252 1.00 25.71 C ATOM 2419 C LEU A 624 5.113 16.005 37.752 1.00 31.82 C ATOM 2420 O LEU A 624 4.711 15.332 38.713 1.00 32.76 O ATOM 2421 CB LEU A 624 7.505 16.931 37.864 1.00 26.87 C ATOM 2422 CG LEU A 624 7.555 17.020 39.433 1.00 34.14 C ATOM 2423 CD1 LEU A 624 7.942 15.675 40.085 1.00 34.72 C ATOM 2424 CD2 LEU A 624 8.496 18.110 39.895 1.00 37.22 C ATOM 2425 H LEU A 624 7.133 16.565 35.250 1.00 0.00 H ATOM 2426 N ARG A 625 4.326 16.858 37.089 1.00 28.63 N ATOM 2427 CA ARG A 625 2.917 17.057 37.439 1.00 28.83 C ATOM 2428 C ARG A 625 2.126 15.767 37.256 1.00 29.47 C ATOM 2429 O ARG A 625 1.327 15.419 38.130 1.00 28.97 O ATOM 2430 CB ARG A 625 2.287 18.188 36.608 1.00 28.96 C ATOM 2431 CG ARG A 625 2.430 19.558 37.247 1.00 41.53 C ATOM 2432 H ARG A 625 4.728 17.399 36.297 1.00 0.00 H ATOM 2433 N LEU A 626 2.331 15.070 36.121 1.00 23.18 N ATOM 2434 CA LEU A 626 1.654 13.823 35.836 1.00 23.05 C ATOM 2435 C LEU A 626 2.044 12.732 36.803 1.00 27.10 C ATOM 2436 O LEU A 626 1.180 11.963 37.213 1.00 27.76 O ATOM 2437 CB LEU A 626 1.924 13.341 34.384 1.00 21.58 C ATOM 2438 CG LEU A 626 0.937 13.837 33.364 1.00 23.75 C ATOM 2439 CD1 LEU A 626 1.421 13.540 31.960 1.00 21.32 C ATOM 2440 CD2 LEU A 626 -0.446 13.225 33.589 1.00 24.08 C ATOM 2441 H LEU A 626 3.003 15.444 35.421 1.00 0.00 H ATOM 2442 N ARG A 627 3.344 12.632 37.126 1.00 24.71 N ATOM 2443 CA ARG A 627 3.881 11.639 38.051 1.00 25.95 C ATOM 2444 C ARG A 627 3.219 11.761 39.425 1.00 30.78 C ATOM 2445 O ARG A 627 2.740 10.756 39.951 1.00 31.31 O ATOM 2446 CB ARG A 627 5.397 11.819 38.188 1.00 29.08 C ATOM 2447 CG ARG A 627 6.111 10.628 38.819 1.00 36.14 C ATOM 2448 CD ARG A 627 7.406 11.049 39.475 1.00 38.67 C ATOM 2449 NE ARG A 627 8.309 11.694 38.520 1.00 44.15 N ATOM 2450 CZ ARG A 627 9.444 12.297 38.854 1.00 57.10 C ATOM 2451 NH1 ARG A 627 9.840 12.330 40.121 1.00 42.82 N ATOM 2452 NH2 ARG A 627 10.200 12.861 37.921 1.00 37.56 N ATOM 2453 HE ARG A 627 8.044 11.679 37.514 1.00 0.00 H ATOM 2454 HH12 ARG A 627 10.730 12.804 40.375 1.00 0.00 H ATOM 2455 HH11 ARG A 627 9.260 11.882 40.859 1.00 0.00 H ATOM 2456 HH22 ARG A 627 11.088 13.332 38.186 1.00 0.00 H ATOM 2457 HH21 ARG A 627 9.904 12.832 36.924 1.00 0.00 H ATOM 2458 H ARG A 627 4.008 13.303 36.690 1.00 0.00 H ATOM 2459 N ASN A 628 3.167 12.996 39.981 1.00 28.90 N ATOM 2460 CA ASN A 628 2.576 13.287 41.288 1.00 29.92 C ATOM 2461 C ASN A 628 1.095 13.008 41.313 1.00 33.90 C ATOM 2462 O ASN A 628 0.620 12.415 42.285 1.00 32.66 O ATOM 2463 CB ASN A 628 2.874 14.718 41.740 1.00 29.92 C ATOM 2464 CG ASN A 628 4.333 14.950 42.060 1.00 43.32 C ATOM 2465 OD1 ASN A 628 5.096 14.017 42.341 1.00 35.26 O ATOM 2466 ND2 ASN A 628 4.741 16.205 42.070 1.00 36.74 N ATOM 2467 HD22 ASN A 628 4.078 16.969 41.830 1.00 0.00 H ATOM 2468 HD21 ASN A 628 5.726 16.430 42.318 1.00 0.00 H ATOM 2469 H ASN A 628 3.574 13.788 39.444 1.00 0.00 H ATOM 2470 N TYR A 629 0.363 13.404 40.243 1.00 29.66 N ATOM 2471 CA TYR A 629 -1.078 13.141 40.155 1.00 29.34 C ATOM 2472 C TYR A 629 -1.348 11.647 40.038 1.00 32.17 C ATOM 2473 O TYR A 629 -2.282 11.147 40.672 1.00 33.25 O ATOM 2474 CB TYR A 629 -1.779 13.920 39.009 1.00 29.59 C ATOM 2475 CG TYR A 629 -3.285 13.852 39.155 1.00 31.36 C ATOM 2476 CD1 TYR A 629 -3.923 14.413 40.259 1.00 34.20 C ATOM 2477 CD2 TYR A 629 -4.061 13.118 38.260 1.00 31.11 C ATOM 2478 CE1 TYR A 629 -5.296 14.279 40.449 1.00 35.82 C ATOM 2479 CE2 TYR A 629 -5.445 13.016 38.417 1.00 32.00 C ATOM 2480 CZ TYR A 629 -6.054 13.577 39.527 1.00 42.89 C ATOM 2481 OH TYR A 629 -7.413 13.458 39.722 1.00 44.91 O ATOM 2482 HH TYR A 629 -7.666 13.918 40.561 1.00 0.00 H ATOM 2483 H TYR A 629 0.835 13.907 39.465 1.00 0.00 H ATOM 2484 N TYR A 630 -0.530 10.934 39.244 1.00 27.55 N ATOM 2485 CA TYR A 630 -0.669 9.481 39.088 1.00 26.58 C ATOM 2486 C TYR A 630 -0.462 8.745 40.429 1.00 31.72 C ATOM 2487 O TYR A 630 -1.268 7.876 40.774 1.00 32.32 O ATOM 2488 CB TYR A 630 0.246 8.928 37.978 1.00 25.19 C ATOM 2489 CG TYR A 630 0.077 7.437 37.771 1.00 26.82 C ATOM 2490 CD1 TYR A 630 -1.158 6.895 37.424 1.00 28.50 C ATOM 2491 CD2 TYR A 630 1.140 6.562 37.970 1.00 28.15 C ATOM 2492 CE1 TYR A 630 -1.323 5.521 37.251 1.00 28.71 C ATOM 2493 CE2 TYR A 630 0.985 5.185 37.810 1.00 29.58 C ATOM 2494 CZ TYR A 630 -0.247 4.672 37.437 1.00 35.16 C ATOM 2495 OH TYR A 630 -0.411 3.320 37.286 1.00 34.24 O ATOM 2496 HH TYR A 630 -1.345 3.130 37.019 1.00 0.00 H ATOM 2497 H TYR A 630 0.224 11.427 38.725 1.00 0.00 H ATOM 2498 N TYR A 631 0.550 9.154 41.224 1.00 30.53 N ATOM 2499 CA TYR A 631 0.772 8.561 42.560 1.00 32.96 C ATOM 2500 C TYR A 631 -0.380 8.858 43.527 1.00 37.25 C ATOM 2501 O TYR A 631 -0.693 8.018 44.385 1.00 37.20 O ATOM 2502 CB TYR A 631 2.116 8.994 43.178 1.00 36.03 C ATOM 2503 CG TYR A 631 3.349 8.611 42.385 1.00 38.08 C ATOM 2504 CD1 TYR A 631 3.335 7.530 41.507 1.00 38.66 C ATOM 2505 CD2 TYR A 631 4.545 9.298 42.550 1.00 40.38 C ATOM 2506 CE1 TYR A 631 4.455 7.201 40.747 1.00 39.44 C ATOM 2507 CE2 TYR A 631 5.695 8.925 41.859 1.00 40.81 C ATOM 2508 CZ TYR A 631 5.640 7.889 40.941 1.00 48.28 C ATOM 2509 OH TYR A 631 6.775 7.540 40.245 1.00 50.76 O ATOM 2510 HH TYR A 631 6.568 6.788 39.635 1.00 0.00 H ATOM 2511 H TYR A 631 1.188 9.904 40.889 1.00 0.00 H ATOM 2512 N ASP A 632 -1.026 10.051 43.383 1.00 33.93 N ATOM 2513 CA ASP A 632 -2.172 10.448 44.203 1.00 35.43 C ATOM 2514 C ASP A 632 -3.367 9.546 43.877 1.00 38.60 C ATOM 2515 O ASP A 632 -4.108 9.147 44.771 1.00 38.61 O ATOM 2516 CB ASP A 632 -2.567 11.912 43.928 1.00 37.91 C ATOM 2517 CG ASP A 632 -1.615 12.972 44.452 1.00 58.84 C ATOM 2518 OD1 ASP A 632 -0.948 12.719 45.476 1.00 61.75 O ATOM 2519 OD2 ASP A 632 -1.566 14.074 43.853 1.00 68.10 O ATOM 2520 H ASP A 632 -0.687 10.711 42.654 1.00 0.00 H ATOM 2521 N VAL A 633 -3.562 9.305 42.602 1.00 33.21 N ATOM 2522 CA VAL A 633 -4.568 8.431 42.128 1.00 34.15 C ATOM 2523 C VAL A 633 -4.303 7.003 42.528 1.00 40.03 C ATOM 2524 O VAL A 633 -5.197 6.302 42.810 1.00 42.59 O ATOM 2525 CB VAL A 633 -4.729 8.545 40.605 1.00 37.09 C ATOM 2526 CG1 VAL A 633 -5.688 7.506 40.088 1.00 37.01 C ATOM 2527 CG2 VAL A 633 -5.144 9.946 40.231 1.00 36.61 C ATOM 2528 H VAL A 633 -2.949 9.778 41.908 1.00 0.00 H ATOM 2529 N VAL A 634 -3.066 6.575 42.479 1.00 36.89 N ATOM 2530 CA VAL A 634 -2.723 5.218 42.807 1.00 38.47 C ATOM 2531 C VAL A 634 -3.078 5.005 44.287 1.00 44.81 C ATOM 2532 O VAL A 634 -3.552 3.967 44.648 1.00 46.39 O ATOM 2533 CB VAL A 634 -1.265 4.887 42.437 1.00 42.95 C ATOM 2534 CG1 VAL A 634 -0.797 3.629 43.116 1.00 44.95 C ATOM 2535 CG2 VAL A 634 -1.136 4.727 40.944 1.00 40.46 C ATOM 2536 H VAL A 634 -2.313 7.234 42.196 1.00 0.00 H ATOM 2537 N ASN A 635 -2.838 6.010 45.113 1.00 42.62 N ATOM 2538 CA ASN A 635 -3.224 6.016 46.521 1.00 45.97 C ATOM 2539 C ASN A 635 -4.702 5.953 46.855 1.00 54.22 C ATOM 2540 O ASN A 635 -5.113 5.194 47.675 1.00 55.29 O ATOM 2541 CB ASN A 635 -2.688 7.248 47.202 1.00 45.15 C ATOM 2542 CG ASN A 635 -2.828 7.179 48.711 1.00 67.61 C ATOM 2543 OD1 ASN A 635 -3.097 6.134 49.272 1.00 58.76 O ATOM 2544 ND2 ASN A 635 -2.638 8.292 49.360 1.00 59.56 N ATOM 2545 HD22 ASN A 635 -2.410 9.164 48.841 1.00 0.00 H ATOM 2546 HD21 ASN A 635 -2.715 8.309 50.397 1.00 0.00 H ATOM 2547 H ASN A 635 -2.345 6.845 44.737 1.00 0.00 H ATOM 2548 N HIS A 636 -5.510 6.727 46.176 1.00 52.68 N ATOM 2549 CA HIS A 636 -6.966 6.745 46.370 1.00 54.21 C ATOM 2550 C HIS A 636 -7.622 5.398 46.017 1.00 59.13 C ATOM 2551 O HIS A 636 -8.516 4.951 46.739 1.00 60.14 O ATOM 2552 CB HIS A 636 -7.621 7.894 45.584 1.00 53.60 C ATOM 2553 H HIS A 636 -5.100 7.362 45.462 1.00 0.00 H ATOM 2554 N HIS A 637 -7.147 4.746 44.932 1.00 54.07 N ATOM 2555 CA HIS A 637 -7.651 3.454 44.446 1.00 82.15 C ATOM 2556 C HIS A 637 -7.430 2.292 45.423 1.00103.09 C ATOM 2557 O HIS A 637 -6.666 2.408 46.379 1.00 65.49 O ATOM 2558 CB HIS A 637 -7.047 3.122 43.074 1.00 80.99 C ATOM 2559 H HIS A 637 -6.369 5.191 44.404 1.00 0.00 H TER 2560 HIS A 637 HETATM 2561 O HOH 1 7.608 12.765 13.516 1.00 16.68 O HETATM 2562 O HOH 2 4.701 17.661 17.874 1.00 18.56 O HETATM 2563 O HOH 3 14.154 3.499 22.480 1.00 21.61 O HETATM 2564 O HOH 4 11.104 17.382 22.272 1.00 17.31 O HETATM 2565 O HOH 5 6.668 9.060 10.936 1.00 23.48 O HETATM 2566 O HOH 6 -4.707 27.106 27.864 1.00 20.92 O HETATM 2567 O HOH 7 -4.066 11.313 16.676 1.00 18.39 O HETATM 2568 O HOH 8 -7.408 23.698 22.838 1.00 16.81 O HETATM 2569 O HOH 9 -13.292 18.113 19.081 1.00 27.66 O HETATM 2570 O HOH 10 0.373 17.028 40.218 1.00 34.60 O HETATM 2571 O HOH 11 -3.921 22.978 18.761 1.00 16.07 O HETATM 2572 O HOH 12 -14.111 15.440 24.666 1.00 25.80 O HETATM 2573 O HOH 13 -15.076 22.451 29.756 1.00 32.35 O HETATM 2574 O HOH 14 21.313 19.798 20.162 1.00 24.91 O HETATM 2575 O HOH 15 -7.872 11.120 18.555 1.00 31.71 O HETATM 2576 O HOH 16 -5.305 11.240 14.253 1.00 25.46 O HETATM 2577 O HOH 17 -2.117 31.102 26.909 1.00 23.10 O HETATM 2578 O HOH 18 8.803 -12.120 3.690 1.00 40.93 O HETATM 2579 O HOH 19 -1.958 33.315 16.465 1.00 26.30 O HETATM 2580 O HOH 20 21.206 19.109 13.788 1.00 27.18 O HETATM 2581 O HOH 21 -3.250 24.413 16.509 1.00 23.74 O HETATM 2582 O HOH 22 2.869 5.968 34.513 1.00 29.18 O HETATM 2583 O HOH 23 12.289 7.512 30.991 1.00 31.64 O HETATM 2584 O HOH 24 -4.631 19.047 11.683 1.00 22.64 O HETATM 2585 O HOH 25 12.010 24.083 24.214 1.00 21.18 O HETATM 2586 O HOH 26 -5.714 8.758 13.248 1.00 36.42 O HETATM 2587 O HOH 27 4.184 -12.856 16.893 1.00 31.34 O HETATM 2588 O HOH 28 -5.053 0.324 18.293 1.00 20.61 O HETATM 2589 O HOH 29 10.344 21.881 32.572 1.00 29.71 O HETATM 2590 O HOH 30 5.455 11.683 11.414 1.00 27.44 O HETATM 2591 O HOH 31 -14.548 11.568 27.562 1.00 26.94 O HETATM 2592 O HOH 32 15.844 14.220 10.696 1.00 34.12 O HETATM 2593 O HOH 33 17.477 16.091 12.053 1.00 28.74 O HETATM 2594 O HOH 34 16.502 6.482 28.529 1.00 33.87 O HETATM 2595 O HOH 35 -15.791 0.133 23.968 1.00 39.25 O HETATM 2596 O HOH 36 20.645 -9.944 11.386 1.00 47.06 O HETATM 2597 O HOH 37 0.878 32.920 27.363 1.00 37.95 O HETATM 2598 O HOH 38 25.041 22.405 22.941 1.00 30.68 O HETATM 2599 O HOH 39 12.141 10.276 31.254 1.00 26.00 O HETATM 2600 O HOH 40 16.830 25.163 11.959 1.00 30.77 O HETATM 2601 O HOH 41 11.919 1.038 24.053 1.00 32.27 O HETATM 2602 O HOH 42 -3.545 28.505 10.382 1.00 37.74 O HETATM 2603 O HOH 43 -5.723 -3.347 19.594 1.00 38.96 O HETATM 2604 O HOH 44 5.684 11.664 8.649 1.00 33.61 O HETATM 2605 O HOH 45 -11.981 11.249 30.438 1.00 26.04 O HETATM 2606 O HOH 46 -8.547 0.268 32.428 1.00 25.62 O HETATM 2607 O HOH 47 16.234 2.469 18.312 1.00 31.99 O HETATM 2608 O HOH 48 17.637 12.288 10.557 1.00 33.37 O HETATM 2609 O HOH 49 19.525 12.409 26.642 1.00 30.55 O HETATM 2610 O HOH 50 3.676 30.991 20.570 1.00 30.17 O HETATM 2611 O HOH 51 13.801 22.817 22.434 1.00 23.88 O HETATM 2612 O HOH 52 2.696 1.497 35.576 1.00 36.07 O HETATM 2613 O HOH 53 -3.309 31.013 16.967 1.00 27.20 O HETATM 2614 O HOH 54 9.036 -6.646 19.222 1.00 26.06 O HETATM 2615 O HOH 55 12.346 14.748 9.513 1.00 30.76 O HETATM 2616 O HOH 56 10.350 15.584 35.650 1.00 27.79 O HETATM 2617 O HOH 57 18.660 12.336 29.202 1.00 35.47 O HETATM 2618 O HOH 58 9.249 5.989 13.478 1.00 34.90 O HETATM 2619 O HOH 59 13.490 14.136 6.562 1.00 34.42 O HETATM 2620 O HOH 60 -8.294 10.140 16.157 1.00 34.08 O HETATM 2621 O HOH 61 12.003 20.916 30.688 1.00 36.65 O HETATM 2622 O HOH 62 9.296 24.376 32.531 1.00 34.95 O HETATM 2623 O HOH 63 15.326 15.259 8.236 1.00 33.51 O HETATM 2624 O HOH 64 21.090 13.596 21.375 1.00 30.47 O HETATM 2625 O HOH 65 23.436 18.415 21.107 1.00 39.79 O HETATM 2626 O HOH 66 12.336 11.942 8.016 1.00 29.27 O HETATM 2627 O HOH 67 3.452 21.950 18.153 1.00 18.71 O HETATM 2628 O HOH 68 14.388 4.206 19.841 1.00 29.23 O HETATM 2629 O HOH 69 -7.634 26.072 6.813 1.00 39.35 O HETATM 2630 O HOH 70 11.887 22.509 26.750 1.00 32.90 O HETATM 2631 O HOH 71 17.102 20.033 26.878 1.00 43.95 O HETATM 2632 O HOH 72 25.452 19.909 22.130 1.00 33.60 O HETATM 2633 O HOH 73 21.849 17.310 23.464 1.00 43.61 O HETATM 2634 O HOH 74 -3.633 25.370 34.036 1.00 31.29 O HETATM 2635 O HOH 75 7.042 4.415 13.345 1.00 41.65 O HETATM 2636 O HOH 76 17.364 1.983 20.762 1.00 40.46 O HETATM 2637 O HOH 77 8.167 20.456 18.018 1.00 28.82 O HETATM 2638 O HOH 78 5.629 20.421 17.198 1.00 28.47 O HETATM 2639 O HOH 79 -13.848 29.909 17.346 1.00 38.31 O HETATM 2640 O HOH 80 2.941 18.106 41.098 1.00 44.98 O HETATM 2641 O HOH 81 14.660 21.089 31.948 1.00 46.72 O HETATM 2642 O HOH 82 -4.621 -2.856 12.077 1.00 36.86 O HETATM 2643 O HOH 83 22.011 16.805 12.662 1.00 42.00 O HETATM 2644 O HOH 84 -14.261 18.565 24.725 1.00 39.30 O HETATM 2645 O HOH 85 -14.023 12.065 16.442 1.00 44.49 O HETATM 2646 O HOH 86 -13.160 -1.318 27.287 1.00 41.72 O HETATM 2647 O HOH 87 11.239 10.160 33.833 1.00 37.48 O HETATM 2648 O HOH 88 -9.219 35.183 16.080 1.00 39.52 O HETATM 2649 O HOH 89 -12.827 5.806 34.838 1.00 36.51 O HETATM 2650 O HOH 90 -0.205 -1.031 35.619 1.00 41.28 O HETATM 2651 O HOH 91 12.204 -14.743 9.621 1.00 44.55 O HETATM 2652 O HOH 92 14.737 16.854 32.177 1.00 41.30 O HETATM 2653 O HOH 93 14.967 20.300 23.483 1.00 27.04 O HETATM 2654 O HOH 94 -15.820 14.031 26.140 1.00 36.24 O HETATM 2655 O HOH 95 -16.638 18.386 26.246 1.00 55.22 O HETATM 2656 O HOH 96 -4.326 32.411 23.874 1.00 24.01 O HETATM 2657 O HOH 97 5.838 20.427 37.577 1.00 34.16 O HETATM 2658 O HOH 98 17.487 20.771 13.423 1.00 41.05 O HETATM 2659 O HOH 99 3.745 32.725 18.410 1.00 32.87 O HETATM 2660 O HOH 100 20.194 17.697 28.029 1.00 55.81 O HETATM 2661 O HOH 101 -8.663 15.534 12.752 1.00 44.41 O HETATM 2662 O HOH 102 15.213 22.116 26.800 1.00 42.78 O HETATM 2663 O HOH 103 -6.827 -5.156 21.280 1.00 49.26 O HETATM 2664 O HOH 104 -12.721 30.115 14.920 1.00 46.25 O HETATM 2665 O HOH 105 1.278 14.228 10.133 1.00 40.55 O HETATM 2666 O HOH 106 -10.510 17.395 13.630 1.00 34.30 O HETATM 2667 O HOH 107 -3.362 1.930 35.947 1.00 41.70 O HETATM 2668 O HOH 108 14.882 13.695 4.169 1.00 44.61 O HETATM 2669 O HOH 109 -11.585 8.874 31.827 1.00 36.68 O HETATM 2670 O HOH 110 18.235 23.329 15.104 1.00 22.99 O HETATM 2671 O HOH 111 17.817 28.893 20.224 1.00 36.03 O HETATM 2672 O HOH 112 9.040 26.716 19.092 1.00 35.21 O HETATM 2673 O HOH 113 10.132 29.126 19.454 1.00 43.04 O HETATM 2674 O HOH 114 -7.601 0.876 36.351 1.00 43.43 O HETATM 2675 O HOH 115 -7.788 37.348 16.974 1.00 43.94 O HETATM 2676 O HOH 116 -5.704 -4.493 33.234 1.00 47.20 O HETATM 2677 O HOH 117 2.825 37.064 16.843 1.00 29.11 O HETATM 2678 O HOH 118 19.078 -6.140 1.090 1.00 37.18 O HETATM 2679 O HOH 119 4.074 3.590 34.565 1.00 38.37 O HETATM 2680 O HOH 120 14.770 11.026 31.100 1.00 38.51 O HETATM 2681 O HOH 121 -4.481 5.711 14.061 1.00 37.04 O HETATM 2682 O HOH 122 16.636 4.116 29.812 1.00 53.98 O HETATM 2683 O HOH 123 19.946 -11.742 13.485 1.00 40.09 O HETATM 2684 O HOH 124 13.484 -17.983 11.588 1.00 51.83 O HETATM 2685 O HOH 125 17.387 -20.112 17.611 1.00 47.25 O HETATM 2686 O HOH 126 -16.550 17.998 31.083 1.00 41.24 O HETATM 2687 O HOH 127 -7.968 25.221 33.702 1.00 48.78 O HETATM 2688 O HOH 128 8.133 24.969 34.885 1.00 47.03 O HETATM 2689 O HOH 129 18.001 11.112 4.545 1.00 38.93 O HETATM 2690 O HOH 130 16.368 24.897 9.081 1.00 47.16 O HETATM 2691 O HOH 131 11.429 28.770 26.409 1.00 48.88 O HETATM 2692 O HOH 132 2.388 -3.721 30.882 1.00 40.75 O HETATM 2693 O HOH 133 8.192 -4.155 22.251 1.00 56.00 O HETATM 2694 O HOH 134 19.379 -8.374 2.587 1.00 46.97 O HETATM 2695 O HOH 135 2.080 36.826 14.327 1.00 36.90 O HETATM 2696 O HOH 136 -0.467 21.891 6.383 1.00 57.93 O HETATM 2697 O HOH 137 -3.262 26.863 15.090 1.00 36.69 O HETATM 2698 O HOH 138 -6.789 31.877 10.708 1.00 45.21 O HETATM 2699 O HOH 139 20.972 5.283 26.668 1.00 53.92 O HETATM 2700 O HOH 140 20.474 7.881 25.641 1.00 43.24 O HETATM 2701 O HOH 141 11.543 25.809 31.050 1.00 51.13 O HETATM 2702 O HOH 142 6.442 8.360 8.265 1.00 57.73 O HETATM 2703 O HOH 143 17.855 18.855 10.783 1.00 46.66 O HETATM 2704 O HOH 144 1.713 12.641 44.756 1.00 46.19 O HETATM 2705 O HOH 145 -17.189 15.973 33.078 1.00 56.43 O HETATM 2706 O HOH 146 8.623 32.162 18.678 1.00 52.07 O HETATM 2707 O HOH 147 3.851 36.081 12.377 1.00 41.56 O HETATM 2708 O HOH 148 -15.976 6.697 26.655 1.00 39.66 O HETATM 2709 O HOH 149 13.621 17.004 29.602 1.00 36.45 O HETATM 2710 O HOH 150 13.453 12.159 10.733 1.00 44.69 O HETATM 2711 O HOH 151 16.189 2.203 27.535 1.00 48.23 O HETATM 2712 O HOH 152 18.054 25.917 14.254 1.00 58.97 O HETATM 2713 O HOH 153 -10.605 30.991 9.131 1.00 53.87 O HETATM 2714 O HOH 154 -1.913 29.124 15.648 1.00 50.54 O HETATM 2715 O HOH 155 18.568 -0.005 26.799 1.00 50.06 O HETATM 2716 O HOH 156 18.230 -13.338 20.895 1.00 37.26 O HETATM 2717 O HOH 157 17.635 -10.723 20.543 1.00 50.69 O HETATM 2718 O HOH 158 21.477 -0.823 0.863 1.00 44.68 O HETATM 2719 O HOH 159 -7.545 12.525 14.978 1.00 49.99 O HETATM 2720 O HOH 160 8.747 7.976 4.256 1.00 52.33 O HETATM 2721 O HOH 161 -1.813 -5.716 15.421 1.00 45.46 O HETATM 2722 O HOH 162 6.905 -6.414 21.164 1.00 46.78 O HETATM 2723 O HOH 163 9.950 4.132 34.215 1.00 44.52 O HETATM 2724 O HOH 164 12.765 5.529 32.778 1.00 66.58 O HETATM 2725 C4 UNN A 165 1.357 4.450 10.853 1.00 -0.02 C HETATM 2726 C5 UNN A 165 1.502 3.775 12.220 1.00 0.09 C HETATM 2727 N1 UNN A 165 2.878 3.726 12.672 1.00 -0.28 N HETATM 2728 C6 UNN A 165 3.407 2.704 13.373 1.00 0.16 C HETATM 2729 N2 UNN A 165 4.676 2.846 13.792 1.00 -0.26 N HETATM 2730 N3 UNN A 165 5.190 1.860 14.551 1.00 -0.21 N HETATM 2731 C7 UNN A 165 4.452 0.763 14.846 1.00 0.22 C HETATM 2732 C8 UNN A 165 5.100 -0.287 15.722 1.00 0.25 C HETATM 2733 N4 UNN A 165 6.382 -0.109 15.993 1.00 -0.29 N HETATM 2734 H9 UNN A 165 6.868 -0.768 16.567 1.00 0.18 H HETATM 2735 H10 UNN A 165 6.865 0.685 15.624 1.00 0.18 H HETATM 2736 O UNN A 165 4.453 -1.253 16.138 1.00 -0.37 O HETATM 2737 C9 UNN A 165 3.117 0.648 14.354 1.00 0.21 C HETATM 2738 N9 UNN A 165 2.599 1.651 13.622 1.00 -0.22 N HETATM 2739 N5 UNN A 165 2.353 -0.453 14.652 1.00 -0.23 N HETATM 2740 C10 UNN A 165 1.005 -0.767 14.415 1.00 0.07 C HETATM 2741 C11 UNN A 165 0.523 -1.887 15.087 1.00 -0.04 C HETATM 2742 C12 UNN A 165 -0.809 -2.246 14.965 1.00 -0.07 C HETATM 2743 C13 UNN A 165 -1.676 -1.488 14.197 1.00 -0.03 C HETATM 2744 C14 UNN A 165 -1.203 -0.364 13.511 1.00 0.13 C HETATM 2745 C15 UNN A 165 0.145 -0.008 13.626 1.00 0.00 C HETATM 2746 H8 UNN A 165 0.521 0.862 13.099 1.00 0.05 H HETATM 2747 N6 UNN A 165 -2.127 0.460 12.801 1.00 -0.08 N HETATM 2748 N8 UNN A 165 -1.786 1.382 11.901 1.00 -0.16 N HETATM 2749 C17 UNN A 165 -2.922 1.902 11.455 1.00 0.04 C HETATM 2750 C16 UNN A 165 -4.004 1.213 12.137 1.00 0.04 C HETATM 2751 N7 UNN A 165 -3.450 0.323 12.950 1.00 -0.16 N HETATM 2752 H23 UNN A 165 -5.070 1.393 12.005 1.00 0.07 H HETATM 2753 H22 UNN A 165 -3.024 2.696 10.717 1.00 0.07 H HETATM 2754 H7 UNN A 165 -2.722 -1.765 14.127 1.00 0.05 H HETATM 2755 H6 UNN A 165 -1.176 -3.129 15.476 1.00 0.06 H HETATM 2756 H5 UNN A 165 1.190 -2.478 15.705 1.00 0.05 H HETATM 2757 H21 UNN A 165 2.870 -1.194 15.146 1.00 0.23 H HETATM 2758 H4 UNN A 165 3.490 4.522 12.443 1.00 0.19 H HETATM 2759 C UNN A 165 0.616 4.454 13.358 1.00 -0.00 C HETATM 2760 C1 UNN A 165 -0.824 4.540 12.871 1.00 -0.01 C HETATM 2761 C2 UNN A 165 -0.939 5.271 11.532 1.00 -0.05 C HETATM 2762 C3 UNN A 165 -0.107 4.595 10.441 1.00 -0.05 C HETATM 2763 H11 UNN A 165 -0.522 3.596 10.244 1.00 0.03 H HETATM 2764 H12 UNN A 165 -0.161 5.201 9.525 1.00 0.03 H HETATM 2765 H13 UNN A 165 -1.994 5.280 11.221 1.00 0.03 H HETATM 2766 H14 UNN A 165 -0.586 6.305 11.660 1.00 0.03 H HETATM 2767 H15 UNN A 165 -1.219 3.520 12.753 1.00 0.03 H HETATM 2768 H16 UNN A 165 -1.420 5.080 13.622 1.00 0.03 H HETATM 2769 N UNN A 165 1.125 5.799 13.698 1.00 0.22 N HETATM 2770 H18 UNN A 165 2.078 5.726 14.018 1.00 0.20 H HETATM 2771 H19 UNN A 165 0.555 6.200 14.427 1.00 0.20 H HETATM 2772 H20 UNN A 165 1.089 6.388 12.881 1.00 0.20 H HETATM 2773 H17 UNN A 165 0.653 3.826 14.261 1.00 0.09 H HETATM 2774 H3 UNN A 165 1.152 2.739 12.101 1.00 0.06 H HETATM 2775 H1 UNN A 165 1.880 3.843 10.099 1.00 0.03 H HETATM 2776 H2 UNN A 165 1.814 5.450 10.900 1.00 0.03 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 408 409 414 415 416 CONECT 415 408 CONECT 416 408 CONECT 2725 2726 2762 2775 2776 CONECT 2726 2725 2727 2759 2774 CONECT 2727 2726 2728 2758 CONECT 2728 2727 2729 2738 CONECT 2729 2728 2730 CONECT 2730 2729 2731 CONECT 2731 2730 2732 2737 CONECT 2732 2731 2733 2736 CONECT 2733 2732 2734 2735 CONECT 2734 2733 CONECT 2735 2733 CONECT 2736 2732 CONECT 2737 2731 2738 2739 CONECT 2738 2728 2737 CONECT 2739 2737 2740 2757 CONECT 2740 2739 2741 2745 CONECT 2741 2740 2742 2756 CONECT 2742 2741 2743 2755 CONECT 2743 2742 2744 2754 CONECT 2744 2743 2745 2747 CONECT 2745 2740 2744 2746 CONECT 2746 2745 CONECT 2747 2744 2748 2751 CONECT 2748 2747 2749 CONECT 2749 2748 2750 2753 CONECT 2750 2749 2751 2752 CONECT 2751 2747 2750 CONECT 2752 2750 CONECT 2753 2749 CONECT 2754 2743 CONECT 2755 2742 CONECT 2756 2741 CONECT 2757 2739 CONECT 2758 2727 CONECT 2759 2726 2760 2769 2773 CONECT 2760 2759 2761 2767 2768 CONECT 2761 2760 2762 2765 2766 CONECT 2762 2725 2761 2763 2764 CONECT 2763 2762 CONECT 2764 2762 CONECT 2765 2761 CONECT 2766 2761 CONECT 2767 2760 CONECT 2768 2760 CONECT 2769 2759 2770 2771 2772 CONECT 2770 2769 CONECT 2771 2769 CONECT 2772 2769 CONECT 2773 2759 CONECT 2774 2726 CONECT 2775 2725 CONECT 2776 2725 MASTER 0 0 0 0 0 0 0 0 2774 2 59 22 END
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Related entries of code: 4rx7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
1xbb
RCSB PDB
PDBbind
291aa, >1XBB_1|Chain... at 96%
1xbc
RCSB PDB
PDBbind
291aa, >1XBC_1|Chain... at 96%
3emg
RCSB PDB
PDBbind
291aa, >3EMG_1|Chain... at 98%
3fqe
RCSB PDB
PDBbind
291aa, >3FQE_1|Chain... at 96%
3fqh
RCSB PDB
PDBbind
291aa, >3FQH_1|Chains... at 96%
3fqs
RCSB PDB
PDBbind
291aa, >3FQS_1|Chain... at 96%
3srv
RCSB PDB
PDBbind
277aa, >3SRV_2|Chain... at 99%
3vf8
RCSB PDB
PDBbind
299aa, >3VF8_1|Chain... at 97%
3vf9
RCSB PDB
PDBbind
299aa, >3VF9_1|Chain... at 97%
4dfl
RCSB PDB
PDBbind
274aa, >4DFL_1|Chain... at 99%
4dfn
RCSB PDB
PDBbind
274aa, >4DFN_1|Chain... at 99%
4f4p
RCSB PDB
PDBbind
273aa, >4F4P_1|Chain... at 99%
4fl1
RCSB PDB
PDBbind
291aa, >4FL1_1|Chain... at 96%
4fl2
RCSB PDB
PDBbind
636aa, >4FL2_1|Chain... *
4fl3
RCSB PDB
PDBbind
635aa, >4FL3_1|Chain... at 99%
4fyo
RCSB PDB
PDBbind
291aa, >4FYO_1|Chain... at 96%
4fz6
RCSB PDB
PDBbind
291aa, >4FZ6_1|Chain... at 96%
4i0r
RCSB PDB
PDBbind
291aa, >4I0R_1|Chain... at 96%
4i0s
RCSB PDB
PDBbind
291aa, >4I0S_1|Chain... at 96%
4i0t
RCSB PDB
PDBbind
291aa, >4I0T_1|Chain... at 96%
4puz
RCSB PDB
PDBbind
291aa, >4PUZ_1|Chains... at 96%
4pv0
RCSB PDB
PDBbind
275aa, >4PV0_1|Chain... at 99%
4px6
RCSB PDB
PDBbind
291aa, >4PX6_1|Chain... at 95%
4rss
RCSB PDB
PDBbind
290aa, >4RSS_1|Chain... at 96%
4rx8
RCSB PDB
PDBbind
289aa, >4RX8_1|Chain... at 96%
4rx9
RCSB PDB
PDBbind
290aa, >4RX9_1|Chain... at 96%
4wnm
RCSB PDB
PDBbind
299aa, >4WNM_1|Chain... at 97%
4xg3
RCSB PDB
PDBbind
290aa, >4XG3_1|Chains... at 96%
4xg4
RCSB PDB
PDBbind
290aa, >4XG4_1|Chain... at 96%
4xg6
RCSB PDB
PDBbind
290aa, >4XG6_1|Chain... at 96%
4xg7
RCSB PDB
PDBbind
290aa, >4XG7_1|Chain... at 96%
4xg8
RCSB PDB
PDBbind
290aa, >4XG8_1|Chains... at 96%
4xg9
RCSB PDB
PDBbind
290aa, >4XG9_1|Chains... at 96%
5c26
RCSB PDB
PDBbind
299aa, >5C26_1|Chain... at 97%
5cxh
RCSB PDB
PDBbind
289aa, >5CXH_1|Chain... at 96%
5cxz
RCSB PDB
PDBbind
289aa, >5CXZ_1|Chain... at 96%
5cy3
RCSB PDB
PDBbind
291aa, >5CY3_1|Chain... at 95%
5ghv
RCSB PDB
PDBbind
290aa, >5GHV_1|Chains... at 96%
5lma
RCSB PDB
PDBbind
277aa, >5LMA_1|Chain... at 99%
5lmb
RCSB PDB
PDBbind
277aa, >5LMB_1|Chains... at 99%
5t68
RCSB PDB
PDBbind
291aa, >5T68_1|Chains... at 96%
5tiu
RCSB PDB
PDBbind
291aa, >5TIU_1|Chain... at 96%
5tr6
RCSB PDB
PDBbind
289aa, >5TR6_1|Chain... at 96%
5tt7
RCSB PDB
PDBbind
289aa, >5TT7_1|Chain... at 96%
5y5t
RCSB PDB
PDBbind
293aa, >5Y5T_1|Chain... at 95%
5y5u
RCSB PDB
PDBbind
293aa, >5Y5U_1|Chains... at 95%
6hm6
RCSB PDB
PDBbind
276aa, >6HM6_1|Chain... at 100%
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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
4rx7
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase SYK Catalytic Domain
Ligand Name
3YV
EC.Number
E.C.2.7.10.2
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50=5nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 1950-1963
Ligand Properties
Formula
C
1
8
H
2
3
N
1
0
O
Molecular Weight
395.442
Exact Mass
395.206
No. of atoms
52
No. of bonds
55
Polar Surface Area
164.17
LOGP Value
1.52 (
Computed with XLOGP3
)
1.11 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 4
Canonical SMILES
NC(=O)c1nnc(nc1Nc1cccc(c1)n1nccn1)N[C@@H]1CCCC[C@@H]1[NH3+]
InChI String
InChI=1S/C18H22N10O/c19-13-6-1-2-7-14(13)24-18-25-17(15(16(20)29)26-27-18)23-11-4-3-5-12(10-11)28-21-8-9-22-28/h3-5,8-10,13-14H,1-2,6-7,19H2,(H2,20,29)(H2,23,24,25,27)/p+1/t13-,14+/m0/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):
P43405
Entrez Gene ID
NCBI Entrez Gene ID:
6850
ASD
Information of known allosteric effects of PDB entries
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