USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 764 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 464 GLN : amide:sc= -0.544 X(o=0.12,f=-0.13) USER MOD Set 1.2: A 467 ASN : amide:sc= 0.66 K(o=0.12,f=-0.7) USER MOD Set 2.1: A 398 GLN : amide:sc= 0.219 K(o=0.37,f=-1) USER MOD Set 2.2: A 435 LYS NZ :NH3+ -125:sc= 0.149 (180deg=0.0209) USER MOD Set 3.1: A 419 GLN : amide:sc= -1.17 K(o=-1.6,f=0.44) USER MOD Set 3.2: A 423 GLN : amide:sc= -0.39 K(o=-1.6,f=-0.013) USER MOD Single : A 0 MET CE :methyl -158:sc= -0.0876 (180deg=-0.578) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -2 SER OG : rot 140:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 141:sc= 0.494 (180deg=0.0318) USER MOD Single : A 399 LYS NZ :NH3+ -170:sc=-0.00108 (180deg=-0.128) USER MOD Single : A 406 ASN : amide:sc= -2.05! C(o=-2!,f=-4.5!) USER MOD Single : A 410 TYR OH : rot 180:sc= 0 USER MOD Single : A 411 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 414 GLN : amide:sc= -1.17 K(o=-1.2,f=-2.1!) USER MOD Single : A 424 MET CE :methyl -166:sc= 0 (180deg=-0.419) USER MOD Single : A 426 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0.0552 K(o=0.055,f=-2.6!) USER MOD Single : A 433 SER OG : rot 180:sc= -0.217 USER MOD Single : A 440 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 GLN : amide:sc= 0.0233 K(o=0.023,f=-1.5!) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= 0.00826 X(o=0.0083,f=0) USER MOD Single : A 445 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 446 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 447 CYS SG : rot 180:sc= 0 USER MOD Single : A 452 SER OG : rot 180:sc= -0.696 USER MOD Single : A 453 TYR OH : rot 32:sc= 0.702 USER MOD Single : A 455 ASN : amide:sc= -0.806 K(o=-0.81,f=0) USER MOD Single : A 458 SER OG : rot 180:sc= 0.0175 USER MOD Single : A 460 GLN : amide:sc= -0.387 X(o=-0.39,f=-0.39) USER MOD Single : A 466 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 GLN : amide:sc= -1.21 K(o=-1.2,f=0) USER MOD Single : A 473 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 474 LYS NZ :NH3+ 166:sc= 0.309 (180deg=-0.0113) USER MOD Single : A 477 LYS NZ :NH3+ -175:sc= 0.0127 (180deg=0.0102) USER MOD Single : A 479 GLN : amide:sc= -0.79 K(o=-0.79,f=-0.14) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ -153:sc= -0.211 (180deg=-0.877) USER MOD Single : A 485 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 487 SER OG : rot 180:sc= 0 USER MOD Single : A 488 LYS NZ :NH3+ -153:sc= -0.726 (180deg=-1.96!) USER MOD Single : A 490 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 10.878 9.298 3.004 1.00 53.25 N ATOM 2 CA GLY A -3 10.642 8.172 3.936 1.00 43.43 C ATOM 3 C GLY A -3 10.312 8.652 5.328 1.00 73.40 C ATOM 4 O GLY A -3 10.781 9.718 5.737 1.00 70.11 O ATOM 0 H1 GLY A -3 11.664 9.061 2.365 1.00 53.25 H new ATOM 0 H2 GLY A -3 10.018 9.472 2.445 1.00 53.25 H new ATOM 0 H3 GLY A -3 11.118 10.153 3.546 1.00 53.25 H new ATOM 0 HA2 GLY A -3 9.824 7.556 3.561 1.00 43.43 H new ATOM 0 HA3 GLY A -3 11.528 7.538 3.971 1.00 43.43 H new ATOM 10 N SER A -2 9.513 7.857 6.051 1.00 21.24 N ATOM 11 CA SER A -2 9.039 8.206 7.394 1.00 61.32 C ATOM 12 C SER A -2 8.521 6.917 8.112 1.00 14.22 C ATOM 13 O SER A -2 9.297 5.960 8.222 1.00 43.24 O ATOM 14 CB SER A -2 7.993 9.340 7.282 1.00 64.44 C ATOM 15 OG SER A -2 7.630 9.853 8.556 1.00 40.45 O ATOM 0 H SER A -2 9.177 6.953 5.720 1.00 21.24 H new ATOM 0 HA SER A -2 9.845 8.594 8.017 1.00 61.32 H new ATOM 0 HB2 SER A -2 8.395 10.145 6.667 1.00 64.44 H new ATOM 0 HB3 SER A -2 7.104 8.965 6.775 1.00 64.44 H new ATOM 0 HG SER A -2 7.542 10.828 8.503 1.00 40.45 H new ATOM 21 N HIS A -1 7.253 6.863 8.612 1.00 62.35 N ATOM 22 CA HIS A -1 6.740 5.634 9.257 1.00 31.22 C ATOM 23 C HIS A -1 5.196 5.399 9.064 1.00 74.45 C ATOM 24 O HIS A -1 4.777 4.239 8.944 1.00 63.11 O ATOM 25 CB HIS A -1 7.194 5.602 10.761 1.00 14.04 C ATOM 26 CG HIS A -1 6.555 4.537 11.630 1.00 43.14 C ATOM 27 ND1 HIS A -1 7.052 3.254 11.739 1.00 5.10 N ATOM 28 CD2 HIS A -1 5.441 4.565 12.409 1.00 74.40 C ATOM 29 CE1 HIS A -1 6.281 2.548 12.547 1.00 52.24 C ATOM 30 NE2 HIS A -1 5.293 3.317 12.965 1.00 23.34 N ATOM 0 H HIS A -1 6.589 7.637 8.580 1.00 62.35 H new ATOM 0 HA HIS A -1 7.185 4.782 8.743 1.00 31.22 H new ATOM 0 HB2 HIS A -1 8.275 5.465 10.790 1.00 14.04 H new ATOM 0 HB3 HIS A -1 6.985 6.576 11.203 1.00 14.04 H new ATOM 0 HD2 HIS A -1 4.791 5.414 12.563 1.00 74.40 H new ATOM 0 HE1 HIS A -1 6.434 1.514 12.820 1.00 52.24 H new ATOM 0 HE2 HIS A -1 4.544 3.032 13.596 1.00 23.34 H new ATOM 39 N MET A 0 4.353 6.453 9.015 1.00 63.53 N ATOM 40 CA MET A 0 2.874 6.252 9.015 1.00 32.01 C ATOM 41 C MET A 0 2.194 7.194 7.962 1.00 35.42 C ATOM 42 O MET A 0 2.862 8.113 7.474 1.00 14.40 O ATOM 43 CB MET A 0 2.320 6.521 10.445 1.00 1.21 C ATOM 44 CG MET A 0 1.373 5.455 11.022 1.00 75.23 C ATOM 45 SD MET A 0 -0.283 5.499 10.308 1.00 21.22 S ATOM 46 CE MET A 0 -0.882 7.052 10.987 1.00 1.43 C ATOM 0 H MET A 0 4.652 7.427 8.976 1.00 63.53 H new ATOM 0 HA MET A 0 2.646 5.223 8.735 1.00 32.01 H new ATOM 0 HB2 MET A 0 3.165 6.631 11.124 1.00 1.21 H new ATOM 0 HB3 MET A 0 1.794 7.476 10.434 1.00 1.21 H new ATOM 0 HG2 MET A 0 1.805 4.468 10.856 1.00 75.23 H new ATOM 0 HG3 MET A 0 1.298 5.593 12.101 1.00 75.23 H new ATOM 0 HE1 MET A 0 -1.972 7.054 10.983 1.00 1.43 H new ATOM 0 HE2 MET A 0 -0.522 7.165 12.010 1.00 1.43 H new ATOM 0 HE3 MET A 0 -0.515 7.880 10.380 1.00 1.43 H new ATOM 56 N GLN A 398 0.878 6.990 7.613 1.00 75.40 N ATOM 57 CA GLN A 398 0.192 7.853 6.621 1.00 44.14 C ATOM 58 C GLN A 398 -0.276 9.192 7.254 1.00 70.23 C ATOM 59 O GLN A 398 -1.288 9.278 7.952 1.00 40.14 O ATOM 60 CB GLN A 398 -0.925 7.071 5.793 1.00 22.41 C ATOM 61 CG GLN A 398 -2.414 7.595 5.776 1.00 52.24 C ATOM 62 CD GLN A 398 -3.377 6.634 5.112 1.00 22.25 C ATOM 63 OE1 GLN A 398 -3.152 5.419 5.102 1.00 14.21 O ATOM 64 NE2 GLN A 398 -4.483 7.166 4.582 1.00 41.14 N ATOM 0 H GLN A 398 0.294 6.249 8.002 1.00 75.40 H new ATOM 0 HA GLN A 398 0.923 8.138 5.865 1.00 44.14 H new ATOM 0 HB2 GLN A 398 -0.587 7.025 4.758 1.00 22.41 H new ATOM 0 HB3 GLN A 398 -0.947 6.047 6.167 1.00 22.41 H new ATOM 0 HG2 GLN A 398 -2.740 7.776 6.800 1.00 52.24 H new ATOM 0 HG3 GLN A 398 -2.450 8.552 5.256 1.00 52.24 H new ATOM 0 HE21 GLN A 398 -4.629 8.175 4.612 1.00 41.14 H new ATOM 0 HE22 GLN A 398 -5.181 6.563 4.147 1.00 41.14 H new ATOM 73 N LYS A 399 0.609 10.190 7.153 1.00 70.33 N ATOM 74 CA LYS A 399 0.247 11.598 7.270 1.00 64.25 C ATOM 75 C LYS A 399 0.572 12.349 5.945 1.00 24.14 C ATOM 76 O LYS A 399 1.715 12.393 5.485 1.00 11.34 O ATOM 77 CB LYS A 399 0.878 12.260 8.548 1.00 4.11 C ATOM 78 CG LYS A 399 2.226 11.685 9.034 1.00 10.31 C ATOM 79 CD LYS A 399 3.357 11.962 8.069 1.00 21.22 C ATOM 80 CE LYS A 399 4.675 11.265 8.500 1.00 43.25 C ATOM 81 NZ LYS A 399 5.052 11.610 9.894 1.00 1.23 N ATOM 0 H LYS A 399 1.604 10.037 6.986 1.00 70.33 H new ATOM 0 HA LYS A 399 -0.830 11.676 7.418 1.00 64.25 H new ATOM 0 HB2 LYS A 399 1.014 13.323 8.349 1.00 4.11 H new ATOM 0 HB3 LYS A 399 0.159 12.178 9.363 1.00 4.11 H new ATOM 0 HG2 LYS A 399 2.470 12.113 10.007 1.00 10.31 H new ATOM 0 HG3 LYS A 399 2.128 10.609 9.175 1.00 10.31 H new ATOM 0 HD2 LYS A 399 3.075 11.620 7.073 1.00 21.22 H new ATOM 0 HD3 LYS A 399 3.521 13.038 8.002 1.00 21.22 H new ATOM 0 HE2 LYS A 399 4.560 10.185 8.411 1.00 43.25 H new ATOM 0 HE3 LYS A 399 5.478 11.557 7.824 1.00 43.25 H new ATOM 0 HZ1 LYS A 399 6.014 11.267 10.088 1.00 1.23 H new ATOM 0 HZ2 LYS A 399 5.021 12.642 10.017 1.00 1.23 H new ATOM 0 HZ3 LYS A 399 4.385 11.163 10.555 1.00 1.23 H new ATOM 95 N GLU A 400 -0.478 12.847 5.289 1.00 50.22 N ATOM 96 CA GLU A 400 -0.345 13.660 4.058 1.00 0.52 C ATOM 97 C GLU A 400 -0.089 15.145 4.400 1.00 3.42 C ATOM 98 O GLU A 400 -0.256 15.560 5.553 1.00 31.54 O ATOM 99 CB GLU A 400 -1.533 13.510 3.049 1.00 14.12 C ATOM 100 CG GLU A 400 -2.902 13.881 3.604 1.00 40.15 C ATOM 101 CD GLU A 400 -3.502 15.108 2.928 1.00 73.04 C ATOM 102 OE1 GLU A 400 -2.920 16.205 3.035 1.00 21.40 O ATOM 103 OE2 GLU A 400 -4.568 14.967 2.293 1.00 24.41 O ATOM 0 H GLU A 400 -1.443 12.705 5.586 1.00 50.22 H new ATOM 0 HA GLU A 400 0.524 13.257 3.538 1.00 0.52 H new ATOM 0 HB2 GLU A 400 -1.330 14.133 2.178 1.00 14.12 H new ATOM 0 HB3 GLU A 400 -1.566 12.477 2.702 1.00 14.12 H new ATOM 0 HG2 GLU A 400 -3.580 13.036 3.481 1.00 40.15 H new ATOM 0 HG3 GLU A 400 -2.816 14.067 4.675 1.00 40.15 H new ATOM 110 N GLY A 401 0.334 15.933 3.396 1.00 64.24 N ATOM 111 CA GLY A 401 0.862 17.281 3.661 1.00 1.00 C ATOM 112 C GLY A 401 -0.097 18.389 3.224 1.00 51.24 C ATOM 113 O GLY A 401 -0.971 18.741 4.016 1.00 15.15 O ATOM 0 H GLY A 401 0.321 15.666 2.412 1.00 64.24 H new ATOM 0 HA2 GLY A 401 1.067 17.383 4.727 1.00 1.00 H new ATOM 0 HA3 GLY A 401 1.812 17.403 3.141 1.00 1.00 H new ATOM 117 N PRO A 402 0.021 19.018 2.006 1.00 64.15 N ATOM 118 CA PRO A 402 -0.909 20.090 1.627 1.00 10.51 C ATOM 119 C PRO A 402 -2.129 19.633 0.793 1.00 64.15 C ATOM 120 O PRO A 402 -2.143 18.522 0.242 1.00 74.11 O ATOM 121 CB PRO A 402 0.023 21.012 0.823 1.00 62.54 C ATOM 122 CG PRO A 402 0.888 20.082 0.061 1.00 52.12 C ATOM 123 CD PRO A 402 1.074 18.851 0.949 1.00 45.42 C ATOM 0 HA PRO A 402 -1.393 20.547 2.490 1.00 10.51 H new ATOM 0 HB2 PRO A 402 -0.541 21.666 0.158 1.00 62.54 H new ATOM 0 HB3 PRO A 402 0.610 21.654 1.479 1.00 62.54 H new ATOM 0 HG2 PRO A 402 0.427 19.811 -0.889 1.00 52.12 H new ATOM 0 HG3 PRO A 402 1.848 20.544 -0.171 1.00 52.12 H new ATOM 0 HD2 PRO A 402 0.936 17.927 0.388 1.00 45.42 H new ATOM 0 HD3 PRO A 402 2.074 18.815 1.381 1.00 45.42 H new ATOM 131 N GLU A 403 -3.182 20.499 0.789 1.00 71.30 N ATOM 132 CA GLU A 403 -4.267 20.484 -0.194 1.00 72.13 C ATOM 133 C GLU A 403 -3.648 20.329 -1.613 1.00 41.30 C ATOM 134 O GLU A 403 -2.794 21.130 -2.037 1.00 0.23 O ATOM 135 CB GLU A 403 -5.114 21.795 0.031 1.00 3.05 C ATOM 136 CG GLU A 403 -4.921 22.998 -0.912 1.00 72.00 C ATOM 137 CD GLU A 403 -5.886 22.976 -2.094 1.00 61.33 C ATOM 138 OE1 GLU A 403 -7.107 23.112 -1.861 1.00 65.50 O ATOM 139 OE2 GLU A 403 -5.434 22.852 -3.252 1.00 44.43 O ATOM 0 H GLU A 403 -3.288 21.234 1.488 1.00 71.30 H new ATOM 0 HA GLU A 403 -4.950 19.642 -0.083 1.00 72.13 H new ATOM 0 HB2 GLU A 403 -6.166 21.514 -0.010 1.00 3.05 H new ATOM 0 HB3 GLU A 403 -4.916 22.141 1.045 1.00 3.05 H new ATOM 0 HG2 GLU A 403 -5.061 23.922 -0.350 1.00 72.00 H new ATOM 0 HG3 GLU A 403 -3.896 23.003 -1.284 1.00 72.00 H new ATOM 146 N GLY A 404 -3.965 19.222 -2.272 1.00 20.31 N ATOM 147 CA GLY A 404 -3.403 18.960 -3.557 1.00 21.43 C ATOM 148 C GLY A 404 -3.044 17.480 -3.830 1.00 12.25 C ATOM 149 O GLY A 404 -3.677 16.845 -4.678 1.00 43.11 O ATOM 0 H GLY A 404 -4.605 18.506 -1.927 1.00 20.31 H new ATOM 0 HA2 GLY A 404 -4.108 19.293 -4.319 1.00 21.43 H new ATOM 0 HA3 GLY A 404 -2.502 19.563 -3.672 1.00 21.43 H new ATOM 153 N ALA A 405 -2.033 16.924 -3.110 1.00 4.23 N ATOM 154 CA ALA A 405 -1.476 15.606 -3.434 1.00 53.32 C ATOM 155 C ALA A 405 -2.127 14.484 -2.538 1.00 2.33 C ATOM 156 O ALA A 405 -1.905 14.473 -1.321 1.00 10.21 O ATOM 157 CB ALA A 405 0.011 15.692 -3.069 1.00 2.14 C ATOM 0 H ALA A 405 -1.596 17.376 -2.306 1.00 4.23 H new ATOM 0 HA ALA A 405 -1.656 15.359 -4.480 1.00 53.32 H new ATOM 0 HB1 ALA A 405 0.494 14.739 -3.285 1.00 2.14 H new ATOM 0 HB2 ALA A 405 0.484 16.480 -3.655 1.00 2.14 H new ATOM 0 HB3 ALA A 405 0.113 15.918 -2.008 1.00 2.14 H new ATOM 163 N ASN A 406 -2.926 13.554 -3.128 1.00 53.32 N ATOM 164 CA ASN A 406 -3.227 12.163 -2.551 1.00 42.10 C ATOM 165 C ASN A 406 -3.636 11.156 -3.693 1.00 44.43 C ATOM 166 O ASN A 406 -4.669 11.343 -4.318 1.00 71.34 O ATOM 167 CB ASN A 406 -4.321 12.266 -1.397 1.00 25.22 C ATOM 168 CG ASN A 406 -5.299 13.420 -1.482 1.00 34.22 C ATOM 169 OD1 ASN A 406 -6.258 13.386 -2.244 1.00 22.20 O ATOM 170 ND2 ASN A 406 -5.136 14.391 -0.591 1.00 61.21 N ATOM 0 H ASN A 406 -3.392 13.723 -4.019 1.00 53.32 H new ATOM 0 HA ASN A 406 -2.321 11.762 -2.097 1.00 42.10 H new ATOM 0 HB2 ASN A 406 -4.892 11.337 -1.387 1.00 25.22 H new ATOM 0 HB3 ASN A 406 -3.801 12.331 -0.441 1.00 25.22 H new ATOM 0 HD21 ASN A 406 -5.822 15.142 -0.524 1.00 61.21 H new ATOM 0 HD22 ASN A 406 -4.324 14.385 0.027 1.00 61.21 H new ATOM 177 N LEU A 407 -2.813 10.086 -3.989 1.00 13.33 N ATOM 178 CA LEU A 407 -3.144 9.075 -5.040 1.00 14.45 C ATOM 179 C LEU A 407 -3.382 7.648 -4.410 1.00 61.41 C ATOM 180 O LEU A 407 -2.480 7.183 -3.708 1.00 23.02 O ATOM 181 CB LEU A 407 -1.899 8.920 -5.969 1.00 14.04 C ATOM 182 CG LEU A 407 -1.348 10.125 -6.754 1.00 62.10 C ATOM 183 CD1 LEU A 407 -2.463 10.931 -7.411 1.00 31.32 C ATOM 184 CD2 LEU A 407 -0.472 10.997 -5.882 1.00 33.25 C ATOM 0 H LEU A 407 -1.927 9.912 -3.514 1.00 13.33 H new ATOM 0 HA LEU A 407 -4.039 9.413 -5.563 1.00 14.45 H new ATOM 0 HB2 LEU A 407 -1.085 8.539 -5.353 1.00 14.04 H new ATOM 0 HB3 LEU A 407 -2.137 8.145 -6.697 1.00 14.04 H new ATOM 0 HG LEU A 407 -0.724 9.730 -7.556 1.00 62.10 H new ATOM 0 HD11 LEU A 407 -2.032 11.772 -7.955 1.00 31.32 H new ATOM 0 HD12 LEU A 407 -3.013 10.294 -8.104 1.00 31.32 H new ATOM 0 HD13 LEU A 407 -3.142 11.304 -6.645 1.00 31.32 H new ATOM 0 HD21 LEU A 407 -0.099 11.838 -6.466 1.00 33.25 H new ATOM 0 HD22 LEU A 407 -1.054 11.370 -5.039 1.00 33.25 H new ATOM 0 HD23 LEU A 407 0.370 10.412 -5.511 1.00 33.25 H new ATOM 196 N PHE A 408 -4.530 6.906 -4.642 1.00 3.22 N ATOM 197 CA PHE A 408 -4.608 5.484 -4.127 1.00 64.13 C ATOM 198 C PHE A 408 -4.849 4.439 -5.267 1.00 52.41 C ATOM 199 O PHE A 408 -5.302 4.806 -6.354 1.00 4.21 O ATOM 200 CB PHE A 408 -5.593 5.248 -2.924 1.00 53.04 C ATOM 201 CG PHE A 408 -5.469 6.221 -1.739 1.00 43.33 C ATOM 202 CD1 PHE A 408 -4.227 6.558 -1.182 1.00 33.33 C ATOM 203 CD2 PHE A 408 -6.603 6.801 -1.191 1.00 51.12 C ATOM 204 CE1 PHE A 408 -4.116 7.459 -0.121 1.00 61.54 C ATOM 205 CE2 PHE A 408 -6.508 7.685 -0.125 1.00 53.23 C ATOM 206 CZ PHE A 408 -5.266 8.018 0.408 1.00 61.11 C ATOM 0 H PHE A 408 -5.354 7.239 -5.143 1.00 3.22 H new ATOM 0 HA PHE A 408 -3.613 5.319 -3.713 1.00 64.13 H new ATOM 0 HB2 PHE A 408 -6.614 5.299 -3.303 1.00 53.04 H new ATOM 0 HB3 PHE A 408 -5.441 4.235 -2.552 1.00 53.04 H new ATOM 0 HD1 PHE A 408 -3.332 6.108 -1.585 1.00 33.33 H new ATOM 0 HD2 PHE A 408 -7.574 6.562 -1.599 1.00 51.12 H new ATOM 0 HE1 PHE A 408 -3.147 7.716 0.281 1.00 61.54 H new ATOM 0 HE2 PHE A 408 -7.404 8.118 0.294 1.00 53.23 H new ATOM 0 HZ PHE A 408 -5.200 8.712 1.233 1.00 61.11 H new ATOM 216 N ILE A 409 -4.531 3.131 -4.980 1.00 13.22 N ATOM 217 CA ILE A 409 -4.258 2.050 -6.056 1.00 74.22 C ATOM 218 C ILE A 409 -5.356 0.902 -5.984 1.00 3.41 C ATOM 219 O ILE A 409 -5.376 0.186 -4.989 1.00 11.42 O ATOM 220 CB ILE A 409 -2.765 1.358 -5.966 1.00 10.33 C ATOM 221 CG1 ILE A 409 -1.567 2.303 -6.362 1.00 14.31 C ATOM 222 CG2 ILE A 409 -2.571 0.071 -6.850 1.00 62.43 C ATOM 223 CD1 ILE A 409 -1.452 3.703 -5.786 1.00 1.31 C ATOM 0 H ILE A 409 -4.452 2.779 -4.026 1.00 13.22 H new ATOM 0 HA ILE A 409 -4.305 2.581 -7.006 1.00 74.22 H new ATOM 0 HB ILE A 409 -2.737 1.112 -4.905 1.00 10.33 H new ATOM 0 HG12 ILE A 409 -0.647 1.776 -6.107 1.00 14.31 H new ATOM 0 HG13 ILE A 409 -1.586 2.405 -7.447 1.00 14.31 H new ATOM 0 HG21 ILE A 409 -1.557 -0.309 -6.722 1.00 62.43 H new ATOM 0 HG22 ILE A 409 -3.286 -0.692 -6.543 1.00 62.43 H new ATOM 0 HG23 ILE A 409 -2.735 0.321 -7.898 1.00 62.43 H new ATOM 0 HD11 ILE A 409 -0.560 4.188 -6.183 1.00 1.31 H new ATOM 0 HD12 ILE A 409 -2.333 4.283 -6.061 1.00 1.31 H new ATOM 0 HD13 ILE A 409 -1.380 3.645 -4.700 1.00 1.31 H new ATOM 235 N TYR A 410 -6.263 0.695 -7.014 1.00 64.32 N ATOM 236 CA TYR A 410 -7.115 -0.536 -7.060 1.00 52.22 C ATOM 237 C TYR A 410 -6.421 -1.566 -7.984 1.00 10.32 C ATOM 238 O TYR A 410 -5.782 -1.170 -8.963 1.00 43.22 O ATOM 239 CB TYR A 410 -8.573 -0.226 -7.595 1.00 5.51 C ATOM 240 CG TYR A 410 -9.598 0.553 -6.727 1.00 23.25 C ATOM 241 CD1 TYR A 410 -9.309 1.238 -5.535 1.00 13.42 C ATOM 242 CD2 TYR A 410 -10.931 0.564 -7.147 1.00 3.32 C ATOM 243 CE1 TYR A 410 -10.297 1.890 -4.825 1.00 54.22 C ATOM 244 CE2 TYR A 410 -11.914 1.225 -6.435 1.00 25.32 C ATOM 245 CZ TYR A 410 -11.595 1.874 -5.272 1.00 72.52 C ATOM 246 OH TYR A 410 -12.579 2.516 -4.551 1.00 74.22 O ATOM 0 H TYR A 410 -6.410 1.343 -7.787 1.00 64.32 H new ATOM 0 HA TYR A 410 -7.223 -0.930 -6.049 1.00 52.22 H new ATOM 0 HB2 TYR A 410 -8.459 0.327 -8.527 1.00 5.51 H new ATOM 0 HB3 TYR A 410 -9.030 -1.183 -7.846 1.00 5.51 H new ATOM 0 HD1 TYR A 410 -8.294 1.255 -5.167 1.00 13.42 H new ATOM 0 HD2 TYR A 410 -11.200 0.042 -8.053 1.00 3.32 H new ATOM 0 HE1 TYR A 410 -10.048 2.415 -3.914 1.00 54.22 H new ATOM 0 HE2 TYR A 410 -12.932 1.230 -6.795 1.00 25.32 H new ATOM 0 HH TYR A 410 -13.440 2.409 -5.006 1.00 74.22 H new ATOM 256 N HIS A 411 -6.528 -2.893 -7.639 1.00 34.32 N ATOM 257 CA HIS A 411 -5.819 -4.009 -8.353 1.00 23.51 C ATOM 258 C HIS A 411 -4.266 -3.998 -8.224 1.00 25.10 C ATOM 259 O HIS A 411 -3.565 -3.782 -9.216 1.00 22.21 O ATOM 260 CB HIS A 411 -6.173 -4.085 -9.836 1.00 22.12 C ATOM 261 CG HIS A 411 -7.608 -4.366 -10.166 1.00 62.14 C ATOM 262 ND1 HIS A 411 -8.474 -5.091 -9.366 1.00 23.54 N ATOM 263 CD2 HIS A 411 -8.335 -3.962 -11.226 1.00 3.22 C ATOM 264 CE1 HIS A 411 -9.673 -5.110 -9.931 1.00 10.23 C ATOM 265 NE2 HIS A 411 -9.610 -4.432 -11.057 1.00 42.03 N ATOM 0 H HIS A 411 -7.105 -3.215 -6.862 1.00 34.32 H new ATOM 0 HA HIS A 411 -6.188 -4.892 -7.831 1.00 23.51 H new ATOM 0 HB2 HIS A 411 -5.894 -3.140 -10.302 1.00 22.12 H new ATOM 0 HB3 HIS A 411 -5.559 -4.860 -10.294 1.00 22.12 H new ATOM 0 HD2 HIS A 411 -7.977 -3.374 -12.058 1.00 3.22 H new ATOM 0 HE1 HIS A 411 -10.551 -5.598 -9.535 1.00 10.23 H new ATOM 0 HE2 HIS A 411 -10.387 -4.281 -11.701 1.00 42.03 H new ATOM 274 N LEU A 412 -3.730 -4.188 -7.011 1.00 3.42 N ATOM 275 CA LEU A 412 -2.282 -4.264 -6.804 1.00 62.20 C ATOM 276 C LEU A 412 -1.694 -5.580 -7.412 1.00 10.13 C ATOM 277 O LEU A 412 -2.197 -6.667 -7.097 1.00 42.11 O ATOM 278 CB LEU A 412 -1.938 -4.079 -5.284 1.00 64.35 C ATOM 279 CG LEU A 412 -0.577 -4.629 -4.776 1.00 10.11 C ATOM 280 CD1 LEU A 412 0.107 -3.653 -3.824 1.00 65.31 C ATOM 281 CD2 LEU A 412 -0.717 -5.985 -4.055 1.00 14.00 C ATOM 0 H LEU A 412 -4.280 -4.292 -6.159 1.00 3.42 H new ATOM 0 HA LEU A 412 -1.802 -3.445 -7.339 1.00 62.20 H new ATOM 0 HB2 LEU A 412 -1.973 -3.013 -5.060 1.00 64.35 H new ATOM 0 HB3 LEU A 412 -2.729 -4.552 -4.702 1.00 64.35 H new ATOM 0 HG LEU A 412 0.030 -4.763 -5.671 1.00 10.11 H new ATOM 0 HD11 LEU A 412 1.056 -4.074 -3.491 1.00 65.31 H new ATOM 0 HD12 LEU A 412 0.290 -2.710 -4.339 1.00 65.31 H new ATOM 0 HD13 LEU A 412 -0.535 -3.477 -2.961 1.00 65.31 H new ATOM 0 HD21 LEU A 412 0.264 -6.323 -3.721 1.00 14.00 H new ATOM 0 HD22 LEU A 412 -1.375 -5.873 -3.193 1.00 14.00 H new ATOM 0 HD23 LEU A 412 -1.139 -6.720 -4.740 1.00 14.00 H new ATOM 293 N PRO A 413 -0.676 -5.520 -8.353 1.00 21.52 N ATOM 294 CA PRO A 413 -0.015 -6.724 -8.905 1.00 54.30 C ATOM 295 C PRO A 413 0.919 -7.534 -7.969 1.00 52.45 C ATOM 296 O PRO A 413 1.079 -7.223 -6.793 1.00 5.31 O ATOM 297 CB PRO A 413 0.650 -6.272 -10.164 1.00 4.12 C ATOM 298 CG PRO A 413 0.940 -4.856 -9.984 1.00 33.12 C ATOM 299 CD PRO A 413 -0.104 -4.292 -9.047 1.00 13.13 C ATOM 0 HA PRO A 413 -0.781 -7.481 -9.075 1.00 54.30 H new ATOM 0 HB2 PRO A 413 1.564 -6.837 -10.346 1.00 4.12 H new ATOM 0 HB3 PRO A 413 0.001 -6.430 -11.025 1.00 4.12 H new ATOM 0 HG2 PRO A 413 1.939 -4.719 -9.571 1.00 33.12 H new ATOM 0 HG3 PRO A 413 0.917 -4.335 -10.941 1.00 33.12 H new ATOM 0 HD2 PRO A 413 0.335 -3.597 -8.331 1.00 13.13 H new ATOM 0 HD3 PRO A 413 -0.875 -3.745 -9.590 1.00 13.13 H new ATOM 307 N GLN A 414 1.537 -8.566 -8.582 1.00 33.51 N ATOM 308 CA GLN A 414 1.847 -9.911 -8.057 1.00 1.04 C ATOM 309 C GLN A 414 2.131 -10.143 -6.515 1.00 33.42 C ATOM 310 O GLN A 414 1.322 -10.850 -5.916 1.00 13.44 O ATOM 311 CB GLN A 414 3.124 -10.303 -8.882 1.00 45.35 C ATOM 312 CG GLN A 414 4.066 -9.124 -9.288 1.00 2.01 C ATOM 313 CD GLN A 414 5.270 -8.958 -8.393 1.00 12.25 C ATOM 314 OE1 GLN A 414 5.773 -9.923 -7.843 1.00 40.45 O ATOM 315 NE2 GLN A 414 5.710 -7.720 -8.218 1.00 51.40 N ATOM 0 H GLN A 414 1.861 -8.469 -9.544 1.00 33.51 H new ATOM 0 HA GLN A 414 0.941 -10.507 -8.163 1.00 1.04 H new ATOM 0 HB2 GLN A 414 3.703 -11.020 -8.300 1.00 45.35 H new ATOM 0 HB3 GLN A 414 2.803 -10.814 -9.789 1.00 45.35 H new ATOM 0 HG2 GLN A 414 4.407 -9.282 -10.311 1.00 2.01 H new ATOM 0 HG3 GLN A 414 3.493 -8.197 -9.282 1.00 2.01 H new ATOM 0 HE21 GLN A 414 5.256 -6.944 -8.700 1.00 51.40 H new ATOM 0 HE22 GLN A 414 6.503 -7.543 -7.601 1.00 51.40 H new ATOM 324 N GLU A 415 3.192 -9.640 -5.846 1.00 13.14 N ATOM 325 CA GLU A 415 3.204 -9.611 -4.338 1.00 73.55 C ATOM 326 C GLU A 415 3.340 -8.196 -3.746 1.00 65.35 C ATOM 327 O GLU A 415 3.479 -8.091 -2.517 1.00 61.12 O ATOM 328 CB GLU A 415 4.252 -10.602 -3.721 1.00 72.01 C ATOM 329 CG GLU A 415 5.655 -10.057 -3.446 1.00 75.55 C ATOM 330 CD GLU A 415 6.460 -9.769 -4.693 1.00 31.40 C ATOM 331 OE1 GLU A 415 7.057 -10.722 -5.238 1.00 40.51 O ATOM 332 OE2 GLU A 415 6.498 -8.599 -5.122 1.00 21.21 O ATOM 0 H GLU A 415 4.027 -9.259 -6.290 1.00 13.14 H new ATOM 0 HA GLU A 415 2.216 -9.965 -4.045 1.00 73.55 H new ATOM 0 HB2 GLU A 415 3.847 -10.980 -2.782 1.00 72.01 H new ATOM 0 HB3 GLU A 415 4.347 -11.454 -4.394 1.00 72.01 H new ATOM 0 HG2 GLU A 415 5.569 -9.141 -2.862 1.00 75.55 H new ATOM 0 HG3 GLU A 415 6.199 -10.776 -2.833 1.00 75.55 H new ATOM 339 N PHE A 416 3.079 -7.138 -4.559 1.00 12.42 N ATOM 340 CA PHE A 416 3.871 -5.849 -4.479 1.00 72.41 C ATOM 341 C PHE A 416 3.885 -5.302 -2.999 1.00 55.31 C ATOM 342 O PHE A 416 2.871 -4.797 -2.516 1.00 52.44 O ATOM 343 CB PHE A 416 3.261 -4.717 -5.414 1.00 23.25 C ATOM 344 CG PHE A 416 3.970 -4.175 -6.646 1.00 50.33 C ATOM 345 CD1 PHE A 416 4.988 -4.804 -7.363 1.00 13.23 C ATOM 346 CD2 PHE A 416 3.549 -2.914 -7.071 1.00 2.03 C ATOM 347 CE1 PHE A 416 5.551 -4.187 -8.467 1.00 13.15 C ATOM 348 CE2 PHE A 416 4.101 -2.301 -8.169 1.00 13.23 C ATOM 349 CZ PHE A 416 5.104 -2.937 -8.879 1.00 71.40 C ATOM 0 H PHE A 416 2.346 -7.135 -5.268 1.00 12.42 H new ATOM 0 HA PHE A 416 4.882 -6.083 -4.813 1.00 72.41 H new ATOM 0 HB2 PHE A 416 2.294 -5.088 -5.754 1.00 23.25 H new ATOM 0 HB3 PHE A 416 3.065 -3.860 -4.770 1.00 23.25 H new ATOM 0 HD1 PHE A 416 5.339 -5.778 -7.055 1.00 13.23 H new ATOM 0 HD2 PHE A 416 2.769 -2.407 -6.522 1.00 2.03 H new ATOM 0 HE1 PHE A 416 6.343 -4.680 -9.012 1.00 13.15 H new ATOM 0 HE2 PHE A 416 3.753 -1.326 -8.477 1.00 13.23 H new ATOM 0 HZ PHE A 416 5.537 -2.465 -9.748 1.00 71.40 H new ATOM 359 N GLY A 417 5.020 -5.461 -2.257 1.00 2.31 N ATOM 360 CA GLY A 417 5.041 -5.130 -0.827 1.00 22.32 C ATOM 361 C GLY A 417 5.818 -3.830 -0.514 1.00 71.23 C ATOM 362 O GLY A 417 6.157 -3.096 -1.452 1.00 51.11 O ATOM 0 H GLY A 417 5.905 -5.809 -2.627 1.00 2.31 H new ATOM 0 HA2 GLY A 417 4.016 -5.028 -0.469 1.00 22.32 H new ATOM 0 HA3 GLY A 417 5.491 -5.956 -0.276 1.00 22.32 H new ATOM 366 N ASP A 418 6.076 -3.546 0.811 1.00 63.50 N ATOM 367 CA ASP A 418 6.674 -2.232 1.305 1.00 3.41 C ATOM 368 C ASP A 418 7.918 -1.742 0.516 1.00 22.23 C ATOM 369 O ASP A 418 7.965 -0.563 0.146 1.00 21.43 O ATOM 370 CB ASP A 418 6.964 -2.193 2.873 1.00 20.12 C ATOM 371 CG ASP A 418 7.764 -0.976 3.327 1.00 44.20 C ATOM 372 OD1 ASP A 418 7.155 0.089 3.537 1.00 52.33 O ATOM 373 OD2 ASP A 418 8.993 -1.111 3.529 1.00 32.20 O ATOM 0 H ASP A 418 5.881 -4.207 1.563 1.00 63.50 H new ATOM 0 HA ASP A 418 5.871 -1.524 1.100 1.00 3.41 H new ATOM 0 HB2 ASP A 418 6.015 -2.211 3.408 1.00 20.12 H new ATOM 0 HB3 ASP A 418 7.505 -3.096 3.154 1.00 20.12 H new ATOM 378 N GLN A 419 8.914 -2.624 0.273 1.00 33.22 N ATOM 379 CA GLN A 419 10.124 -2.252 -0.483 1.00 11.33 C ATOM 380 C GLN A 419 9.842 -1.758 -1.900 1.00 41.14 C ATOM 381 O GLN A 419 10.446 -0.754 -2.302 1.00 32.31 O ATOM 382 CB GLN A 419 11.191 -3.375 -0.534 1.00 11.24 C ATOM 383 CG GLN A 419 10.747 -4.713 -1.216 1.00 5.50 C ATOM 384 CD GLN A 419 11.504 -5.080 -2.502 1.00 22.02 C ATOM 385 OE1 GLN A 419 11.700 -6.261 -2.784 1.00 74.31 O ATOM 386 NE2 GLN A 419 11.894 -4.107 -3.320 1.00 13.51 N ATOM 0 H GLN A 419 8.901 -3.594 0.589 1.00 33.22 H new ATOM 0 HA GLN A 419 10.529 -1.417 0.090 1.00 11.33 H new ATOM 0 HB2 GLN A 419 12.066 -2.994 -1.061 1.00 11.24 H new ATOM 0 HB3 GLN A 419 11.505 -3.597 0.486 1.00 11.24 H new ATOM 0 HG2 GLN A 419 10.869 -5.525 -0.499 1.00 5.50 H new ATOM 0 HG3 GLN A 419 9.684 -4.648 -1.446 1.00 5.50 H new ATOM 0 HE21 GLN A 419 11.724 -3.133 -3.071 1.00 13.51 H new ATOM 0 HE22 GLN A 419 12.363 -4.335 -4.196 1.00 13.51 H new ATOM 395 N ASP A 420 8.965 -2.453 -2.664 1.00 22.20 N ATOM 396 CA ASP A 420 8.721 -2.053 -4.061 1.00 40.23 C ATOM 397 C ASP A 420 8.132 -0.647 -4.163 1.00 63.52 C ATOM 398 O ASP A 420 8.666 0.148 -4.931 1.00 51.43 O ATOM 399 CB ASP A 420 7.884 -3.045 -4.896 1.00 23.22 C ATOM 400 CG ASP A 420 6.692 -2.407 -5.530 1.00 34.01 C ATOM 401 OD1 ASP A 420 6.846 -1.843 -6.633 1.00 12.15 O ATOM 402 OD2 ASP A 420 5.629 -2.405 -4.882 1.00 24.33 O ATOM 0 H ASP A 420 8.434 -3.264 -2.347 1.00 22.20 H new ATOM 0 HA ASP A 420 9.716 -2.061 -4.505 1.00 40.23 H new ATOM 0 HB2 ASP A 420 8.513 -3.480 -5.672 1.00 23.22 H new ATOM 0 HB3 ASP A 420 7.555 -3.864 -4.256 1.00 23.22 H new ATOM 407 N ILE A 421 7.043 -0.360 -3.393 1.00 65.31 N ATOM 408 CA ILE A 421 6.300 0.899 -3.554 1.00 1.34 C ATOM 409 C ILE A 421 7.187 2.127 -3.225 1.00 53.23 C ATOM 410 O ILE A 421 6.887 3.241 -3.666 1.00 70.01 O ATOM 411 CB ILE A 421 4.908 0.928 -2.720 1.00 13.34 C ATOM 412 CG1 ILE A 421 3.652 1.027 -3.650 1.00 43.23 C ATOM 413 CG2 ILE A 421 4.840 2.001 -1.621 1.00 63.42 C ATOM 414 CD1 ILE A 421 2.390 1.629 -3.052 1.00 44.14 C ATOM 0 H ILE A 421 6.675 -0.979 -2.671 1.00 65.31 H new ATOM 0 HA ILE A 421 6.023 0.957 -4.607 1.00 1.34 H new ATOM 0 HB ILE A 421 4.893 -0.036 -2.211 1.00 13.34 H new ATOM 0 HG12 ILE A 421 3.925 1.616 -4.525 1.00 43.23 H new ATOM 0 HG13 ILE A 421 3.413 0.024 -4.003 1.00 43.23 H new ATOM 0 HG21 ILE A 421 3.875 1.945 -1.117 1.00 63.42 H new ATOM 0 HG22 ILE A 421 5.637 1.832 -0.897 1.00 63.42 H new ATOM 0 HG23 ILE A 421 4.960 2.988 -2.068 1.00 63.42 H new ATOM 0 HD11 ILE A 421 1.600 1.637 -3.803 1.00 44.14 H new ATOM 0 HD12 ILE A 421 2.072 1.032 -2.197 1.00 44.14 H new ATOM 0 HD13 ILE A 421 2.592 2.650 -2.727 1.00 44.14 H new ATOM 426 N LEU A 422 8.320 1.904 -2.522 1.00 42.43 N ATOM 427 CA LEU A 422 9.114 2.988 -2.070 1.00 72.31 C ATOM 428 C LEU A 422 10.087 3.371 -3.209 1.00 12.05 C ATOM 429 O LEU A 422 10.338 4.540 -3.444 1.00 14.52 O ATOM 430 CB LEU A 422 9.849 2.698 -0.688 1.00 74.34 C ATOM 431 CG LEU A 422 10.762 3.846 -0.137 1.00 1.24 C ATOM 432 CD1 LEU A 422 9.992 5.152 0.157 1.00 74.14 C ATOM 433 CD2 LEU A 422 11.508 3.475 1.148 1.00 42.53 C ATOM 0 H LEU A 422 8.674 0.980 -2.275 1.00 42.43 H new ATOM 0 HA LEU A 422 8.469 3.837 -1.842 1.00 72.31 H new ATOM 0 HB2 LEU A 422 9.091 2.472 0.062 1.00 74.34 H new ATOM 0 HB3 LEU A 422 10.458 1.802 -0.805 1.00 74.34 H new ATOM 0 HG LEU A 422 11.473 4.001 -0.948 1.00 1.24 H new ATOM 0 HD11 LEU A 422 10.684 5.905 0.535 1.00 74.14 H new ATOM 0 HD12 LEU A 422 9.527 5.515 -0.760 1.00 74.14 H new ATOM 0 HD13 LEU A 422 9.221 4.960 0.903 1.00 74.14 H new ATOM 0 HD21 LEU A 422 12.120 4.318 1.470 1.00 42.53 H new ATOM 0 HD22 LEU A 422 10.788 3.230 1.929 1.00 42.53 H new ATOM 0 HD23 LEU A 422 12.148 2.613 0.961 1.00 42.53 H new ATOM 445 N GLN A 423 10.567 2.338 -3.933 1.00 64.32 N ATOM 446 CA GLN A 423 11.509 2.491 -5.093 1.00 15.40 C ATOM 447 C GLN A 423 10.811 2.717 -6.456 1.00 21.40 C ATOM 448 O GLN A 423 11.141 3.682 -7.137 1.00 65.11 O ATOM 449 CB GLN A 423 12.460 1.264 -5.285 1.00 62.23 C ATOM 450 CG GLN A 423 13.432 0.928 -4.140 1.00 43.33 C ATOM 451 CD GLN A 423 13.853 -0.531 -4.161 1.00 25.01 C ATOM 452 OE1 GLN A 423 14.805 -0.900 -4.844 1.00 51.21 O ATOM 453 NE2 GLN A 423 13.184 -1.368 -3.387 1.00 32.34 N ATOM 0 H GLN A 423 10.320 1.367 -3.740 1.00 64.32 H new ATOM 0 HA GLN A 423 12.074 3.381 -4.815 1.00 15.40 H new ATOM 0 HB2 GLN A 423 11.842 0.386 -5.469 1.00 62.23 H new ATOM 0 HB3 GLN A 423 13.049 1.434 -6.186 1.00 62.23 H new ATOM 0 HG2 GLN A 423 14.316 1.561 -4.217 1.00 43.33 H new ATOM 0 HG3 GLN A 423 12.959 1.155 -3.185 1.00 43.33 H new ATOM 0 HE21 GLN A 423 12.398 -1.031 -2.831 1.00 32.34 H new ATOM 0 HE22 GLN A 423 13.454 -2.351 -3.345 1.00 32.34 H new ATOM 462 N MET A 424 9.918 1.791 -6.891 1.00 42.54 N ATOM 463 CA MET A 424 9.237 1.904 -8.245 1.00 34.52 C ATOM 464 C MET A 424 8.386 3.220 -8.367 1.00 13.12 C ATOM 465 O MET A 424 8.136 3.687 -9.476 1.00 23.22 O ATOM 466 CB MET A 424 8.382 0.592 -8.639 1.00 52.24 C ATOM 467 CG MET A 424 7.798 0.443 -10.120 1.00 45.23 C ATOM 468 SD MET A 424 9.087 0.327 -11.379 1.00 60.04 S ATOM 469 CE MET A 424 9.199 2.017 -11.960 1.00 64.44 C ATOM 0 H MET A 424 9.645 0.969 -6.352 1.00 42.54 H new ATOM 0 HA MET A 424 10.040 1.968 -8.979 1.00 34.52 H new ATOM 0 HB2 MET A 424 9.012 -0.277 -8.448 1.00 52.24 H new ATOM 0 HB3 MET A 424 7.540 0.533 -7.949 1.00 52.24 H new ATOM 0 HG2 MET A 424 7.169 -0.446 -10.169 1.00 45.23 H new ATOM 0 HG3 MET A 424 7.159 1.298 -10.340 1.00 45.23 H new ATOM 0 HE1 MET A 424 9.764 2.045 -12.892 1.00 64.44 H new ATOM 0 HE2 MET A 424 8.197 2.410 -12.131 1.00 64.44 H new ATOM 0 HE3 MET A 424 9.705 2.626 -11.211 1.00 64.44 H new ATOM 479 N PHE A 425 7.979 3.859 -7.244 1.00 12.21 N ATOM 480 CA PHE A 425 7.178 5.078 -7.302 1.00 34.11 C ATOM 481 C PHE A 425 8.058 6.331 -6.964 1.00 41.54 C ATOM 482 O PHE A 425 7.554 7.447 -6.909 1.00 3.23 O ATOM 483 CB PHE A 425 5.942 4.838 -6.414 1.00 10.01 C ATOM 484 CG PHE A 425 4.589 4.758 -7.114 1.00 4.22 C ATOM 485 CD1 PHE A 425 4.191 3.552 -7.704 1.00 42.02 C ATOM 486 CD2 PHE A 425 3.682 5.836 -7.159 1.00 13.01 C ATOM 487 CE1 PHE A 425 2.958 3.424 -8.303 1.00 41.34 C ATOM 488 CE2 PHE A 425 2.466 5.685 -7.766 1.00 51.23 C ATOM 489 CZ PHE A 425 2.100 4.491 -8.331 1.00 4.41 C ATOM 0 H PHE A 425 8.197 3.543 -6.299 1.00 12.21 H new ATOM 0 HA PHE A 425 6.808 5.308 -8.301 1.00 34.11 H new ATOM 0 HB2 PHE A 425 6.095 3.908 -5.866 1.00 10.01 H new ATOM 0 HB3 PHE A 425 5.895 5.639 -5.676 1.00 10.01 H new ATOM 0 HD1 PHE A 425 4.863 2.707 -7.689 1.00 42.02 H new ATOM 0 HD2 PHE A 425 3.948 6.783 -6.713 1.00 13.01 H new ATOM 0 HE1 PHE A 425 2.668 2.484 -8.750 1.00 41.34 H new ATOM 0 HE2 PHE A 425 1.783 6.521 -7.801 1.00 51.23 H new ATOM 0 HZ PHE A 425 1.132 4.391 -8.800 1.00 4.41 H new ATOM 499 N MET A 426 9.390 6.107 -6.714 1.00 25.33 N ATOM 500 CA MET A 426 10.387 7.155 -6.358 1.00 41.02 C ATOM 501 C MET A 426 10.832 8.122 -7.506 1.00 74.04 C ATOM 502 O MET A 426 10.953 9.307 -7.225 1.00 23.23 O ATOM 503 CB MET A 426 11.697 6.526 -5.839 1.00 24.21 C ATOM 504 CG MET A 426 12.076 7.025 -4.462 1.00 34.42 C ATOM 505 SD MET A 426 13.460 6.147 -3.717 1.00 33.35 S ATOM 506 CE MET A 426 13.392 6.826 -2.057 1.00 53.44 C ATOM 0 H MET A 426 9.799 5.174 -6.757 1.00 25.33 H new ATOM 0 HA MET A 426 9.843 7.734 -5.612 1.00 41.02 H new ATOM 0 HB2 MET A 426 11.589 5.442 -5.812 1.00 24.21 H new ATOM 0 HB3 MET A 426 12.504 6.749 -6.537 1.00 24.21 H new ATOM 0 HG2 MET A 426 12.324 8.084 -4.527 1.00 34.42 H new ATOM 0 HG3 MET A 426 11.210 6.940 -3.805 1.00 34.42 H new ATOM 0 HE1 MET A 426 14.186 6.389 -1.452 1.00 53.44 H new ATOM 0 HE2 MET A 426 13.523 7.907 -2.101 1.00 53.44 H new ATOM 0 HE3 MET A 426 12.426 6.595 -1.609 1.00 53.44 H new ATOM 516 N PRO A 427 11.153 7.645 -8.788 1.00 75.23 N ATOM 517 CA PRO A 427 11.995 8.404 -9.800 1.00 2.12 C ATOM 518 C PRO A 427 11.518 9.827 -10.300 1.00 51.23 C ATOM 519 O PRO A 427 12.195 10.413 -11.146 1.00 40.00 O ATOM 520 CB PRO A 427 12.074 7.376 -10.969 1.00 32.42 C ATOM 521 CG PRO A 427 10.804 6.631 -10.847 1.00 55.14 C ATOM 522 CD PRO A 427 10.761 6.330 -9.389 1.00 14.25 C ATOM 0 HA PRO A 427 12.933 8.706 -9.334 1.00 2.12 H new ATOM 0 HB2 PRO A 427 12.159 7.871 -11.936 1.00 32.42 H new ATOM 0 HB3 PRO A 427 12.938 6.719 -10.870 1.00 32.42 H new ATOM 0 HG2 PRO A 427 9.949 7.227 -11.166 1.00 55.14 H new ATOM 0 HG3 PRO A 427 10.803 5.724 -11.451 1.00 55.14 H new ATOM 0 HD2 PRO A 427 9.769 6.014 -9.067 1.00 14.25 H new ATOM 0 HD3 PRO A 427 11.454 5.534 -9.116 1.00 14.25 H new ATOM 530 N PHE A 428 10.384 10.377 -9.809 1.00 1.03 N ATOM 531 CA PHE A 428 10.030 11.814 -10.055 1.00 71.52 C ATOM 532 C PHE A 428 9.932 12.693 -8.747 1.00 3.31 C ATOM 533 O PHE A 428 9.362 13.785 -8.813 1.00 12.24 O ATOM 534 CB PHE A 428 8.715 12.014 -10.896 1.00 53.24 C ATOM 535 CG PHE A 428 8.379 10.994 -11.980 1.00 41.12 C ATOM 536 CD1 PHE A 428 8.901 11.109 -13.269 1.00 10.24 C ATOM 537 CD2 PHE A 428 7.486 9.953 -11.724 1.00 3.32 C ATOM 538 CE1 PHE A 428 8.548 10.203 -14.262 1.00 23.21 C ATOM 539 CE2 PHE A 428 7.131 9.052 -12.718 1.00 53.25 C ATOM 540 CZ PHE A 428 7.663 9.179 -13.984 1.00 74.30 C ATOM 0 H PHE A 428 9.702 9.867 -9.248 1.00 1.03 H new ATOM 0 HA PHE A 428 10.878 12.165 -10.642 1.00 71.52 H new ATOM 0 HB2 PHE A 428 7.878 12.044 -10.199 1.00 53.24 H new ATOM 0 HB3 PHE A 428 8.771 12.994 -11.370 1.00 53.24 H new ATOM 0 HD1 PHE A 428 9.587 11.911 -13.498 1.00 10.24 H new ATOM 0 HD2 PHE A 428 7.064 9.847 -10.736 1.00 3.32 H new ATOM 0 HE1 PHE A 428 8.966 10.300 -15.253 1.00 23.21 H new ATOM 0 HE2 PHE A 428 6.439 8.252 -12.500 1.00 53.25 H new ATOM 0 HZ PHE A 428 7.388 8.478 -14.758 1.00 74.30 H new ATOM 550 N GLY A 429 10.500 12.270 -7.579 1.00 23.02 N ATOM 551 CA GLY A 429 10.618 13.173 -6.419 1.00 3.23 C ATOM 552 C GLY A 429 10.144 12.560 -5.067 1.00 3.15 C ATOM 553 O GLY A 429 9.792 11.378 -5.034 1.00 31.43 O ATOM 0 H GLY A 429 10.871 11.332 -7.428 1.00 23.02 H new ATOM 0 HA2 GLY A 429 11.659 13.479 -6.318 1.00 3.23 H new ATOM 0 HA3 GLY A 429 10.038 14.075 -6.617 1.00 3.23 H new ATOM 557 N ASN A 430 10.125 13.355 -3.947 1.00 34.41 N ATOM 558 CA ASN A 430 10.146 12.788 -2.566 1.00 61.22 C ATOM 559 C ASN A 430 8.736 12.332 -2.034 1.00 65.00 C ATOM 560 O ASN A 430 7.736 13.045 -2.184 1.00 51.35 O ATOM 561 CB ASN A 430 10.841 13.772 -1.552 1.00 74.31 C ATOM 562 CG ASN A 430 10.115 15.096 -1.309 1.00 22.32 C ATOM 563 OD1 ASN A 430 9.514 15.679 -2.211 1.00 1.51 O ATOM 564 ND2 ASN A 430 10.149 15.572 -0.062 1.00 52.03 N ATOM 0 H ASN A 430 10.096 14.374 -3.978 1.00 34.41 H new ATOM 0 HA ASN A 430 10.742 11.878 -2.638 1.00 61.22 H new ATOM 0 HB2 ASN A 430 10.953 13.260 -0.596 1.00 74.31 H new ATOM 0 HB3 ASN A 430 11.845 13.991 -1.917 1.00 74.31 H new ATOM 0 HD21 ASN A 430 9.668 16.442 0.165 1.00 52.03 H new ATOM 0 HD22 ASN A 430 10.656 15.065 0.664 1.00 52.03 H new ATOM 571 N VAL A 431 8.678 11.104 -1.455 1.00 2.22 N ATOM 572 CA VAL A 431 7.437 10.478 -0.920 1.00 2.45 C ATOM 573 C VAL A 431 7.455 10.358 0.663 1.00 21.13 C ATOM 574 O VAL A 431 8.514 10.059 1.225 1.00 71.52 O ATOM 575 CB VAL A 431 7.195 9.096 -1.654 1.00 4.55 C ATOM 576 CG1 VAL A 431 8.484 8.339 -1.914 1.00 23.13 C ATOM 577 CG2 VAL A 431 6.225 8.159 -0.933 1.00 74.20 C ATOM 0 H VAL A 431 9.502 10.513 -1.345 1.00 2.22 H new ATOM 0 HA VAL A 431 6.587 11.127 -1.134 1.00 2.45 H new ATOM 0 HB VAL A 431 6.739 9.392 -2.599 1.00 4.55 H new ATOM 0 HG11 VAL A 431 8.259 7.400 -2.419 1.00 23.13 H new ATOM 0 HG12 VAL A 431 9.139 8.941 -2.543 1.00 23.13 H new ATOM 0 HG13 VAL A 431 8.981 8.131 -0.967 1.00 23.13 H new ATOM 0 HG21 VAL A 431 6.117 7.237 -1.504 1.00 74.20 H new ATOM 0 HG22 VAL A 431 6.612 7.928 0.059 1.00 74.20 H new ATOM 0 HG23 VAL A 431 5.253 8.643 -0.840 1.00 74.20 H new ATOM 587 N ILE A 432 6.301 10.592 1.393 1.00 73.13 N ATOM 588 CA ILE A 432 6.295 10.576 2.895 1.00 71.12 C ATOM 589 C ILE A 432 5.560 9.305 3.488 1.00 52.13 C ATOM 590 O ILE A 432 5.824 8.927 4.630 1.00 22.52 O ATOM 591 CB ILE A 432 5.631 11.879 3.561 1.00 4.33 C ATOM 592 CG1 ILE A 432 5.648 13.116 2.647 1.00 54.12 C ATOM 593 CG2 ILE A 432 6.317 12.282 4.851 1.00 5.51 C ATOM 594 CD1 ILE A 432 5.078 14.412 3.263 1.00 34.31 C ATOM 0 H ILE A 432 5.393 10.788 0.972 1.00 73.13 H new ATOM 0 HA ILE A 432 7.354 10.553 3.151 1.00 71.12 H new ATOM 0 HB ILE A 432 4.601 11.574 3.746 1.00 4.33 H new ATOM 0 HG12 ILE A 432 6.677 13.304 2.340 1.00 54.12 H new ATOM 0 HG13 ILE A 432 5.083 12.886 1.744 1.00 54.12 H new ATOM 0 HG21 ILE A 432 5.831 13.167 5.261 1.00 5.51 H new ATOM 0 HG22 ILE A 432 6.249 11.465 5.570 1.00 5.51 H new ATOM 0 HG23 ILE A 432 7.365 12.504 4.652 1.00 5.51 H new ATOM 0 HD11 ILE A 432 5.139 15.219 2.533 1.00 34.31 H new ATOM 0 HD12 ILE A 432 4.037 14.254 3.543 1.00 34.31 H new ATOM 0 HD13 ILE A 432 5.656 14.679 4.148 1.00 34.31 H new ATOM 606 N SER A 433 4.678 8.632 2.695 1.00 1.40 N ATOM 607 CA SER A 433 3.743 7.558 3.195 1.00 73.04 C ATOM 608 C SER A 433 3.754 6.285 2.280 1.00 74.13 C ATOM 609 O SER A 433 3.546 6.377 1.065 1.00 72.34 O ATOM 610 CB SER A 433 2.285 8.171 3.296 1.00 33.44 C ATOM 611 OG SER A 433 2.252 9.266 4.195 1.00 53.10 O ATOM 0 H SER A 433 4.588 8.811 1.695 1.00 1.40 H new ATOM 0 HA SER A 433 4.082 7.228 4.177 1.00 73.04 H new ATOM 0 HB2 SER A 433 1.955 8.497 2.309 1.00 33.44 H new ATOM 0 HB3 SER A 433 1.587 7.403 3.628 1.00 33.44 H new ATOM 0 HG SER A 433 1.342 9.627 4.238 1.00 53.10 H new ATOM 617 N ALA A 434 3.998 5.095 2.914 1.00 63.43 N ATOM 618 CA ALA A 434 3.900 3.745 2.248 1.00 73.41 C ATOM 619 C ALA A 434 3.377 2.628 3.265 1.00 22.14 C ATOM 620 O ALA A 434 4.008 2.460 4.310 1.00 74.54 O ATOM 621 CB ALA A 434 5.276 3.309 1.696 1.00 53.01 C ATOM 0 H ALA A 434 4.267 5.040 3.896 1.00 63.43 H new ATOM 0 HA ALA A 434 3.187 3.843 1.430 1.00 73.41 H new ATOM 0 HB1 ALA A 434 5.184 2.333 1.220 1.00 53.01 H new ATOM 0 HB2 ALA A 434 5.622 4.039 0.964 1.00 53.01 H new ATOM 0 HB3 ALA A 434 5.993 3.247 2.514 1.00 53.01 H new ATOM 627 N LYS A 435 2.224 1.889 3.002 1.00 61.12 N ATOM 628 CA LYS A 435 1.790 0.696 3.827 1.00 13.24 C ATOM 629 C LYS A 435 0.849 -0.260 2.970 1.00 12.12 C ATOM 630 O LYS A 435 -0.015 0.260 2.246 1.00 43.45 O ATOM 631 CB LYS A 435 1.149 1.090 5.235 1.00 20.30 C ATOM 632 CG LYS A 435 -0.189 1.831 5.308 1.00 54.41 C ATOM 633 CD LYS A 435 -1.378 0.877 5.350 1.00 53.51 C ATOM 634 CE LYS A 435 -2.741 1.585 5.316 1.00 72.13 C ATOM 635 NZ LYS A 435 -2.954 2.507 6.462 1.00 71.25 N ATOM 0 H LYS A 435 1.591 2.103 2.231 1.00 61.12 H new ATOM 0 HA LYS A 435 2.692 0.141 4.084 1.00 13.24 H new ATOM 0 HB2 LYS A 435 1.036 0.168 5.804 1.00 20.30 H new ATOM 0 HB3 LYS A 435 1.883 1.701 5.761 1.00 20.30 H new ATOM 0 HG2 LYS A 435 -0.203 2.464 6.195 1.00 54.41 H new ATOM 0 HG3 LYS A 435 -0.285 2.489 4.445 1.00 54.41 H new ATOM 0 HD2 LYS A 435 -1.313 0.193 4.504 1.00 53.51 H new ATOM 0 HD3 LYS A 435 -1.315 0.272 6.255 1.00 53.51 H new ATOM 0 HE2 LYS A 435 -2.828 2.147 4.386 1.00 72.13 H new ATOM 0 HE3 LYS A 435 -3.532 0.835 5.310 1.00 72.13 H new ATOM 0 HZ1 LYS A 435 -3.835 2.253 6.953 1.00 71.25 H new ATOM 0 HZ2 LYS A 435 -2.155 2.430 7.123 1.00 71.25 H new ATOM 0 HZ3 LYS A 435 -3.021 3.484 6.113 1.00 71.25 H new ATOM 649 N VAL A 436 1.010 -1.641 3.010 1.00 13.32 N ATOM 650 CA VAL A 436 -0.032 -2.555 2.401 1.00 71.11 C ATOM 651 C VAL A 436 -0.872 -3.201 3.557 1.00 64.25 C ATOM 652 O VAL A 436 -0.570 -4.265 4.097 1.00 24.33 O ATOM 653 CB VAL A 436 0.599 -3.665 1.376 1.00 72.12 C ATOM 654 CG1 VAL A 436 -0.333 -4.846 1.030 1.00 24.14 C ATOM 655 CG2 VAL A 436 1.050 -3.100 0.007 1.00 2.24 C ATOM 0 H VAL A 436 1.806 -2.118 3.433 1.00 13.32 H new ATOM 0 HA VAL A 436 -0.692 -1.959 1.771 1.00 71.11 H new ATOM 0 HB VAL A 436 1.451 -4.004 1.965 1.00 72.12 H new ATOM 0 HG11 VAL A 436 0.177 -5.524 0.346 1.00 24.14 H new ATOM 0 HG12 VAL A 436 -0.596 -5.381 1.942 1.00 24.14 H new ATOM 0 HG13 VAL A 436 -1.239 -4.468 0.557 1.00 24.14 H new ATOM 0 HG21 VAL A 436 1.454 -3.907 -0.604 1.00 2.24 H new ATOM 0 HG22 VAL A 436 0.196 -2.653 -0.501 1.00 2.24 H new ATOM 0 HG23 VAL A 436 1.818 -2.342 0.161 1.00 2.24 H new ATOM 665 N PHE A 437 -1.842 -2.402 4.023 1.00 52.24 N ATOM 666 CA PHE A 437 -3.098 -2.808 4.667 1.00 5.45 C ATOM 667 C PHE A 437 -4.334 -2.262 3.916 1.00 22.41 C ATOM 668 O PHE A 437 -4.242 -1.246 3.221 1.00 33.31 O ATOM 669 CB PHE A 437 -3.207 -2.368 6.139 1.00 72.25 C ATOM 670 CG PHE A 437 -2.545 -3.270 7.162 1.00 43.24 C ATOM 671 CD1 PHE A 437 -3.132 -4.474 7.560 1.00 61.51 C ATOM 672 CD2 PHE A 437 -1.352 -2.890 7.763 1.00 75.00 C ATOM 673 CE1 PHE A 437 -2.530 -5.274 8.525 1.00 61.15 C ATOM 674 CE2 PHE A 437 -0.752 -3.686 8.720 1.00 13.02 C ATOM 675 CZ PHE A 437 -1.342 -4.877 9.098 1.00 31.30 C ATOM 0 H PHE A 437 -1.764 -1.387 3.955 1.00 52.24 H new ATOM 0 HA PHE A 437 -3.080 -3.897 4.630 1.00 5.45 H new ATOM 0 HB2 PHE A 437 -2.774 -1.372 6.231 1.00 72.25 H new ATOM 0 HB3 PHE A 437 -4.264 -2.281 6.393 1.00 72.25 H new ATOM 0 HD1 PHE A 437 -4.064 -4.787 7.113 1.00 61.51 H new ATOM 0 HD2 PHE A 437 -0.886 -1.958 7.478 1.00 75.00 H new ATOM 0 HE1 PHE A 437 -2.992 -6.203 8.824 1.00 61.15 H new ATOM 0 HE2 PHE A 437 0.179 -3.377 9.173 1.00 13.02 H new ATOM 0 HZ PHE A 437 -0.870 -5.498 9.845 1.00 31.30 H new ATOM 685 N ILE A 438 -5.477 -2.949 4.083 1.00 13.41 N ATOM 686 CA ILE A 438 -6.829 -2.394 3.686 1.00 11.14 C ATOM 687 C ILE A 438 -7.370 -1.555 4.897 1.00 3.02 C ATOM 688 O ILE A 438 -7.422 -2.100 6.005 1.00 32.01 O ATOM 689 CB ILE A 438 -7.893 -3.565 3.372 1.00 74.04 C ATOM 690 CG1 ILE A 438 -7.254 -4.723 2.566 1.00 32.14 C ATOM 691 CG2 ILE A 438 -9.216 -3.128 2.675 1.00 41.34 C ATOM 692 CD1 ILE A 438 -7.101 -6.006 3.360 1.00 60.31 C ATOM 0 H ILE A 438 -5.516 -3.885 4.486 1.00 13.41 H new ATOM 0 HA ILE A 438 -6.709 -1.794 2.784 1.00 11.14 H new ATOM 0 HB ILE A 438 -8.181 -3.899 4.369 1.00 74.04 H new ATOM 0 HG12 ILE A 438 -7.865 -4.922 1.686 1.00 32.14 H new ATOM 0 HG13 ILE A 438 -6.274 -4.408 2.209 1.00 32.14 H new ATOM 0 HG21 ILE A 438 -9.849 -4.001 2.517 1.00 41.34 H new ATOM 0 HG22 ILE A 438 -9.739 -2.410 3.306 1.00 41.34 H new ATOM 0 HG23 ILE A 438 -8.986 -2.667 1.714 1.00 41.34 H new ATOM 0 HD11 ILE A 438 -6.647 -6.771 2.731 1.00 60.31 H new ATOM 0 HD12 ILE A 438 -6.465 -5.824 4.226 1.00 60.31 H new ATOM 0 HD13 ILE A 438 -8.081 -6.346 3.695 1.00 60.31 H new ATOM 704 N ASP A 439 -7.698 -0.217 4.712 1.00 1.11 N ATOM 705 CA ASP A 439 -8.237 0.643 5.814 1.00 75.42 C ATOM 706 C ASP A 439 -9.589 0.121 6.386 1.00 71.52 C ATOM 707 O ASP A 439 -10.637 0.306 5.760 1.00 32.40 O ATOM 708 CB ASP A 439 -8.407 2.117 5.369 1.00 51.14 C ATOM 709 CG ASP A 439 -7.187 2.958 5.717 1.00 52.03 C ATOM 710 OD1 ASP A 439 -6.109 2.380 5.987 1.00 13.42 O ATOM 711 OD2 ASP A 439 -7.300 4.195 5.717 1.00 2.14 O ATOM 0 H ASP A 439 -7.596 0.269 3.821 1.00 1.11 H new ATOM 0 HA ASP A 439 -7.490 0.592 6.607 1.00 75.42 H new ATOM 0 HB2 ASP A 439 -8.579 2.154 4.293 1.00 51.14 H new ATOM 0 HB3 ASP A 439 -9.289 2.542 5.848 1.00 51.14 H new ATOM 716 N LYS A 440 -9.535 -0.557 7.570 1.00 30.11 N ATOM 717 CA LYS A 440 -10.711 -1.210 8.237 1.00 51.34 C ATOM 718 C LYS A 440 -11.855 -0.246 8.745 1.00 61.42 C ATOM 719 O LYS A 440 -12.902 -0.736 9.171 1.00 51.31 O ATOM 720 CB LYS A 440 -10.210 -2.154 9.402 1.00 41.10 C ATOM 721 CG LYS A 440 -8.682 -2.513 9.383 1.00 72.00 C ATOM 722 CD LYS A 440 -7.761 -1.557 10.218 1.00 1.13 C ATOM 723 CE LYS A 440 -6.286 -1.487 9.723 1.00 33.31 C ATOM 724 NZ LYS A 440 -5.453 -0.658 10.632 1.00 24.13 N ATOM 0 H LYS A 440 -8.668 -0.669 8.096 1.00 30.11 H new ATOM 0 HA LYS A 440 -11.194 -1.786 7.448 1.00 51.34 H new ATOM 0 HB2 LYS A 440 -10.440 -1.677 10.355 1.00 41.10 H new ATOM 0 HB3 LYS A 440 -10.782 -3.081 9.364 1.00 41.10 H new ATOM 0 HG2 LYS A 440 -8.559 -3.529 9.758 1.00 72.00 H new ATOM 0 HG3 LYS A 440 -8.338 -2.511 8.349 1.00 72.00 H new ATOM 0 HD2 LYS A 440 -8.186 -0.554 10.197 1.00 1.13 H new ATOM 0 HD3 LYS A 440 -7.767 -1.884 11.258 1.00 1.13 H new ATOM 0 HE2 LYS A 440 -5.872 -2.493 9.663 1.00 33.31 H new ATOM 0 HE3 LYS A 440 -6.257 -1.069 8.717 1.00 33.31 H new ATOM 0 HZ1 LYS A 440 -4.476 -0.629 10.278 1.00 24.13 H new ATOM 0 HZ2 LYS A 440 -5.836 0.308 10.670 1.00 24.13 H new ATOM 0 HZ3 LYS A 440 -5.463 -1.072 11.586 1.00 24.13 H new ATOM 738 N GLN A 441 -11.675 1.097 8.697 1.00 23.41 N ATOM 739 CA GLN A 441 -12.663 2.074 9.198 1.00 4.12 C ATOM 740 C GLN A 441 -13.674 2.609 8.129 1.00 3.42 C ATOM 741 O GLN A 441 -14.839 2.789 8.473 1.00 42.25 O ATOM 742 CB GLN A 441 -11.937 3.205 9.997 1.00 32.21 C ATOM 743 CG GLN A 441 -10.500 3.534 9.545 1.00 41.13 C ATOM 744 CD GLN A 441 -9.812 4.572 10.425 1.00 32.14 C ATOM 745 OE1 GLN A 441 -9.866 5.767 10.157 1.00 21.12 O ATOM 746 NE2 GLN A 441 -9.180 4.117 11.508 1.00 4.15 N ATOM 0 H GLN A 441 -10.837 1.530 8.308 1.00 23.41 H new ATOM 0 HA GLN A 441 -13.316 1.533 9.883 1.00 4.12 H new ATOM 0 HB2 GLN A 441 -12.536 4.113 9.928 1.00 32.21 H new ATOM 0 HB3 GLN A 441 -11.910 2.920 11.049 1.00 32.21 H new ATOM 0 HG2 GLN A 441 -9.908 2.619 9.545 1.00 41.13 H new ATOM 0 HG3 GLN A 441 -10.524 3.898 8.518 1.00 41.13 H new ATOM 0 HE21 GLN A 441 -9.155 3.116 11.701 1.00 4.15 H new ATOM 0 HE22 GLN A 441 -8.722 4.770 12.143 1.00 4.15 H new ATOM 755 N THR A 442 -13.280 2.855 6.853 1.00 64.30 N ATOM 756 CA THR A 442 -14.283 3.231 5.805 1.00 20.31 C ATOM 757 C THR A 442 -14.447 2.156 4.683 1.00 4.04 C ATOM 758 O THR A 442 -15.023 2.478 3.638 1.00 32.14 O ATOM 759 CB THR A 442 -14.023 4.655 5.153 1.00 15.11 C ATOM 760 OG1 THR A 442 -12.630 4.816 4.854 1.00 4.01 O ATOM 761 CG2 THR A 442 -14.505 5.836 6.017 1.00 5.12 C ATOM 0 H THR A 442 -12.315 2.805 6.526 1.00 64.30 H new ATOM 0 HA THR A 442 -15.221 3.285 6.358 1.00 20.31 H new ATOM 0 HB THR A 442 -14.616 4.677 4.239 1.00 15.11 H new ATOM 0 HG1 THR A 442 -12.482 5.697 4.451 1.00 4.01 H new ATOM 0 HG21 THR A 442 -14.292 6.773 5.503 1.00 5.12 H new ATOM 0 HG22 THR A 442 -15.579 5.750 6.184 1.00 5.12 H new ATOM 0 HG23 THR A 442 -13.986 5.821 6.975 1.00 5.12 H new ATOM 769 N ASN A 443 -13.989 0.871 4.944 1.00 32.12 N ATOM 770 CA ASN A 443 -14.066 -0.324 3.976 1.00 22.04 C ATOM 771 C ASN A 443 -13.797 0.013 2.475 1.00 12.32 C ATOM 772 O ASN A 443 -14.534 -0.423 1.584 1.00 12.14 O ATOM 773 CB ASN A 443 -15.402 -1.156 4.109 1.00 12.42 C ATOM 774 CG ASN A 443 -16.697 -0.364 3.939 1.00 51.10 C ATOM 775 OD1 ASN A 443 -17.201 0.226 4.895 1.00 51.34 O ATOM 776 ND2 ASN A 443 -17.258 -0.370 2.737 1.00 12.25 N ATOM 0 H ASN A 443 -13.553 0.625 5.833 1.00 32.12 H new ATOM 0 HA ASN A 443 -13.234 -0.945 4.307 1.00 22.04 H new ATOM 0 HB2 ASN A 443 -15.386 -1.954 3.367 1.00 12.42 H new ATOM 0 HB3 ASN A 443 -15.415 -1.632 5.089 1.00 12.42 H new ATOM 0 HD21 ASN A 443 -18.136 0.125 2.581 1.00 12.25 H new ATOM 0 HD22 ASN A 443 -16.811 -0.870 1.968 1.00 12.25 H new ATOM 783 N LEU A 444 -12.705 0.721 2.184 1.00 74.21 N ATOM 784 CA LEU A 444 -12.338 0.991 0.777 1.00 33.14 C ATOM 785 C LEU A 444 -11.459 -0.181 0.209 1.00 34.12 C ATOM 786 O LEU A 444 -11.094 -1.037 1.005 1.00 73.54 O ATOM 787 CB LEU A 444 -11.827 2.469 0.579 1.00 13.44 C ATOM 788 CG LEU A 444 -10.886 3.142 1.609 1.00 60.11 C ATOM 789 CD1 LEU A 444 -9.524 2.516 1.679 1.00 63.13 C ATOM 790 CD2 LEU A 444 -10.711 4.620 1.249 1.00 43.21 C ATOM 0 H LEU A 444 -12.068 1.113 2.878 1.00 74.21 H new ATOM 0 HA LEU A 444 -13.218 0.978 0.134 1.00 33.14 H new ATOM 0 HB2 LEU A 444 -11.319 2.503 -0.385 1.00 13.44 H new ATOM 0 HB3 LEU A 444 -12.711 3.102 0.496 1.00 13.44 H new ATOM 0 HG LEU A 444 -11.359 3.012 2.583 1.00 60.11 H new ATOM 0 HD11 LEU A 444 -8.921 3.039 2.421 1.00 63.13 H new ATOM 0 HD12 LEU A 444 -9.619 1.468 1.963 1.00 63.13 H new ATOM 0 HD13 LEU A 444 -9.041 2.585 0.704 1.00 63.13 H new ATOM 0 HD21 LEU A 444 -10.049 5.095 1.973 1.00 43.21 H new ATOM 0 HD22 LEU A 444 -10.278 4.703 0.252 1.00 43.21 H new ATOM 0 HD23 LEU A 444 -11.682 5.116 1.265 1.00 43.21 H new ATOM 802 N SER A 445 -11.148 -0.224 -1.145 1.00 73.42 N ATOM 803 CA SER A 445 -10.937 -1.499 -1.966 1.00 60.24 C ATOM 804 C SER A 445 -9.928 -2.487 -1.346 1.00 74.34 C ATOM 805 O SER A 445 -9.100 -2.098 -0.552 1.00 11.43 O ATOM 806 CB SER A 445 -10.484 -1.171 -3.445 1.00 43.33 C ATOM 807 OG SER A 445 -10.185 -2.339 -4.197 1.00 32.22 O ATOM 0 H SER A 445 -11.036 0.624 -1.701 1.00 73.42 H new ATOM 0 HA SER A 445 -11.913 -1.985 -1.969 1.00 60.24 H new ATOM 0 HB2 SER A 445 -11.274 -0.612 -3.947 1.00 43.33 H new ATOM 0 HB3 SER A 445 -9.605 -0.526 -3.417 1.00 43.33 H new ATOM 0 HG SER A 445 -9.912 -2.084 -5.103 1.00 32.22 H new ATOM 813 N LYS A 446 -10.010 -3.791 -1.689 1.00 60.50 N ATOM 814 CA LYS A 446 -9.089 -4.758 -1.070 1.00 13.04 C ATOM 815 C LYS A 446 -8.014 -5.237 -2.044 1.00 13.23 C ATOM 816 O LYS A 446 -8.200 -5.138 -3.271 1.00 11.20 O ATOM 817 CB LYS A 446 -9.837 -5.943 -0.459 1.00 64.12 C ATOM 818 CG LYS A 446 -10.616 -6.783 -1.464 1.00 63.41 C ATOM 819 CD LYS A 446 -11.182 -8.040 -0.829 1.00 23.23 C ATOM 820 CE LYS A 446 -11.947 -8.875 -1.845 1.00 63.30 C ATOM 821 NZ LYS A 446 -12.582 -10.063 -1.219 1.00 13.13 N ATOM 0 H LYS A 446 -10.672 -4.182 -2.359 1.00 60.50 H new ATOM 0 HA LYS A 446 -8.584 -4.228 -0.262 1.00 13.04 H new ATOM 0 HB2 LYS A 446 -9.120 -6.584 0.053 1.00 64.12 H new ATOM 0 HB3 LYS A 446 -10.528 -5.570 0.297 1.00 64.12 H new ATOM 0 HG2 LYS A 446 -11.429 -6.189 -1.882 1.00 63.41 H new ATOM 0 HG3 LYS A 446 -9.963 -7.057 -2.293 1.00 63.41 H new ATOM 0 HD2 LYS A 446 -10.371 -8.632 -0.404 1.00 23.23 H new ATOM 0 HD3 LYS A 446 -11.843 -7.768 -0.006 1.00 23.23 H new ATOM 0 HE2 LYS A 446 -12.713 -8.260 -2.317 1.00 63.30 H new ATOM 0 HE3 LYS A 446 -11.268 -9.199 -2.634 1.00 63.30 H new ATOM 0 HZ1 LYS A 446 -13.093 -10.606 -1.944 1.00 13.13 H new ATOM 0 HZ2 LYS A 446 -11.849 -10.663 -0.790 1.00 13.13 H new ATOM 0 HZ3 LYS A 446 -13.249 -9.753 -0.484 1.00 13.13 H new ATOM 835 N CYS A 447 -6.910 -5.790 -1.465 1.00 43.42 N ATOM 836 CA CYS A 447 -5.643 -6.051 -2.182 1.00 42.34 C ATOM 837 C CYS A 447 -5.186 -4.752 -2.860 1.00 22.02 C ATOM 838 O CYS A 447 -5.218 -4.598 -4.094 1.00 11.13 O ATOM 839 CB CYS A 447 -5.783 -7.218 -3.177 1.00 11.20 C ATOM 840 SG CYS A 447 -6.514 -8.720 -2.474 1.00 3.52 S ATOM 0 H CYS A 447 -6.882 -6.066 -0.483 1.00 43.42 H new ATOM 0 HA CYS A 447 -4.878 -6.363 -1.472 1.00 42.34 H new ATOM 0 HB2 CYS A 447 -6.394 -6.891 -4.018 1.00 11.20 H new ATOM 0 HB3 CYS A 447 -4.797 -7.460 -3.575 1.00 11.20 H new ATOM 0 HG CYS A 447 -6.589 -9.637 -3.392 1.00 3.52 H new ATOM 846 N PHE A 448 -4.771 -3.819 -2.001 1.00 13.13 N ATOM 847 CA PHE A 448 -4.813 -2.397 -2.303 1.00 73.34 C ATOM 848 C PHE A 448 -3.787 -1.610 -1.421 1.00 34.31 C ATOM 849 O PHE A 448 -3.541 -1.995 -0.275 1.00 3.21 O ATOM 850 CB PHE A 448 -6.279 -1.942 -2.035 1.00 54.14 C ATOM 851 CG PHE A 448 -6.492 -0.594 -1.438 1.00 12.40 C ATOM 852 CD1 PHE A 448 -6.561 0.550 -2.213 1.00 74.30 C ATOM 853 CD2 PHE A 448 -6.641 -0.490 -0.082 1.00 0.54 C ATOM 854 CE1 PHE A 448 -6.778 1.767 -1.649 1.00 31.23 C ATOM 855 CE2 PHE A 448 -6.863 0.710 0.487 1.00 52.51 C ATOM 856 CZ PHE A 448 -6.919 1.854 -0.296 1.00 50.33 C ATOM 0 H PHE A 448 -4.397 -4.034 -1.077 1.00 13.13 H new ATOM 0 HA PHE A 448 -4.532 -2.196 -3.337 1.00 73.34 H new ATOM 0 HB2 PHE A 448 -6.819 -1.978 -2.981 1.00 54.14 H new ATOM 0 HB3 PHE A 448 -6.742 -2.677 -1.376 1.00 54.14 H new ATOM 0 HD1 PHE A 448 -6.440 0.474 -3.284 1.00 74.30 H new ATOM 0 HD2 PHE A 448 -6.580 -1.374 0.535 1.00 0.54 H new ATOM 0 HE1 PHE A 448 -6.838 2.653 -2.264 1.00 31.23 H new ATOM 0 HE2 PHE A 448 -6.998 0.782 1.556 1.00 52.51 H new ATOM 0 HZ PHE A 448 -7.075 2.817 0.168 1.00 50.33 H new ATOM 866 N GLY A 449 -3.187 -0.530 -1.959 1.00 13.23 N ATOM 867 CA GLY A 449 -2.382 0.406 -1.086 1.00 11.41 C ATOM 868 C GLY A 449 -2.387 1.916 -1.327 1.00 41.30 C ATOM 869 O GLY A 449 -3.001 2.435 -2.265 1.00 70.10 O ATOM 0 H GLY A 449 -3.228 -0.274 -2.946 1.00 13.23 H new ATOM 0 HA2 GLY A 449 -2.712 0.247 -0.060 1.00 11.41 H new ATOM 0 HA3 GLY A 449 -1.344 0.078 -1.141 1.00 11.41 H new ATOM 873 N PHE A 450 -1.663 2.605 -0.378 1.00 14.32 N ATOM 874 CA PHE A 450 -1.670 4.098 -0.223 1.00 43.34 C ATOM 875 C PHE A 450 -0.262 4.759 -0.610 1.00 34.33 C ATOM 876 O PHE A 450 0.710 4.478 0.089 1.00 41.35 O ATOM 877 CB PHE A 450 -2.020 4.428 1.298 1.00 23.45 C ATOM 878 CG PHE A 450 -3.396 4.034 1.775 1.00 74.33 C ATOM 879 CD1 PHE A 450 -3.697 2.731 2.042 1.00 53.45 C ATOM 880 CD2 PHE A 450 -4.368 4.983 1.999 1.00 61.30 C ATOM 881 CE1 PHE A 450 -4.920 2.363 2.506 1.00 1.20 C ATOM 882 CE2 PHE A 450 -5.616 4.630 2.455 1.00 42.42 C ATOM 883 CZ PHE A 450 -5.890 3.310 2.711 1.00 5.11 C ATOM 0 H PHE A 450 -1.060 2.136 0.298 1.00 14.32 H new ATOM 0 HA PHE A 450 -2.411 4.517 -0.903 1.00 43.34 H new ATOM 0 HB2 PHE A 450 -1.285 3.933 1.932 1.00 23.45 H new ATOM 0 HB3 PHE A 450 -1.901 5.501 1.450 1.00 23.45 H new ATOM 0 HD1 PHE A 450 -2.945 1.973 1.881 1.00 53.45 H new ATOM 0 HD2 PHE A 450 -4.146 6.023 1.813 1.00 61.30 H new ATOM 0 HE1 PHE A 450 -5.128 1.324 2.713 1.00 1.20 H new ATOM 0 HE2 PHE A 450 -6.373 5.384 2.610 1.00 42.42 H new ATOM 0 HZ PHE A 450 -6.865 3.018 3.072 1.00 5.11 H new ATOM 893 N VAL A 451 -0.108 5.645 -1.696 1.00 12.14 N ATOM 894 CA VAL A 451 1.190 6.419 -1.902 1.00 62.24 C ATOM 895 C VAL A 451 0.862 7.944 -1.841 1.00 43.25 C ATOM 896 O VAL A 451 -0.076 8.368 -2.510 1.00 11.20 O ATOM 897 CB VAL A 451 1.898 6.198 -3.314 1.00 71.31 C ATOM 898 CG1 VAL A 451 3.409 5.985 -3.248 1.00 23.22 C ATOM 899 CG2 VAL A 451 1.245 5.148 -4.180 1.00 14.14 C ATOM 0 H VAL A 451 -0.827 5.825 -2.396 1.00 12.14 H new ATOM 0 HA VAL A 451 1.864 6.058 -1.125 1.00 62.24 H new ATOM 0 HB VAL A 451 1.742 7.159 -3.804 1.00 71.31 H new ATOM 0 HG11 VAL A 451 3.801 5.844 -4.255 1.00 23.22 H new ATOM 0 HG12 VAL A 451 3.880 6.857 -2.794 1.00 23.22 H new ATOM 0 HG13 VAL A 451 3.626 5.102 -2.647 1.00 23.22 H new ATOM 0 HG21 VAL A 451 1.789 5.062 -5.120 1.00 14.14 H new ATOM 0 HG22 VAL A 451 1.260 4.189 -3.663 1.00 14.14 H new ATOM 0 HG23 VAL A 451 0.213 5.434 -4.383 1.00 14.14 H new ATOM 909 N SER A 452 1.585 8.783 -1.054 1.00 32.11 N ATOM 910 CA SER A 452 1.240 10.204 -0.927 1.00 61.30 C ATOM 911 C SER A 452 2.588 11.101 -1.146 1.00 22.54 C ATOM 912 O SER A 452 3.611 10.750 -0.548 1.00 3.40 O ATOM 913 CB SER A 452 0.549 10.318 0.488 1.00 12.24 C ATOM 914 OG SER A 452 0.165 9.042 0.993 1.00 24.20 O ATOM 0 H SER A 452 2.398 8.495 -0.509 1.00 32.11 H new ATOM 0 HA SER A 452 0.549 10.589 -1.677 1.00 61.30 H new ATOM 0 HB2 SER A 452 1.233 10.796 1.189 1.00 12.24 H new ATOM 0 HB3 SER A 452 -0.330 10.959 0.413 1.00 12.24 H new ATOM 0 HG SER A 452 -0.258 9.151 1.870 1.00 24.20 H new ATOM 920 N TYR A 453 2.623 12.228 -2.011 1.00 74.24 N ATOM 921 CA TYR A 453 3.899 13.020 -2.355 1.00 4.05 C ATOM 922 C TYR A 453 3.888 14.454 -1.700 1.00 21.43 C ATOM 923 O TYR A 453 2.914 14.782 -1.018 1.00 42.14 O ATOM 924 CB TYR A 453 4.009 13.284 -3.884 1.00 53.43 C ATOM 925 CG TYR A 453 4.440 12.163 -4.848 1.00 20.22 C ATOM 926 CD1 TYR A 453 5.771 11.702 -5.003 1.00 34.41 C ATOM 927 CD2 TYR A 453 3.480 11.599 -5.661 1.00 20.45 C ATOM 928 CE1 TYR A 453 6.065 10.706 -5.932 1.00 5.22 C ATOM 929 CE2 TYR A 453 3.770 10.625 -6.572 1.00 32.33 C ATOM 930 CZ TYR A 453 5.056 10.174 -6.709 1.00 65.03 C ATOM 931 OH TYR A 453 5.336 9.195 -7.633 1.00 55.23 O ATOM 0 H TYR A 453 1.789 12.594 -2.470 1.00 74.24 H new ATOM 0 HA TYR A 453 4.723 12.411 -1.984 1.00 4.05 H new ATOM 0 HB2 TYR A 453 3.034 13.637 -4.219 1.00 53.43 H new ATOM 0 HB3 TYR A 453 4.710 14.108 -4.017 1.00 53.43 H new ATOM 0 HD1 TYR A 453 6.560 12.124 -4.399 1.00 34.41 H new ATOM 0 HD2 TYR A 453 2.459 11.941 -5.574 1.00 20.45 H new ATOM 0 HE1 TYR A 453 7.079 10.351 -6.044 1.00 5.22 H new ATOM 0 HE2 TYR A 453 2.984 10.209 -7.186 1.00 32.33 H new ATOM 0 HH TYR A 453 6.080 8.644 -7.311 1.00 55.23 H new ATOM 941 N ASP A 454 4.970 15.322 -1.891 1.00 13.53 N ATOM 942 CA ASP A 454 5.012 16.652 -1.214 1.00 35.22 C ATOM 943 C ASP A 454 4.348 17.842 -2.005 1.00 54.03 C ATOM 944 O ASP A 454 3.848 18.760 -1.350 1.00 50.20 O ATOM 945 CB ASP A 454 6.457 17.068 -0.810 1.00 42.21 C ATOM 946 CG ASP A 454 6.509 18.240 0.166 1.00 40.44 C ATOM 947 OD1 ASP A 454 6.204 18.031 1.358 1.00 11.14 O ATOM 948 OD2 ASP A 454 6.887 19.362 -0.252 1.00 71.24 O ATOM 0 H ASP A 454 5.775 15.117 -2.482 1.00 13.53 H new ATOM 0 HA ASP A 454 4.402 16.484 -0.327 1.00 35.22 H new ATOM 0 HB2 ASP A 454 6.960 16.211 -0.362 1.00 42.21 H new ATOM 0 HB3 ASP A 454 7.015 17.331 -1.709 1.00 42.21 H new ATOM 953 N ASN A 455 4.258 17.854 -3.379 1.00 2.22 N ATOM 954 CA ASN A 455 3.672 19.042 -4.059 1.00 23.21 C ATOM 955 C ASN A 455 2.926 18.748 -5.389 1.00 61.01 C ATOM 956 O ASN A 455 3.397 17.885 -6.115 1.00 24.22 O ATOM 957 CB ASN A 455 4.637 20.255 -4.139 1.00 62.01 C ATOM 958 CG ASN A 455 5.972 20.109 -4.890 1.00 53.23 C ATOM 959 OD1 ASN A 455 6.390 21.048 -5.564 1.00 32.50 O ATOM 960 ND2 ASN A 455 6.666 18.976 -4.793 1.00 14.20 N ATOM 0 H ASN A 455 4.565 17.101 -3.995 1.00 2.22 H new ATOM 0 HA ASN A 455 2.873 19.349 -3.385 1.00 23.21 H new ATOM 0 HB2 ASN A 455 4.091 21.078 -4.600 1.00 62.01 H new ATOM 0 HB3 ASN A 455 4.868 20.558 -3.118 1.00 62.01 H new ATOM 0 HD21 ASN A 455 7.556 18.880 -5.282 1.00 14.20 H new ATOM 0 HD22 ASN A 455 6.307 18.205 -4.230 1.00 14.20 H new ATOM 967 N PRO A 456 1.685 19.396 -5.704 1.00 70.04 N ATOM 968 CA PRO A 456 0.830 19.037 -6.886 1.00 34.24 C ATOM 969 C PRO A 456 1.486 18.966 -8.326 1.00 72.41 C ATOM 970 O PRO A 456 0.833 18.462 -9.244 1.00 53.53 O ATOM 971 CB PRO A 456 -0.361 20.053 -6.822 1.00 51.33 C ATOM 972 CG PRO A 456 0.002 21.073 -5.815 1.00 60.10 C ATOM 973 CD PRO A 456 0.860 20.328 -4.853 1.00 33.42 C ATOM 0 HA PRO A 456 0.552 17.988 -6.785 1.00 34.24 H new ATOM 0 HB2 PRO A 456 -0.529 20.513 -7.796 1.00 51.33 H new ATOM 0 HB3 PRO A 456 -1.286 19.548 -6.544 1.00 51.33 H new ATOM 0 HG2 PRO A 456 0.538 21.908 -6.266 1.00 60.10 H new ATOM 0 HG3 PRO A 456 -0.881 21.487 -5.327 1.00 60.10 H new ATOM 0 HD2 PRO A 456 1.494 21.007 -4.283 1.00 33.42 H new ATOM 0 HD3 PRO A 456 0.257 19.775 -4.133 1.00 33.42 H new ATOM 981 N VAL A 457 2.758 19.425 -8.523 1.00 51.51 N ATOM 982 CA VAL A 457 3.476 19.253 -9.839 1.00 41.34 C ATOM 983 C VAL A 457 3.949 17.760 -10.030 1.00 1.15 C ATOM 984 O VAL A 457 3.861 17.243 -11.150 1.00 23.14 O ATOM 985 CB VAL A 457 4.695 20.279 -10.059 1.00 74.20 C ATOM 986 CG1 VAL A 457 5.432 20.069 -11.401 1.00 3.05 C ATOM 987 CG2 VAL A 457 4.261 21.755 -10.064 1.00 21.54 C ATOM 0 H VAL A 457 3.303 19.908 -7.809 1.00 51.51 H new ATOM 0 HA VAL A 457 2.745 19.497 -10.610 1.00 41.34 H new ATOM 0 HB VAL A 457 5.345 20.065 -9.211 1.00 74.20 H new ATOM 0 HG11 VAL A 457 6.243 20.792 -11.488 1.00 3.05 H new ATOM 0 HG12 VAL A 457 5.841 19.059 -11.437 1.00 3.05 H new ATOM 0 HG13 VAL A 457 4.733 20.207 -12.226 1.00 3.05 H new ATOM 0 HG21 VAL A 457 5.133 22.390 -10.217 1.00 21.54 H new ATOM 0 HG22 VAL A 457 3.545 21.921 -10.869 1.00 21.54 H new ATOM 0 HG23 VAL A 457 3.796 22.001 -9.109 1.00 21.54 H new ATOM 997 N SER A 458 4.396 17.034 -8.952 1.00 41.41 N ATOM 998 CA SER A 458 4.873 15.622 -9.107 1.00 10.34 C ATOM 999 C SER A 458 3.733 14.566 -9.325 1.00 62.03 C ATOM 1000 O SER A 458 4.005 13.492 -9.866 1.00 54.03 O ATOM 1001 CB SER A 458 5.834 15.187 -7.959 1.00 44.41 C ATOM 1002 OG SER A 458 5.519 15.803 -6.720 1.00 14.01 O ATOM 0 H SER A 458 4.434 17.392 -7.998 1.00 41.41 H new ATOM 0 HA SER A 458 5.441 15.635 -10.037 1.00 10.34 H new ATOM 0 HB2 SER A 458 5.789 14.104 -7.844 1.00 44.41 H new ATOM 0 HB3 SER A 458 6.859 15.436 -8.234 1.00 44.41 H new ATOM 0 HG SER A 458 6.148 15.497 -6.033 1.00 14.01 H new ATOM 1008 N ALA A 459 2.468 14.873 -8.921 1.00 30.52 N ATOM 1009 CA ALA A 459 1.299 13.965 -9.164 1.00 62.32 C ATOM 1010 C ALA A 459 0.905 13.813 -10.655 1.00 71.03 C ATOM 1011 O ALA A 459 0.549 12.707 -11.061 1.00 62.42 O ATOM 1012 CB ALA A 459 0.052 14.288 -8.350 1.00 43.22 C ATOM 0 H ALA A 459 2.228 15.734 -8.429 1.00 30.52 H new ATOM 0 HA ALA A 459 1.688 13.010 -8.811 1.00 62.32 H new ATOM 0 HB1 ALA A 459 -0.737 13.577 -8.596 1.00 43.22 H new ATOM 0 HB2 ALA A 459 0.284 14.220 -7.287 1.00 43.22 H new ATOM 0 HB3 ALA A 459 -0.284 15.298 -8.584 1.00 43.22 H new ATOM 1018 N GLN A 460 0.989 14.901 -11.484 1.00 52.31 N ATOM 1019 CA GLN A 460 0.483 14.859 -12.880 1.00 63.21 C ATOM 1020 C GLN A 460 1.353 13.962 -13.781 1.00 71.44 C ATOM 1021 O GLN A 460 0.819 13.292 -14.670 1.00 62.41 O ATOM 1022 CB GLN A 460 0.295 16.263 -13.516 1.00 2.24 C ATOM 1023 CG GLN A 460 -0.763 17.147 -12.805 1.00 33.41 C ATOM 1024 CD GLN A 460 -1.990 16.394 -12.290 1.00 72.33 C ATOM 1025 OE1 GLN A 460 -2.953 16.177 -13.020 1.00 71.24 O ATOM 1026 NE2 GLN A 460 -1.974 16.035 -11.008 1.00 40.43 N ATOM 0 H GLN A 460 1.395 15.796 -11.210 1.00 52.31 H new ATOM 0 HA GLN A 460 -0.510 14.415 -12.811 1.00 63.21 H new ATOM 0 HB2 GLN A 460 1.252 16.784 -13.508 1.00 2.24 H new ATOM 0 HB3 GLN A 460 0.007 16.141 -14.560 1.00 2.24 H new ATOM 0 HG2 GLN A 460 -0.287 17.654 -11.965 1.00 33.41 H new ATOM 0 HG3 GLN A 460 -1.094 17.920 -13.498 1.00 33.41 H new ATOM 0 HE21 GLN A 460 -1.155 16.233 -10.433 1.00 40.43 H new ATOM 0 HE22 GLN A 460 -2.781 15.562 -10.601 1.00 40.43 H new ATOM 1035 N ALA A 461 2.687 13.923 -13.535 1.00 32.22 N ATOM 1036 CA ALA A 461 3.580 13.016 -14.285 1.00 1.30 C ATOM 1037 C ALA A 461 3.425 11.517 -13.876 1.00 3.22 C ATOM 1038 O ALA A 461 3.578 10.655 -14.747 1.00 1.14 O ATOM 1039 CB ALA A 461 5.056 13.469 -14.241 1.00 34.44 C ATOM 0 H ALA A 461 3.157 14.499 -12.836 1.00 32.22 H new ATOM 0 HA ALA A 461 3.253 13.085 -15.322 1.00 1.30 H new ATOM 0 HB1 ALA A 461 5.669 12.768 -14.807 1.00 34.44 H new ATOM 0 HB2 ALA A 461 5.145 14.464 -14.678 1.00 34.44 H new ATOM 0 HB3 ALA A 461 5.398 13.496 -13.206 1.00 34.44 H new ATOM 1045 N ALA A 462 3.118 11.182 -12.581 1.00 73.42 N ATOM 1046 CA ALA A 462 2.858 9.771 -12.208 1.00 74.02 C ATOM 1047 C ALA A 462 1.544 9.204 -12.789 1.00 52.20 C ATOM 1048 O ALA A 462 1.566 8.064 -13.223 1.00 51.12 O ATOM 1049 CB ALA A 462 2.936 9.497 -10.695 1.00 72.53 C ATOM 0 H ALA A 462 3.049 11.849 -11.813 1.00 73.42 H new ATOM 0 HA ALA A 462 3.683 9.234 -12.677 1.00 74.02 H new ATOM 0 HB1 ALA A 462 2.734 8.443 -10.505 1.00 72.53 H new ATOM 0 HB2 ALA A 462 3.933 9.747 -10.331 1.00 72.53 H new ATOM 0 HB3 ALA A 462 2.197 10.107 -10.176 1.00 72.53 H new ATOM 1055 N ILE A 463 0.422 9.986 -12.833 1.00 41.51 N ATOM 1056 CA ILE A 463 -0.853 9.502 -13.373 1.00 61.14 C ATOM 1057 C ILE A 463 -0.697 9.032 -14.861 1.00 1.31 C ATOM 1058 O ILE A 463 -1.233 7.991 -15.186 1.00 3.22 O ATOM 1059 CB ILE A 463 -2.027 10.569 -13.137 1.00 74.21 C ATOM 1060 CG1 ILE A 463 -2.267 10.794 -11.570 1.00 3.33 C ATOM 1061 CG2 ILE A 463 -3.358 10.175 -13.849 1.00 54.42 C ATOM 1062 CD1 ILE A 463 -3.391 11.750 -11.176 1.00 4.03 C ATOM 0 H ILE A 463 0.393 10.949 -12.498 1.00 41.51 H new ATOM 0 HA ILE A 463 -1.155 8.613 -12.819 1.00 61.14 H new ATOM 0 HB ILE A 463 -1.700 11.506 -13.589 1.00 74.21 H new ATOM 0 HG12 ILE A 463 -2.470 9.825 -11.115 1.00 3.33 H new ATOM 0 HG13 ILE A 463 -1.339 11.163 -11.134 1.00 3.33 H new ATOM 0 HG21 ILE A 463 -4.114 10.935 -13.653 1.00 54.42 H new ATOM 0 HG22 ILE A 463 -3.188 10.101 -14.923 1.00 54.42 H new ATOM 0 HG23 ILE A 463 -3.703 9.213 -13.469 1.00 54.42 H new ATOM 0 HD11 ILE A 463 -3.449 11.815 -10.089 1.00 4.03 H new ATOM 0 HD12 ILE A 463 -3.189 12.739 -11.588 1.00 4.03 H new ATOM 0 HD13 ILE A 463 -4.338 11.380 -11.569 1.00 4.03 H new ATOM 1074 N GLN A 464 0.120 9.723 -15.724 1.00 45.04 N ATOM 1075 CA GLN A 464 0.402 9.221 -17.116 1.00 12.03 C ATOM 1076 C GLN A 464 1.236 7.890 -17.188 1.00 63.34 C ATOM 1077 O GLN A 464 0.807 6.978 -17.885 1.00 32.03 O ATOM 1078 CB GLN A 464 1.042 10.324 -18.045 1.00 13.30 C ATOM 1079 CG GLN A 464 0.127 10.887 -19.164 1.00 60.05 C ATOM 1080 CD GLN A 464 -1.399 10.790 -18.930 1.00 60.54 C ATOM 1081 OE1 GLN A 464 -2.015 9.790 -19.302 1.00 24.13 O ATOM 1082 NE2 GLN A 464 -2.020 11.825 -18.344 1.00 3.41 N ATOM 0 H GLN A 464 0.582 10.602 -15.491 1.00 45.04 H new ATOM 0 HA GLN A 464 -0.588 8.975 -17.499 1.00 12.03 H new ATOM 0 HB2 GLN A 464 1.368 11.154 -17.418 1.00 13.30 H new ATOM 0 HB3 GLN A 464 1.935 9.906 -18.510 1.00 13.30 H new ATOM 0 HG2 GLN A 464 0.382 11.936 -19.316 1.00 60.05 H new ATOM 0 HG3 GLN A 464 0.363 10.364 -20.091 1.00 60.05 H new ATOM 0 HE21 GLN A 464 -1.483 12.640 -18.046 1.00 3.41 H new ATOM 0 HE22 GLN A 464 -3.029 11.797 -18.196 1.00 3.41 H new ATOM 1091 N ALA A 465 2.410 7.765 -16.510 1.00 74.32 N ATOM 1092 CA ALA A 465 3.238 6.497 -16.566 1.00 41.12 C ATOM 1093 C ALA A 465 2.683 5.311 -15.661 1.00 24.50 C ATOM 1094 O ALA A 465 3.264 4.224 -15.645 1.00 44.41 O ATOM 1095 CB ALA A 465 4.744 6.787 -16.277 1.00 51.03 C ATOM 0 H ALA A 465 2.809 8.501 -15.927 1.00 74.32 H new ATOM 0 HA ALA A 465 3.147 6.137 -17.591 1.00 41.12 H new ATOM 0 HB1 ALA A 465 5.309 5.856 -16.325 1.00 51.03 H new ATOM 0 HB2 ALA A 465 5.129 7.485 -17.021 1.00 51.03 H new ATOM 0 HB3 ALA A 465 4.846 7.223 -15.283 1.00 51.03 H new ATOM 1101 N MET A 466 1.564 5.542 -14.932 1.00 52.54 N ATOM 1102 CA MET A 466 0.943 4.574 -13.957 1.00 14.14 C ATOM 1103 C MET A 466 -0.520 4.197 -14.325 1.00 63.40 C ATOM 1104 O MET A 466 -1.028 3.219 -13.777 1.00 62.31 O ATOM 1105 CB MET A 466 0.994 5.059 -12.466 1.00 11.55 C ATOM 1106 CG MET A 466 2.325 4.855 -11.722 1.00 33.22 C ATOM 1107 SD MET A 466 3.724 5.762 -12.400 1.00 2.30 S ATOM 1108 CE MET A 466 5.052 5.094 -11.404 1.00 1.05 C ATOM 0 H MET A 466 1.048 6.419 -14.997 1.00 52.54 H new ATOM 0 HA MET A 466 1.567 3.684 -14.041 1.00 14.14 H new ATOM 0 HB2 MET A 466 0.751 6.121 -12.444 1.00 11.55 H new ATOM 0 HB3 MET A 466 0.211 4.541 -11.912 1.00 11.55 H new ATOM 0 HG2 MET A 466 2.191 5.150 -10.681 1.00 33.22 H new ATOM 0 HG3 MET A 466 2.565 3.792 -11.724 1.00 33.22 H new ATOM 0 HE1 MET A 466 5.995 5.554 -11.699 1.00 1.05 H new ATOM 0 HE2 MET A 466 4.859 5.304 -10.352 1.00 1.05 H new ATOM 0 HE3 MET A 466 5.112 4.016 -11.553 1.00 1.05 H new ATOM 1118 N ASN A 467 -1.228 4.935 -15.212 1.00 0.22 N ATOM 1119 CA ASN A 467 -2.510 4.421 -15.713 1.00 41.13 C ATOM 1120 C ASN A 467 -2.201 3.339 -16.824 1.00 71.43 C ATOM 1121 O ASN A 467 -1.448 3.641 -17.755 1.00 12.30 O ATOM 1122 CB ASN A 467 -3.523 5.539 -16.170 1.00 2.45 C ATOM 1123 CG ASN A 467 -3.065 6.644 -17.120 1.00 50.02 C ATOM 1124 OD1 ASN A 467 -3.596 7.752 -17.042 1.00 54.02 O ATOM 1125 ND2 ASN A 467 -2.139 6.400 -18.020 1.00 54.14 N ATOM 0 H ASN A 467 -0.946 5.845 -15.577 1.00 0.22 H new ATOM 0 HA ASN A 467 -3.047 3.948 -14.891 1.00 41.13 H new ATOM 0 HB2 ASN A 467 -4.369 5.037 -16.640 1.00 2.45 H new ATOM 0 HB3 ASN A 467 -3.900 6.022 -15.269 1.00 2.45 H new ATOM 0 HD21 ASN A 467 -1.851 7.134 -18.667 1.00 54.14 H new ATOM 0 HD22 ASN A 467 -1.709 5.477 -18.072 1.00 54.14 H new ATOM 1132 N GLY A 468 -2.712 2.074 -16.728 1.00 51.51 N ATOM 1133 CA GLY A 468 -2.336 1.058 -17.740 1.00 1.51 C ATOM 1134 C GLY A 468 -1.150 0.087 -17.442 1.00 31.13 C ATOM 1135 O GLY A 468 -0.707 -0.554 -18.398 1.00 1.12 O ATOM 0 H GLY A 468 -3.350 1.753 -16.000 1.00 51.51 H new ATOM 0 HA2 GLY A 468 -3.218 0.448 -17.936 1.00 1.51 H new ATOM 0 HA3 GLY A 468 -2.103 1.587 -18.664 1.00 1.51 H new ATOM 1139 N PHE A 469 -0.613 -0.067 -16.190 1.00 62.53 N ATOM 1140 CA PHE A 469 0.683 -0.819 -16.022 1.00 74.25 C ATOM 1141 C PHE A 469 0.428 -2.366 -16.118 1.00 73.31 C ATOM 1142 O PHE A 469 -0.250 -2.934 -15.253 1.00 0.04 O ATOM 1143 CB PHE A 469 1.422 -0.429 -14.673 1.00 34.02 C ATOM 1144 CG PHE A 469 2.939 -0.644 -14.539 1.00 42.13 C ATOM 1145 CD1 PHE A 469 3.788 -0.972 -15.603 1.00 71.44 C ATOM 1146 CD2 PHE A 469 3.524 -0.452 -13.283 1.00 73.54 C ATOM 1147 CE1 PHE A 469 5.168 -1.097 -15.405 1.00 0.42 C ATOM 1148 CE2 PHE A 469 4.889 -0.586 -13.094 1.00 50.43 C ATOM 1149 CZ PHE A 469 5.703 -0.906 -14.154 1.00 44.32 C ATOM 0 H PHE A 469 -1.024 0.293 -15.329 1.00 62.53 H new ATOM 0 HA PHE A 469 1.350 -0.531 -16.835 1.00 74.25 H new ATOM 0 HB2 PHE A 469 1.227 0.628 -14.490 1.00 34.02 H new ATOM 0 HB3 PHE A 469 0.943 -0.986 -13.868 1.00 34.02 H new ATOM 0 HD1 PHE A 469 3.373 -1.130 -16.588 1.00 71.44 H new ATOM 0 HD2 PHE A 469 2.897 -0.194 -12.442 1.00 73.54 H new ATOM 0 HE1 PHE A 469 5.812 -1.344 -16.236 1.00 0.42 H new ATOM 0 HE2 PHE A 469 5.315 -0.439 -12.112 1.00 50.43 H new ATOM 0 HZ PHE A 469 6.768 -1.008 -14.003 1.00 44.32 H new ATOM 1159 N GLN A 470 0.939 -3.036 -17.198 1.00 65.22 N ATOM 1160 CA GLN A 470 0.683 -4.471 -17.457 1.00 21.51 C ATOM 1161 C GLN A 470 1.925 -5.382 -17.083 1.00 50.42 C ATOM 1162 O GLN A 470 3.006 -5.182 -17.632 1.00 74.02 O ATOM 1163 CB GLN A 470 0.286 -4.550 -18.958 1.00 33.33 C ATOM 1164 CG GLN A 470 -0.045 -5.927 -19.585 1.00 2.32 C ATOM 1165 CD GLN A 470 -0.437 -5.844 -21.054 1.00 24.11 C ATOM 1166 OE1 GLN A 470 -0.310 -6.815 -21.794 1.00 60.15 O ATOM 1167 NE2 GLN A 470 -0.845 -4.674 -21.492 1.00 54.44 N ATOM 0 H GLN A 470 1.532 -2.593 -17.900 1.00 65.22 H new ATOM 0 HA GLN A 470 -0.115 -4.862 -16.826 1.00 21.51 H new ATOM 0 HB2 GLN A 470 -0.583 -3.908 -19.101 1.00 33.33 H new ATOM 0 HB3 GLN A 470 1.102 -4.115 -19.536 1.00 33.33 H new ATOM 0 HG2 GLN A 470 0.821 -6.581 -19.484 1.00 2.32 H new ATOM 0 HG3 GLN A 470 -0.859 -6.387 -19.025 1.00 2.32 H new ATOM 0 HE21 GLN A 470 -0.938 -3.891 -20.845 1.00 54.44 H new ATOM 0 HE22 GLN A 470 -1.069 -4.549 -22.479 1.00 54.44 H new ATOM 1176 N ILE A 471 1.770 -6.366 -16.122 1.00 74.13 N ATOM 1177 CA ILE A 471 2.922 -7.177 -15.545 1.00 61.24 C ATOM 1178 C ILE A 471 2.387 -8.619 -15.217 1.00 31.34 C ATOM 1179 O ILE A 471 1.828 -8.795 -14.125 1.00 2.12 O ATOM 1180 CB ILE A 471 3.504 -6.554 -14.182 1.00 41.23 C ATOM 1181 CG1 ILE A 471 3.445 -5.008 -14.236 1.00 51.53 C ATOM 1182 CG2 ILE A 471 4.937 -7.021 -13.850 1.00 5.21 C ATOM 1183 CD1 ILE A 471 4.112 -4.241 -13.104 1.00 73.24 C ATOM 0 H ILE A 471 0.862 -6.618 -15.730 1.00 74.13 H new ATOM 0 HA ILE A 471 3.723 -7.181 -16.284 1.00 61.24 H new ATOM 0 HB ILE A 471 2.868 -6.925 -13.378 1.00 41.23 H new ATOM 0 HG12 ILE A 471 3.899 -4.686 -15.174 1.00 51.53 H new ATOM 0 HG13 ILE A 471 2.397 -4.712 -14.271 1.00 51.53 H new ATOM 0 HG21 ILE A 471 5.263 -6.560 -12.918 1.00 5.21 H new ATOM 0 HG22 ILE A 471 4.951 -8.106 -13.743 1.00 5.21 H new ATOM 0 HG23 ILE A 471 5.611 -6.727 -14.655 1.00 5.21 H new ATOM 0 HD11 ILE A 471 3.994 -3.170 -13.271 1.00 73.24 H new ATOM 0 HD12 ILE A 471 3.648 -4.514 -12.156 1.00 73.24 H new ATOM 0 HD13 ILE A 471 5.173 -4.488 -13.073 1.00 73.24 H new ATOM 1195 N GLY A 472 2.503 -9.642 -16.142 1.00 4.51 N ATOM 1196 CA GLY A 472 1.906 -10.976 -15.901 1.00 72.55 C ATOM 1197 C GLY A 472 0.333 -10.945 -15.916 1.00 61.31 C ATOM 1198 O GLY A 472 -0.248 -10.475 -16.898 1.00 21.34 O ATOM 0 H GLY A 472 2.994 -9.554 -17.032 1.00 4.51 H new ATOM 0 HA2 GLY A 472 2.260 -11.671 -16.662 1.00 72.55 H new ATOM 0 HA3 GLY A 472 2.249 -11.355 -14.939 1.00 72.55 H new ATOM 1202 N MET A 473 -0.358 -11.410 -14.838 1.00 61.14 N ATOM 1203 CA MET A 473 -1.882 -11.549 -14.841 1.00 32.12 C ATOM 1204 C MET A 473 -2.664 -10.522 -13.946 1.00 64.24 C ATOM 1205 O MET A 473 -3.746 -10.827 -13.445 1.00 45.12 O ATOM 1206 CB MET A 473 -2.317 -13.055 -14.608 1.00 22.21 C ATOM 1207 CG MET A 473 -2.118 -13.734 -13.224 1.00 62.00 C ATOM 1208 SD MET A 473 -3.617 -13.757 -12.220 1.00 61.45 S ATOM 1209 CE MET A 473 -3.015 -14.551 -10.731 1.00 22.21 C ATOM 0 H MET A 473 0.084 -11.695 -13.964 1.00 61.14 H new ATOM 0 HA MET A 473 -2.194 -11.262 -15.845 1.00 32.12 H new ATOM 0 HB2 MET A 473 -3.378 -13.123 -14.849 1.00 22.21 H new ATOM 0 HB3 MET A 473 -1.784 -13.660 -15.342 1.00 22.21 H new ATOM 0 HG2 MET A 473 -1.774 -14.757 -13.375 1.00 62.00 H new ATOM 0 HG3 MET A 473 -1.332 -13.211 -12.680 1.00 62.00 H new ATOM 0 HE1 MET A 473 -3.828 -14.638 -10.011 1.00 22.21 H new ATOM 0 HE2 MET A 473 -2.639 -15.544 -10.975 1.00 22.21 H new ATOM 0 HE3 MET A 473 -2.211 -13.954 -10.300 1.00 22.21 H new ATOM 1219 N LYS A 474 -2.159 -9.274 -13.801 1.00 43.40 N ATOM 1220 CA LYS A 474 -2.883 -8.211 -13.100 1.00 33.11 C ATOM 1221 C LYS A 474 -2.663 -6.880 -13.864 1.00 72.33 C ATOM 1222 O LYS A 474 -1.575 -6.682 -14.420 1.00 41.12 O ATOM 1223 CB LYS A 474 -2.391 -7.982 -11.647 1.00 10.01 C ATOM 1224 CG LYS A 474 -3.023 -8.835 -10.500 1.00 32.05 C ATOM 1225 CD LYS A 474 -4.277 -8.182 -9.882 1.00 32.44 C ATOM 1226 CE LYS A 474 -4.826 -8.957 -8.675 1.00 1.12 C ATOM 1227 NZ LYS A 474 -3.755 -9.267 -7.683 1.00 42.44 N ATOM 0 H LYS A 474 -1.250 -8.988 -14.165 1.00 43.40 H new ATOM 0 HA LYS A 474 -3.928 -8.518 -13.062 1.00 33.11 H new ATOM 0 HB2 LYS A 474 -1.314 -8.152 -11.631 1.00 10.01 H new ATOM 0 HB3 LYS A 474 -2.551 -6.931 -11.405 1.00 10.01 H new ATOM 0 HG2 LYS A 474 -3.287 -9.818 -10.889 1.00 32.05 H new ATOM 0 HG3 LYS A 474 -2.279 -8.991 -9.719 1.00 32.05 H new ATOM 0 HD2 LYS A 474 -4.035 -7.165 -9.574 1.00 32.44 H new ATOM 0 HD3 LYS A 474 -5.054 -8.109 -10.643 1.00 32.44 H new ATOM 0 HE2 LYS A 474 -5.610 -8.372 -8.193 1.00 1.12 H new ATOM 0 HE3 LYS A 474 -5.285 -9.885 -9.017 1.00 1.12 H new ATOM 0 HZ1 LYS A 474 -4.188 -9.572 -6.788 1.00 42.44 H new ATOM 0 HZ2 LYS A 474 -3.150 -10.028 -8.052 1.00 42.44 H new ATOM 0 HZ3 LYS A 474 -3.179 -8.417 -7.516 1.00 42.44 H new ATOM 1241 N ARG A 475 -3.650 -5.971 -13.913 1.00 44.24 N ATOM 1242 CA ARG A 475 -3.343 -4.568 -14.286 1.00 24.02 C ATOM 1243 C ARG A 475 -3.344 -3.591 -13.035 1.00 44.03 C ATOM 1244 O ARG A 475 -4.323 -3.588 -12.296 1.00 22.31 O ATOM 1245 CB ARG A 475 -4.349 -4.020 -15.364 1.00 43.51 C ATOM 1246 CG ARG A 475 -3.951 -2.686 -15.973 1.00 12.12 C ATOM 1247 CD ARG A 475 -3.560 -2.863 -17.441 1.00 12.51 C ATOM 1248 NE ARG A 475 -3.032 -4.217 -17.727 1.00 61.21 N ATOM 1249 CZ ARG A 475 -3.649 -5.137 -18.508 1.00 61.31 C ATOM 1250 NH1 ARG A 475 -4.794 -4.859 -19.125 1.00 42.03 N ATOM 1251 NH2 ARG A 475 -3.150 -6.368 -18.593 1.00 23.31 N ATOM 0 H ARG A 475 -4.631 -6.163 -13.709 1.00 44.24 H new ATOM 0 HA ARG A 475 -2.338 -4.590 -14.706 1.00 24.02 H new ATOM 0 HB2 ARG A 475 -4.444 -4.756 -16.162 1.00 43.51 H new ATOM 0 HB3 ARG A 475 -5.333 -3.918 -14.906 1.00 43.51 H new ATOM 0 HG2 ARG A 475 -4.779 -1.982 -15.893 1.00 12.12 H new ATOM 0 HG3 ARG A 475 -3.116 -2.260 -15.417 1.00 12.12 H new ATOM 0 HD2 ARG A 475 -4.430 -2.675 -18.071 1.00 12.51 H new ATOM 0 HD3 ARG A 475 -2.808 -2.120 -17.706 1.00 12.51 H new ATOM 0 HE ARG A 475 -2.140 -4.476 -17.306 1.00 61.21 H new ATOM 0 HH11 ARG A 475 -5.223 -3.940 -19.015 1.00 42.03 H new ATOM 0 HH12 ARG A 475 -5.243 -5.565 -19.709 1.00 42.03 H new ATOM 0 HH21 ARG A 475 -2.308 -6.614 -18.072 1.00 23.31 H new ATOM 0 HH22 ARG A 475 -3.609 -7.065 -19.179 1.00 23.31 H new ATOM 1265 N LEU A 476 -2.254 -2.765 -12.811 1.00 35.45 N ATOM 1266 CA LEU A 476 -2.297 -1.579 -11.860 1.00 14.21 C ATOM 1267 C LEU A 476 -3.365 -0.489 -12.301 1.00 60.41 C ATOM 1268 O LEU A 476 -3.329 -0.063 -13.462 1.00 13.35 O ATOM 1269 CB LEU A 476 -0.915 -0.841 -11.884 1.00 23.21 C ATOM 1270 CG LEU A 476 -0.591 0.162 -10.753 1.00 22.11 C ATOM 1271 CD1 LEU A 476 0.334 -0.433 -9.679 1.00 30.01 C ATOM 1272 CD2 LEU A 476 0.081 1.407 -11.301 1.00 65.02 C ATOM 0 H LEU A 476 -1.351 -2.895 -13.267 1.00 35.45 H new ATOM 0 HA LEU A 476 -2.551 -1.982 -10.880 1.00 14.21 H new ATOM 0 HB2 LEU A 476 -0.134 -1.601 -11.886 1.00 23.21 H new ATOM 0 HB3 LEU A 476 -0.842 -0.307 -12.831 1.00 23.21 H new ATOM 0 HG LEU A 476 -1.551 0.409 -10.300 1.00 22.11 H new ATOM 0 HD11 LEU A 476 0.528 0.315 -8.910 1.00 30.01 H new ATOM 0 HD12 LEU A 476 -0.145 -1.302 -9.227 1.00 30.01 H new ATOM 0 HD13 LEU A 476 1.276 -0.735 -10.137 1.00 30.01 H new ATOM 0 HD21 LEU A 476 0.297 2.094 -10.483 1.00 65.02 H new ATOM 0 HD22 LEU A 476 1.011 1.130 -11.797 1.00 65.02 H new ATOM 0 HD23 LEU A 476 -0.582 1.893 -12.017 1.00 65.02 H new ATOM 1284 N LYS A 477 -4.324 -0.040 -11.411 1.00 20.24 N ATOM 1285 CA LYS A 477 -5.196 1.164 -11.730 1.00 33.23 C ATOM 1286 C LYS A 477 -5.084 2.322 -10.622 1.00 41.11 C ATOM 1287 O LYS A 477 -5.420 2.083 -9.462 1.00 24.44 O ATOM 1288 CB LYS A 477 -6.676 0.710 -12.062 1.00 41.12 C ATOM 1289 CG LYS A 477 -7.880 1.711 -11.843 1.00 32.51 C ATOM 1290 CD LYS A 477 -7.813 3.032 -12.647 1.00 13.24 C ATOM 1291 CE LYS A 477 -9.125 3.846 -12.499 1.00 52.01 C ATOM 1292 NZ LYS A 477 -8.993 5.238 -13.023 1.00 22.51 N ATOM 0 H LYS A 477 -4.510 -0.470 -10.505 1.00 20.24 H new ATOM 0 HA LYS A 477 -4.813 1.634 -12.636 1.00 33.23 H new ATOM 0 HB2 LYS A 477 -6.694 0.406 -13.109 1.00 41.12 H new ATOM 0 HB3 LYS A 477 -6.883 -0.180 -11.468 1.00 41.12 H new ATOM 0 HG2 LYS A 477 -8.806 1.197 -12.101 1.00 32.51 H new ATOM 0 HG3 LYS A 477 -7.936 1.956 -10.782 1.00 32.51 H new ATOM 0 HD2 LYS A 477 -6.970 3.630 -12.300 1.00 13.24 H new ATOM 0 HD3 LYS A 477 -7.636 2.812 -13.700 1.00 13.24 H new ATOM 0 HE2 LYS A 477 -9.928 3.335 -13.030 1.00 52.01 H new ATOM 0 HE3 LYS A 477 -9.411 3.882 -11.448 1.00 52.01 H new ATOM 0 HZ1 LYS A 477 -9.866 5.768 -12.826 1.00 22.51 H new ATOM 0 HZ2 LYS A 477 -8.190 5.709 -12.559 1.00 22.51 H new ATOM 0 HZ3 LYS A 477 -8.831 5.208 -14.050 1.00 22.51 H new ATOM 1306 N VAL A 478 -4.610 3.588 -10.983 1.00 51.41 N ATOM 1307 CA VAL A 478 -4.457 4.725 -10.036 1.00 71.41 C ATOM 1308 C VAL A 478 -5.755 5.629 -10.005 1.00 75.12 C ATOM 1309 O VAL A 478 -6.403 5.783 -11.051 1.00 4.22 O ATOM 1310 CB VAL A 478 -3.163 5.574 -10.487 1.00 54.21 C ATOM 1311 CG1 VAL A 478 -3.286 7.099 -10.413 1.00 3.01 C ATOM 1312 CG2 VAL A 478 -1.918 5.213 -9.700 1.00 21.22 C ATOM 0 H VAL A 478 -4.333 3.820 -11.937 1.00 51.41 H new ATOM 0 HA VAL A 478 -4.321 4.348 -9.022 1.00 71.41 H new ATOM 0 HB VAL A 478 -3.086 5.288 -11.536 1.00 54.21 H new ATOM 0 HG11 VAL A 478 -2.352 7.556 -10.741 1.00 3.01 H new ATOM 0 HG12 VAL A 478 -4.099 7.430 -11.059 1.00 3.01 H new ATOM 0 HG13 VAL A 478 -3.494 7.398 -9.386 1.00 3.01 H new ATOM 0 HG21 VAL A 478 -1.080 5.817 -10.048 1.00 21.22 H new ATOM 0 HG22 VAL A 478 -2.089 5.405 -8.641 1.00 21.22 H new ATOM 0 HG23 VAL A 478 -1.689 4.157 -9.845 1.00 21.22 H new ATOM 1322 N GLN A 479 -6.166 6.224 -8.827 1.00 44.32 N ATOM 1323 CA GLN A 479 -7.253 7.216 -8.828 1.00 72.11 C ATOM 1324 C GLN A 479 -6.676 8.662 -8.568 1.00 31.11 C ATOM 1325 O GLN A 479 -5.934 8.830 -7.592 1.00 22.34 O ATOM 1326 CB GLN A 479 -8.345 6.890 -7.731 1.00 0.30 C ATOM 1327 CG GLN A 479 -8.827 5.420 -7.624 1.00 72.24 C ATOM 1328 CD GLN A 479 -9.992 5.298 -6.664 1.00 61.33 C ATOM 1329 OE1 GLN A 479 -11.137 5.546 -7.025 1.00 12.13 O ATOM 1330 NE2 GLN A 479 -9.729 4.809 -5.464 1.00 63.01 N ATOM 0 H GLN A 479 -5.764 6.028 -7.910 1.00 44.32 H new ATOM 0 HA GLN A 479 -7.726 7.175 -9.809 1.00 72.11 H new ATOM 0 HB2 GLN A 479 -7.947 7.186 -6.760 1.00 0.30 H new ATOM 0 HB3 GLN A 479 -9.215 7.517 -7.924 1.00 0.30 H new ATOM 0 HG2 GLN A 479 -9.123 5.058 -8.609 1.00 72.24 H new ATOM 0 HG3 GLN A 479 -8.006 4.788 -7.286 1.00 72.24 H new ATOM 0 HE21 GLN A 479 -8.765 4.613 -5.193 1.00 63.01 H new ATOM 0 HE22 GLN A 479 -10.490 4.628 -4.809 1.00 63.01 H new ATOM 1339 N LEU A 480 -6.986 9.700 -9.442 1.00 5.13 N ATOM 1340 CA LEU A 480 -6.611 11.130 -9.161 1.00 50.21 C ATOM 1341 C LEU A 480 -7.435 11.649 -7.944 1.00 62.41 C ATOM 1342 O LEU A 480 -8.654 11.807 -8.092 1.00 45.44 O ATOM 1343 CB LEU A 480 -6.931 12.038 -10.431 1.00 72.54 C ATOM 1344 CG LEU A 480 -6.456 13.541 -10.452 1.00 32.55 C ATOM 1345 CD1 LEU A 480 -6.215 13.990 -11.894 1.00 63.34 C ATOM 1346 CD2 LEU A 480 -7.481 14.506 -9.847 1.00 5.15 C ATOM 0 H LEU A 480 -7.483 9.566 -10.323 1.00 5.13 H new ATOM 0 HA LEU A 480 -5.545 11.182 -8.940 1.00 50.21 H new ATOM 0 HB2 LEU A 480 -6.497 11.546 -11.301 1.00 72.54 H new ATOM 0 HB3 LEU A 480 -8.012 12.035 -10.570 1.00 72.54 H new ATOM 0 HG LEU A 480 -5.546 13.575 -9.853 1.00 32.55 H new ATOM 0 HD11 LEU A 480 -5.887 15.029 -11.901 1.00 63.34 H new ATOM 0 HD12 LEU A 480 -5.446 13.364 -12.346 1.00 63.34 H new ATOM 0 HD13 LEU A 480 -7.140 13.897 -12.463 1.00 63.34 H new ATOM 0 HD21 LEU A 480 -7.093 15.524 -9.892 1.00 5.15 H new ATOM 0 HD22 LEU A 480 -8.412 14.447 -10.410 1.00 5.15 H new ATOM 0 HD23 LEU A 480 -7.667 14.234 -8.808 1.00 5.15 H new ATOM 1358 N LYS A 481 -6.853 11.882 -6.728 1.00 43.02 N ATOM 1359 CA LYS A 481 -7.701 12.461 -5.664 1.00 74.50 C ATOM 1360 C LYS A 481 -7.112 13.830 -5.241 1.00 44.42 C ATOM 1361 O LYS A 481 -5.888 13.955 -5.126 1.00 10.52 O ATOM 1362 CB LYS A 481 -7.948 11.457 -4.444 1.00 43.33 C ATOM 1363 CG LYS A 481 -9.439 11.209 -4.056 1.00 60.43 C ATOM 1364 CD LYS A 481 -9.849 9.709 -4.144 1.00 52.40 C ATOM 1365 CE LYS A 481 -11.362 9.518 -4.276 1.00 53.00 C ATOM 1366 NZ LYS A 481 -11.706 8.140 -4.724 1.00 32.11 N ATOM 0 H LYS A 481 -5.881 11.693 -6.481 1.00 43.02 H new ATOM 0 HA LYS A 481 -8.702 12.631 -6.060 1.00 74.50 H new ATOM 0 HB2 LYS A 481 -7.493 10.498 -4.690 1.00 43.33 H new ATOM 0 HB3 LYS A 481 -7.425 11.843 -3.569 1.00 43.33 H new ATOM 0 HG2 LYS A 481 -9.609 11.568 -3.041 1.00 60.43 H new ATOM 0 HG3 LYS A 481 -10.082 11.795 -4.713 1.00 60.43 H new ATOM 0 HD2 LYS A 481 -9.353 9.250 -4.999 1.00 52.40 H new ATOM 0 HD3 LYS A 481 -9.497 9.187 -3.254 1.00 52.40 H new ATOM 0 HE2 LYS A 481 -11.839 9.719 -3.317 1.00 53.00 H new ATOM 0 HE3 LYS A 481 -11.760 10.242 -4.987 1.00 53.00 H new ATOM 0 HZ1 LYS A 481 -12.739 8.048 -4.802 1.00 32.11 H new ATOM 0 HZ2 LYS A 481 -11.271 7.958 -5.651 1.00 32.11 H new ATOM 0 HZ3 LYS A 481 -11.348 7.451 -4.032 1.00 32.11 H new ATOM 1380 N ARG A 482 -7.961 14.882 -5.079 1.00 64.12 N ATOM 1381 CA ARG A 482 -7.457 16.224 -4.768 1.00 1.33 C ATOM 1382 C ARG A 482 -7.404 16.516 -3.229 1.00 14.22 C ATOM 1383 O ARG A 482 -6.532 17.277 -2.799 1.00 15.24 O ATOM 1384 CB ARG A 482 -8.279 17.287 -5.606 1.00 33.14 C ATOM 1385 CG ARG A 482 -8.375 18.739 -5.058 1.00 44.45 C ATOM 1386 CD ARG A 482 -9.264 19.639 -5.951 1.00 13.10 C ATOM 1387 NE ARG A 482 -10.655 19.156 -6.016 1.00 55.14 N ATOM 1388 CZ ARG A 482 -11.609 19.682 -6.802 1.00 53.52 C ATOM 1389 NH1 ARG A 482 -11.346 20.721 -7.591 1.00 15.53 N ATOM 1390 NH2 ARG A 482 -12.841 19.179 -6.772 1.00 52.53 N ATOM 0 H ARG A 482 -8.976 14.817 -5.159 1.00 64.12 H new ATOM 0 HA ARG A 482 -6.413 16.296 -5.071 1.00 1.33 H new ATOM 0 HB2 ARG A 482 -7.841 17.336 -6.603 1.00 33.14 H new ATOM 0 HB3 ARG A 482 -9.294 16.907 -5.722 1.00 33.14 H new ATOM 0 HG2 ARG A 482 -8.781 18.719 -4.046 1.00 44.45 H new ATOM 0 HG3 ARG A 482 -7.375 19.168 -4.992 1.00 44.45 H new ATOM 0 HD2 ARG A 482 -9.252 20.658 -5.563 1.00 13.10 H new ATOM 0 HD3 ARG A 482 -8.846 19.676 -6.957 1.00 13.10 H new ATOM 0 HE ARG A 482 -10.911 18.367 -5.423 1.00 55.14 H new ATOM 0 HH11 ARG A 482 -10.411 21.128 -7.604 1.00 15.53 H new ATOM 0 HH12 ARG A 482 -12.080 21.111 -8.183 1.00 15.53 H new ATOM 0 HH21 ARG A 482 -13.058 18.397 -6.154 1.00 52.53 H new ATOM 0 HH22 ARG A 482 -13.568 19.575 -7.367 1.00 52.53 H new ATOM 1404 N SER A 483 -8.274 15.882 -2.389 1.00 23.23 N ATOM 1405 CA SER A 483 -8.250 16.140 -0.913 1.00 30.23 C ATOM 1406 C SER A 483 -9.011 15.010 -0.120 1.00 65.31 C ATOM 1407 O SER A 483 -9.888 14.375 -0.723 1.00 30.45 O ATOM 1408 CB SER A 483 -8.876 17.535 -0.606 1.00 34.45 C ATOM 1409 OG SER A 483 -10.124 17.691 -1.264 1.00 44.12 O ATOM 0 H SER A 483 -8.979 15.210 -2.693 1.00 23.23 H new ATOM 0 HA SER A 483 -7.211 16.134 -0.584 1.00 30.23 H new ATOM 0 HB2 SER A 483 -9.012 17.647 0.470 1.00 34.45 H new ATOM 0 HB3 SER A 483 -8.192 18.322 -0.925 1.00 34.45 H new ATOM 0 HG SER A 483 -10.497 18.573 -1.054 1.00 44.12 H new ATOM 1415 N LYS A 484 -8.695 14.747 1.218 1.00 32.41 N ATOM 1416 CA LYS A 484 -9.446 13.741 2.042 1.00 4.34 C ATOM 1417 C LYS A 484 -9.032 13.867 3.525 1.00 45.30 C ATOM 1418 O LYS A 484 -7.844 13.941 3.842 1.00 42.42 O ATOM 1419 CB LYS A 484 -9.217 12.260 1.538 1.00 63.04 C ATOM 1420 CG LYS A 484 -9.943 11.120 2.314 1.00 53.25 C ATOM 1421 CD LYS A 484 -9.484 9.720 1.862 1.00 11.24 C ATOM 1422 CE LYS A 484 -10.438 9.027 0.867 1.00 1.23 C ATOM 1423 NZ LYS A 484 -11.856 9.025 1.338 1.00 41.33 N ATOM 0 H LYS A 484 -7.941 15.215 1.721 1.00 32.41 H new ATOM 0 HA LYS A 484 -10.509 13.957 1.934 1.00 4.34 H new ATOM 0 HB2 LYS A 484 -9.526 12.207 0.494 1.00 63.04 H new ATOM 0 HB3 LYS A 484 -8.146 12.057 1.564 1.00 63.04 H new ATOM 0 HG2 LYS A 484 -9.756 11.234 3.382 1.00 53.25 H new ATOM 0 HG3 LYS A 484 -11.019 11.212 2.167 1.00 53.25 H new ATOM 0 HD2 LYS A 484 -8.499 9.804 1.403 1.00 11.24 H new ATOM 0 HD3 LYS A 484 -9.373 9.086 2.742 1.00 11.24 H new ATOM 0 HE2 LYS A 484 -10.380 9.531 -0.098 1.00 1.23 H new ATOM 0 HE3 LYS A 484 -10.110 8.000 0.710 1.00 1.23 H new ATOM 0 HZ1 LYS A 484 -12.357 8.211 0.928 1.00 41.33 H new ATOM 0 HZ2 LYS A 484 -11.877 8.958 2.376 1.00 41.33 H new ATOM 0 HZ3 LYS A 484 -12.322 9.905 1.039 1.00 41.33 H new ATOM 1437 N ASN A 485 -10.025 13.915 4.422 1.00 33.31 N ATOM 1438 CA ASN A 485 -9.785 14.051 5.865 1.00 24.41 C ATOM 1439 C ASN A 485 -10.580 12.976 6.661 1.00 74.43 C ATOM 1440 O ASN A 485 -11.778 13.120 6.901 1.00 41.41 O ATOM 1441 CB ASN A 485 -10.092 15.534 6.318 1.00 33.33 C ATOM 1442 CG ASN A 485 -11.434 16.085 5.827 1.00 62.34 C ATOM 1443 OD1 ASN A 485 -12.462 15.924 6.478 1.00 43.34 O ATOM 1444 ND2 ASN A 485 -11.427 16.773 4.691 1.00 14.01 N ATOM 0 H ASN A 485 -11.012 13.861 4.170 1.00 33.31 H new ATOM 0 HA ASN A 485 -8.735 13.864 6.088 1.00 24.41 H new ATOM 0 HB2 ASN A 485 -10.072 15.579 7.407 1.00 33.33 H new ATOM 0 HB3 ASN A 485 -9.294 16.183 5.957 1.00 33.33 H new ATOM 0 HD21 ASN A 485 -12.291 17.184 4.338 1.00 14.01 H new ATOM 0 HD22 ASN A 485 -10.557 16.890 4.171 1.00 14.01 H new ATOM 1451 N ASP A 486 -9.902 11.862 7.031 1.00 1.24 N ATOM 1452 CA ASP A 486 -10.563 10.744 7.769 1.00 2.11 C ATOM 1453 C ASP A 486 -9.547 10.086 8.721 1.00 61.04 C ATOM 1454 O ASP A 486 -8.463 9.680 8.291 1.00 53.40 O ATOM 1455 CB ASP A 486 -11.195 9.700 6.792 1.00 53.30 C ATOM 1456 CG ASP A 486 -12.277 8.854 7.450 1.00 34.44 C ATOM 1457 OD1 ASP A 486 -11.936 7.886 8.155 1.00 0.22 O ATOM 1458 OD2 ASP A 486 -13.476 9.154 7.237 1.00 2.15 O ATOM 0 H ASP A 486 -8.912 11.709 6.837 1.00 1.24 H new ATOM 0 HA ASP A 486 -11.384 11.152 8.358 1.00 2.11 H new ATOM 0 HB2 ASP A 486 -11.620 10.222 5.935 1.00 53.30 H new ATOM 0 HB3 ASP A 486 -10.411 9.046 6.410 1.00 53.30 H new ATOM 1463 N SER A 487 -9.904 10.019 10.021 1.00 34.11 N ATOM 1464 CA SER A 487 -8.976 9.602 11.090 1.00 34.00 C ATOM 1465 C SER A 487 -9.747 9.079 12.330 1.00 13.01 C ATOM 1466 O SER A 487 -10.495 9.825 12.969 1.00 34.42 O ATOM 1467 CB SER A 487 -8.061 10.803 11.456 1.00 42.53 C ATOM 1468 OG SER A 487 -7.145 10.483 12.497 1.00 0.33 O ATOM 0 H SER A 487 -10.839 10.251 10.356 1.00 34.11 H new ATOM 0 HA SER A 487 -8.359 8.777 10.733 1.00 34.00 H new ATOM 0 HB2 SER A 487 -7.508 11.119 10.572 1.00 42.53 H new ATOM 0 HB3 SER A 487 -8.678 11.647 11.764 1.00 42.53 H new ATOM 0 HG SER A 487 -6.588 11.265 12.695 1.00 0.33 H new ATOM 1474 N LYS A 488 -9.568 7.782 12.648 1.00 64.23 N ATOM 1475 CA LYS A 488 -10.192 7.149 13.821 1.00 41.00 C ATOM 1476 C LYS A 488 -9.145 6.298 14.594 1.00 12.43 C ATOM 1477 O LYS A 488 -8.097 5.984 14.015 1.00 61.42 O ATOM 1478 CB LYS A 488 -11.379 6.276 13.359 1.00 33.41 C ATOM 1479 CG LYS A 488 -12.742 6.819 13.772 1.00 43.44 C ATOM 1480 CD LYS A 488 -13.842 5.751 13.745 1.00 2.11 C ATOM 1481 CE LYS A 488 -13.864 4.873 15.010 1.00 12.11 C ATOM 1482 NZ LYS A 488 -12.764 3.861 15.061 1.00 53.23 N ATOM 0 H LYS A 488 -8.988 7.147 12.099 1.00 64.23 H new ATOM 0 HA LYS A 488 -10.563 7.919 14.497 1.00 41.00 H new ATOM 0 HB2 LYS A 488 -11.349 6.184 12.273 1.00 33.41 H new ATOM 0 HB3 LYS A 488 -11.260 5.272 13.767 1.00 33.41 H new ATOM 0 HG2 LYS A 488 -12.672 7.236 14.777 1.00 43.44 H new ATOM 0 HG3 LYS A 488 -13.019 7.636 13.106 1.00 43.44 H new ATOM 0 HD2 LYS A 488 -14.810 6.238 13.632 1.00 2.11 H new ATOM 0 HD3 LYS A 488 -13.701 5.115 12.871 1.00 2.11 H new ATOM 0 HE2 LYS A 488 -13.795 5.515 15.888 1.00 12.11 H new ATOM 0 HE3 LYS A 488 -14.823 4.357 15.066 1.00 12.11 H new ATOM 0 HZ1 LYS A 488 -13.066 3.048 15.635 1.00 53.23 H new ATOM 0 HZ2 LYS A 488 -12.542 3.540 14.097 1.00 53.23 H new ATOM 0 HZ3 LYS A 488 -11.917 4.290 15.487 1.00 53.23 H new ATOM 1496 N PRO A 489 -9.380 5.941 15.920 1.00 55.24 N ATOM 1497 CA PRO A 489 -8.522 4.977 16.701 1.00 65.40 C ATOM 1498 C PRO A 489 -8.461 3.533 16.113 1.00 3.34 C ATOM 1499 O PRO A 489 -8.830 3.312 14.954 1.00 51.53 O ATOM 1500 CB PRO A 489 -9.207 4.921 18.085 1.00 11.21 C ATOM 1501 CG PRO A 489 -10.553 5.543 17.925 1.00 20.30 C ATOM 1502 CD PRO A 489 -10.435 6.518 16.788 1.00 63.35 C ATOM 0 HA PRO A 489 -7.487 5.320 16.700 1.00 65.40 H new ATOM 0 HB2 PRO A 489 -9.296 3.891 18.431 1.00 11.21 H new ATOM 0 HB3 PRO A 489 -8.619 5.458 18.829 1.00 11.21 H new ATOM 0 HG2 PRO A 489 -11.308 4.786 17.711 1.00 20.30 H new ATOM 0 HG3 PRO A 489 -10.859 6.049 18.841 1.00 20.30 H new ATOM 0 HD2 PRO A 489 -11.379 6.621 16.252 1.00 63.35 H new ATOM 0 HD3 PRO A 489 -10.160 7.511 17.142 1.00 63.35 H new ATOM 1510 N TYR A 490 -7.956 2.569 16.936 1.00 65.52 N ATOM 1511 CA TYR A 490 -7.914 1.118 16.594 1.00 24.14 C ATOM 1512 C TYR A 490 -9.271 0.608 16.075 1.00 53.11 C ATOM 1513 O TYR A 490 -10.241 0.579 16.861 1.00 52.05 O ATOM 1514 CB TYR A 490 -7.496 0.260 17.818 1.00 40.10 C ATOM 1515 CG TYR A 490 -6.392 -0.752 17.538 1.00 42.44 C ATOM 1516 CD1 TYR A 490 -6.593 -1.821 16.669 1.00 63.43 C ATOM 1517 CD2 TYR A 490 -5.153 -0.639 18.161 1.00 20.13 C ATOM 1518 CE1 TYR A 490 -5.590 -2.744 16.429 1.00 51.14 C ATOM 1519 CE2 TYR A 490 -4.147 -1.558 17.923 1.00 73.14 C ATOM 1520 CZ TYR A 490 -4.371 -2.607 17.057 1.00 63.42 C ATOM 1521 OH TYR A 490 -3.371 -3.523 16.822 1.00 35.25 O ATOM 1522 OXT TYR A 490 -9.338 0.239 14.882 1.00 37.22 O ATOM 0 H TYR A 490 -7.567 2.778 17.855 1.00 65.52 H new ATOM 0 HA TYR A 490 -7.171 1.015 15.803 1.00 24.14 H new ATOM 0 HB2 TYR A 490 -7.166 0.926 18.616 1.00 40.10 H new ATOM 0 HB3 TYR A 490 -8.372 -0.272 18.188 1.00 40.10 H new ATOM 0 HD1 TYR A 490 -7.547 -1.932 16.174 1.00 63.43 H new ATOM 0 HD2 TYR A 490 -4.974 0.180 18.842 1.00 20.13 H new ATOM 0 HE1 TYR A 490 -5.762 -3.568 15.752 1.00 51.14 H new ATOM 0 HE2 TYR A 490 -3.190 -1.454 18.413 1.00 73.14 H new ATOM 0 HH TYR A 490 -2.576 -3.280 17.342 1.00 35.25 H new TER 1532 TYR A 490