USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 825 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 514 ASN : amide:sc= 1.02 K(o=1,f=-6.8!) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 490 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 497 LYS NZ :NH3+ -123:sc= 0.776 (180deg=-0.24) USER MOD Set 3.1: A 484 TYR OH : rot 31:sc= 0.869 USER MOD Set 3.2: A 485 LYS NZ :NH3+ 146:sc= 0.807 (180deg=0) USER MOD Set 4.1: A 474 LYS NZ :NH3+ 178:sc= 0.729 (180deg=-0.274) USER MOD Set 4.2: A 488 THR OG1 : rot 130:sc= 0.257 USER MOD Set 5.1: A 472 SER OG : rot 133:sc= 0.038 USER MOD Set 5.2: A 522 THR OG1 : rot -72:sc= -0.0363 USER MOD Set 6.1: A 441 THR OG1 : rot 118:sc= 0.742 USER MOD Set 6.2: A 530 ASN : amide:sc= -2.38! K(o=-1.6!,f=-2.7) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -2.36! K(o=-2.4!,f=-1.7) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -146:sc= 0.58 USER MOD Single : A 461 HIS : no HD1:sc= -0.402 X(o=-0.4,f=-0.028) USER MOD Single : A 463 LYS NZ :NH3+ 148:sc= 2.07 (180deg=-0.653) USER MOD Single : A 464 ASN : amide:sc= -0.148 K(o=-0.15,f=-8.4!) USER MOD Single : A 473 THR OG1 : rot 100:sc= 0.269 USER MOD Single : A 478 TYR OH : rot 43:sc= 0.211 USER MOD Single : A 480 ASN : amide:sc= -0.985 K(o=-0.99,f=-13!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 494 LYS NZ :NH3+ 166:sc= -0.0562 (180deg=-0.234) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 21:sc= 0.405 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= -0.032 X(o=-0.032,f=-0.45) USER MOD Single : A 510 MET CE :methyl -163:sc= -0.102 (180deg=-0.494) USER MOD Single : A 511 TYR OH : rot 180:sc= 0 USER MOD Single : A 516 THR OG1 : rot 70:sc= -0.422 USER MOD Single : A 521 ASN : amide:sc= 0 X(o=0,f=0.03) USER MOD Single : A 527 ASN : amide:sc= -0.876 K(o=-0.88,f=-9.7!) USER MOD Single : A 529 ASN : amide:sc= -0.683 K(o=-0.68,f=0) USER MOD Single : A 531 ASN : amide:sc= -1.71 K(o=-1.7,f=0) USER MOD Single : A 538 SER OG : rot 80:sc= 0.747 USER MOD ----------------------------------------------------------------- ATOM 35 N PHE A 437 -7.211 13.271 16.221 1.00 75.21 N ATOM 36 CA PHE A 437 -6.810 13.204 14.810 1.00 43.11 C ATOM 37 C PHE A 437 -6.320 11.791 14.457 1.00 24.32 C ATOM 38 O PHE A 437 -5.742 11.097 15.297 1.00 22.51 O ATOM 39 CB PHE A 437 -5.715 14.239 14.506 1.00 51.05 C ATOM 40 CG PHE A 437 -6.170 15.665 14.685 1.00 75.13 C ATOM 41 CD1 PHE A 437 -6.920 16.296 13.702 1.00 31.31 C ATOM 42 CD2 PHE A 437 -5.853 16.370 15.837 1.00 75.34 C ATOM 43 CE1 PHE A 437 -7.343 17.601 13.865 1.00 65.22 C ATOM 44 CE2 PHE A 437 -6.274 17.675 16.004 1.00 35.01 C ATOM 45 CZ PHE A 437 -7.021 18.291 15.017 1.00 74.13 C ATOM 0 HA PHE A 437 -7.681 13.434 14.197 1.00 43.11 H new ATOM 0 HB2 PHE A 437 -4.860 14.054 15.157 1.00 51.05 H new ATOM 0 HB3 PHE A 437 -5.371 14.102 13.481 1.00 51.05 H new ATOM 0 HD1 PHE A 437 -7.176 15.761 12.800 1.00 31.31 H new ATOM 0 HD2 PHE A 437 -5.271 15.893 16.612 1.00 75.34 H new ATOM 0 HE1 PHE A 437 -7.925 18.081 13.092 1.00 65.22 H new ATOM 0 HE2 PHE A 437 -6.020 18.214 16.905 1.00 35.01 H new ATOM 0 HZ PHE A 437 -7.352 19.311 15.147 1.00 74.13 H new ATOM 55 N PRO A 438 -6.568 11.332 13.217 1.00 34.34 N ATOM 56 CA PRO A 438 -6.208 9.978 12.781 1.00 60.44 C ATOM 57 C PRO A 438 -4.707 9.780 12.512 1.00 71.33 C ATOM 58 O PRO A 438 -3.906 10.716 12.565 1.00 61.42 O ATOM 59 CB PRO A 438 -7.015 9.779 11.483 1.00 61.13 C ATOM 60 CG PRO A 438 -7.884 10.988 11.346 1.00 15.32 C ATOM 61 CD PRO A 438 -7.224 12.080 12.138 1.00 62.33 C ATOM 0 HA PRO A 438 -6.433 9.254 13.564 1.00 60.44 H new ATOM 0 HB2 PRO A 438 -6.352 9.676 10.624 1.00 61.13 H new ATOM 0 HB3 PRO A 438 -7.616 8.871 11.533 1.00 61.13 H new ATOM 0 HG2 PRO A 438 -7.986 11.275 10.300 1.00 15.32 H new ATOM 0 HG3 PRO A 438 -8.888 10.789 11.722 1.00 15.32 H new ATOM 0 HD2 PRO A 438 -6.507 12.641 11.538 1.00 62.33 H new ATOM 0 HD3 PRO A 438 -7.948 12.798 12.523 1.00 62.33 H new ATOM 69 N ASP A 439 -4.350 8.529 12.240 1.00 70.44 N ATOM 70 CA ASP A 439 -2.980 8.149 11.901 1.00 72.43 C ATOM 71 C ASP A 439 -3.014 6.888 11.022 1.00 30.05 C ATOM 72 O ASP A 439 -2.834 5.767 11.502 1.00 2.30 O ATOM 73 CB ASP A 439 -2.165 7.922 13.184 1.00 72.33 C ATOM 74 CG ASP A 439 -0.702 7.609 12.917 1.00 73.41 C ATOM 75 OD1 ASP A 439 0.003 8.469 12.356 1.00 22.22 O ATOM 76 OD2 ASP A 439 -0.248 6.503 13.271 1.00 45.24 O ATOM 0 H ASP A 439 -5.004 7.746 12.248 1.00 70.44 H new ATOM 0 HA ASP A 439 -2.495 8.949 11.342 1.00 72.43 H new ATOM 0 HB2 ASP A 439 -2.231 8.811 13.811 1.00 72.33 H new ATOM 0 HB3 ASP A 439 -2.608 7.101 13.748 1.00 72.33 H new ATOM 81 N LEU A 440 -3.323 7.085 9.744 1.00 53.30 N ATOM 82 CA LEU A 440 -3.493 5.986 8.790 1.00 42.30 C ATOM 83 C LEU A 440 -2.148 5.537 8.208 1.00 73.13 C ATOM 84 O LEU A 440 -1.527 6.255 7.425 1.00 21.24 O ATOM 85 CB LEU A 440 -4.433 6.418 7.652 1.00 21.03 C ATOM 86 CG LEU A 440 -5.838 6.875 8.091 1.00 52.35 C ATOM 87 CD1 LEU A 440 -6.613 7.460 6.912 1.00 35.01 C ATOM 88 CD2 LEU A 440 -6.615 5.717 8.718 1.00 50.13 C ATOM 0 H LEU A 440 -3.463 8.010 9.337 1.00 53.30 H new ATOM 0 HA LEU A 440 -3.930 5.143 9.325 1.00 42.30 H new ATOM 0 HB2 LEU A 440 -3.960 7.232 7.103 1.00 21.03 H new ATOM 0 HB3 LEU A 440 -4.541 5.585 6.957 1.00 21.03 H new ATOM 0 HG LEU A 440 -5.717 7.655 8.843 1.00 52.35 H new ATOM 0 HD11 LEU A 440 -7.601 7.775 7.247 1.00 35.01 H new ATOM 0 HD12 LEU A 440 -6.074 8.319 6.513 1.00 35.01 H new ATOM 0 HD13 LEU A 440 -6.718 6.704 6.134 1.00 35.01 H new ATOM 0 HD21 LEU A 440 -7.603 6.063 9.020 1.00 50.13 H new ATOM 0 HD22 LEU A 440 -6.719 4.912 7.990 1.00 50.13 H new ATOM 0 HD23 LEU A 440 -6.077 5.349 9.591 1.00 50.13 H new ATOM 100 N THR A 441 -1.708 4.341 8.580 1.00 24.13 N ATOM 101 CA THR A 441 -0.441 3.804 8.075 1.00 50.42 C ATOM 102 C THR A 441 -0.663 2.553 7.225 1.00 30.35 C ATOM 103 O THR A 441 -1.609 1.790 7.446 1.00 11.21 O ATOM 104 CB THR A 441 0.546 3.475 9.218 1.00 64.34 C ATOM 105 OG1 THR A 441 1.820 3.099 8.675 1.00 33.15 O ATOM 106 CG2 THR A 441 0.023 2.359 10.112 1.00 70.31 C ATOM 0 H THR A 441 -2.203 3.725 9.225 1.00 24.13 H new ATOM 0 HA THR A 441 -0.005 4.586 7.454 1.00 50.42 H new ATOM 0 HB THR A 441 0.654 4.372 9.827 1.00 64.34 H new ATOM 0 HG1 THR A 441 2.502 3.741 8.965 1.00 33.15 H new ATOM 0 HG21 THR A 441 0.746 2.158 10.903 1.00 70.31 H new ATOM 0 HG22 THR A 441 -0.925 2.662 10.556 1.00 70.31 H new ATOM 0 HG23 THR A 441 -0.126 1.457 9.518 1.00 70.31 H new ATOM 114 N VAL A 442 0.212 2.351 6.250 1.00 40.51 N ATOM 115 CA VAL A 442 0.119 1.209 5.341 1.00 25.04 C ATOM 116 C VAL A 442 1.389 0.342 5.407 1.00 51.14 C ATOM 117 O VAL A 442 2.486 0.845 5.662 1.00 60.13 O ATOM 118 CB VAL A 442 -0.126 1.677 3.881 1.00 22.44 C ATOM 119 CG1 VAL A 442 -1.472 2.389 3.755 1.00 55.13 C ATOM 120 CG2 VAL A 442 0.998 2.590 3.403 1.00 73.13 C ATOM 0 H VAL A 442 1.003 2.968 6.064 1.00 40.51 H new ATOM 0 HA VAL A 442 -0.730 0.606 5.662 1.00 25.04 H new ATOM 0 HB VAL A 442 -0.142 0.790 3.248 1.00 22.44 H new ATOM 0 HG11 VAL A 442 -1.620 2.707 2.723 1.00 55.13 H new ATOM 0 HG12 VAL A 442 -2.272 1.708 4.043 1.00 55.13 H new ATOM 0 HG13 VAL A 442 -1.485 3.261 4.409 1.00 55.13 H new ATOM 0 HG21 VAL A 442 0.801 2.903 2.378 1.00 73.13 H new ATOM 0 HG22 VAL A 442 1.052 3.468 4.047 1.00 73.13 H new ATOM 0 HG23 VAL A 442 1.945 2.052 3.443 1.00 73.13 H new ATOM 130 N GLU A 443 1.229 -0.965 5.194 1.00 1.44 N ATOM 131 CA GLU A 443 2.348 -1.920 5.268 1.00 63.45 C ATOM 132 C GLU A 443 2.248 -2.969 4.148 1.00 42.14 C ATOM 133 O GLU A 443 1.189 -3.555 3.932 1.00 73.21 O ATOM 134 CB GLU A 443 2.344 -2.620 6.641 1.00 4.13 C ATOM 135 CG GLU A 443 2.404 -1.655 7.825 1.00 42.43 C ATOM 136 CD GLU A 443 2.230 -2.342 9.173 1.00 22.14 C ATOM 137 OE1 GLU A 443 1.163 -2.953 9.404 1.00 4.23 O ATOM 138 OE2 GLU A 443 3.147 -2.260 10.019 1.00 13.31 O ATOM 0 H GLU A 443 0.332 -1.393 4.967 1.00 1.44 H new ATOM 0 HA GLU A 443 3.280 -1.370 5.141 1.00 63.45 H new ATOM 0 HB2 GLU A 443 1.444 -3.229 6.726 1.00 4.13 H new ATOM 0 HB3 GLU A 443 3.195 -3.300 6.695 1.00 4.13 H new ATOM 0 HG2 GLU A 443 3.361 -1.134 7.812 1.00 42.43 H new ATOM 0 HG3 GLU A 443 1.628 -0.899 7.708 1.00 42.43 H new ATOM 145 N ILE A 444 3.348 -3.205 3.432 1.00 20.33 N ATOM 146 CA ILE A 444 3.358 -4.178 2.324 1.00 41.44 C ATOM 147 C ILE A 444 4.092 -5.473 2.718 1.00 44.21 C ATOM 148 O ILE A 444 5.136 -5.432 3.371 1.00 4.44 O ATOM 149 CB ILE A 444 4.024 -3.584 1.054 1.00 72.12 C ATOM 150 CG1 ILE A 444 3.370 -2.243 0.678 1.00 51.22 C ATOM 151 CG2 ILE A 444 3.931 -4.572 -0.113 1.00 10.04 C ATOM 152 CD1 ILE A 444 4.009 -1.560 -0.514 1.00 62.14 C ATOM 0 H ILE A 444 4.242 -2.742 3.593 1.00 20.33 H new ATOM 0 HA ILE A 444 2.316 -4.412 2.105 1.00 41.44 H new ATOM 0 HB ILE A 444 5.077 -3.404 1.270 1.00 72.12 H new ATOM 0 HG12 ILE A 444 2.315 -2.412 0.464 1.00 51.22 H new ATOM 0 HG13 ILE A 444 3.418 -1.573 1.537 1.00 51.22 H new ATOM 0 HG21 ILE A 444 4.403 -4.139 -0.995 1.00 10.04 H new ATOM 0 HG22 ILE A 444 4.440 -5.498 0.153 1.00 10.04 H new ATOM 0 HG23 ILE A 444 2.884 -4.783 -0.329 1.00 10.04 H new ATOM 0 HD11 ILE A 444 3.492 -0.622 -0.716 1.00 62.14 H new ATOM 0 HD12 ILE A 444 5.058 -1.357 -0.298 1.00 62.14 H new ATOM 0 HD13 ILE A 444 3.937 -2.209 -1.387 1.00 62.14 H new ATOM 164 N LYS A 445 3.542 -6.621 2.321 1.00 3.25 N ATOM 165 CA LYS A 445 4.144 -7.924 2.641 1.00 4.45 C ATOM 166 C LYS A 445 4.013 -8.907 1.459 1.00 3.54 C ATOM 167 O LYS A 445 2.947 -9.019 0.853 1.00 61.34 O ATOM 168 CB LYS A 445 3.459 -8.510 3.885 1.00 62.21 C ATOM 169 CG LYS A 445 4.170 -9.720 4.492 1.00 43.14 C ATOM 170 CD LYS A 445 5.500 -9.332 5.137 1.00 51.31 C ATOM 171 CE LYS A 445 6.182 -10.526 5.795 1.00 65.02 C ATOM 172 NZ LYS A 445 7.446 -10.141 6.477 1.00 50.22 N ATOM 0 H LYS A 445 2.681 -6.679 1.777 1.00 3.25 H new ATOM 0 HA LYS A 445 5.206 -7.774 2.837 1.00 4.45 H new ATOM 0 HB2 LYS A 445 3.384 -7.731 4.643 1.00 62.21 H new ATOM 0 HB3 LYS A 445 2.441 -8.797 3.622 1.00 62.21 H new ATOM 0 HG2 LYS A 445 3.525 -10.183 5.239 1.00 43.14 H new ATOM 0 HG3 LYS A 445 4.346 -10.465 3.716 1.00 43.14 H new ATOM 0 HD2 LYS A 445 6.160 -8.908 4.381 1.00 51.31 H new ATOM 0 HD3 LYS A 445 5.329 -8.555 5.882 1.00 51.31 H new ATOM 0 HE2 LYS A 445 5.503 -10.978 6.518 1.00 65.02 H new ATOM 0 HE3 LYS A 445 6.394 -11.283 5.040 1.00 65.02 H new ATOM 0 HZ1 LYS A 445 7.877 -10.982 6.911 1.00 50.22 H new ATOM 0 HZ2 LYS A 445 8.105 -9.734 5.783 1.00 50.22 H new ATOM 0 HZ3 LYS A 445 7.242 -9.437 7.215 1.00 50.22 H new ATOM 186 N GLY A 446 5.098 -9.618 1.138 1.00 13.03 N ATOM 187 CA GLY A 446 5.064 -10.593 0.043 1.00 63.31 C ATOM 188 C GLY A 446 6.452 -11.056 -0.412 1.00 2.31 C ATOM 189 O GLY A 446 7.439 -10.848 0.294 1.00 2.45 O ATOM 0 H GLY A 446 5.998 -9.540 1.612 1.00 13.03 H new ATOM 0 HA2 GLY A 446 4.486 -11.462 0.359 1.00 63.31 H new ATOM 0 HA3 GLY A 446 4.540 -10.154 -0.806 1.00 63.31 H new ATOM 193 N PRO A 447 6.558 -11.700 -1.596 1.00 24.44 N ATOM 194 CA PRO A 447 7.850 -12.184 -2.131 1.00 50.43 C ATOM 195 C PRO A 447 8.793 -11.046 -2.584 1.00 53.04 C ATOM 196 O PRO A 447 8.369 -10.095 -3.245 1.00 65.03 O ATOM 197 CB PRO A 447 7.431 -13.050 -3.329 1.00 63.44 C ATOM 198 CG PRO A 447 6.120 -12.486 -3.762 1.00 62.31 C ATOM 199 CD PRO A 447 5.433 -12.019 -2.501 1.00 21.05 C ATOM 0 HA PRO A 447 8.422 -12.717 -1.372 1.00 50.43 H new ATOM 0 HB2 PRO A 447 8.168 -13.000 -4.131 1.00 63.44 H new ATOM 0 HB3 PRO A 447 7.337 -14.099 -3.046 1.00 63.44 H new ATOM 0 HG2 PRO A 447 6.261 -11.660 -4.459 1.00 62.31 H new ATOM 0 HG3 PRO A 447 5.522 -13.238 -4.277 1.00 62.31 H new ATOM 0 HD2 PRO A 447 4.805 -11.147 -2.685 1.00 21.05 H new ATOM 0 HD3 PRO A 447 4.789 -12.793 -2.084 1.00 21.05 H new ATOM 207 N ASP A 448 10.077 -11.167 -2.240 1.00 31.03 N ATOM 208 CA ASP A 448 11.082 -10.147 -2.572 1.00 70.44 C ATOM 209 C ASP A 448 11.616 -10.317 -4.010 1.00 2.10 C ATOM 210 O ASP A 448 11.749 -9.344 -4.755 1.00 13.43 O ATOM 211 CB ASP A 448 12.237 -10.226 -1.564 1.00 14.34 C ATOM 212 CG ASP A 448 13.257 -9.116 -1.745 1.00 51.11 C ATOM 213 OD1 ASP A 448 13.089 -8.043 -1.133 1.00 45.14 O ATOM 214 OD2 ASP A 448 14.242 -9.310 -2.491 1.00 42.12 O ATOM 0 H ASP A 448 10.450 -11.966 -1.728 1.00 31.03 H new ATOM 0 HA ASP A 448 10.607 -9.167 -2.516 1.00 70.44 H new ATOM 0 HB2 ASP A 448 11.833 -10.180 -0.553 1.00 14.34 H new ATOM 0 HB3 ASP A 448 12.735 -11.190 -1.665 1.00 14.34 H new ATOM 219 N VAL A 449 11.928 -11.556 -4.393 1.00 71.25 N ATOM 220 CA VAL A 449 12.459 -11.846 -5.734 1.00 71.40 C ATOM 221 C VAL A 449 11.484 -12.715 -6.544 1.00 33.05 C ATOM 222 O VAL A 449 10.952 -13.707 -6.043 1.00 43.12 O ATOM 223 CB VAL A 449 13.838 -12.553 -5.658 1.00 71.21 C ATOM 224 CG1 VAL A 449 14.381 -12.847 -7.057 1.00 1.11 C ATOM 225 CG2 VAL A 449 14.834 -11.714 -4.855 1.00 35.13 C ATOM 0 H VAL A 449 11.824 -12.377 -3.797 1.00 71.25 H new ATOM 0 HA VAL A 449 12.583 -10.888 -6.238 1.00 71.40 H new ATOM 0 HB VAL A 449 13.701 -13.504 -5.144 1.00 71.21 H new ATOM 0 HG11 VAL A 449 15.348 -13.343 -6.975 1.00 1.11 H new ATOM 0 HG12 VAL A 449 13.685 -13.496 -7.589 1.00 1.11 H new ATOM 0 HG13 VAL A 449 14.497 -11.913 -7.606 1.00 1.11 H new ATOM 0 HG21 VAL A 449 15.794 -12.229 -4.815 1.00 35.13 H new ATOM 0 HG22 VAL A 449 14.962 -10.744 -5.335 1.00 35.13 H new ATOM 0 HG23 VAL A 449 14.456 -11.571 -3.843 1.00 35.13 H new ATOM 235 N VAL A 450 11.250 -12.333 -7.797 1.00 53.44 N ATOM 236 CA VAL A 450 10.337 -13.069 -8.681 1.00 60.02 C ATOM 237 C VAL A 450 10.934 -13.248 -10.086 1.00 63.12 C ATOM 238 O VAL A 450 11.883 -12.562 -10.465 1.00 73.34 O ATOM 239 CB VAL A 450 8.963 -12.356 -8.792 1.00 75.10 C ATOM 240 CG1 VAL A 450 8.272 -12.287 -7.430 1.00 33.13 C ATOM 241 CG2 VAL A 450 9.123 -10.960 -9.395 1.00 13.44 C ATOM 0 H VAL A 450 11.680 -11.515 -8.229 1.00 53.44 H new ATOM 0 HA VAL A 450 10.192 -14.052 -8.234 1.00 60.02 H new ATOM 0 HB VAL A 450 8.331 -12.942 -9.459 1.00 75.10 H new ATOM 0 HG11 VAL A 450 7.311 -11.783 -7.535 1.00 33.13 H new ATOM 0 HG12 VAL A 450 8.113 -13.297 -7.051 1.00 33.13 H new ATOM 0 HG13 VAL A 450 8.899 -11.732 -6.732 1.00 33.13 H new ATOM 0 HG21 VAL A 450 8.147 -10.479 -9.463 1.00 13.44 H new ATOM 0 HG22 VAL A 450 9.778 -10.363 -8.761 1.00 13.44 H new ATOM 0 HG23 VAL A 450 9.558 -11.042 -10.391 1.00 13.44 H new ATOM 251 N GLY A 451 10.373 -14.179 -10.853 1.00 63.45 N ATOM 252 CA GLY A 451 10.844 -14.422 -12.214 1.00 62.35 C ATOM 253 C GLY A 451 9.994 -13.728 -13.273 1.00 63.30 C ATOM 254 O GLY A 451 8.882 -13.272 -12.995 1.00 71.44 O ATOM 0 H GLY A 451 9.598 -14.773 -10.559 1.00 63.45 H new ATOM 0 HA2 GLY A 451 11.875 -14.079 -12.302 1.00 62.35 H new ATOM 0 HA3 GLY A 451 10.847 -15.495 -12.405 1.00 62.35 H new ATOM 258 N VAL A 452 10.515 -13.652 -14.495 1.00 15.23 N ATOM 259 CA VAL A 452 9.806 -13.009 -15.603 1.00 4.24 C ATOM 260 C VAL A 452 8.574 -13.830 -16.042 1.00 63.13 C ATOM 261 O VAL A 452 8.635 -15.057 -16.142 1.00 30.52 O ATOM 262 CB VAL A 452 10.752 -12.778 -16.810 1.00 23.24 C ATOM 263 CG1 VAL A 452 11.206 -14.100 -17.426 1.00 25.21 C ATOM 264 CG2 VAL A 452 10.097 -11.877 -17.854 1.00 14.41 C ATOM 0 H VAL A 452 11.429 -14.029 -14.746 1.00 15.23 H new ATOM 0 HA VAL A 452 9.457 -12.041 -15.243 1.00 4.24 H new ATOM 0 HB VAL A 452 11.642 -12.269 -16.440 1.00 23.24 H new ATOM 0 HG11 VAL A 452 11.867 -13.900 -18.269 1.00 25.21 H new ATOM 0 HG12 VAL A 452 11.739 -14.686 -16.677 1.00 25.21 H new ATOM 0 HG13 VAL A 452 10.336 -14.658 -17.772 1.00 25.21 H new ATOM 0 HG21 VAL A 452 10.782 -11.731 -18.690 1.00 14.41 H new ATOM 0 HG22 VAL A 452 9.180 -12.344 -18.213 1.00 14.41 H new ATOM 0 HG23 VAL A 452 9.861 -10.912 -17.405 1.00 14.41 H new ATOM 274 N ASN A 453 7.458 -13.139 -16.286 1.00 71.32 N ATOM 275 CA ASN A 453 6.178 -13.776 -16.650 1.00 41.25 C ATOM 276 C ASN A 453 5.611 -14.652 -15.517 1.00 21.44 C ATOM 277 O ASN A 453 4.704 -15.457 -15.738 1.00 31.33 O ATOM 278 CB ASN A 453 6.312 -14.602 -17.937 1.00 14.41 C ATOM 279 CG ASN A 453 6.652 -13.744 -19.139 1.00 43.11 C ATOM 280 OD1 ASN A 453 5.771 -13.186 -19.783 1.00 52.15 O ATOM 281 ND2 ASN A 453 7.924 -13.642 -19.463 1.00 4.32 N ATOM 0 H ASN A 453 7.410 -12.121 -16.238 1.00 71.32 H new ATOM 0 HA ASN A 453 5.472 -12.964 -16.823 1.00 41.25 H new ATOM 0 HB2 ASN A 453 7.086 -15.357 -17.802 1.00 14.41 H new ATOM 0 HB3 ASN A 453 5.378 -15.132 -18.124 1.00 14.41 H new ATOM 0 HD21 ASN A 453 8.201 -13.086 -20.272 1.00 4.32 H new ATOM 0 HD22 ASN A 453 8.632 -14.119 -18.905 1.00 4.32 H new ATOM 288 N LYS A 454 6.129 -14.478 -14.303 1.00 43.13 N ATOM 289 CA LYS A 454 5.633 -15.220 -13.137 1.00 24.32 C ATOM 290 C LYS A 454 4.596 -14.409 -12.349 1.00 70.44 C ATOM 291 O LYS A 454 4.699 -13.187 -12.231 1.00 12.52 O ATOM 292 CB LYS A 454 6.796 -15.616 -12.215 1.00 21.32 C ATOM 293 CG LYS A 454 7.697 -16.707 -12.790 1.00 13.41 C ATOM 294 CD LYS A 454 6.936 -18.013 -13.018 1.00 63.41 C ATOM 295 CE LYS A 454 6.326 -18.550 -11.726 1.00 30.43 C ATOM 296 NZ LYS A 454 5.582 -19.818 -11.944 1.00 3.24 N ATOM 0 H LYS A 454 6.891 -13.832 -14.097 1.00 43.13 H new ATOM 0 HA LYS A 454 5.146 -16.122 -13.509 1.00 24.32 H new ATOM 0 HB2 LYS A 454 7.399 -14.732 -12.007 1.00 21.32 H new ATOM 0 HB3 LYS A 454 6.392 -15.957 -11.262 1.00 21.32 H new ATOM 0 HG2 LYS A 454 8.123 -16.366 -13.733 1.00 13.41 H new ATOM 0 HG3 LYS A 454 8.530 -16.886 -12.110 1.00 13.41 H new ATOM 0 HD2 LYS A 454 6.147 -17.850 -13.752 1.00 63.41 H new ATOM 0 HD3 LYS A 454 7.612 -18.758 -13.438 1.00 63.41 H new ATOM 0 HE2 LYS A 454 7.116 -18.715 -10.994 1.00 30.43 H new ATOM 0 HE3 LYS A 454 5.653 -17.803 -11.305 1.00 30.43 H new ATOM 0 HZ1 LYS A 454 5.185 -20.147 -11.041 1.00 3.24 H new ATOM 0 HZ2 LYS A 454 4.811 -19.656 -12.623 1.00 3.24 H new ATOM 0 HZ3 LYS A 454 6.229 -20.540 -12.321 1.00 3.24 H new ATOM 310 N LEU A 455 3.594 -15.098 -11.813 1.00 55.12 N ATOM 311 CA LEU A 455 2.546 -14.454 -11.021 1.00 63.43 C ATOM 312 C LEU A 455 3.006 -14.227 -9.572 1.00 51.34 C ATOM 313 O LEU A 455 3.403 -15.169 -8.880 1.00 13.22 O ATOM 314 CB LEU A 455 1.273 -15.312 -11.043 1.00 71.31 C ATOM 315 CG LEU A 455 0.048 -14.688 -10.355 1.00 34.25 C ATOM 316 CD1 LEU A 455 -0.328 -13.369 -11.024 1.00 42.54 C ATOM 317 CD2 LEU A 455 -1.132 -15.660 -10.369 1.00 52.24 C ATOM 0 H LEU A 455 3.483 -16.107 -11.912 1.00 55.12 H new ATOM 0 HA LEU A 455 2.333 -13.481 -11.463 1.00 63.43 H new ATOM 0 HB2 LEU A 455 1.017 -15.526 -12.081 1.00 71.31 H new ATOM 0 HB3 LEU A 455 1.490 -16.267 -10.565 1.00 71.31 H new ATOM 0 HG LEU A 455 0.305 -14.482 -9.316 1.00 34.25 H new ATOM 0 HD11 LEU A 455 -1.197 -12.942 -10.524 1.00 42.54 H new ATOM 0 HD12 LEU A 455 0.509 -12.674 -10.954 1.00 42.54 H new ATOM 0 HD13 LEU A 455 -0.565 -13.548 -12.073 1.00 42.54 H new ATOM 0 HD21 LEU A 455 -1.989 -15.199 -9.877 1.00 52.24 H new ATOM 0 HD22 LEU A 455 -1.392 -15.902 -11.400 1.00 52.24 H new ATOM 0 HD23 LEU A 455 -0.858 -16.573 -9.840 1.00 52.24 H new ATOM 329 N ALA A 456 2.968 -12.976 -9.122 1.00 24.42 N ATOM 330 CA ALA A 456 3.331 -12.633 -7.743 1.00 3.42 C ATOM 331 C ALA A 456 2.144 -12.012 -6.992 1.00 54.53 C ATOM 332 O ALA A 456 1.478 -11.111 -7.500 1.00 22.12 O ATOM 333 CB ALA A 456 4.522 -11.682 -7.736 1.00 75.12 C ATOM 0 H ALA A 456 2.689 -12.177 -9.692 1.00 24.42 H new ATOM 0 HA ALA A 456 3.607 -13.552 -7.226 1.00 3.42 H new ATOM 0 HB1 ALA A 456 4.783 -11.434 -6.707 1.00 75.12 H new ATOM 0 HB2 ALA A 456 5.373 -12.161 -8.221 1.00 75.12 H new ATOM 0 HB3 ALA A 456 4.263 -10.770 -8.275 1.00 75.12 H new ATOM 339 N GLU A 457 1.887 -12.496 -5.782 1.00 4.32 N ATOM 340 CA GLU A 457 0.781 -11.994 -4.955 1.00 23.44 C ATOM 341 C GLU A 457 1.280 -11.435 -3.618 1.00 50.25 C ATOM 342 O GLU A 457 2.079 -12.066 -2.919 1.00 22.42 O ATOM 343 CB GLU A 457 -0.249 -13.110 -4.719 1.00 0.45 C ATOM 344 CG GLU A 457 -1.243 -13.271 -5.865 1.00 50.42 C ATOM 345 CD GLU A 457 -2.077 -14.537 -5.759 1.00 15.15 C ATOM 346 OE1 GLU A 457 -3.009 -14.569 -4.926 1.00 33.52 O ATOM 347 OE2 GLU A 457 -1.814 -15.497 -6.511 1.00 3.13 O ATOM 0 H GLU A 457 2.430 -13.240 -5.344 1.00 4.32 H new ATOM 0 HA GLU A 457 0.306 -11.175 -5.495 1.00 23.44 H new ATOM 0 HB2 GLU A 457 0.276 -14.053 -4.569 1.00 0.45 H new ATOM 0 HB3 GLU A 457 -0.796 -12.900 -3.800 1.00 0.45 H new ATOM 0 HG2 GLU A 457 -1.907 -12.407 -5.886 1.00 50.42 H new ATOM 0 HG3 GLU A 457 -0.700 -13.279 -6.810 1.00 50.42 H new ATOM 354 N TYR A 458 0.803 -10.242 -3.277 1.00 23.24 N ATOM 355 CA TYR A 458 1.189 -9.561 -2.034 1.00 22.43 C ATOM 356 C TYR A 458 -0.049 -9.218 -1.187 1.00 1.24 C ATOM 357 O TYR A 458 -1.167 -9.139 -1.705 1.00 72.12 O ATOM 358 CB TYR A 458 1.954 -8.267 -2.353 1.00 52.12 C ATOM 359 CG TYR A 458 3.229 -8.464 -3.159 1.00 43.10 C ATOM 360 CD1 TYR A 458 3.181 -8.784 -4.514 1.00 1.34 C ATOM 361 CD2 TYR A 458 4.480 -8.320 -2.568 1.00 42.15 C ATOM 362 CE1 TYR A 458 4.338 -8.957 -5.249 1.00 75.45 C ATOM 363 CE2 TYR A 458 5.639 -8.492 -3.299 1.00 44.44 C ATOM 364 CZ TYR A 458 5.564 -8.811 -4.637 1.00 43.42 C ATOM 365 OH TYR A 458 6.719 -8.984 -5.364 1.00 25.43 O ATOM 0 H TYR A 458 0.140 -9.717 -3.848 1.00 23.24 H new ATOM 0 HA TYR A 458 1.829 -10.237 -1.468 1.00 22.43 H new ATOM 0 HB2 TYR A 458 1.293 -7.596 -2.902 1.00 52.12 H new ATOM 0 HB3 TYR A 458 2.206 -7.770 -1.416 1.00 52.12 H new ATOM 0 HD1 TYR A 458 2.223 -8.899 -4.998 1.00 1.34 H new ATOM 0 HD2 TYR A 458 4.546 -8.069 -1.520 1.00 42.15 H new ATOM 0 HE1 TYR A 458 4.282 -9.206 -6.299 1.00 75.45 H new ATOM 0 HE2 TYR A 458 6.602 -8.377 -2.823 1.00 44.44 H new ATOM 0 HH TYR A 458 7.410 -9.379 -4.792 1.00 25.43 H new ATOM 375 N GLU A 459 0.163 -8.997 0.112 1.00 62.43 N ATOM 376 CA GLU A 459 -0.913 -8.572 1.015 1.00 42.32 C ATOM 377 C GLU A 459 -0.581 -7.215 1.657 1.00 22.52 C ATOM 378 O GLU A 459 0.489 -7.033 2.244 1.00 74.44 O ATOM 379 CB GLU A 459 -1.164 -9.615 2.123 1.00 43.21 C ATOM 380 CG GLU A 459 -1.723 -10.956 1.636 1.00 72.30 C ATOM 381 CD GLU A 459 -0.646 -11.967 1.259 1.00 4.13 C ATOM 382 OE1 GLU A 459 -0.174 -12.696 2.158 1.00 30.34 O ATOM 383 OE2 GLU A 459 -0.283 -12.052 0.069 1.00 45.11 O ATOM 0 H GLU A 459 1.071 -9.105 0.564 1.00 62.43 H new ATOM 0 HA GLU A 459 -1.818 -8.476 0.416 1.00 42.32 H new ATOM 0 HB2 GLU A 459 -0.226 -9.798 2.647 1.00 43.21 H new ATOM 0 HB3 GLU A 459 -1.858 -9.192 2.849 1.00 43.21 H new ATOM 0 HG2 GLU A 459 -2.352 -11.383 2.417 1.00 72.30 H new ATOM 0 HG3 GLU A 459 -2.363 -10.781 0.771 1.00 72.30 H new ATOM 390 N VAL A 460 -1.509 -6.269 1.547 1.00 20.10 N ATOM 391 CA VAL A 460 -1.333 -4.926 2.105 1.00 50.52 C ATOM 392 C VAL A 460 -2.078 -4.769 3.437 1.00 23.40 C ATOM 393 O VAL A 460 -3.294 -4.953 3.509 1.00 45.01 O ATOM 394 CB VAL A 460 -1.836 -3.836 1.124 1.00 2.25 C ATOM 395 CG1 VAL A 460 -1.573 -2.436 1.682 1.00 11.20 C ATOM 396 CG2 VAL A 460 -1.192 -4.002 -0.249 1.00 43.44 C ATOM 0 H VAL A 460 -2.401 -6.407 1.072 1.00 20.10 H new ATOM 0 HA VAL A 460 -0.264 -4.798 2.272 1.00 50.52 H new ATOM 0 HB VAL A 460 -2.913 -3.957 1.010 1.00 2.25 H new ATOM 0 HG11 VAL A 460 -1.935 -1.689 0.976 1.00 11.20 H new ATOM 0 HG12 VAL A 460 -2.094 -2.319 2.632 1.00 11.20 H new ATOM 0 HG13 VAL A 460 -0.502 -2.301 1.836 1.00 11.20 H new ATOM 0 HG21 VAL A 460 -1.560 -3.226 -0.920 1.00 43.44 H new ATOM 0 HG22 VAL A 460 -0.109 -3.917 -0.156 1.00 43.44 H new ATOM 0 HG23 VAL A 460 -1.446 -4.982 -0.654 1.00 43.44 H new ATOM 406 N HIS A 461 -1.334 -4.437 4.487 1.00 11.13 N ATOM 407 CA HIS A 461 -1.907 -4.173 5.810 1.00 2.04 C ATOM 408 C HIS A 461 -2.116 -2.666 6.015 1.00 31.15 C ATOM 409 O HIS A 461 -1.153 -1.909 6.126 1.00 15.52 O ATOM 410 CB HIS A 461 -0.976 -4.708 6.906 1.00 22.41 C ATOM 411 CG HIS A 461 -0.736 -6.186 6.850 1.00 74.11 C ATOM 412 ND1 HIS A 461 -0.896 -7.013 7.941 1.00 54.41 N ATOM 413 CD2 HIS A 461 -0.319 -6.986 5.837 1.00 24.51 C ATOM 414 CE1 HIS A 461 -0.592 -8.249 7.604 1.00 2.41 C ATOM 415 NE2 HIS A 461 -0.240 -8.261 6.336 1.00 52.14 N ATOM 0 H HIS A 461 -0.319 -4.343 4.449 1.00 11.13 H new ATOM 0 HA HIS A 461 -2.870 -4.679 5.871 1.00 2.04 H new ATOM 0 HB2 HIS A 461 -0.018 -4.194 6.834 1.00 22.41 H new ATOM 0 HB3 HIS A 461 -1.399 -4.458 7.879 1.00 22.41 H new ATOM 0 HD2 HIS A 461 -0.092 -6.677 4.827 1.00 24.51 H new ATOM 0 HE1 HIS A 461 -0.626 -9.108 8.258 1.00 2.41 H new ATOM 0 HE2 HIS A 461 0.046 -9.086 5.809 1.00 52.14 H new ATOM 424 N VAL A 462 -3.368 -2.229 6.051 1.00 75.33 N ATOM 425 CA VAL A 462 -3.678 -0.814 6.279 1.00 13.54 C ATOM 426 C VAL A 462 -4.410 -0.637 7.616 1.00 15.04 C ATOM 427 O VAL A 462 -5.447 -1.251 7.855 1.00 55.31 O ATOM 428 CB VAL A 462 -4.516 -0.221 5.112 1.00 41.43 C ATOM 429 CG1 VAL A 462 -3.786 -0.415 3.784 1.00 74.23 C ATOM 430 CG2 VAL A 462 -5.908 -0.842 5.042 1.00 41.12 C ATOM 0 H VAL A 462 -4.185 -2.826 5.927 1.00 75.33 H new ATOM 0 HA VAL A 462 -2.736 -0.266 6.320 1.00 13.54 H new ATOM 0 HB VAL A 462 -4.638 0.845 5.303 1.00 41.43 H new ATOM 0 HG11 VAL A 462 -4.384 0.005 2.975 1.00 74.23 H new ATOM 0 HG12 VAL A 462 -2.821 0.091 3.822 1.00 74.23 H new ATOM 0 HG13 VAL A 462 -3.631 -1.479 3.606 1.00 74.23 H new ATOM 0 HG21 VAL A 462 -6.462 -0.401 4.213 1.00 41.12 H new ATOM 0 HG22 VAL A 462 -5.819 -1.917 4.888 1.00 41.12 H new ATOM 0 HG23 VAL A 462 -6.438 -0.652 5.975 1.00 41.12 H new ATOM 440 N LYS A 463 -3.863 0.191 8.498 1.00 71.11 N ATOM 441 CA LYS A 463 -4.395 0.318 9.861 1.00 75.32 C ATOM 442 C LYS A 463 -4.421 1.772 10.354 1.00 13.25 C ATOM 443 O LYS A 463 -3.574 2.590 9.990 1.00 12.44 O ATOM 444 CB LYS A 463 -3.574 -0.548 10.827 1.00 11.44 C ATOM 445 CG LYS A 463 -2.065 -0.408 10.643 1.00 62.45 C ATOM 446 CD LYS A 463 -1.295 -0.811 11.899 1.00 23.35 C ATOM 447 CE LYS A 463 -1.421 -2.297 12.213 1.00 44.50 C ATOM 448 NZ LYS A 463 -0.839 -3.148 11.143 1.00 30.55 N ATOM 0 H LYS A 463 -3.056 0.784 8.302 1.00 71.11 H new ATOM 0 HA LYS A 463 -5.428 -0.030 9.835 1.00 75.32 H new ATOM 0 HB2 LYS A 463 -3.833 -0.280 11.851 1.00 11.44 H new ATOM 0 HB3 LYS A 463 -3.853 -1.593 10.691 1.00 11.44 H new ATOM 0 HG2 LYS A 463 -1.743 -1.028 9.806 1.00 62.45 H new ATOM 0 HG3 LYS A 463 -1.825 0.624 10.386 1.00 62.45 H new ATOM 0 HD2 LYS A 463 -0.242 -0.558 11.772 1.00 23.35 H new ATOM 0 HD3 LYS A 463 -1.662 -0.232 12.747 1.00 23.35 H new ATOM 0 HE2 LYS A 463 -0.921 -2.511 13.157 1.00 44.50 H new ATOM 0 HE3 LYS A 463 -2.473 -2.551 12.345 1.00 44.50 H new ATOM 0 HZ1 LYS A 463 -0.450 -4.016 11.563 1.00 30.55 H new ATOM 0 HZ2 LYS A 463 -1.579 -3.397 10.456 1.00 30.55 H new ATOM 0 HZ3 LYS A 463 -0.080 -2.627 10.660 1.00 30.55 H new ATOM 462 N ASN A 464 -5.407 2.074 11.197 1.00 34.45 N ATOM 463 CA ASN A 464 -5.546 3.401 11.804 1.00 21.25 C ATOM 464 C ASN A 464 -4.997 3.379 13.240 1.00 51.43 C ATOM 465 O ASN A 464 -5.405 2.550 14.048 1.00 34.23 O ATOM 466 CB ASN A 464 -7.033 3.792 11.806 1.00 31.01 C ATOM 467 CG ASN A 464 -7.302 5.210 12.292 1.00 42.42 C ATOM 468 OD1 ASN A 464 -6.571 5.764 13.110 1.00 15.14 O ATOM 469 ND2 ASN A 464 -8.370 5.802 11.797 1.00 61.12 N ATOM 0 H ASN A 464 -6.129 1.411 11.479 1.00 34.45 H new ATOM 0 HA ASN A 464 -4.979 4.134 11.230 1.00 21.25 H new ATOM 0 HB2 ASN A 464 -7.427 3.685 10.795 1.00 31.01 H new ATOM 0 HB3 ASN A 464 -7.581 3.093 12.438 1.00 31.01 H new ATOM 0 HD21 ASN A 464 -8.611 6.748 12.091 1.00 61.12 H new ATOM 0 HD22 ASN A 464 -8.956 5.314 11.119 1.00 61.12 H new ATOM 476 N LEU A 465 -4.096 4.302 13.568 1.00 32.11 N ATOM 477 CA LEU A 465 -3.478 4.331 14.902 1.00 53.54 C ATOM 478 C LEU A 465 -3.852 5.594 15.692 1.00 14.33 C ATOM 479 O LEU A 465 -3.477 5.742 16.853 1.00 3.45 O ATOM 480 CB LEU A 465 -1.953 4.218 14.771 1.00 33.52 C ATOM 481 CG LEU A 465 -1.454 2.972 14.018 1.00 21.42 C ATOM 482 CD1 LEU A 465 0.070 2.954 13.937 1.00 64.02 C ATOM 483 CD2 LEU A 465 -1.972 1.695 14.677 1.00 54.44 C ATOM 0 H LEU A 465 -3.776 5.037 12.937 1.00 32.11 H new ATOM 0 HA LEU A 465 -3.864 3.479 15.461 1.00 53.54 H new ATOM 0 HB2 LEU A 465 -1.581 5.106 14.260 1.00 33.52 H new ATOM 0 HB3 LEU A 465 -1.517 4.219 15.770 1.00 33.52 H new ATOM 0 HG LEU A 465 -1.846 3.017 13.002 1.00 21.42 H new ATOM 0 HD11 LEU A 465 0.395 2.063 13.400 1.00 64.02 H new ATOM 0 HD12 LEU A 465 0.417 3.843 13.409 1.00 64.02 H new ATOM 0 HD13 LEU A 465 0.488 2.944 14.944 1.00 64.02 H new ATOM 0 HD21 LEU A 465 -1.606 0.828 14.127 1.00 54.44 H new ATOM 0 HD22 LEU A 465 -1.618 1.648 15.707 1.00 54.44 H new ATOM 0 HD23 LEU A 465 -3.062 1.697 14.668 1.00 54.44 H new ATOM 495 N GLY A 466 -4.613 6.490 15.066 1.00 24.33 N ATOM 496 CA GLY A 466 -5.015 7.732 15.729 1.00 53.14 C ATOM 497 C GLY A 466 -6.074 7.521 16.810 1.00 3.24 C ATOM 498 O GLY A 466 -6.212 8.334 17.726 1.00 24.51 O ATOM 0 H GLY A 466 -4.961 6.383 14.113 1.00 24.33 H new ATOM 0 HA2 GLY A 466 -4.137 8.199 16.176 1.00 53.14 H new ATOM 0 HA3 GLY A 466 -5.400 8.427 14.983 1.00 53.14 H new ATOM 502 N GLY A 467 -6.818 6.420 16.707 1.00 62.42 N ATOM 503 CA GLY A 467 -7.876 6.126 17.673 1.00 71.24 C ATOM 504 C GLY A 467 -9.223 6.748 17.303 1.00 14.35 C ATOM 505 O GLY A 467 -10.122 6.832 18.136 1.00 73.24 O ATOM 0 H GLY A 467 -6.709 5.722 15.971 1.00 62.42 H new ATOM 0 HA2 GLY A 467 -7.993 5.045 17.755 1.00 71.24 H new ATOM 0 HA3 GLY A 467 -7.573 6.490 18.655 1.00 71.24 H new ATOM 509 N ILE A 468 -9.365 7.164 16.046 1.00 73.30 N ATOM 510 CA ILE A 468 -10.617 7.760 15.552 1.00 4.00 C ATOM 511 C ILE A 468 -10.992 7.188 14.171 1.00 72.34 C ATOM 512 O ILE A 468 -10.125 6.982 13.322 1.00 62.11 O ATOM 513 CB ILE A 468 -10.505 9.308 15.474 1.00 12.12 C ATOM 514 CG1 ILE A 468 -11.802 9.932 14.924 1.00 53.02 C ATOM 515 CG2 ILE A 468 -9.303 9.720 14.629 1.00 13.43 C ATOM 516 CD1 ILE A 468 -11.774 11.446 14.844 1.00 14.53 C ATOM 0 H ILE A 468 -8.628 7.101 15.344 1.00 73.30 H new ATOM 0 HA ILE A 468 -11.405 7.505 16.260 1.00 4.00 H new ATOM 0 HB ILE A 468 -10.357 9.686 16.486 1.00 12.12 H new ATOM 0 HG12 ILE A 468 -11.993 9.530 13.929 1.00 53.02 H new ATOM 0 HG13 ILE A 468 -12.636 9.627 15.556 1.00 53.02 H new ATOM 0 HG21 ILE A 468 -9.243 10.808 14.587 1.00 13.43 H new ATOM 0 HG22 ILE A 468 -8.391 9.323 15.075 1.00 13.43 H new ATOM 0 HG23 ILE A 468 -9.415 9.324 13.620 1.00 13.43 H new ATOM 0 HD11 ILE A 468 -12.723 11.807 14.447 1.00 14.53 H new ATOM 0 HD12 ILE A 468 -11.616 11.860 15.840 1.00 14.53 H new ATOM 0 HD13 ILE A 468 -10.963 11.761 14.187 1.00 14.53 H new ATOM 528 N GLY A 469 -12.283 6.926 13.956 1.00 42.31 N ATOM 529 CA GLY A 469 -12.733 6.305 12.708 1.00 55.15 C ATOM 530 C GLY A 469 -12.657 7.227 11.489 1.00 21.11 C ATOM 531 O GLY A 469 -13.027 8.402 11.560 1.00 51.34 O ATOM 0 H GLY A 469 -13.028 7.131 14.622 1.00 42.31 H new ATOM 0 HA2 GLY A 469 -12.129 5.418 12.518 1.00 55.15 H new ATOM 0 HA3 GLY A 469 -13.762 5.969 12.832 1.00 55.15 H new ATOM 535 N VAL A 470 -12.181 6.684 10.361 1.00 54.33 N ATOM 536 CA VAL A 470 -12.035 7.453 9.116 1.00 73.54 C ATOM 537 C VAL A 470 -12.632 6.701 7.903 1.00 75.33 C ATOM 538 O VAL A 470 -12.112 5.659 7.485 1.00 32.51 O ATOM 539 CB VAL A 470 -10.542 7.762 8.832 1.00 53.22 C ATOM 540 CG1 VAL A 470 -10.385 8.599 7.565 1.00 73.23 C ATOM 541 CG2 VAL A 470 -9.896 8.459 10.027 1.00 43.20 C ATOM 0 H VAL A 470 -11.889 5.710 10.284 1.00 54.33 H new ATOM 0 HA VAL A 470 -12.584 8.384 9.255 1.00 73.54 H new ATOM 0 HB VAL A 470 -10.028 6.814 8.672 1.00 53.22 H new ATOM 0 HG11 VAL A 470 -9.328 8.800 7.391 1.00 73.23 H new ATOM 0 HG12 VAL A 470 -10.795 8.053 6.715 1.00 73.23 H new ATOM 0 HG13 VAL A 470 -10.919 9.542 7.683 1.00 73.23 H new ATOM 0 HG21 VAL A 470 -8.849 8.666 9.805 1.00 43.20 H new ATOM 0 HG22 VAL A 470 -10.417 9.396 10.227 1.00 43.20 H new ATOM 0 HG23 VAL A 470 -9.961 7.814 10.903 1.00 43.20 H new ATOM 551 N PRO A 471 -13.729 7.226 7.311 1.00 24.13 N ATOM 552 CA PRO A 471 -14.349 6.653 6.102 1.00 22.33 C ATOM 553 C PRO A 471 -13.740 7.199 4.794 1.00 50.44 C ATOM 554 O PRO A 471 -14.006 6.688 3.706 1.00 22.22 O ATOM 555 CB PRO A 471 -15.805 7.095 6.251 1.00 1.32 C ATOM 556 CG PRO A 471 -15.720 8.432 6.917 1.00 23.30 C ATOM 557 CD PRO A 471 -14.484 8.406 7.795 1.00 25.32 C ATOM 0 HA PRO A 471 -14.206 5.575 6.029 1.00 22.33 H new ATOM 0 HB2 PRO A 471 -16.301 7.164 5.283 1.00 1.32 H new ATOM 0 HB3 PRO A 471 -16.376 6.387 6.852 1.00 1.32 H new ATOM 0 HG2 PRO A 471 -15.652 9.229 6.177 1.00 23.30 H new ATOM 0 HG3 PRO A 471 -16.613 8.625 7.512 1.00 23.30 H new ATOM 0 HD2 PRO A 471 -13.902 9.322 7.693 1.00 25.32 H new ATOM 0 HD3 PRO A 471 -14.744 8.309 8.849 1.00 25.32 H new ATOM 565 N SER A 472 -12.930 8.243 4.920 1.00 72.21 N ATOM 566 CA SER A 472 -12.304 8.930 3.777 1.00 5.35 C ATOM 567 C SER A 472 -11.036 8.213 3.275 1.00 1.13 C ATOM 568 O SER A 472 -10.288 8.761 2.462 1.00 44.42 O ATOM 569 CB SER A 472 -11.973 10.382 4.145 1.00 51.23 C ATOM 570 OG SER A 472 -11.079 10.447 5.241 1.00 3.32 O ATOM 0 H SER A 472 -12.681 8.647 5.823 1.00 72.21 H new ATOM 0 HA SER A 472 -13.028 8.913 2.963 1.00 5.35 H new ATOM 0 HB2 SER A 472 -11.533 10.886 3.284 1.00 51.23 H new ATOM 0 HB3 SER A 472 -12.892 10.915 4.391 1.00 51.23 H new ATOM 0 HG SER A 472 -10.359 11.081 5.039 1.00 3.32 H new ATOM 576 N THR A 473 -10.818 6.974 3.716 1.00 2.14 N ATOM 577 CA THR A 473 -9.510 6.313 3.582 1.00 2.22 C ATOM 578 C THR A 473 -9.356 5.582 2.235 1.00 3.23 C ATOM 579 O THR A 473 -9.986 4.556 1.979 1.00 12.24 O ATOM 580 CB THR A 473 -9.313 5.275 4.719 1.00 14.03 C ATOM 581 OG1 THR A 473 -9.426 5.910 6.000 1.00 62.15 O ATOM 582 CG2 THR A 473 -7.961 4.577 4.619 1.00 23.55 C ATOM 0 H THR A 473 -11.530 6.402 4.171 1.00 2.14 H new ATOM 0 HA THR A 473 -8.759 7.101 3.640 1.00 2.22 H new ATOM 0 HB THR A 473 -10.095 4.524 4.610 1.00 14.03 H new ATOM 0 HG1 THR A 473 -10.318 5.744 6.370 1.00 62.15 H new ATOM 0 HG21 THR A 473 -7.862 3.858 5.432 1.00 23.55 H new ATOM 0 HG22 THR A 473 -7.890 4.056 3.664 1.00 23.55 H new ATOM 0 HG23 THR A 473 -7.164 5.317 4.689 1.00 23.55 H new ATOM 590 N LYS A 474 -8.510 6.146 1.373 1.00 50.02 N ATOM 591 CA LYS A 474 -8.190 5.557 0.064 1.00 70.33 C ATOM 592 C LYS A 474 -6.741 5.038 0.020 1.00 24.10 C ATOM 593 O LYS A 474 -5.810 5.753 0.380 1.00 55.52 O ATOM 594 CB LYS A 474 -8.387 6.603 -1.043 1.00 12.41 C ATOM 595 CG LYS A 474 -9.839 7.015 -1.263 1.00 12.53 C ATOM 596 CD LYS A 474 -9.961 8.119 -2.316 1.00 65.15 C ATOM 597 CE LYS A 474 -11.415 8.405 -2.673 1.00 11.44 C ATOM 598 NZ LYS A 474 -12.066 7.231 -3.312 1.00 61.05 N ATOM 0 H LYS A 474 -8.025 7.024 1.558 1.00 50.02 H new ATOM 0 HA LYS A 474 -8.863 4.715 -0.095 1.00 70.33 H new ATOM 0 HB2 LYS A 474 -7.803 7.490 -0.797 1.00 12.41 H new ATOM 0 HB3 LYS A 474 -7.988 6.207 -1.977 1.00 12.41 H new ATOM 0 HG2 LYS A 474 -10.420 6.148 -1.576 1.00 12.53 H new ATOM 0 HG3 LYS A 474 -10.266 7.361 -0.322 1.00 12.53 H new ATOM 0 HD2 LYS A 474 -9.493 9.030 -1.943 1.00 65.15 H new ATOM 0 HD3 LYS A 474 -9.417 7.826 -3.214 1.00 65.15 H new ATOM 0 HE2 LYS A 474 -11.964 8.680 -1.772 1.00 11.44 H new ATOM 0 HE3 LYS A 474 -11.463 9.260 -3.348 1.00 11.44 H new ATOM 0 HZ1 LYS A 474 -13.063 7.452 -3.510 1.00 61.05 H new ATOM 0 HZ2 LYS A 474 -11.578 7.006 -4.202 1.00 61.05 H new ATOM 0 HZ3 LYS A 474 -12.013 6.413 -2.672 1.00 61.05 H new ATOM 612 N VAL A 475 -6.559 3.800 -0.433 1.00 20.01 N ATOM 613 CA VAL A 475 -5.224 3.196 -0.555 1.00 24.24 C ATOM 614 C VAL A 475 -4.842 2.997 -2.033 1.00 32.33 C ATOM 615 O VAL A 475 -5.630 2.467 -2.814 1.00 63.10 O ATOM 616 CB VAL A 475 -5.166 1.828 0.171 1.00 53.45 C ATOM 617 CG1 VAL A 475 -3.757 1.235 0.110 1.00 23.34 C ATOM 618 CG2 VAL A 475 -5.647 1.967 1.617 1.00 15.01 C ATOM 0 H VAL A 475 -7.321 3.188 -0.725 1.00 20.01 H new ATOM 0 HA VAL A 475 -4.515 3.881 -0.090 1.00 24.24 H new ATOM 0 HB VAL A 475 -5.836 1.138 -0.343 1.00 53.45 H new ATOM 0 HG11 VAL A 475 -3.743 0.275 0.627 1.00 23.34 H new ATOM 0 HG12 VAL A 475 -3.468 1.091 -0.931 1.00 23.34 H new ATOM 0 HG13 VAL A 475 -3.055 1.916 0.591 1.00 23.34 H new ATOM 0 HG21 VAL A 475 -5.599 0.997 2.111 1.00 15.01 H new ATOM 0 HG22 VAL A 475 -5.009 2.675 2.146 1.00 15.01 H new ATOM 0 HG23 VAL A 475 -6.675 2.328 1.625 1.00 15.01 H new ATOM 628 N ARG A 476 -3.645 3.434 -2.417 1.00 55.10 N ATOM 629 CA ARG A 476 -3.165 3.270 -3.798 1.00 53.40 C ATOM 630 C ARG A 476 -1.823 2.531 -3.840 1.00 52.42 C ATOM 631 O ARG A 476 -1.021 2.623 -2.912 1.00 14.23 O ATOM 632 CB ARG A 476 -3.014 4.635 -4.487 1.00 0.11 C ATOM 633 CG ARG A 476 -4.306 5.442 -4.569 1.00 41.43 C ATOM 634 CD ARG A 476 -4.107 6.743 -5.341 1.00 65.44 C ATOM 635 NE ARG A 476 -5.295 7.593 -5.317 1.00 22.23 N ATOM 636 CZ ARG A 476 -5.289 8.867 -5.607 1.00 22.33 C ATOM 637 NH1 ARG A 476 -4.197 9.445 -6.002 1.00 2.31 N ATOM 638 NH2 ARG A 476 -6.382 9.554 -5.516 1.00 1.23 N ATOM 0 H ARG A 476 -2.986 3.905 -1.797 1.00 55.10 H new ATOM 0 HA ARG A 476 -3.908 2.676 -4.329 1.00 53.40 H new ATOM 0 HB2 ARG A 476 -2.267 5.220 -3.950 1.00 0.11 H new ATOM 0 HB3 ARG A 476 -2.632 4.480 -5.496 1.00 0.11 H new ATOM 0 HG2 ARG A 476 -5.078 4.845 -5.054 1.00 41.43 H new ATOM 0 HG3 ARG A 476 -4.661 5.666 -3.563 1.00 41.43 H new ATOM 0 HD2 ARG A 476 -3.265 7.289 -4.916 1.00 65.44 H new ATOM 0 HD3 ARG A 476 -3.849 6.513 -6.375 1.00 65.44 H new ATOM 0 HE ARG A 476 -6.184 7.165 -5.058 1.00 22.23 H new ATOM 0 HH11 ARG A 476 -3.336 8.905 -6.088 1.00 2.31 H new ATOM 0 HH12 ARG A 476 -4.199 10.440 -6.227 1.00 2.31 H new ATOM 0 HH21 ARG A 476 -7.246 9.101 -5.218 1.00 1.23 H new ATOM 0 HH22 ARG A 476 -6.379 10.549 -5.742 1.00 1.23 H new ATOM 652 N VAL A 477 -1.588 1.799 -4.928 1.00 12.54 N ATOM 653 CA VAL A 477 -0.326 1.078 -5.129 1.00 34.53 C ATOM 654 C VAL A 477 0.365 1.524 -6.428 1.00 51.33 C ATOM 655 O VAL A 477 -0.205 1.411 -7.517 1.00 52.44 O ATOM 656 CB VAL A 477 -0.558 -0.456 -5.171 1.00 54.31 C ATOM 657 CG1 VAL A 477 0.743 -1.200 -5.480 1.00 55.34 C ATOM 658 CG2 VAL A 477 -1.157 -0.943 -3.853 1.00 4.03 C ATOM 0 H VAL A 477 -2.258 1.688 -5.689 1.00 12.54 H new ATOM 0 HA VAL A 477 0.319 1.316 -4.283 1.00 34.53 H new ATOM 0 HB VAL A 477 -1.265 -0.670 -5.972 1.00 54.31 H new ATOM 0 HG11 VAL A 477 0.552 -2.273 -5.503 1.00 55.34 H new ATOM 0 HG12 VAL A 477 1.125 -0.878 -6.449 1.00 55.34 H new ATOM 0 HG13 VAL A 477 1.480 -0.980 -4.708 1.00 55.34 H new ATOM 0 HG21 VAL A 477 -1.313 -2.021 -3.900 1.00 4.03 H new ATOM 0 HG22 VAL A 477 -0.475 -0.711 -3.035 1.00 4.03 H new ATOM 0 HG23 VAL A 477 -2.112 -0.446 -3.681 1.00 4.03 H new ATOM 668 N TYR A 478 1.587 2.038 -6.304 1.00 34.41 N ATOM 669 CA TYR A 478 2.375 2.483 -7.460 1.00 51.24 C ATOM 670 C TYR A 478 3.618 1.601 -7.651 1.00 33.11 C ATOM 671 O TYR A 478 4.305 1.271 -6.689 1.00 74.35 O ATOM 672 CB TYR A 478 2.828 3.941 -7.276 1.00 61.33 C ATOM 673 CG TYR A 478 1.705 4.932 -7.029 1.00 72.34 C ATOM 674 CD1 TYR A 478 1.255 5.193 -5.738 1.00 10.03 C ATOM 675 CD2 TYR A 478 1.103 5.616 -8.082 1.00 51.24 C ATOM 676 CE1 TYR A 478 0.244 6.103 -5.505 1.00 44.51 C ATOM 677 CE2 TYR A 478 0.091 6.529 -7.853 1.00 54.44 C ATOM 678 CZ TYR A 478 -0.336 6.768 -6.562 1.00 41.04 C ATOM 679 OH TYR A 478 -1.343 7.679 -6.327 1.00 33.13 O ATOM 0 H TYR A 478 2.059 2.159 -5.408 1.00 34.41 H new ATOM 0 HA TYR A 478 1.737 2.403 -8.340 1.00 51.24 H new ATOM 0 HB2 TYR A 478 3.524 3.987 -6.439 1.00 61.33 H new ATOM 0 HB3 TYR A 478 3.377 4.251 -8.165 1.00 61.33 H new ATOM 0 HD1 TYR A 478 1.705 4.674 -4.904 1.00 10.03 H new ATOM 0 HD2 TYR A 478 1.432 5.430 -9.094 1.00 51.24 H new ATOM 0 HE1 TYR A 478 -0.091 6.293 -4.496 1.00 44.51 H new ATOM 0 HE2 TYR A 478 -0.364 7.053 -8.680 1.00 54.44 H new ATOM 0 HH TYR A 478 -1.109 8.233 -5.554 1.00 33.13 H new ATOM 689 N ILE A 479 3.908 1.238 -8.895 1.00 31.12 N ATOM 690 CA ILE A 479 5.127 0.494 -9.224 1.00 25.13 C ATOM 691 C ILE A 479 6.064 1.363 -10.076 1.00 30.33 C ATOM 692 O ILE A 479 5.746 1.697 -11.219 1.00 41.03 O ATOM 693 CB ILE A 479 4.803 -0.824 -9.977 1.00 23.42 C ATOM 694 CG1 ILE A 479 3.859 -1.704 -9.134 1.00 61.02 C ATOM 695 CG2 ILE A 479 6.089 -1.580 -10.320 1.00 44.51 C ATOM 696 CD1 ILE A 479 3.456 -3.001 -9.808 1.00 10.02 C ATOM 0 H ILE A 479 3.315 1.446 -9.699 1.00 31.12 H new ATOM 0 HA ILE A 479 5.621 0.236 -8.287 1.00 25.13 H new ATOM 0 HB ILE A 479 4.299 -0.575 -10.911 1.00 23.42 H new ATOM 0 HG12 ILE A 479 4.345 -1.935 -8.186 1.00 61.02 H new ATOM 0 HG13 ILE A 479 2.960 -1.134 -8.900 1.00 61.02 H new ATOM 0 HG21 ILE A 479 5.840 -2.501 -10.847 1.00 44.51 H new ATOM 0 HG22 ILE A 479 6.719 -0.957 -10.955 1.00 44.51 H new ATOM 0 HG23 ILE A 479 6.625 -1.821 -9.402 1.00 44.51 H new ATOM 0 HD11 ILE A 479 2.792 -3.562 -9.150 1.00 10.02 H new ATOM 0 HD12 ILE A 479 2.940 -2.780 -10.742 1.00 10.02 H new ATOM 0 HD13 ILE A 479 4.346 -3.594 -10.017 1.00 10.02 H new ATOM 708 N ASN A 480 7.206 1.750 -9.500 1.00 43.12 N ATOM 709 CA ASN A 480 8.168 2.642 -10.170 1.00 54.21 C ATOM 710 C ASN A 480 7.502 3.949 -10.643 1.00 64.34 C ATOM 711 O ASN A 480 7.869 4.513 -11.674 1.00 14.12 O ATOM 712 CB ASN A 480 8.833 1.920 -11.354 1.00 50.11 C ATOM 713 CG ASN A 480 9.635 0.711 -10.911 1.00 60.12 C ATOM 714 OD1 ASN A 480 9.311 0.062 -9.925 1.00 51.11 O ATOM 715 ND2 ASN A 480 10.687 0.394 -11.634 1.00 23.55 N ATOM 0 H ASN A 480 7.492 1.459 -8.565 1.00 43.12 H new ATOM 0 HA ASN A 480 8.933 2.908 -9.441 1.00 54.21 H new ATOM 0 HB2 ASN A 480 8.067 1.606 -12.062 1.00 50.11 H new ATOM 0 HB3 ASN A 480 9.487 2.615 -11.880 1.00 50.11 H new ATOM 0 HD21 ASN A 480 11.258 -0.412 -11.378 1.00 23.55 H new ATOM 0 HD22 ASN A 480 10.932 0.954 -12.451 1.00 23.55 H new ATOM 722 N GLY A 481 6.528 4.429 -9.869 1.00 54.25 N ATOM 723 CA GLY A 481 5.831 5.669 -10.204 1.00 52.31 C ATOM 724 C GLY A 481 4.539 5.448 -10.995 1.00 62.44 C ATOM 725 O GLY A 481 3.676 6.328 -11.045 1.00 71.31 O ATOM 0 H GLY A 481 6.206 3.981 -9.011 1.00 54.25 H new ATOM 0 HA2 GLY A 481 5.597 6.205 -9.284 1.00 52.31 H new ATOM 0 HA3 GLY A 481 6.498 6.306 -10.784 1.00 52.31 H new ATOM 729 N THR A 482 4.402 4.274 -11.610 1.00 55.52 N ATOM 730 CA THR A 482 3.218 3.943 -12.423 1.00 33.42 C ATOM 731 C THR A 482 2.088 3.350 -11.566 1.00 25.23 C ATOM 732 O THR A 482 2.288 2.355 -10.871 1.00 13.14 O ATOM 733 CB THR A 482 3.579 2.929 -13.540 1.00 20.33 C ATOM 734 OG1 THR A 482 4.619 3.460 -14.377 1.00 52.42 O ATOM 735 CG2 THR A 482 2.360 2.583 -14.395 1.00 43.11 C ATOM 0 H THR A 482 5.097 3.529 -11.564 1.00 55.52 H new ATOM 0 HA THR A 482 2.873 4.876 -12.868 1.00 33.42 H new ATOM 0 HB THR A 482 3.930 2.017 -13.057 1.00 20.33 H new ATOM 0 HG1 THR A 482 4.839 2.810 -15.077 1.00 52.42 H new ATOM 0 HG21 THR A 482 2.648 1.870 -15.168 1.00 43.11 H new ATOM 0 HG22 THR A 482 1.587 2.143 -13.765 1.00 43.11 H new ATOM 0 HG23 THR A 482 1.974 3.489 -14.862 1.00 43.11 H new ATOM 743 N LEU A 483 0.901 3.955 -11.620 1.00 13.13 N ATOM 744 CA LEU A 483 -0.249 3.472 -10.845 1.00 1.53 C ATOM 745 C LEU A 483 -0.665 2.053 -11.266 1.00 61.51 C ATOM 746 O LEU A 483 -1.004 1.807 -12.423 1.00 62.12 O ATOM 747 CB LEU A 483 -1.440 4.430 -10.995 1.00 63.11 C ATOM 748 CG LEU A 483 -2.715 4.017 -10.234 1.00 22.51 C ATOM 749 CD1 LEU A 483 -2.461 3.975 -8.729 1.00 20.20 C ATOM 750 CD2 LEU A 483 -3.875 4.955 -10.563 1.00 53.42 C ATOM 0 H LEU A 483 0.708 4.779 -12.190 1.00 13.13 H new ATOM 0 HA LEU A 483 0.057 3.437 -9.799 1.00 1.53 H new ATOM 0 HB2 LEU A 483 -1.136 5.419 -10.652 1.00 63.11 H new ATOM 0 HB3 LEU A 483 -1.682 4.521 -12.054 1.00 63.11 H new ATOM 0 HG LEU A 483 -2.990 3.014 -10.559 1.00 22.51 H new ATOM 0 HD11 LEU A 483 -3.375 3.681 -8.214 1.00 20.20 H new ATOM 0 HD12 LEU A 483 -1.674 3.252 -8.513 1.00 20.20 H new ATOM 0 HD13 LEU A 483 -2.152 4.962 -8.385 1.00 20.20 H new ATOM 0 HD21 LEU A 483 -4.763 4.642 -10.014 1.00 53.42 H new ATOM 0 HD22 LEU A 483 -3.612 5.973 -10.278 1.00 53.42 H new ATOM 0 HD23 LEU A 483 -4.079 4.920 -11.633 1.00 53.42 H new ATOM 762 N TYR A 484 -0.628 1.124 -10.315 1.00 31.24 N ATOM 763 CA TYR A 484 -1.013 -0.267 -10.566 1.00 41.25 C ATOM 764 C TYR A 484 -2.489 -0.538 -10.197 1.00 24.41 C ATOM 765 O TYR A 484 -3.205 -1.221 -10.935 1.00 22.21 O ATOM 766 CB TYR A 484 -0.079 -1.211 -9.786 1.00 74.33 C ATOM 767 CG TYR A 484 -0.659 -2.596 -9.570 1.00 13.42 C ATOM 768 CD1 TYR A 484 -0.706 -3.533 -10.599 1.00 64.31 C ATOM 769 CD2 TYR A 484 -1.196 -2.948 -8.340 1.00 71.32 C ATOM 770 CE1 TYR A 484 -1.266 -4.781 -10.399 1.00 33.32 C ATOM 771 CE2 TYR A 484 -1.762 -4.184 -8.139 1.00 0.35 C ATOM 772 CZ TYR A 484 -1.796 -5.098 -9.166 1.00 4.51 C ATOM 773 OH TYR A 484 -2.385 -6.323 -8.962 1.00 14.32 O ATOM 0 H TYR A 484 -0.334 1.309 -9.356 1.00 31.24 H new ATOM 0 HA TYR A 484 -0.913 -0.455 -11.635 1.00 41.25 H new ATOM 0 HB2 TYR A 484 0.865 -1.301 -10.324 1.00 74.33 H new ATOM 0 HB3 TYR A 484 0.148 -0.766 -8.817 1.00 74.33 H new ATOM 0 HD1 TYR A 484 -0.299 -3.281 -11.567 1.00 64.31 H new ATOM 0 HD2 TYR A 484 -1.169 -2.238 -7.526 1.00 71.32 H new ATOM 0 HE1 TYR A 484 -1.288 -5.502 -11.202 1.00 33.32 H new ATOM 0 HE2 TYR A 484 -2.180 -4.437 -7.176 1.00 0.35 H new ATOM 0 HH TYR A 484 -1.953 -6.993 -9.532 1.00 14.32 H new ATOM 783 N LYS A 485 -2.939 -0.015 -9.051 1.00 41.51 N ATOM 784 CA LYS A 485 -4.313 -0.266 -8.574 1.00 23.13 C ATOM 785 C LYS A 485 -4.687 0.674 -7.414 1.00 13.11 C ATOM 786 O LYS A 485 -3.811 1.237 -6.752 1.00 65.22 O ATOM 787 CB LYS A 485 -4.447 -1.735 -8.136 1.00 4.32 C ATOM 788 CG LYS A 485 -5.890 -2.224 -7.935 1.00 4.41 C ATOM 789 CD LYS A 485 -6.174 -3.496 -8.741 1.00 74.40 C ATOM 790 CE LYS A 485 -5.225 -4.639 -8.372 1.00 31.43 C ATOM 791 NZ LYS A 485 -5.166 -5.682 -9.434 1.00 74.54 N ATOM 0 H LYS A 485 -2.382 0.580 -8.438 1.00 41.51 H new ATOM 0 HA LYS A 485 -5.002 -0.066 -9.394 1.00 23.13 H new ATOM 0 HB2 LYS A 485 -3.966 -2.366 -8.883 1.00 4.32 H new ATOM 0 HB3 LYS A 485 -3.900 -1.872 -7.203 1.00 4.32 H new ATOM 0 HG2 LYS A 485 -6.065 -2.417 -6.877 1.00 4.41 H new ATOM 0 HG3 LYS A 485 -6.585 -1.440 -8.235 1.00 4.41 H new ATOM 0 HD2 LYS A 485 -7.203 -3.811 -8.569 1.00 74.40 H new ATOM 0 HD3 LYS A 485 -6.081 -3.278 -9.805 1.00 74.40 H new ATOM 0 HE2 LYS A 485 -4.226 -4.239 -8.201 1.00 31.43 H new ATOM 0 HE3 LYS A 485 -5.551 -5.093 -7.436 1.00 31.43 H new ATOM 0 HZ1 LYS A 485 -4.207 -6.082 -9.475 1.00 74.54 H new ATOM 0 HZ2 LYS A 485 -5.847 -6.437 -9.217 1.00 74.54 H new ATOM 0 HZ3 LYS A 485 -5.402 -5.256 -10.353 1.00 74.54 H new ATOM 805 N ASN A 486 -5.990 0.844 -7.174 1.00 62.15 N ATOM 806 CA ASN A 486 -6.474 1.710 -6.090 1.00 42.42 C ATOM 807 C ASN A 486 -7.734 1.135 -5.408 1.00 51.41 C ATOM 808 O ASN A 486 -8.578 0.518 -6.056 1.00 53.00 O ATOM 809 CB ASN A 486 -6.747 3.121 -6.631 1.00 42.43 C ATOM 810 CG ASN A 486 -7.790 3.140 -7.736 1.00 64.23 C ATOM 811 OD1 ASN A 486 -8.978 3.313 -7.486 1.00 12.44 O ATOM 812 ND2 ASN A 486 -7.358 2.958 -8.969 1.00 4.30 N ATOM 0 H ASN A 486 -6.730 0.395 -7.714 1.00 62.15 H new ATOM 0 HA ASN A 486 -5.695 1.760 -5.330 1.00 42.42 H new ATOM 0 HB2 ASN A 486 -7.080 3.760 -5.813 1.00 42.43 H new ATOM 0 HB3 ASN A 486 -5.817 3.546 -7.009 1.00 42.43 H new ATOM 0 HD21 ASN A 486 -8.019 2.959 -9.746 1.00 4.30 H new ATOM 0 HD22 ASN A 486 -6.363 2.817 -9.145 1.00 4.30 H new ATOM 819 N TRP A 487 -7.832 1.334 -4.092 1.00 20.13 N ATOM 820 CA TRP A 487 -8.985 0.878 -3.295 1.00 62.23 C ATOM 821 C TRP A 487 -9.496 1.995 -2.364 1.00 15.40 C ATOM 822 O TRP A 487 -8.725 2.849 -1.919 1.00 60.04 O ATOM 823 CB TRP A 487 -8.602 -0.331 -2.425 1.00 75.30 C ATOM 824 CG TRP A 487 -8.188 -1.560 -3.187 1.00 62.33 C ATOM 825 CD1 TRP A 487 -9.008 -2.521 -3.707 1.00 61.01 C ATOM 826 CD2 TRP A 487 -6.849 -1.978 -3.483 1.00 41.42 C ATOM 827 NE1 TRP A 487 -8.261 -3.504 -4.308 1.00 44.24 N ATOM 828 CE2 TRP A 487 -6.935 -3.192 -4.187 1.00 11.44 C ATOM 829 CE3 TRP A 487 -5.587 -1.436 -3.228 1.00 21.42 C ATOM 830 CZ2 TRP A 487 -5.808 -3.880 -4.629 1.00 3.21 C ATOM 831 CZ3 TRP A 487 -4.470 -2.119 -3.667 1.00 64.13 C ATOM 832 CH2 TRP A 487 -4.585 -3.328 -4.363 1.00 65.41 C ATOM 0 H TRP A 487 -7.118 1.815 -3.544 1.00 20.13 H new ATOM 0 HA TRP A 487 -9.769 0.600 -4.000 1.00 62.23 H new ATOM 0 HB2 TRP A 487 -7.785 -0.040 -1.765 1.00 75.30 H new ATOM 0 HB3 TRP A 487 -9.450 -0.585 -1.790 1.00 75.30 H new ATOM 0 HD1 TRP A 487 -10.087 -2.509 -3.653 1.00 61.01 H new ATOM 0 HE1 TRP A 487 -8.635 -4.333 -4.770 1.00 44.24 H new ATOM 0 HE3 TRP A 487 -5.487 -0.501 -2.698 1.00 21.42 H new ATOM 0 HZ2 TRP A 487 -5.896 -4.815 -5.162 1.00 3.21 H new ATOM 0 HZ3 TRP A 487 -3.489 -1.713 -3.470 1.00 64.13 H new ATOM 0 HH2 TRP A 487 -3.691 -3.835 -4.696 1.00 65.41 H new ATOM 843 N THR A 488 -10.796 1.991 -2.079 1.00 63.21 N ATOM 844 CA THR A 488 -11.373 2.868 -1.045 1.00 2.42 C ATOM 845 C THR A 488 -12.001 2.026 0.074 1.00 24.45 C ATOM 846 O THR A 488 -12.924 1.245 -0.173 1.00 3.33 O ATOM 847 CB THR A 488 -12.449 3.826 -1.620 1.00 42.45 C ATOM 848 OG1 THR A 488 -11.869 4.703 -2.597 1.00 5.34 O ATOM 849 CG2 THR A 488 -13.092 4.664 -0.518 1.00 74.24 C ATOM 0 H THR A 488 -11.476 1.392 -2.546 1.00 63.21 H new ATOM 0 HA THR A 488 -10.556 3.472 -0.651 1.00 2.42 H new ATOM 0 HB THR A 488 -13.217 3.210 -2.088 1.00 42.45 H new ATOM 0 HG1 THR A 488 -12.411 4.688 -3.413 1.00 5.34 H new ATOM 0 HG21 THR A 488 -13.841 5.325 -0.954 1.00 74.24 H new ATOM 0 HG22 THR A 488 -13.567 4.006 0.209 1.00 74.24 H new ATOM 0 HG23 THR A 488 -12.327 5.261 -0.021 1.00 74.24 H new ATOM 857 N VAL A 489 -11.506 2.191 1.300 1.00 13.21 N ATOM 858 CA VAL A 489 -11.955 1.378 2.440 1.00 52.13 C ATOM 859 C VAL A 489 -12.227 2.235 3.685 1.00 64.45 C ATOM 860 O VAL A 489 -11.956 3.437 3.707 1.00 71.11 O ATOM 861 CB VAL A 489 -10.909 0.287 2.805 1.00 54.15 C ATOM 862 CG1 VAL A 489 -10.710 -0.699 1.654 1.00 15.31 C ATOM 863 CG2 VAL A 489 -9.577 0.923 3.208 1.00 13.33 C ATOM 0 H VAL A 489 -10.792 2.881 1.534 1.00 13.21 H new ATOM 0 HA VAL A 489 -12.885 0.903 2.126 1.00 52.13 H new ATOM 0 HB VAL A 489 -11.296 -0.270 3.659 1.00 54.15 H new ATOM 0 HG11 VAL A 489 -9.973 -1.449 1.941 1.00 15.31 H new ATOM 0 HG12 VAL A 489 -11.657 -1.189 1.427 1.00 15.31 H new ATOM 0 HG13 VAL A 489 -10.358 -0.163 0.772 1.00 15.31 H new ATOM 0 HG21 VAL A 489 -8.861 0.140 3.459 1.00 13.33 H new ATOM 0 HG22 VAL A 489 -9.191 1.515 2.378 1.00 13.33 H new ATOM 0 HG23 VAL A 489 -9.729 1.567 4.074 1.00 13.33 H new ATOM 873 N SER A 490 -12.775 1.604 4.720 1.00 24.15 N ATOM 874 CA SER A 490 -13.014 2.274 6.004 1.00 21.02 C ATOM 875 C SER A 490 -12.101 1.704 7.091 1.00 74.43 C ATOM 876 O SER A 490 -11.898 0.488 7.174 1.00 34.44 O ATOM 877 CB SER A 490 -14.480 2.115 6.444 1.00 51.43 C ATOM 878 OG SER A 490 -14.769 0.773 6.822 1.00 21.02 O ATOM 0 H SER A 490 -13.064 0.626 4.698 1.00 24.15 H new ATOM 0 HA SER A 490 -12.795 3.333 5.866 1.00 21.02 H new ATOM 0 HB2 SER A 490 -14.684 2.782 7.282 1.00 51.43 H new ATOM 0 HB3 SER A 490 -15.140 2.415 5.630 1.00 51.43 H new ATOM 0 HG SER A 490 -15.707 0.706 7.098 1.00 21.02 H new ATOM 884 N LEU A 491 -11.538 2.583 7.913 1.00 52.41 N ATOM 885 CA LEU A 491 -10.746 2.161 9.073 1.00 53.11 C ATOM 886 C LEU A 491 -11.248 2.842 10.348 1.00 73.34 C ATOM 887 O LEU A 491 -11.210 4.068 10.466 1.00 65.41 O ATOM 888 CB LEU A 491 -9.260 2.490 8.869 1.00 62.15 C ATOM 889 CG LEU A 491 -8.529 1.638 7.820 1.00 12.31 C ATOM 890 CD1 LEU A 491 -7.077 2.083 7.685 1.00 32.04 C ATOM 891 CD2 LEU A 491 -8.604 0.158 8.187 1.00 15.44 C ATOM 0 H LEU A 491 -11.613 3.594 7.801 1.00 52.41 H new ATOM 0 HA LEU A 491 -10.860 1.082 9.176 1.00 53.11 H new ATOM 0 HB2 LEU A 491 -9.174 3.538 8.583 1.00 62.15 H new ATOM 0 HB3 LEU A 491 -8.747 2.377 9.824 1.00 62.15 H new ATOM 0 HG LEU A 491 -9.022 1.780 6.858 1.00 12.31 H new ATOM 0 HD11 LEU A 491 -6.576 1.468 6.938 1.00 32.04 H new ATOM 0 HD12 LEU A 491 -7.044 3.128 7.376 1.00 32.04 H new ATOM 0 HD13 LEU A 491 -6.572 1.972 8.644 1.00 32.04 H new ATOM 0 HD21 LEU A 491 -8.081 -0.431 7.433 1.00 15.44 H new ATOM 0 HD22 LEU A 491 -8.137 0.000 9.159 1.00 15.44 H new ATOM 0 HD23 LEU A 491 -9.648 -0.154 8.231 1.00 15.44 H new ATOM 903 N GLY A 492 -11.695 2.042 11.307 1.00 33.13 N ATOM 904 CA GLY A 492 -12.151 2.581 12.579 1.00 12.11 C ATOM 905 C GLY A 492 -11.011 2.814 13.561 1.00 74.32 C ATOM 906 O GLY A 492 -9.838 2.644 13.214 1.00 24.22 O ATOM 0 H GLY A 492 -11.751 1.027 11.229 1.00 33.13 H new ATOM 0 HA2 GLY A 492 -12.672 3.522 12.404 1.00 12.11 H new ATOM 0 HA3 GLY A 492 -12.872 1.894 13.022 1.00 12.11 H new ATOM 910 N PRO A 493 -11.321 3.209 14.806 1.00 21.14 N ATOM 911 CA PRO A 493 -10.302 3.418 15.840 1.00 2.34 C ATOM 912 C PRO A 493 -9.470 2.152 16.094 1.00 52.54 C ATOM 913 O PRO A 493 -9.959 1.184 16.676 1.00 63.11 O ATOM 914 CB PRO A 493 -11.118 3.808 17.087 1.00 70.23 C ATOM 915 CG PRO A 493 -12.512 3.360 16.799 1.00 41.10 C ATOM 916 CD PRO A 493 -12.679 3.478 15.309 1.00 50.02 C ATOM 0 HA PRO A 493 -9.575 4.178 15.553 1.00 2.34 H new ATOM 0 HB2 PRO A 493 -10.726 3.324 17.981 1.00 70.23 H new ATOM 0 HB3 PRO A 493 -11.078 4.883 17.263 1.00 70.23 H new ATOM 0 HG2 PRO A 493 -12.669 2.334 17.130 1.00 41.10 H new ATOM 0 HG3 PRO A 493 -13.239 3.980 17.325 1.00 41.10 H new ATOM 0 HD2 PRO A 493 -13.402 2.759 14.925 1.00 50.02 H new ATOM 0 HD3 PRO A 493 -13.029 4.468 15.018 1.00 50.02 H new ATOM 924 N LYS A 494 -8.223 2.156 15.610 1.00 60.53 N ATOM 925 CA LYS A 494 -7.286 1.038 15.819 1.00 13.40 C ATOM 926 C LYS A 494 -7.673 -0.207 14.995 1.00 11.22 C ATOM 927 O LYS A 494 -7.367 -1.338 15.381 1.00 61.31 O ATOM 928 CB LYS A 494 -7.190 0.691 17.315 1.00 75.23 C ATOM 929 CG LYS A 494 -6.722 1.855 18.187 1.00 41.30 C ATOM 930 CD LYS A 494 -5.281 2.258 17.885 1.00 22.42 C ATOM 931 CE LYS A 494 -4.828 3.424 18.759 1.00 70.34 C ATOM 932 NZ LYS A 494 -4.945 3.116 20.211 1.00 73.53 N ATOM 0 H LYS A 494 -7.834 2.926 15.066 1.00 60.53 H new ATOM 0 HA LYS A 494 -6.307 1.363 15.467 1.00 13.40 H new ATOM 0 HB2 LYS A 494 -8.167 0.357 17.665 1.00 75.23 H new ATOM 0 HB3 LYS A 494 -6.503 -0.145 17.441 1.00 75.23 H new ATOM 0 HG2 LYS A 494 -7.378 2.711 18.030 1.00 41.30 H new ATOM 0 HG3 LYS A 494 -6.807 1.577 19.238 1.00 41.30 H new ATOM 0 HD2 LYS A 494 -4.623 1.404 18.046 1.00 22.42 H new ATOM 0 HD3 LYS A 494 -5.193 2.534 16.834 1.00 22.42 H new ATOM 0 HE2 LYS A 494 -3.793 3.672 18.524 1.00 70.34 H new ATOM 0 HE3 LYS A 494 -5.427 4.304 18.526 1.00 70.34 H new ATOM 0 HZ1 LYS A 494 -4.416 3.823 20.760 1.00 73.53 H new ATOM 0 HZ2 LYS A 494 -5.946 3.139 20.491 1.00 73.53 H new ATOM 0 HZ3 LYS A 494 -4.555 2.170 20.398 1.00 73.53 H new ATOM 946 N GLU A 495 -8.318 0.009 13.847 1.00 23.01 N ATOM 947 CA GLU A 495 -8.723 -1.096 12.961 1.00 50.43 C ATOM 948 C GLU A 495 -7.720 -1.306 11.810 1.00 35.43 C ATOM 949 O GLU A 495 -7.010 -0.378 11.413 1.00 50.51 O ATOM 950 CB GLU A 495 -10.117 -0.826 12.371 1.00 11.42 C ATOM 951 CG GLU A 495 -10.617 -1.945 11.455 1.00 32.22 C ATOM 952 CD GLU A 495 -11.974 -1.665 10.834 1.00 33.05 C ATOM 953 OE1 GLU A 495 -12.099 -0.667 10.098 1.00 24.35 O ATOM 954 OE2 GLU A 495 -12.914 -2.459 11.052 1.00 61.33 O ATOM 0 H GLU A 495 -8.573 0.936 13.505 1.00 23.01 H new ATOM 0 HA GLU A 495 -8.745 -2.001 13.568 1.00 50.43 H new ATOM 0 HB2 GLU A 495 -10.828 -0.689 13.186 1.00 11.42 H new ATOM 0 HB3 GLU A 495 -10.091 0.108 11.810 1.00 11.42 H new ATOM 0 HG2 GLU A 495 -9.889 -2.104 10.659 1.00 32.22 H new ATOM 0 HG3 GLU A 495 -10.673 -2.872 12.026 1.00 32.22 H new ATOM 961 N GLU A 496 -7.685 -2.530 11.273 1.00 64.44 N ATOM 962 CA GLU A 496 -6.828 -2.870 10.127 1.00 44.01 C ATOM 963 C GLU A 496 -7.626 -3.596 9.023 1.00 12.13 C ATOM 964 O GLU A 496 -8.527 -4.387 9.309 1.00 11.12 O ATOM 965 CB GLU A 496 -5.656 -3.757 10.581 1.00 51.20 C ATOM 966 CG GLU A 496 -4.735 -4.204 9.440 1.00 25.03 C ATOM 967 CD GLU A 496 -3.665 -5.187 9.887 1.00 44.34 C ATOM 968 OE1 GLU A 496 -3.997 -6.369 10.122 1.00 43.52 O ATOM 969 OE2 GLU A 496 -2.485 -4.791 9.995 1.00 50.21 O ATOM 0 H GLU A 496 -8.245 -3.310 11.616 1.00 64.44 H new ATOM 0 HA GLU A 496 -6.442 -1.937 9.716 1.00 44.01 H new ATOM 0 HB2 GLU A 496 -5.066 -3.213 11.319 1.00 51.20 H new ATOM 0 HB3 GLU A 496 -6.054 -4.640 11.080 1.00 51.20 H new ATOM 0 HG2 GLU A 496 -5.336 -4.663 8.655 1.00 25.03 H new ATOM 0 HG3 GLU A 496 -4.255 -3.328 9.004 1.00 25.03 H new ATOM 976 N LYS A 497 -7.292 -3.304 7.766 1.00 12.32 N ATOM 977 CA LYS A 497 -7.843 -4.016 6.604 1.00 21.24 C ATOM 978 C LYS A 497 -6.716 -4.736 5.844 1.00 31.33 C ATOM 979 O LYS A 497 -5.583 -4.247 5.789 1.00 31.24 O ATOM 980 CB LYS A 497 -8.546 -3.037 5.646 1.00 4.44 C ATOM 981 CG LYS A 497 -9.847 -2.431 6.173 1.00 33.41 C ATOM 982 CD LYS A 497 -10.974 -3.456 6.221 1.00 21.33 C ATOM 983 CE LYS A 497 -12.331 -2.796 6.442 1.00 1.03 C ATOM 984 NZ LYS A 497 -12.408 -2.074 7.742 1.00 65.32 N ATOM 0 H LYS A 497 -6.631 -2.567 7.520 1.00 12.32 H new ATOM 0 HA LYS A 497 -8.569 -4.743 6.967 1.00 21.24 H new ATOM 0 HB2 LYS A 497 -7.856 -2.227 5.410 1.00 4.44 H new ATOM 0 HB3 LYS A 497 -8.759 -3.557 4.712 1.00 4.44 H new ATOM 0 HG2 LYS A 497 -9.681 -2.027 7.172 1.00 33.41 H new ATOM 0 HG3 LYS A 497 -10.142 -1.596 5.537 1.00 33.41 H new ATOM 0 HD2 LYS A 497 -10.992 -4.020 5.289 1.00 21.33 H new ATOM 0 HD3 LYS A 497 -10.782 -4.170 7.022 1.00 21.33 H new ATOM 0 HE2 LYS A 497 -12.528 -2.097 5.629 1.00 1.03 H new ATOM 0 HE3 LYS A 497 -13.112 -3.556 6.405 1.00 1.03 H new ATOM 0 HZ1 LYS A 497 -13.202 -2.447 8.300 1.00 65.32 H new ATOM 0 HZ2 LYS A 497 -11.521 -2.210 8.268 1.00 65.32 H new ATOM 0 HZ3 LYS A 497 -12.554 -1.059 7.567 1.00 65.32 H new ATOM 998 N VAL A 498 -7.022 -5.889 5.254 1.00 73.00 N ATOM 999 CA VAL A 498 -6.038 -6.633 4.461 1.00 24.40 C ATOM 1000 C VAL A 498 -6.476 -6.728 2.991 1.00 63.23 C ATOM 1001 O VAL A 498 -7.471 -7.378 2.665 1.00 73.04 O ATOM 1002 CB VAL A 498 -5.816 -8.058 5.027 1.00 41.01 C ATOM 1003 CG1 VAL A 498 -4.768 -8.816 4.209 1.00 32.13 C ATOM 1004 CG2 VAL A 498 -5.416 -7.996 6.502 1.00 40.53 C ATOM 0 H VAL A 498 -7.940 -6.330 5.308 1.00 73.00 H new ATOM 0 HA VAL A 498 -5.098 -6.084 4.519 1.00 24.40 H new ATOM 0 HB VAL A 498 -6.757 -8.603 4.951 1.00 41.01 H new ATOM 0 HG11 VAL A 498 -4.631 -9.813 4.627 1.00 32.13 H new ATOM 0 HG12 VAL A 498 -5.104 -8.899 3.175 1.00 32.13 H new ATOM 0 HG13 VAL A 498 -3.822 -8.276 4.241 1.00 32.13 H new ATOM 0 HG21 VAL A 498 -5.265 -9.007 6.881 1.00 40.53 H new ATOM 0 HG22 VAL A 498 -4.491 -7.428 6.605 1.00 40.53 H new ATOM 0 HG23 VAL A 498 -6.206 -7.509 7.073 1.00 40.53 H new ATOM 1014 N LEU A 499 -5.727 -6.074 2.107 1.00 64.31 N ATOM 1015 CA LEU A 499 -6.051 -6.053 0.671 1.00 73.52 C ATOM 1016 C LEU A 499 -5.021 -6.853 -0.142 1.00 14.44 C ATOM 1017 O LEU A 499 -3.826 -6.806 0.142 1.00 54.10 O ATOM 1018 CB LEU A 499 -6.100 -4.599 0.171 1.00 1.14 C ATOM 1019 CG LEU A 499 -7.015 -3.656 0.980 1.00 61.21 C ATOM 1020 CD1 LEU A 499 -6.924 -2.222 0.457 1.00 45.12 C ATOM 1021 CD2 LEU A 499 -8.464 -4.152 0.961 1.00 71.02 C ATOM 0 H LEU A 499 -4.888 -5.549 2.354 1.00 64.31 H new ATOM 0 HA LEU A 499 -7.027 -6.519 0.533 1.00 73.52 H new ATOM 0 HB2 LEU A 499 -5.088 -4.194 0.181 1.00 1.14 H new ATOM 0 HB3 LEU A 499 -6.433 -4.600 -0.867 1.00 1.14 H new ATOM 0 HG LEU A 499 -6.670 -3.659 2.014 1.00 61.21 H new ATOM 0 HD11 LEU A 499 -7.579 -1.578 1.045 1.00 45.12 H new ATOM 0 HD12 LEU A 499 -5.896 -1.869 0.541 1.00 45.12 H new ATOM 0 HD13 LEU A 499 -7.232 -2.196 -0.588 1.00 45.12 H new ATOM 0 HD21 LEU A 499 -9.089 -3.471 1.538 1.00 71.02 H new ATOM 0 HD22 LEU A 499 -8.822 -4.190 -0.068 1.00 71.02 H new ATOM 0 HD23 LEU A 499 -8.513 -5.149 1.399 1.00 71.02 H new ATOM 1033 N THR A 500 -5.479 -7.581 -1.156 1.00 34.04 N ATOM 1034 CA THR A 500 -4.580 -8.400 -1.990 1.00 32.41 C ATOM 1035 C THR A 500 -4.496 -7.894 -3.431 1.00 74.14 C ATOM 1036 O THR A 500 -5.442 -7.300 -3.955 1.00 32.35 O ATOM 1037 CB THR A 500 -5.022 -9.883 -2.036 1.00 72.51 C ATOM 1038 OG1 THR A 500 -6.426 -9.976 -2.335 1.00 32.23 O ATOM 1039 CG2 THR A 500 -4.719 -10.605 -0.727 1.00 65.34 C ATOM 0 H THR A 500 -6.462 -7.626 -1.426 1.00 34.04 H new ATOM 0 HA THR A 500 -3.602 -8.316 -1.517 1.00 32.41 H new ATOM 0 HB THR A 500 -4.451 -10.371 -2.826 1.00 72.51 H new ATOM 0 HG1 THR A 500 -6.693 -10.919 -2.363 1.00 32.23 H new ATOM 0 HG21 THR A 500 -5.044 -11.643 -0.800 1.00 65.34 H new ATOM 0 HG22 THR A 500 -3.647 -10.574 -0.534 1.00 65.34 H new ATOM 0 HG23 THR A 500 -5.249 -10.115 0.090 1.00 65.34 H new ATOM 1047 N PHE A 501 -3.356 -8.145 -4.073 1.00 32.12 N ATOM 1048 CA PHE A 501 -3.184 -7.829 -5.493 1.00 42.05 C ATOM 1049 C PHE A 501 -2.185 -8.788 -6.162 1.00 51.42 C ATOM 1050 O PHE A 501 -1.243 -9.270 -5.525 1.00 60.45 O ATOM 1051 CB PHE A 501 -2.741 -6.368 -5.680 1.00 4.20 C ATOM 1052 CG PHE A 501 -1.381 -6.029 -5.110 1.00 42.31 C ATOM 1053 CD1 PHE A 501 -1.249 -5.592 -3.801 1.00 63.15 C ATOM 1054 CD2 PHE A 501 -0.237 -6.132 -5.894 1.00 13.53 C ATOM 1055 CE1 PHE A 501 -0.008 -5.264 -3.288 1.00 35.13 C ATOM 1056 CE2 PHE A 501 1.004 -5.809 -5.383 1.00 34.53 C ATOM 1057 CZ PHE A 501 1.119 -5.373 -4.079 1.00 54.51 C ATOM 0 H PHE A 501 -2.537 -8.566 -3.634 1.00 32.12 H new ATOM 0 HA PHE A 501 -4.151 -7.959 -5.980 1.00 42.05 H new ATOM 0 HB2 PHE A 501 -2.738 -6.140 -6.746 1.00 4.20 H new ATOM 0 HB3 PHE A 501 -3.483 -5.718 -5.217 1.00 4.20 H new ATOM 0 HD1 PHE A 501 -2.125 -5.507 -3.175 1.00 63.15 H new ATOM 0 HD2 PHE A 501 -0.321 -6.469 -6.917 1.00 13.53 H new ATOM 0 HE1 PHE A 501 0.080 -4.922 -2.267 1.00 35.13 H new ATOM 0 HE2 PHE A 501 1.884 -5.897 -6.003 1.00 34.53 H new ATOM 0 HZ PHE A 501 2.088 -5.117 -3.678 1.00 54.51 H new ATOM 1067 N SER A 502 -2.399 -9.059 -7.446 1.00 71.31 N ATOM 1068 CA SER A 502 -1.546 -9.984 -8.206 1.00 74.44 C ATOM 1069 C SER A 502 -0.857 -9.267 -9.374 1.00 3.24 C ATOM 1070 O SER A 502 -1.511 -8.634 -10.202 1.00 11.04 O ATOM 1071 CB SER A 502 -2.381 -11.154 -8.743 1.00 51.31 C ATOM 1072 OG SER A 502 -3.377 -10.698 -9.645 1.00 75.53 O ATOM 0 H SER A 502 -3.159 -8.651 -7.990 1.00 71.31 H new ATOM 0 HA SER A 502 -0.779 -10.364 -7.531 1.00 74.44 H new ATOM 0 HB2 SER A 502 -1.730 -11.869 -9.246 1.00 51.31 H new ATOM 0 HB3 SER A 502 -2.851 -11.681 -7.913 1.00 51.31 H new ATOM 0 HG SER A 502 -3.129 -9.814 -9.987 1.00 75.53 H new ATOM 1078 N TRP A 503 0.464 -9.367 -9.438 1.00 24.42 N ATOM 1079 CA TRP A 503 1.250 -8.691 -10.477 1.00 22.30 C ATOM 1080 C TRP A 503 2.151 -9.687 -11.227 1.00 30.45 C ATOM 1081 O TRP A 503 2.765 -10.564 -10.621 1.00 15.25 O ATOM 1082 CB TRP A 503 2.088 -7.575 -9.835 1.00 41.33 C ATOM 1083 CG TRP A 503 3.014 -6.870 -10.786 1.00 15.34 C ATOM 1084 CD1 TRP A 503 2.686 -6.288 -11.977 1.00 73.42 C ATOM 1085 CD2 TRP A 503 4.420 -6.662 -10.613 1.00 12.42 C ATOM 1086 NE1 TRP A 503 3.805 -5.742 -12.558 1.00 62.11 N ATOM 1087 CE2 TRP A 503 4.882 -5.957 -11.739 1.00 71.01 C ATOM 1088 CE3 TRP A 503 5.334 -7.009 -9.613 1.00 4.23 C ATOM 1089 CZ2 TRP A 503 6.216 -5.588 -11.892 1.00 1.23 C ATOM 1090 CZ3 TRP A 503 6.658 -6.642 -9.765 1.00 74.04 C ATOM 1091 CH2 TRP A 503 7.089 -5.940 -10.898 1.00 3.01 C ATOM 0 H TRP A 503 1.022 -9.912 -8.781 1.00 24.42 H new ATOM 0 HA TRP A 503 0.569 -8.254 -11.207 1.00 22.30 H new ATOM 0 HB2 TRP A 503 1.415 -6.841 -9.391 1.00 41.33 H new ATOM 0 HB3 TRP A 503 2.676 -8.001 -9.022 1.00 41.33 H new ATOM 0 HD1 TRP A 503 1.693 -6.261 -12.400 1.00 73.42 H new ATOM 0 HE1 TRP A 503 3.830 -5.255 -13.454 1.00 62.11 H new ATOM 0 HE3 TRP A 503 5.011 -7.554 -8.738 1.00 4.23 H new ATOM 0 HZ2 TRP A 503 6.550 -5.044 -12.763 1.00 1.23 H new ATOM 0 HZ3 TRP A 503 7.372 -6.901 -8.997 1.00 74.04 H new ATOM 0 HH2 TRP A 503 8.131 -5.671 -10.989 1.00 3.01 H new ATOM 1102 N THR A 504 2.206 -9.562 -12.553 1.00 64.33 N ATOM 1103 CA THR A 504 3.048 -10.436 -13.386 1.00 24.05 C ATOM 1104 C THR A 504 4.065 -9.613 -14.197 1.00 11.32 C ATOM 1105 O THR A 504 3.721 -9.022 -15.224 1.00 2.23 O ATOM 1106 CB THR A 504 2.188 -11.293 -14.357 1.00 24.33 C ATOM 1107 OG1 THR A 504 1.266 -12.112 -13.613 1.00 20.12 O ATOM 1108 CG2 THR A 504 3.058 -12.188 -15.238 1.00 4.23 C ATOM 0 H THR A 504 1.679 -8.865 -13.079 1.00 64.33 H new ATOM 0 HA THR A 504 3.584 -11.102 -12.710 1.00 24.05 H new ATOM 0 HB THR A 504 1.638 -10.606 -15.000 1.00 24.33 H new ATOM 0 HG1 THR A 504 0.728 -12.646 -14.234 1.00 20.12 H new ATOM 0 HG21 THR A 504 2.422 -12.772 -15.903 1.00 4.23 H new ATOM 0 HG22 THR A 504 3.733 -11.570 -15.831 1.00 4.23 H new ATOM 0 HG23 THR A 504 3.641 -12.861 -14.609 1.00 4.23 H new ATOM 1116 N PRO A 505 5.332 -9.555 -13.743 1.00 15.23 N ATOM 1117 CA PRO A 505 6.384 -8.782 -14.423 1.00 62.03 C ATOM 1118 C PRO A 505 6.939 -9.487 -15.673 1.00 54.20 C ATOM 1119 O PRO A 505 7.685 -10.462 -15.576 1.00 0.10 O ATOM 1120 CB PRO A 505 7.468 -8.661 -13.346 1.00 51.33 C ATOM 1121 CG PRO A 505 7.314 -9.895 -12.521 1.00 44.35 C ATOM 1122 CD PRO A 505 5.841 -10.227 -12.528 1.00 61.10 C ATOM 0 HA PRO A 505 6.011 -7.828 -14.795 1.00 62.03 H new ATOM 0 HB2 PRO A 505 8.462 -8.601 -13.789 1.00 51.33 H new ATOM 0 HB3 PRO A 505 7.332 -7.762 -12.745 1.00 51.33 H new ATOM 0 HG2 PRO A 505 7.900 -10.716 -12.935 1.00 44.35 H new ATOM 0 HG3 PRO A 505 7.671 -9.730 -11.504 1.00 44.35 H new ATOM 0 HD2 PRO A 505 5.674 -11.303 -12.567 1.00 61.10 H new ATOM 0 HD3 PRO A 505 5.344 -9.860 -11.630 1.00 61.10 H new ATOM 1130 N THR A 506 6.571 -8.992 -16.853 1.00 0.54 N ATOM 1131 CA THR A 506 7.048 -9.564 -18.124 1.00 44.14 C ATOM 1132 C THR A 506 8.384 -8.947 -18.569 1.00 65.54 C ATOM 1133 O THR A 506 8.828 -9.153 -19.699 1.00 2.20 O ATOM 1134 CB THR A 506 6.005 -9.380 -19.253 1.00 72.25 C ATOM 1135 OG1 THR A 506 5.779 -7.984 -19.503 1.00 24.12 O ATOM 1136 CG2 THR A 506 4.683 -10.053 -18.890 1.00 45.11 C ATOM 0 H THR A 506 5.944 -8.195 -16.962 1.00 0.54 H new ATOM 0 HA THR A 506 7.199 -10.628 -17.941 1.00 44.14 H new ATOM 0 HB THR A 506 6.402 -9.849 -20.154 1.00 72.25 H new ATOM 0 HG1 THR A 506 5.119 -7.883 -20.220 1.00 24.12 H new ATOM 0 HG21 THR A 506 3.967 -9.909 -19.699 1.00 45.11 H new ATOM 0 HG22 THR A 506 4.848 -11.119 -18.736 1.00 45.11 H new ATOM 0 HG23 THR A 506 4.289 -9.611 -17.975 1.00 45.11 H new ATOM 1144 N GLN A 507 9.030 -8.207 -17.665 1.00 33.54 N ATOM 1145 CA GLN A 507 10.333 -7.581 -17.935 1.00 31.33 C ATOM 1146 C GLN A 507 11.231 -7.618 -16.686 1.00 4.02 C ATOM 1147 O GLN A 507 10.794 -7.273 -15.588 1.00 14.31 O ATOM 1148 CB GLN A 507 10.144 -6.127 -18.398 1.00 51.01 C ATOM 1149 CG GLN A 507 11.453 -5.384 -18.667 1.00 61.31 C ATOM 1150 CD GLN A 507 12.267 -5.997 -19.797 1.00 32.34 C ATOM 1151 OE1 GLN A 507 11.723 -6.548 -20.749 1.00 12.51 O ATOM 1152 NE2 GLN A 507 13.577 -5.926 -19.691 1.00 13.35 N ATOM 0 H GLN A 507 8.670 -8.023 -16.729 1.00 33.54 H new ATOM 0 HA GLN A 507 10.819 -8.148 -18.729 1.00 31.33 H new ATOM 0 HB2 GLN A 507 9.542 -6.121 -19.307 1.00 51.01 H new ATOM 0 HB3 GLN A 507 9.580 -5.585 -17.639 1.00 51.01 H new ATOM 0 HG2 GLN A 507 11.231 -4.345 -18.910 1.00 61.31 H new ATOM 0 HG3 GLN A 507 12.053 -5.377 -17.757 1.00 61.31 H new ATOM 0 HE21 GLN A 507 13.999 -5.461 -18.887 1.00 13.35 H new ATOM 0 HE22 GLN A 507 14.170 -6.336 -20.413 1.00 13.35 H new ATOM 1161 N GLU A 508 12.484 -8.031 -16.867 1.00 24.15 N ATOM 1162 CA GLU A 508 13.440 -8.145 -15.757 1.00 60.30 C ATOM 1163 C GLU A 508 13.938 -6.772 -15.265 1.00 51.42 C ATOM 1164 O GLU A 508 13.989 -5.802 -16.025 1.00 12.13 O ATOM 1165 CB GLU A 508 14.622 -9.052 -16.166 1.00 4.51 C ATOM 1166 CG GLU A 508 15.316 -8.676 -17.482 1.00 13.55 C ATOM 1167 CD GLU A 508 16.183 -7.429 -17.384 1.00 21.50 C ATOM 1168 OE1 GLU A 508 17.084 -7.393 -16.517 1.00 73.22 O ATOM 1169 OE2 GLU A 508 15.978 -6.486 -18.178 1.00 32.50 O ATOM 0 H GLU A 508 12.866 -8.294 -17.775 1.00 24.15 H new ATOM 0 HA GLU A 508 12.916 -8.602 -14.918 1.00 60.30 H new ATOM 0 HB2 GLU A 508 15.363 -9.037 -15.367 1.00 4.51 H new ATOM 0 HB3 GLU A 508 14.260 -10.077 -16.246 1.00 4.51 H new ATOM 0 HG2 GLU A 508 15.934 -9.512 -17.808 1.00 13.55 H new ATOM 0 HG3 GLU A 508 14.558 -8.521 -18.250 1.00 13.55 H new ATOM 1176 N GLY A 509 14.282 -6.693 -13.982 1.00 35.40 N ATOM 1177 CA GLY A 509 14.796 -5.447 -13.419 1.00 13.02 C ATOM 1178 C GLY A 509 14.381 -5.221 -11.971 1.00 21.53 C ATOM 1179 O GLY A 509 13.787 -6.096 -11.342 1.00 13.34 O ATOM 0 H GLY A 509 14.216 -7.466 -13.320 1.00 35.40 H new ATOM 0 HA2 GLY A 509 15.884 -5.451 -13.481 1.00 13.02 H new ATOM 0 HA3 GLY A 509 14.445 -4.611 -14.024 1.00 13.02 H new ATOM 1183 N MET A 510 14.699 -4.044 -11.440 1.00 2.21 N ATOM 1184 CA MET A 510 14.339 -3.691 -10.062 1.00 72.12 C ATOM 1185 C MET A 510 13.078 -2.813 -10.029 1.00 24.33 C ATOM 1186 O MET A 510 13.089 -1.666 -10.484 1.00 52.41 O ATOM 1187 CB MET A 510 15.504 -2.970 -9.370 1.00 3.20 C ATOM 1188 CG MET A 510 16.755 -3.828 -9.222 1.00 23.32 C ATOM 1189 SD MET A 510 16.459 -5.336 -8.272 1.00 64.42 S ATOM 1190 CE MET A 510 15.966 -4.658 -6.687 1.00 64.45 C ATOM 0 H MET A 510 15.206 -3.314 -11.941 1.00 2.21 H new ATOM 0 HA MET A 510 14.127 -4.615 -9.523 1.00 72.12 H new ATOM 0 HB2 MET A 510 15.754 -2.074 -9.938 1.00 3.20 H new ATOM 0 HB3 MET A 510 15.181 -2.641 -8.382 1.00 3.20 H new ATOM 0 HG2 MET A 510 17.127 -4.094 -10.211 1.00 23.32 H new ATOM 0 HG3 MET A 510 17.535 -3.244 -8.734 1.00 23.32 H new ATOM 0 HE1 MET A 510 16.042 -5.430 -5.921 1.00 64.45 H new ATOM 0 HE2 MET A 510 16.620 -3.825 -6.429 1.00 64.45 H new ATOM 0 HE3 MET A 510 14.936 -4.306 -6.746 1.00 64.45 H new ATOM 1200 N TYR A 511 11.990 -3.361 -9.491 1.00 63.04 N ATOM 1201 CA TYR A 511 10.708 -2.653 -9.432 1.00 74.21 C ATOM 1202 C TYR A 511 10.290 -2.370 -7.983 1.00 22.22 C ATOM 1203 O TYR A 511 10.100 -3.285 -7.185 1.00 62.41 O ATOM 1204 CB TYR A 511 9.627 -3.460 -10.160 1.00 31.44 C ATOM 1205 CG TYR A 511 9.861 -3.558 -11.659 1.00 73.42 C ATOM 1206 CD1 TYR A 511 10.706 -4.526 -12.194 1.00 12.11 C ATOM 1207 CD2 TYR A 511 9.246 -2.671 -12.537 1.00 34.15 C ATOM 1208 CE1 TYR A 511 10.926 -4.609 -13.556 1.00 13.34 C ATOM 1209 CE2 TYR A 511 9.463 -2.747 -13.899 1.00 73.00 C ATOM 1210 CZ TYR A 511 10.302 -3.716 -14.404 1.00 75.33 C ATOM 1211 OH TYR A 511 10.521 -3.791 -15.763 1.00 54.52 O ATOM 0 H TYR A 511 11.969 -4.297 -9.087 1.00 63.04 H new ATOM 0 HA TYR A 511 10.828 -1.692 -9.932 1.00 74.21 H new ATOM 0 HB2 TYR A 511 9.587 -4.464 -9.739 1.00 31.44 H new ATOM 0 HB3 TYR A 511 8.656 -3.000 -9.980 1.00 31.44 H new ATOM 0 HD1 TYR A 511 11.198 -5.224 -11.533 1.00 12.11 H new ATOM 0 HD2 TYR A 511 8.587 -1.909 -12.147 1.00 34.15 H new ATOM 0 HE1 TYR A 511 11.582 -5.368 -13.955 1.00 13.34 H new ATOM 0 HE2 TYR A 511 8.977 -2.050 -14.565 1.00 73.00 H new ATOM 0 HH TYR A 511 10.006 -3.091 -16.216 1.00 54.52 H new ATOM 1221 N ARG A 512 10.148 -1.091 -7.655 1.00 11.02 N ATOM 1222 CA ARG A 512 9.797 -0.673 -6.298 1.00 40.53 C ATOM 1223 C ARG A 512 8.290 -0.397 -6.175 1.00 42.44 C ATOM 1224 O ARG A 512 7.751 0.492 -6.840 1.00 71.51 O ATOM 1225 CB ARG A 512 10.593 0.582 -5.914 1.00 60.50 C ATOM 1226 CG ARG A 512 10.588 0.879 -4.417 1.00 15.23 C ATOM 1227 CD ARG A 512 11.166 2.257 -4.112 1.00 52.30 C ATOM 1228 NE ARG A 512 10.288 3.324 -4.587 1.00 53.33 N ATOM 1229 CZ ARG A 512 10.672 4.546 -4.827 1.00 73.23 C ATOM 1230 NH1 ARG A 512 11.916 4.888 -4.707 1.00 43.43 N ATOM 1231 NH2 ARG A 512 9.806 5.430 -5.202 1.00 20.23 N ATOM 0 H ARG A 512 10.271 -0.320 -8.312 1.00 11.02 H new ATOM 0 HA ARG A 512 10.050 -1.485 -5.616 1.00 40.53 H new ATOM 0 HB2 ARG A 512 11.624 0.464 -6.248 1.00 60.50 H new ATOM 0 HB3 ARG A 512 10.181 1.439 -6.447 1.00 60.50 H new ATOM 0 HG2 ARG A 512 9.568 0.821 -4.038 1.00 15.23 H new ATOM 0 HG3 ARG A 512 11.166 0.118 -3.893 1.00 15.23 H new ATOM 0 HD2 ARG A 512 11.316 2.360 -3.037 1.00 52.30 H new ATOM 0 HD3 ARG A 512 12.145 2.354 -4.582 1.00 52.30 H new ATOM 0 HE ARG A 512 9.306 3.096 -4.742 1.00 53.33 H new ATOM 0 HH11 ARG A 512 12.610 4.197 -4.421 1.00 43.43 H new ATOM 0 HH12 ARG A 512 12.202 5.848 -4.898 1.00 43.43 H new ATOM 0 HH21 ARG A 512 8.826 5.170 -5.309 1.00 20.23 H new ATOM 0 HH22 ARG A 512 10.103 6.387 -5.391 1.00 20.23 H new ATOM 1245 N ILE A 513 7.625 -1.167 -5.322 1.00 32.13 N ATOM 1246 CA ILE A 513 6.190 -1.008 -5.067 1.00 73.32 C ATOM 1247 C ILE A 513 5.941 -0.129 -3.829 1.00 71.41 C ATOM 1248 O ILE A 513 6.381 -0.451 -2.723 1.00 13.34 O ATOM 1249 CB ILE A 513 5.513 -2.390 -4.859 1.00 4.34 C ATOM 1250 CG1 ILE A 513 5.746 -3.290 -6.088 1.00 34.43 C ATOM 1251 CG2 ILE A 513 4.016 -2.224 -4.578 1.00 61.14 C ATOM 1252 CD1 ILE A 513 5.164 -4.684 -5.952 1.00 54.25 C ATOM 0 H ILE A 513 8.060 -1.919 -4.787 1.00 32.13 H new ATOM 0 HA ILE A 513 5.755 -0.521 -5.940 1.00 73.32 H new ATOM 0 HB ILE A 513 5.965 -2.870 -3.991 1.00 4.34 H new ATOM 0 HG12 ILE A 513 5.311 -2.810 -6.965 1.00 34.43 H new ATOM 0 HG13 ILE A 513 6.818 -3.371 -6.268 1.00 34.43 H new ATOM 0 HG21 ILE A 513 3.562 -3.204 -4.435 1.00 61.14 H new ATOM 0 HG22 ILE A 513 3.879 -1.626 -3.677 1.00 61.14 H new ATOM 0 HG23 ILE A 513 3.541 -1.723 -5.421 1.00 61.14 H new ATOM 0 HD11 ILE A 513 5.370 -5.254 -6.858 1.00 54.25 H new ATOM 0 HD12 ILE A 513 5.617 -5.185 -5.096 1.00 54.25 H new ATOM 0 HD13 ILE A 513 4.086 -4.615 -5.804 1.00 54.25 H new ATOM 1264 N ASN A 514 5.245 0.986 -4.023 1.00 33.00 N ATOM 1265 CA ASN A 514 4.908 1.897 -2.923 1.00 43.11 C ATOM 1266 C ASN A 514 3.391 1.964 -2.698 1.00 14.31 C ATOM 1267 O ASN A 514 2.612 2.034 -3.650 1.00 42.24 O ATOM 1268 CB ASN A 514 5.445 3.305 -3.205 1.00 52.33 C ATOM 1269 CG ASN A 514 6.960 3.352 -3.239 1.00 63.42 C ATOM 1270 OD1 ASN A 514 7.578 3.180 -4.283 1.00 13.23 O ATOM 1271 ND2 ASN A 514 7.570 3.593 -2.096 1.00 72.52 N ATOM 0 H ASN A 514 4.900 1.286 -4.935 1.00 33.00 H new ATOM 0 HA ASN A 514 5.376 1.505 -2.020 1.00 43.11 H new ATOM 0 HB2 ASN A 514 5.052 3.656 -4.159 1.00 52.33 H new ATOM 0 HB3 ASN A 514 5.080 3.990 -2.439 1.00 52.33 H new ATOM 0 HD21 ASN A 514 8.588 3.641 -2.062 1.00 72.52 H new ATOM 0 HD22 ASN A 514 7.024 3.731 -1.246 1.00 72.52 H new ATOM 1278 N ALA A 515 2.982 1.946 -1.434 1.00 20.13 N ATOM 1279 CA ALA A 515 1.568 2.094 -1.073 1.00 70.53 C ATOM 1280 C ALA A 515 1.329 3.424 -0.348 1.00 13.32 C ATOM 1281 O ALA A 515 2.070 3.785 0.567 1.00 31.23 O ATOM 1282 CB ALA A 515 1.111 0.926 -0.202 1.00 54.03 C ATOM 0 H ALA A 515 3.608 1.830 -0.637 1.00 20.13 H new ATOM 0 HA ALA A 515 0.981 2.092 -1.992 1.00 70.53 H new ATOM 0 HB1 ALA A 515 0.060 1.054 0.055 1.00 54.03 H new ATOM 0 HB2 ALA A 515 1.240 -0.008 -0.749 1.00 54.03 H new ATOM 0 HB3 ALA A 515 1.707 0.897 0.710 1.00 54.03 H new ATOM 1288 N THR A 516 0.295 4.146 -0.764 1.00 52.12 N ATOM 1289 CA THR A 516 -0.047 5.442 -0.166 1.00 41.31 C ATOM 1290 C THR A 516 -1.504 5.471 0.298 1.00 73.34 C ATOM 1291 O THR A 516 -2.390 4.931 -0.366 1.00 20.34 O ATOM 1292 CB THR A 516 0.172 6.604 -1.167 1.00 42.44 C ATOM 1293 OG1 THR A 516 -0.559 6.356 -2.377 1.00 54.24 O ATOM 1294 CG2 THR A 516 1.653 6.785 -1.494 1.00 24.10 C ATOM 0 H THR A 516 -0.328 3.858 -1.518 1.00 52.12 H new ATOM 0 HA THR A 516 0.614 5.572 0.691 1.00 41.31 H new ATOM 0 HB THR A 516 -0.191 7.519 -0.699 1.00 42.44 H new ATOM 0 HG1 THR A 516 -1.520 6.440 -2.202 1.00 54.24 H new ATOM 0 HG21 THR A 516 1.772 7.608 -2.199 1.00 24.10 H new ATOM 0 HG22 THR A 516 2.203 7.008 -0.580 1.00 24.10 H new ATOM 0 HG23 THR A 516 2.042 5.869 -1.937 1.00 24.10 H new ATOM 1302 N VAL A 517 -1.752 6.099 1.445 1.00 44.22 N ATOM 1303 CA VAL A 517 -3.120 6.254 1.954 1.00 73.22 C ATOM 1304 C VAL A 517 -3.538 7.734 2.001 1.00 20.13 C ATOM 1305 O VAL A 517 -2.732 8.610 2.316 1.00 44.14 O ATOM 1306 CB VAL A 517 -3.284 5.607 3.354 1.00 24.53 C ATOM 1307 CG1 VAL A 517 -2.334 6.234 4.368 1.00 74.52 C ATOM 1308 CG2 VAL A 517 -4.732 5.693 3.835 1.00 61.43 C ATOM 0 H VAL A 517 -1.031 6.508 2.039 1.00 44.22 H new ATOM 0 HA VAL A 517 -3.778 5.733 1.258 1.00 73.22 H new ATOM 0 HB VAL A 517 -3.024 4.553 3.262 1.00 24.53 H new ATOM 0 HG11 VAL A 517 -2.473 5.759 5.339 1.00 74.52 H new ATOM 0 HG12 VAL A 517 -1.305 6.092 4.039 1.00 74.52 H new ATOM 0 HG13 VAL A 517 -2.544 7.300 4.452 1.00 74.52 H new ATOM 0 HG21 VAL A 517 -4.817 5.231 4.819 1.00 61.43 H new ATOM 0 HG22 VAL A 517 -5.033 6.739 3.898 1.00 61.43 H new ATOM 0 HG23 VAL A 517 -5.381 5.170 3.132 1.00 61.43 H new ATOM 1318 N ASP A 518 -4.805 7.988 1.668 1.00 24.23 N ATOM 1319 CA ASP A 518 -5.362 9.344 1.597 1.00 35.44 C ATOM 1320 C ASP A 518 -4.473 10.289 0.761 1.00 10.42 C ATOM 1321 O ASP A 518 -3.983 11.311 1.244 1.00 51.13 O ATOM 1322 CB ASP A 518 -5.612 9.915 3.006 1.00 51.42 C ATOM 1323 CG ASP A 518 -6.466 11.176 2.978 1.00 62.44 C ATOM 1324 OD1 ASP A 518 -7.358 11.280 2.106 1.00 5.31 O ATOM 1325 OD2 ASP A 518 -6.256 12.070 3.821 1.00 14.23 O ATOM 0 H ASP A 518 -5.478 7.257 1.439 1.00 24.23 H new ATOM 0 HA ASP A 518 -6.323 9.273 1.087 1.00 35.44 H new ATOM 0 HB2 ASP A 518 -6.104 9.160 3.619 1.00 51.42 H new ATOM 0 HB3 ASP A 518 -4.656 10.137 3.480 1.00 51.42 H new ATOM 1330 N GLU A 519 -4.257 9.922 -0.501 1.00 73.13 N ATOM 1331 CA GLU A 519 -3.534 10.776 -1.455 1.00 71.23 C ATOM 1332 C GLU A 519 -4.231 12.133 -1.629 1.00 12.44 C ATOM 1333 O GLU A 519 -3.588 13.157 -1.857 1.00 4.24 O ATOM 1334 CB GLU A 519 -3.420 10.064 -2.809 1.00 43.12 C ATOM 1335 CG GLU A 519 -2.418 8.918 -2.823 1.00 51.01 C ATOM 1336 CD GLU A 519 -0.975 9.397 -2.886 1.00 41.05 C ATOM 1337 OE1 GLU A 519 -0.486 9.981 -1.896 1.00 53.23 O ATOM 1338 OE2 GLU A 519 -0.327 9.196 -3.938 1.00 75.51 O ATOM 0 H GLU A 519 -4.573 9.035 -0.893 1.00 73.13 H new ATOM 0 HA GLU A 519 -2.536 10.961 -1.057 1.00 71.23 H new ATOM 0 HB2 GLU A 519 -4.401 9.679 -3.089 1.00 43.12 H new ATOM 0 HB3 GLU A 519 -3.134 10.792 -3.568 1.00 43.12 H new ATOM 0 HG2 GLU A 519 -2.556 8.310 -1.929 1.00 51.01 H new ATOM 0 HG3 GLU A 519 -2.620 8.275 -3.680 1.00 51.01 H new ATOM 1345 N GLU A 520 -5.554 12.120 -1.522 1.00 71.41 N ATOM 1346 CA GLU A 520 -6.365 13.337 -1.633 1.00 32.21 C ATOM 1347 C GLU A 520 -6.141 14.281 -0.437 1.00 2.54 C ATOM 1348 O GLU A 520 -6.468 15.469 -0.506 1.00 41.22 O ATOM 1349 CB GLU A 520 -7.850 12.954 -1.715 1.00 31.11 C ATOM 1350 CG GLU A 520 -8.167 11.905 -2.778 1.00 34.11 C ATOM 1351 CD GLU A 520 -7.921 12.398 -4.197 1.00 64.33 C ATOM 1352 OE1 GLU A 520 -8.849 12.982 -4.794 1.00 61.34 O ATOM 1353 OE2 GLU A 520 -6.805 12.194 -4.723 1.00 3.22 O ATOM 0 H GLU A 520 -6.097 11.273 -1.357 1.00 71.41 H new ATOM 0 HA GLU A 520 -6.061 13.865 -2.537 1.00 32.21 H new ATOM 0 HB2 GLU A 520 -8.171 12.579 -0.743 1.00 31.11 H new ATOM 0 HB3 GLU A 520 -8.434 13.851 -1.920 1.00 31.11 H new ATOM 0 HG2 GLU A 520 -7.559 11.019 -2.597 1.00 34.11 H new ATOM 0 HG3 GLU A 520 -9.209 11.602 -2.681 1.00 34.11 H new ATOM 1360 N ASN A 521 -5.587 13.735 0.650 1.00 23.40 N ATOM 1361 CA ASN A 521 -5.403 14.463 1.911 1.00 54.51 C ATOM 1362 C ASN A 521 -6.722 15.109 2.366 1.00 13.24 C ATOM 1363 O ASN A 521 -6.899 16.329 2.313 1.00 22.31 O ATOM 1364 CB ASN A 521 -4.281 15.505 1.801 1.00 0.00 C ATOM 1365 CG ASN A 521 -3.890 16.078 3.157 1.00 12.52 C ATOM 1366 OD1 ASN A 521 -4.432 17.086 3.601 1.00 23.40 O ATOM 1367 ND2 ASN A 521 -2.957 15.433 3.832 1.00 21.44 N ATOM 0 H ASN A 521 -5.252 12.772 0.681 1.00 23.40 H new ATOM 0 HA ASN A 521 -5.101 13.742 2.671 1.00 54.51 H new ATOM 0 HB2 ASN A 521 -3.407 15.047 1.337 1.00 0.00 H new ATOM 0 HB3 ASN A 521 -4.603 16.315 1.146 1.00 0.00 H new ATOM 0 HD21 ASN A 521 -2.667 15.769 4.750 1.00 21.44 H new ATOM 0 HD22 ASN A 521 -2.526 14.598 3.435 1.00 21.44 H new ATOM 1374 N THR A 522 -7.655 14.266 2.784 1.00 4.50 N ATOM 1375 CA THR A 522 -8.988 14.709 3.205 1.00 5.01 C ATOM 1376 C THR A 522 -9.079 14.863 4.725 1.00 44.14 C ATOM 1377 O THR A 522 -10.054 15.412 5.248 1.00 40.45 O ATOM 1378 CB THR A 522 -10.073 13.709 2.744 1.00 64.43 C ATOM 1379 OG1 THR A 522 -9.817 12.412 3.306 1.00 73.33 O ATOM 1380 CG2 THR A 522 -10.118 13.606 1.221 1.00 23.45 C ATOM 0 H THR A 522 -7.516 13.257 2.843 1.00 4.50 H new ATOM 0 HA THR A 522 -9.157 15.680 2.738 1.00 5.01 H new ATOM 0 HB THR A 522 -11.038 14.076 3.093 1.00 64.43 H new ATOM 0 HG1 THR A 522 -9.041 12.010 2.862 1.00 73.33 H new ATOM 0 HG21 THR A 522 -10.890 12.895 0.927 1.00 23.45 H new ATOM 0 HG22 THR A 522 -10.344 14.584 0.797 1.00 23.45 H new ATOM 0 HG23 THR A 522 -9.151 13.265 0.851 1.00 23.45 H new ATOM 1388 N VAL A 523 -8.065 14.376 5.432 1.00 52.02 N ATOM 1389 CA VAL A 523 -8.050 14.430 6.896 1.00 54.45 C ATOM 1390 C VAL A 523 -6.637 14.733 7.443 1.00 74.42 C ATOM 1391 O VAL A 523 -5.632 14.316 6.870 1.00 73.23 O ATOM 1392 CB VAL A 523 -8.595 13.113 7.506 1.00 72.34 C ATOM 1393 CG1 VAL A 523 -7.667 11.933 7.207 1.00 31.52 C ATOM 1394 CG2 VAL A 523 -8.834 13.271 9.005 1.00 41.51 C ATOM 0 H VAL A 523 -7.241 13.939 5.019 1.00 52.02 H new ATOM 0 HA VAL A 523 -8.705 15.248 7.195 1.00 54.45 H new ATOM 0 HB VAL A 523 -9.554 12.895 7.035 1.00 72.34 H new ATOM 0 HG11 VAL A 523 -8.078 11.025 7.649 1.00 31.52 H new ATOM 0 HG12 VAL A 523 -7.579 11.804 6.128 1.00 31.52 H new ATOM 0 HG13 VAL A 523 -6.682 12.128 7.631 1.00 31.52 H new ATOM 0 HG21 VAL A 523 -9.216 12.335 9.413 1.00 41.51 H new ATOM 0 HG22 VAL A 523 -7.896 13.526 9.498 1.00 41.51 H new ATOM 0 HG23 VAL A 523 -9.561 14.065 9.176 1.00 41.51 H new ATOM 1404 N VAL A 524 -6.570 15.498 8.535 1.00 1.41 N ATOM 1405 CA VAL A 524 -5.287 15.893 9.130 1.00 2.33 C ATOM 1406 C VAL A 524 -4.727 14.792 10.046 1.00 24.21 C ATOM 1407 O VAL A 524 -5.314 14.468 11.080 1.00 31.00 O ATOM 1408 CB VAL A 524 -5.430 17.209 9.936 1.00 74.31 C ATOM 1409 CG1 VAL A 524 -4.089 17.635 10.537 1.00 62.35 C ATOM 1410 CG2 VAL A 524 -6.011 18.315 9.054 1.00 31.32 C ATOM 0 H VAL A 524 -7.388 15.857 9.027 1.00 1.41 H new ATOM 0 HA VAL A 524 -4.590 16.050 8.307 1.00 2.33 H new ATOM 0 HB VAL A 524 -6.120 17.030 10.761 1.00 74.31 H new ATOM 0 HG11 VAL A 524 -4.219 18.561 11.097 1.00 62.35 H new ATOM 0 HG12 VAL A 524 -3.726 16.855 11.206 1.00 62.35 H new ATOM 0 HG13 VAL A 524 -3.366 17.793 9.737 1.00 62.35 H new ATOM 0 HG21 VAL A 524 -6.105 19.232 9.635 1.00 31.32 H new ATOM 0 HG22 VAL A 524 -5.349 18.489 8.206 1.00 31.32 H new ATOM 0 HG23 VAL A 524 -6.994 18.013 8.692 1.00 31.32 H new ATOM 1420 N GLU A 525 -3.573 14.248 9.663 1.00 73.22 N ATOM 1421 CA GLU A 525 -2.968 13.101 10.355 1.00 53.34 C ATOM 1422 C GLU A 525 -1.988 13.532 11.458 1.00 52.14 C ATOM 1423 O GLU A 525 -1.425 14.631 11.423 1.00 43.13 O ATOM 1424 CB GLU A 525 -2.221 12.235 9.331 1.00 2.14 C ATOM 1425 CG GLU A 525 -3.091 11.759 8.172 1.00 63.42 C ATOM 1426 CD GLU A 525 -4.065 10.670 8.582 1.00 44.00 C ATOM 1427 OE1 GLU A 525 -5.118 10.992 9.173 1.00 23.22 O ATOM 1428 OE2 GLU A 525 -3.762 9.488 8.330 1.00 71.23 O ATOM 0 H GLU A 525 -3.030 14.585 8.868 1.00 73.22 H new ATOM 0 HA GLU A 525 -3.773 12.540 10.830 1.00 53.34 H new ATOM 0 HB2 GLU A 525 -1.381 12.804 8.932 1.00 2.14 H new ATOM 0 HB3 GLU A 525 -1.804 11.366 9.840 1.00 2.14 H new ATOM 0 HG2 GLU A 525 -3.647 12.605 7.768 1.00 63.42 H new ATOM 0 HG3 GLU A 525 -2.452 11.387 7.372 1.00 63.42 H new ATOM 1435 N LEU A 526 -1.780 12.641 12.430 1.00 45.23 N ATOM 1436 CA LEU A 526 -0.813 12.870 13.513 1.00 3.05 C ATOM 1437 C LEU A 526 0.634 12.767 13.002 1.00 64.35 C ATOM 1438 O LEU A 526 1.510 13.532 13.418 1.00 13.55 O ATOM 1439 CB LEU A 526 -1.035 11.856 14.647 1.00 64.14 C ATOM 1440 CG LEU A 526 -2.388 11.961 15.369 1.00 3.41 C ATOM 1441 CD1 LEU A 526 -2.552 10.830 16.383 1.00 65.22 C ATOM 1442 CD2 LEU A 526 -2.532 13.321 16.054 1.00 22.23 C ATOM 0 H LEU A 526 -2.270 11.749 12.492 1.00 45.23 H new ATOM 0 HA LEU A 526 -0.971 13.880 13.892 1.00 3.05 H new ATOM 0 HB2 LEU A 526 -0.938 10.851 14.237 1.00 64.14 H new ATOM 0 HB3 LEU A 526 -0.240 11.978 15.382 1.00 64.14 H new ATOM 0 HG LEU A 526 -3.177 11.867 14.623 1.00 3.41 H new ATOM 0 HD11 LEU A 526 -3.517 10.925 16.881 1.00 65.22 H new ATOM 0 HD12 LEU A 526 -2.502 9.870 15.869 1.00 65.22 H new ATOM 0 HD13 LEU A 526 -1.754 10.887 17.123 1.00 65.22 H new ATOM 0 HD21 LEU A 526 -3.497 13.374 16.559 1.00 22.23 H new ATOM 0 HD22 LEU A 526 -1.733 13.447 16.784 1.00 22.23 H new ATOM 0 HD23 LEU A 526 -2.469 14.113 15.308 1.00 22.23 H new ATOM 1454 N ASN A 527 0.881 11.815 12.102 1.00 42.34 N ATOM 1455 CA ASN A 527 2.214 11.621 11.521 1.00 33.31 C ATOM 1456 C ASN A 527 2.173 11.801 9.993 1.00 61.30 C ATOM 1457 O ASN A 527 1.456 11.091 9.295 1.00 32.14 O ATOM 1458 CB ASN A 527 2.740 10.226 11.878 1.00 25.13 C ATOM 1459 CG ASN A 527 4.212 10.040 11.548 1.00 72.34 C ATOM 1460 OD1 ASN A 527 4.761 10.692 10.666 1.00 51.14 O ATOM 1461 ND2 ASN A 527 4.856 9.126 12.244 1.00 11.44 N ATOM 0 H ASN A 527 0.175 11.164 11.758 1.00 42.34 H new ATOM 0 HA ASN A 527 2.887 12.372 11.935 1.00 33.31 H new ATOM 0 HB2 ASN A 527 2.587 10.048 12.943 1.00 25.13 H new ATOM 0 HB3 ASN A 527 2.157 9.477 11.343 1.00 25.13 H new ATOM 0 HD21 ASN A 527 5.842 8.943 12.056 1.00 11.44 H new ATOM 0 HD22 ASN A 527 4.369 8.602 12.971 1.00 11.44 H new ATOM 1468 N GLU A 528 2.968 12.737 9.479 1.00 53.43 N ATOM 1469 CA GLU A 528 2.957 13.066 8.046 1.00 20.41 C ATOM 1470 C GLU A 528 3.833 12.096 7.225 1.00 41.40 C ATOM 1471 O GLU A 528 3.694 11.993 6.007 1.00 30.11 O ATOM 1472 CB GLU A 528 3.437 14.515 7.857 1.00 12.53 C ATOM 1473 CG GLU A 528 3.406 15.018 6.415 1.00 15.34 C ATOM 1474 CD GLU A 528 2.009 15.018 5.809 1.00 70.12 C ATOM 1475 OE1 GLU A 528 1.150 15.800 6.275 1.00 34.20 O ATOM 1476 OE2 GLU A 528 1.771 14.250 4.850 1.00 5.11 O ATOM 0 H GLU A 528 3.630 13.284 10.030 1.00 53.43 H new ATOM 0 HA GLU A 528 1.936 12.963 7.678 1.00 20.41 H new ATOM 0 HB2 GLU A 528 2.817 15.171 8.469 1.00 12.53 H new ATOM 0 HB3 GLU A 528 4.457 14.597 8.234 1.00 12.53 H new ATOM 0 HG2 GLU A 528 3.809 16.030 6.381 1.00 15.34 H new ATOM 0 HG3 GLU A 528 4.059 14.394 5.805 1.00 15.34 H new ATOM 1483 N ASN A 529 4.725 11.373 7.899 1.00 61.54 N ATOM 1484 CA ASN A 529 5.625 10.419 7.225 1.00 43.54 C ATOM 1485 C ASN A 529 5.146 8.968 7.397 1.00 62.43 C ATOM 1486 O ASN A 529 5.889 8.024 7.124 1.00 74.34 O ATOM 1487 CB ASN A 529 7.045 10.563 7.787 1.00 44.12 C ATOM 1488 CG ASN A 529 7.609 11.961 7.618 1.00 41.33 C ATOM 1489 OD1 ASN A 529 8.368 12.437 8.453 1.00 31.52 O ATOM 1490 ND2 ASN A 529 7.259 12.628 6.537 1.00 52.42 N ATOM 0 H ASN A 529 4.849 11.424 8.910 1.00 61.54 H new ATOM 0 HA ASN A 529 5.621 10.650 6.160 1.00 43.54 H new ATOM 0 HB2 ASN A 529 7.039 10.305 8.846 1.00 44.12 H new ATOM 0 HB3 ASN A 529 7.701 9.849 7.289 1.00 44.12 H new ATOM 0 HD21 ASN A 529 7.622 13.568 6.378 1.00 52.42 H new ATOM 0 HD22 ASN A 529 6.625 12.205 5.859 1.00 52.42 H new ATOM 1497 N ASN A 530 3.899 8.801 7.822 1.00 33.20 N ATOM 1498 CA ASN A 530 3.361 7.481 8.176 1.00 22.43 C ATOM 1499 C ASN A 530 2.403 6.931 7.098 1.00 61.01 C ATOM 1500 O ASN A 530 2.047 5.753 7.114 1.00 73.35 O ATOM 1501 CB ASN A 530 2.629 7.606 9.516 1.00 72.30 C ATOM 1502 CG ASN A 530 2.298 6.276 10.157 1.00 13.34 C ATOM 1503 OD1 ASN A 530 3.007 5.289 9.986 1.00 64.02 O ATOM 1504 ND2 ASN A 530 1.229 6.244 10.919 1.00 35.31 N ATOM 0 H ASN A 530 3.233 9.566 7.932 1.00 33.20 H new ATOM 0 HA ASN A 530 4.189 6.776 8.249 1.00 22.43 H new ATOM 0 HB2 ASN A 530 3.245 8.187 10.203 1.00 72.30 H new ATOM 0 HB3 ASN A 530 1.706 8.166 9.364 1.00 72.30 H new ATOM 0 HD21 ASN A 530 0.965 5.379 11.391 1.00 35.31 H new ATOM 0 HD22 ASN A 530 0.663 7.084 11.039 1.00 35.31 H new ATOM 1511 N ASN A 531 2.013 7.780 6.149 1.00 62.22 N ATOM 1512 CA ASN A 531 0.976 7.431 5.165 1.00 24.43 C ATOM 1513 C ASN A 531 1.541 6.699 3.931 1.00 14.24 C ATOM 1514 O ASN A 531 0.808 6.436 2.972 1.00 65.02 O ATOM 1515 CB ASN A 531 0.236 8.700 4.719 1.00 14.02 C ATOM 1516 CG ASN A 531 -0.356 9.467 5.889 1.00 72.23 C ATOM 1517 OD1 ASN A 531 0.286 10.346 6.452 1.00 52.31 O ATOM 1518 ND2 ASN A 531 -1.574 9.131 6.268 1.00 34.44 N ATOM 0 H ASN A 531 2.397 8.718 6.036 1.00 62.22 H new ATOM 0 HA ASN A 531 0.288 6.743 5.658 1.00 24.43 H new ATOM 0 HB2 ASN A 531 0.925 9.347 4.175 1.00 14.02 H new ATOM 0 HB3 ASN A 531 -0.560 8.428 4.026 1.00 14.02 H new ATOM 0 HD21 ASN A 531 -2.013 9.608 7.055 1.00 34.44 H new ATOM 0 HD22 ASN A 531 -2.077 8.394 5.774 1.00 34.44 H new ATOM 1525 N VAL A 532 2.833 6.362 3.951 1.00 40.11 N ATOM 1526 CA VAL A 532 3.476 5.692 2.807 1.00 54.05 C ATOM 1527 C VAL A 532 4.275 4.443 3.239 1.00 32.23 C ATOM 1528 O VAL A 532 4.899 4.425 4.299 1.00 4.10 O ATOM 1529 CB VAL A 532 4.424 6.660 2.046 1.00 24.42 C ATOM 1530 CG1 VAL A 532 5.044 5.973 0.825 1.00 20.40 C ATOM 1531 CG2 VAL A 532 3.686 7.935 1.637 1.00 33.52 C ATOM 0 H VAL A 532 3.455 6.539 4.740 1.00 40.11 H new ATOM 0 HA VAL A 532 2.669 5.378 2.145 1.00 54.05 H new ATOM 0 HB VAL A 532 5.233 6.939 2.722 1.00 24.42 H new ATOM 0 HG11 VAL A 532 5.703 6.672 0.310 1.00 20.40 H new ATOM 0 HG12 VAL A 532 5.618 5.104 1.148 1.00 20.40 H new ATOM 0 HG13 VAL A 532 4.253 5.653 0.147 1.00 20.40 H new ATOM 0 HG21 VAL A 532 4.370 8.597 1.106 1.00 33.52 H new ATOM 0 HG22 VAL A 532 2.850 7.679 0.986 1.00 33.52 H new ATOM 0 HG23 VAL A 532 3.311 8.440 2.527 1.00 33.52 H new ATOM 1541 N ALA A 533 4.247 3.401 2.402 1.00 42.35 N ATOM 1542 CA ALA A 533 5.036 2.178 2.635 1.00 41.04 C ATOM 1543 C ALA A 533 5.835 1.792 1.384 1.00 72.41 C ATOM 1544 O ALA A 533 5.357 1.955 0.259 1.00 14.41 O ATOM 1545 CB ALA A 533 4.133 1.026 3.052 1.00 55.44 C ATOM 0 H ALA A 533 3.685 3.377 1.551 1.00 42.35 H new ATOM 0 HA ALA A 533 5.738 2.385 3.443 1.00 41.04 H new ATOM 0 HB1 ALA A 533 4.736 0.133 3.219 1.00 55.44 H new ATOM 0 HB2 ALA A 533 3.610 1.288 3.972 1.00 55.44 H new ATOM 0 HB3 ALA A 533 3.405 0.831 2.264 1.00 55.44 H new ATOM 1551 N THR A 534 7.049 1.283 1.581 1.00 61.34 N ATOM 1552 CA THR A 534 7.927 0.903 0.465 1.00 42.22 C ATOM 1553 C THR A 534 8.246 -0.597 0.473 1.00 31.22 C ATOM 1554 O THR A 534 8.528 -1.176 1.520 1.00 32.40 O ATOM 1555 CB THR A 534 9.260 1.689 0.505 1.00 60.33 C ATOM 1556 OG1 THR A 534 8.995 3.099 0.517 1.00 50.10 O ATOM 1557 CG2 THR A 534 10.145 1.348 -0.691 1.00 14.00 C ATOM 0 H THR A 534 7.452 1.122 2.504 1.00 61.34 H new ATOM 0 HA THR A 534 7.382 1.147 -0.447 1.00 42.22 H new ATOM 0 HB THR A 534 9.789 1.403 1.414 1.00 60.33 H new ATOM 0 HG1 THR A 534 9.842 3.591 0.544 1.00 50.10 H new ATOM 0 HG21 THR A 534 11.073 1.917 -0.631 1.00 14.00 H new ATOM 0 HG22 THR A 534 10.372 0.282 -0.683 1.00 14.00 H new ATOM 0 HG23 THR A 534 9.623 1.601 -1.614 1.00 14.00 H new ATOM 1565 N PHE A 535 8.175 -1.221 -0.696 1.00 52.40 N ATOM 1566 CA PHE A 535 8.604 -2.611 -0.869 1.00 54.44 C ATOM 1567 C PHE A 535 9.294 -2.769 -2.232 1.00 62.54 C ATOM 1568 O PHE A 535 8.674 -2.572 -3.271 1.00 71.10 O ATOM 1569 CB PHE A 535 7.392 -3.551 -0.765 1.00 54.03 C ATOM 1570 CG PHE A 535 7.752 -5.014 -0.626 1.00 74.23 C ATOM 1571 CD1 PHE A 535 8.086 -5.777 -1.737 1.00 10.12 C ATOM 1572 CD2 PHE A 535 7.756 -5.624 0.621 1.00 65.34 C ATOM 1573 CE1 PHE A 535 8.416 -7.113 -1.606 1.00 15.11 C ATOM 1574 CE2 PHE A 535 8.083 -6.958 0.755 1.00 12.14 C ATOM 1575 CZ PHE A 535 8.415 -7.705 -0.359 1.00 1.13 C ATOM 0 H PHE A 535 7.822 -0.785 -1.548 1.00 52.40 H new ATOM 0 HA PHE A 535 9.312 -2.874 -0.083 1.00 54.44 H new ATOM 0 HB2 PHE A 535 6.788 -3.254 0.093 1.00 54.03 H new ATOM 0 HB3 PHE A 535 6.771 -3.424 -1.651 1.00 54.03 H new ATOM 0 HD1 PHE A 535 8.088 -5.321 -2.716 1.00 10.12 H new ATOM 0 HD2 PHE A 535 7.500 -5.047 1.497 1.00 65.34 H new ATOM 0 HE1 PHE A 535 8.675 -7.694 -2.479 1.00 15.11 H new ATOM 0 HE2 PHE A 535 8.079 -7.419 1.732 1.00 12.14 H new ATOM 0 HZ PHE A 535 8.673 -8.749 -0.254 1.00 1.13 H new ATOM 1585 N ASP A 536 10.575 -3.119 -2.225 1.00 23.44 N ATOM 1586 CA ASP A 536 11.357 -3.209 -3.464 1.00 1.22 C ATOM 1587 C ASP A 536 11.527 -4.668 -3.929 1.00 42.01 C ATOM 1588 O ASP A 536 12.019 -5.520 -3.189 1.00 60.34 O ATOM 1589 CB ASP A 536 12.715 -2.508 -3.284 1.00 41.21 C ATOM 1590 CG ASP A 536 13.461 -2.943 -2.030 1.00 32.42 C ATOM 1591 OD1 ASP A 536 12.931 -2.745 -0.914 1.00 54.11 O ATOM 1592 OD2 ASP A 536 14.593 -3.451 -2.152 1.00 15.44 O ATOM 0 H ASP A 536 11.098 -3.346 -1.379 1.00 23.44 H new ATOM 0 HA ASP A 536 10.807 -2.695 -4.252 1.00 1.22 H new ATOM 0 HB2 ASP A 536 13.337 -2.710 -4.156 1.00 41.21 H new ATOM 0 HB3 ASP A 536 12.557 -1.430 -3.248 1.00 41.21 H new ATOM 1597 N VAL A 537 11.117 -4.937 -5.169 1.00 64.41 N ATOM 1598 CA VAL A 537 11.120 -6.296 -5.731 1.00 53.15 C ATOM 1599 C VAL A 537 12.154 -6.440 -6.864 1.00 72.42 C ATOM 1600 O VAL A 537 12.377 -5.509 -7.640 1.00 24.22 O ATOM 1601 CB VAL A 537 9.715 -6.659 -6.287 1.00 33.10 C ATOM 1602 CG1 VAL A 537 9.681 -8.096 -6.809 1.00 34.41 C ATOM 1603 CG2 VAL A 537 8.640 -6.439 -5.225 1.00 32.41 C ATOM 0 H VAL A 537 10.774 -4.225 -5.813 1.00 64.41 H new ATOM 0 HA VAL A 537 11.387 -6.975 -4.922 1.00 53.15 H new ATOM 0 HB VAL A 537 9.505 -5.996 -7.127 1.00 33.10 H new ATOM 0 HG11 VAL A 537 8.685 -8.321 -7.191 1.00 34.41 H new ATOM 0 HG12 VAL A 537 10.412 -8.210 -7.610 1.00 34.41 H new ATOM 0 HG13 VAL A 537 9.922 -8.783 -5.998 1.00 34.41 H new ATOM 0 HG21 VAL A 537 7.664 -6.699 -5.636 1.00 32.41 H new ATOM 0 HG22 VAL A 537 8.849 -7.068 -4.360 1.00 32.41 H new ATOM 0 HG23 VAL A 537 8.638 -5.392 -4.921 1.00 32.41 H new ATOM 1613 N SER A 538 12.778 -7.615 -6.955 1.00 33.34 N ATOM 1614 CA SER A 538 13.757 -7.897 -8.020 1.00 44.33 C ATOM 1615 C SER A 538 13.226 -8.962 -8.993 1.00 13.14 C ATOM 1616 O SER A 538 12.788 -10.035 -8.574 1.00 14.54 O ATOM 1617 CB SER A 538 15.091 -8.364 -7.423 1.00 42.05 C ATOM 1618 OG SER A 538 16.075 -8.531 -8.431 1.00 4.52 O ATOM 0 H SER A 538 12.627 -8.389 -6.308 1.00 33.34 H new ATOM 0 HA SER A 538 13.918 -6.970 -8.571 1.00 44.33 H new ATOM 0 HB2 SER A 538 15.438 -7.637 -6.689 1.00 42.05 H new ATOM 0 HB3 SER A 538 14.946 -9.306 -6.894 1.00 42.05 H new ATOM 0 HG SER A 538 16.455 -7.659 -8.664 1.00 4.52 H new ATOM 1624 N VAL A 539 13.267 -8.662 -10.290 1.00 3.40 N ATOM 1625 CA VAL A 539 12.754 -9.577 -11.319 1.00 51.31 C ATOM 1626 C VAL A 539 13.891 -10.163 -12.178 1.00 3.33 C ATOM 1627 O VAL A 539 14.688 -9.423 -12.763 1.00 3.33 O ATOM 1628 CB VAL A 539 11.739 -8.863 -12.248 1.00 10.13 C ATOM 1629 CG1 VAL A 539 11.120 -9.848 -13.243 1.00 24.53 C ATOM 1630 CG2 VAL A 539 10.656 -8.160 -11.431 1.00 73.24 C ATOM 0 H VAL A 539 13.650 -7.791 -10.658 1.00 3.40 H new ATOM 0 HA VAL A 539 12.254 -10.389 -10.791 1.00 51.31 H new ATOM 0 HB VAL A 539 12.278 -8.106 -12.817 1.00 10.13 H new ATOM 0 HG11 VAL A 539 10.412 -9.322 -13.883 1.00 24.53 H new ATOM 0 HG12 VAL A 539 11.906 -10.288 -13.857 1.00 24.53 H new ATOM 0 HG13 VAL A 539 10.601 -10.637 -12.699 1.00 24.53 H new ATOM 0 HG21 VAL A 539 9.955 -7.666 -12.104 1.00 73.24 H new ATOM 0 HG22 VAL A 539 10.123 -8.894 -10.827 1.00 73.24 H new ATOM 0 HG23 VAL A 539 11.116 -7.418 -10.779 1.00 73.24 H new ATOM 1640 N VAL A 540 13.949 -11.494 -12.260 1.00 20.21 N ATOM 1641 CA VAL A 540 14.977 -12.190 -13.053 1.00 14.22 C ATOM 1642 C VAL A 540 14.360 -12.999 -14.210 1.00 52.50 C ATOM 1643 O VAL A 540 13.170 -13.313 -14.204 1.00 71.23 O ATOM 1644 CB VAL A 540 15.824 -13.141 -12.167 1.00 32.23 C ATOM 1645 CG1 VAL A 540 16.581 -12.359 -11.091 1.00 45.10 C ATOM 1646 CG2 VAL A 540 14.941 -14.220 -11.534 1.00 23.14 C ATOM 0 H VAL A 540 13.295 -12.118 -11.787 1.00 20.21 H new ATOM 0 HA VAL A 540 15.620 -11.415 -13.470 1.00 14.22 H new ATOM 0 HB VAL A 540 16.559 -13.632 -12.805 1.00 32.23 H new ATOM 0 HG11 VAL A 540 17.167 -13.049 -10.484 1.00 45.10 H new ATOM 0 HG12 VAL A 540 17.247 -11.638 -11.566 1.00 45.10 H new ATOM 0 HG13 VAL A 540 15.869 -11.832 -10.456 1.00 45.10 H new ATOM 0 HG21 VAL A 540 15.555 -14.876 -10.917 1.00 23.14 H new ATOM 0 HG22 VAL A 540 14.178 -13.749 -10.915 1.00 23.14 H new ATOM 0 HG23 VAL A 540 14.461 -14.804 -12.319 1.00 23.14 H new ATOM 1656 N LEU A 541 15.183 -13.340 -15.202 1.00 61.22 N ATOM 1657 CA LEU A 541 14.722 -14.109 -16.371 1.00 43.32 C ATOM 1658 C LEU A 541 14.637 -15.623 -16.093 1.00 4.24 C ATOM 1659 O LEU A 541 14.029 -16.366 -16.869 1.00 21.34 O ATOM 1660 CB LEU A 541 15.652 -13.856 -17.570 1.00 25.15 C ATOM 1661 CG LEU A 541 15.652 -12.418 -18.120 1.00 65.04 C ATOM 1662 CD1 LEU A 541 16.673 -12.270 -19.247 1.00 43.52 C ATOM 1663 CD2 LEU A 541 14.254 -12.024 -18.602 1.00 51.34 C ATOM 0 H LEU A 541 16.174 -13.098 -15.224 1.00 61.22 H new ATOM 0 HA LEU A 541 13.714 -13.763 -16.598 1.00 43.32 H new ATOM 0 HB2 LEU A 541 16.670 -14.114 -17.278 1.00 25.15 H new ATOM 0 HB3 LEU A 541 15.370 -14.534 -18.375 1.00 25.15 H new ATOM 0 HG LEU A 541 15.937 -11.744 -17.312 1.00 65.04 H new ATOM 0 HD11 LEU A 541 16.656 -11.246 -19.621 1.00 43.52 H new ATOM 0 HD12 LEU A 541 17.669 -12.502 -18.869 1.00 43.52 H new ATOM 0 HD13 LEU A 541 16.424 -12.956 -20.056 1.00 43.52 H new ATOM 0 HD21 LEU A 541 14.276 -11.004 -18.987 1.00 51.34 H new ATOM 0 HD22 LEU A 541 13.937 -12.704 -19.393 1.00 51.34 H new ATOM 0 HD23 LEU A 541 13.552 -12.083 -17.770 1.00 51.34 H new ATOM 1675 N GLU A 542 15.244 -16.080 -14.998 1.00 3.44 N ATOM 1676 CA GLU A 542 15.292 -17.520 -14.682 1.00 41.30 C ATOM 1677 C GLU A 542 14.204 -17.950 -13.661 1.00 14.40 C ATOM 1678 O GLU A 542 14.487 -18.019 -12.442 1.00 38.76 O ATOM 1679 CB GLU A 542 16.704 -17.898 -14.194 1.00 62.21 C ATOM 1680 CG GLU A 542 17.253 -17.014 -13.073 1.00 22.32 C ATOM 1681 CD GLU A 542 18.630 -17.458 -12.605 1.00 0.24 C ATOM 1682 OE1 GLU A 542 18.749 -18.584 -12.082 1.00 3.52 O ATOM 1683 OE2 GLU A 542 19.601 -16.692 -12.770 1.00 40.41 O ATOM 0 H GLU A 542 15.709 -15.483 -14.314 1.00 3.44 H new ATOM 0 HA GLU A 542 15.071 -18.067 -15.598 1.00 41.30 H new ATOM 0 HB2 GLU A 542 16.689 -18.932 -13.848 1.00 62.21 H new ATOM 0 HB3 GLU A 542 17.389 -17.855 -15.040 1.00 62.21 H new ATOM 0 HG2 GLU A 542 17.306 -15.982 -13.421 1.00 22.32 H new ATOM 0 HG3 GLU A 542 16.563 -17.031 -12.230 1.00 22.32 H new