USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=22 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 527 ASN : amide:sc= 0.727 K(o=-1.2,f=-3.5) USER MOD Set 1.2: A 529 ASN : amide:sc= 1.12 K(o=-1.2,f=-3.3) USER MOD Set 1.3: A 530 ASN : amide:sc= -3.08! C(o=-1.2!,f=-3.5!) USER MOD Set 2.1: A 514 ASN : amide:sc= -0.0856 K(o=-0.74,f=-6.1!) USER MOD Set 2.2: A 534 THR OG1 : rot 180:sc= -0.654 USER MOD Set 3.1: A 472 SER OG : rot -124:sc= 0.91 USER MOD Set 3.2: A 522 THR OG1 : rot -71:sc= 1.27 USER MOD Single : A 441 THR OG1 : rot 54:sc= 0.0241 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.587 K(o=-0.59,f=-3.1) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -146:sc= -0.161 USER MOD Single : A 461 HIS : no HE2:sc= 0.472 K(o=0.47,f=-2.8!) USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -0.161 K(o=-0.16,f=-10!) USER MOD Single : A 473 THR OG1 : rot 96:sc= 0.0138 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 TYR OH : rot 30:sc= -0.186 USER MOD Single : A 480 ASN : amide:sc= -0.256 K(o=-0.26,f=-7!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 168:sc=-0.00483 (180deg=-0.134) USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 488 THR OG1 : rot 170:sc= -0.271 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 179:sc= 1.28 (180deg=1.21) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 24:sc= 0.38 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 X(o=0,f=-0.37) USER MOD Single : A 510 MET CE :methyl -149:sc= -0.732 (180deg=-2.49!) USER MOD Single : A 511 TYR OH : rot 29:sc= -0.0764 USER MOD Single : A 516 THR OG1 : rot 9:sc= -1.64 USER MOD Single : A 521 ASN : amide:sc=-0.00132 X(o=-0.0013,f=-0.098) USER MOD Single : A 531 ASN : amide:sc= -2.36! C(o=-2.4!,f=-4.4!) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 35 N PHE A 437 -7.194 13.137 16.433 1.00 4.42 N ATOM 36 CA PHE A 437 -6.430 13.126 15.181 1.00 15.33 C ATOM 37 C PHE A 437 -6.101 11.680 14.774 1.00 10.12 C ATOM 38 O PHE A 437 -5.519 10.929 15.558 1.00 71.34 O ATOM 39 CB PHE A 437 -5.122 13.916 15.335 1.00 15.53 C ATOM 40 CG PHE A 437 -5.306 15.377 15.663 1.00 51.14 C ATOM 41 CD1 PHE A 437 -5.509 16.307 14.653 1.00 3.45 C ATOM 42 CD2 PHE A 437 -5.264 15.820 16.978 1.00 4.11 C ATOM 43 CE1 PHE A 437 -5.668 17.646 14.949 1.00 62.31 C ATOM 44 CE2 PHE A 437 -5.423 17.160 17.277 1.00 11.14 C ATOM 45 CZ PHE A 437 -5.625 18.073 16.262 1.00 64.31 C ATOM 0 HA PHE A 437 -7.040 13.595 14.409 1.00 15.33 H new ATOM 0 HB2 PHE A 437 -4.524 13.453 16.120 1.00 15.53 H new ATOM 0 HB3 PHE A 437 -4.552 13.834 14.410 1.00 15.53 H new ATOM 0 HD1 PHE A 437 -5.543 15.980 13.624 1.00 3.45 H new ATOM 0 HD2 PHE A 437 -5.105 15.110 17.776 1.00 4.11 H new ATOM 0 HE1 PHE A 437 -5.826 18.360 14.154 1.00 62.31 H new ATOM 0 HE2 PHE A 437 -5.389 17.492 18.304 1.00 11.14 H new ATOM 0 HZ PHE A 437 -5.749 19.120 16.494 1.00 64.31 H new ATOM 55 N PRO A 438 -6.483 11.263 13.555 1.00 12.31 N ATOM 56 CA PRO A 438 -6.192 9.910 13.062 1.00 12.13 C ATOM 57 C PRO A 438 -4.707 9.704 12.719 1.00 73.24 C ATOM 58 O PRO A 438 -3.903 10.636 12.796 1.00 5.23 O ATOM 59 CB PRO A 438 -7.079 9.785 11.818 1.00 50.34 C ATOM 60 CG PRO A 438 -7.275 11.185 11.343 1.00 1.04 C ATOM 61 CD PRO A 438 -7.231 12.065 12.568 1.00 1.34 C ATOM 0 HA PRO A 438 -6.396 9.149 13.816 1.00 12.13 H new ATOM 0 HB2 PRO A 438 -6.603 9.172 11.053 1.00 50.34 H new ATOM 0 HB3 PRO A 438 -8.031 9.312 12.058 1.00 50.34 H new ATOM 0 HG2 PRO A 438 -6.496 11.467 10.635 1.00 1.04 H new ATOM 0 HG3 PRO A 438 -8.229 11.289 10.825 1.00 1.04 H new ATOM 0 HD2 PRO A 438 -6.732 13.012 12.362 1.00 1.34 H new ATOM 0 HD3 PRO A 438 -8.233 12.304 12.924 1.00 1.34 H new ATOM 69 N ASP A 439 -4.351 8.472 12.377 1.00 64.42 N ATOM 70 CA ASP A 439 -2.972 8.131 12.018 1.00 2.21 C ATOM 71 C ASP A 439 -2.957 6.906 11.088 1.00 70.14 C ATOM 72 O ASP A 439 -2.768 5.769 11.527 1.00 62.25 O ATOM 73 CB ASP A 439 -2.147 7.873 13.287 1.00 63.41 C ATOM 74 CG ASP A 439 -0.658 7.753 13.014 1.00 73.13 C ATOM 75 OD1 ASP A 439 0.022 8.798 12.935 1.00 55.51 O ATOM 76 OD2 ASP A 439 -0.158 6.614 12.906 1.00 62.43 O ATOM 0 H ASP A 439 -4.999 7.685 12.339 1.00 64.42 H new ATOM 0 HA ASP A 439 -2.521 8.968 11.484 1.00 2.21 H new ATOM 0 HB2 ASP A 439 -2.317 8.684 13.995 1.00 63.41 H new ATOM 0 HB3 ASP A 439 -2.498 6.957 13.762 1.00 63.41 H new ATOM 81 N LEU A 440 -3.220 7.144 9.811 1.00 31.04 N ATOM 82 CA LEU A 440 -3.289 6.077 8.811 1.00 21.54 C ATOM 83 C LEU A 440 -1.889 5.648 8.344 1.00 13.41 C ATOM 84 O LEU A 440 -1.147 6.431 7.750 1.00 64.30 O ATOM 85 CB LEU A 440 -4.128 6.544 7.615 1.00 43.53 C ATOM 86 CG LEU A 440 -5.612 6.829 7.916 1.00 65.33 C ATOM 87 CD1 LEU A 440 -6.257 7.612 6.777 1.00 31.12 C ATOM 88 CD2 LEU A 440 -6.375 5.532 8.169 1.00 22.00 C ATOM 0 H LEU A 440 -3.392 8.077 9.435 1.00 31.04 H new ATOM 0 HA LEU A 440 -3.762 5.210 9.272 1.00 21.54 H new ATOM 0 HB2 LEU A 440 -3.677 7.450 7.209 1.00 43.53 H new ATOM 0 HB3 LEU A 440 -4.073 5.784 6.836 1.00 43.53 H new ATOM 0 HG LEU A 440 -5.659 7.436 8.820 1.00 65.33 H new ATOM 0 HD11 LEU A 440 -7.304 7.801 7.013 1.00 31.12 H new ATOM 0 HD12 LEU A 440 -5.737 8.561 6.648 1.00 31.12 H new ATOM 0 HD13 LEU A 440 -6.191 7.034 5.855 1.00 31.12 H new ATOM 0 HD21 LEU A 440 -7.420 5.760 8.379 1.00 22.00 H new ATOM 0 HD22 LEU A 440 -6.313 4.895 7.287 1.00 22.00 H new ATOM 0 HD23 LEU A 440 -5.938 5.013 9.022 1.00 22.00 H new ATOM 100 N THR A 441 -1.534 4.396 8.613 1.00 34.43 N ATOM 101 CA THR A 441 -0.243 3.841 8.187 1.00 34.24 C ATOM 102 C THR A 441 -0.435 2.542 7.395 1.00 71.10 C ATOM 103 O THR A 441 -1.432 1.834 7.571 1.00 3.55 O ATOM 104 CB THR A 441 0.694 3.574 9.393 1.00 72.44 C ATOM 105 OG1 THR A 441 1.942 3.021 8.949 1.00 61.11 O ATOM 106 CG2 THR A 441 0.053 2.627 10.398 1.00 25.42 C ATOM 0 H THR A 441 -2.122 3.739 9.126 1.00 34.43 H new ATOM 0 HA THR A 441 0.223 4.588 7.545 1.00 34.24 H new ATOM 0 HB THR A 441 0.873 4.531 9.883 1.00 72.44 H new ATOM 0 HG1 THR A 441 2.334 3.605 8.266 1.00 61.11 H new ATOM 0 HG21 THR A 441 0.737 2.462 11.230 1.00 25.42 H new ATOM 0 HG22 THR A 441 -0.873 3.065 10.771 1.00 25.42 H new ATOM 0 HG23 THR A 441 -0.165 1.675 9.913 1.00 25.42 H new ATOM 114 N VAL A 442 0.517 2.234 6.519 1.00 3.23 N ATOM 115 CA VAL A 442 0.411 1.062 5.640 1.00 61.32 C ATOM 116 C VAL A 442 1.693 0.213 5.640 1.00 4.32 C ATOM 117 O VAL A 442 2.796 0.724 5.833 1.00 12.32 O ATOM 118 CB VAL A 442 0.080 1.480 4.182 1.00 35.32 C ATOM 119 CG1 VAL A 442 -1.324 2.072 4.091 1.00 71.31 C ATOM 120 CG2 VAL A 442 1.114 2.474 3.656 1.00 22.30 C ATOM 0 H VAL A 442 1.372 2.776 6.395 1.00 3.23 H new ATOM 0 HA VAL A 442 -0.403 0.457 6.040 1.00 61.32 H new ATOM 0 HB VAL A 442 0.115 0.586 3.560 1.00 35.32 H new ATOM 0 HG11 VAL A 442 -1.532 2.357 3.060 1.00 71.31 H new ATOM 0 HG12 VAL A 442 -2.053 1.330 4.417 1.00 71.31 H new ATOM 0 HG13 VAL A 442 -1.390 2.952 4.731 1.00 71.31 H new ATOM 0 HG21 VAL A 442 0.863 2.753 2.633 1.00 22.30 H new ATOM 0 HG22 VAL A 442 1.116 3.364 4.285 1.00 22.30 H new ATOM 0 HG23 VAL A 442 2.102 2.015 3.674 1.00 22.30 H new ATOM 130 N GLU A 443 1.526 -1.092 5.434 1.00 72.11 N ATOM 131 CA GLU A 443 2.655 -2.025 5.307 1.00 63.24 C ATOM 132 C GLU A 443 2.521 -2.875 4.035 1.00 45.32 C ATOM 133 O GLU A 443 1.414 -3.251 3.647 1.00 45.15 O ATOM 134 CB GLU A 443 2.726 -2.960 6.525 1.00 30.41 C ATOM 135 CG GLU A 443 2.908 -2.250 7.862 1.00 1.41 C ATOM 136 CD GLU A 443 3.095 -3.230 9.010 1.00 32.21 C ATOM 137 OE1 GLU A 443 2.130 -3.943 9.352 1.00 31.24 O ATOM 138 OE2 GLU A 443 4.211 -3.303 9.568 1.00 61.12 O ATOM 0 H GLU A 443 0.611 -1.535 5.350 1.00 72.11 H new ATOM 0 HA GLU A 443 3.567 -1.431 5.250 1.00 63.24 H new ATOM 0 HB2 GLU A 443 1.812 -3.553 6.565 1.00 30.41 H new ATOM 0 HB3 GLU A 443 3.552 -3.657 6.384 1.00 30.41 H new ATOM 0 HG2 GLU A 443 3.773 -1.589 7.806 1.00 1.41 H new ATOM 0 HG3 GLU A 443 2.039 -1.622 8.060 1.00 1.41 H new ATOM 145 N ILE A 444 3.644 -3.179 3.391 1.00 65.31 N ATOM 146 CA ILE A 444 3.645 -4.040 2.200 1.00 33.01 C ATOM 147 C ILE A 444 4.393 -5.351 2.477 1.00 1.13 C ATOM 148 O ILE A 444 5.493 -5.341 3.031 1.00 65.13 O ATOM 149 CB ILE A 444 4.294 -3.329 0.985 1.00 20.22 C ATOM 150 CG1 ILE A 444 3.564 -2.010 0.685 1.00 53.45 C ATOM 151 CG2 ILE A 444 4.289 -4.241 -0.248 1.00 64.31 C ATOM 152 CD1 ILE A 444 4.176 -1.217 -0.448 1.00 45.05 C ATOM 0 H ILE A 444 4.567 -2.845 3.669 1.00 65.31 H new ATOM 0 HA ILE A 444 2.604 -4.259 1.962 1.00 33.01 H new ATOM 0 HB ILE A 444 5.331 -3.103 1.234 1.00 20.22 H new ATOM 0 HG12 ILE A 444 2.524 -2.228 0.443 1.00 53.45 H new ATOM 0 HG13 ILE A 444 3.559 -1.395 1.585 1.00 53.45 H new ATOM 0 HG21 ILE A 444 4.749 -3.720 -1.088 1.00 64.31 H new ATOM 0 HG22 ILE A 444 4.852 -5.149 -0.031 1.00 64.31 H new ATOM 0 HG23 ILE A 444 3.262 -4.503 -0.503 1.00 64.31 H new ATOM 0 HD11 ILE A 444 3.606 -0.300 -0.600 1.00 45.05 H new ATOM 0 HD12 ILE A 444 5.208 -0.966 -0.201 1.00 45.05 H new ATOM 0 HD13 ILE A 444 4.156 -1.812 -1.361 1.00 45.05 H new ATOM 164 N LYS A 445 3.793 -6.474 2.098 1.00 60.21 N ATOM 165 CA LYS A 445 4.407 -7.787 2.326 1.00 63.20 C ATOM 166 C LYS A 445 4.347 -8.650 1.054 1.00 45.21 C ATOM 167 O LYS A 445 3.392 -8.563 0.283 1.00 24.23 O ATOM 168 CB LYS A 445 3.693 -8.507 3.480 1.00 21.21 C ATOM 169 CG LYS A 445 4.557 -9.550 4.181 1.00 63.41 C ATOM 170 CD LYS A 445 5.702 -8.896 4.954 1.00 23.25 C ATOM 171 CE LYS A 445 6.639 -9.919 5.586 1.00 23.22 C ATOM 172 NZ LYS A 445 7.689 -9.264 6.411 1.00 12.42 N ATOM 0 H LYS A 445 2.886 -6.507 1.633 1.00 60.21 H new ATOM 0 HA LYS A 445 5.454 -7.634 2.588 1.00 63.20 H new ATOM 0 HB2 LYS A 445 3.367 -7.767 4.211 1.00 21.21 H new ATOM 0 HB3 LYS A 445 2.796 -8.991 3.094 1.00 21.21 H new ATOM 0 HG2 LYS A 445 3.942 -10.135 4.865 1.00 63.41 H new ATOM 0 HG3 LYS A 445 4.962 -10.244 3.444 1.00 63.41 H new ATOM 0 HD2 LYS A 445 6.271 -8.254 4.281 1.00 23.25 H new ATOM 0 HD3 LYS A 445 5.290 -8.255 5.733 1.00 23.25 H new ATOM 0 HE2 LYS A 445 6.063 -10.606 6.207 1.00 23.22 H new ATOM 0 HE3 LYS A 445 7.109 -10.515 4.804 1.00 23.22 H new ATOM 0 HZ1 LYS A 445 8.308 -9.990 6.825 1.00 12.42 H new ATOM 0 HZ2 LYS A 445 8.254 -8.628 5.813 1.00 12.42 H new ATOM 0 HZ3 LYS A 445 7.240 -8.716 7.173 1.00 12.42 H new ATOM 186 N GLY A 446 5.365 -9.476 0.835 1.00 42.41 N ATOM 187 CA GLY A 446 5.373 -10.357 -0.332 1.00 74.21 C ATOM 188 C GLY A 446 6.764 -10.864 -0.711 1.00 21.31 C ATOM 189 O GLY A 446 7.736 -10.629 0.015 1.00 22.22 O ATOM 0 H GLY A 446 6.184 -9.555 1.438 1.00 42.41 H new ATOM 0 HA2 GLY A 446 4.726 -11.212 -0.135 1.00 74.21 H new ATOM 0 HA3 GLY A 446 4.947 -9.824 -1.182 1.00 74.21 H new ATOM 193 N PRO A 447 6.889 -11.577 -1.851 1.00 55.32 N ATOM 194 CA PRO A 447 8.179 -12.113 -2.326 1.00 20.31 C ATOM 195 C PRO A 447 9.129 -11.019 -2.850 1.00 71.30 C ATOM 196 O PRO A 447 8.771 -10.229 -3.726 1.00 34.10 O ATOM 197 CB PRO A 447 7.768 -13.065 -3.459 1.00 31.50 C ATOM 198 CG PRO A 447 6.476 -12.514 -3.962 1.00 45.25 C ATOM 199 CD PRO A 447 5.779 -11.926 -2.761 1.00 44.24 C ATOM 0 HA PRO A 447 8.737 -12.595 -1.523 1.00 20.31 H new ATOM 0 HB2 PRO A 447 8.521 -13.092 -4.247 1.00 31.50 H new ATOM 0 HB3 PRO A 447 7.649 -14.086 -3.096 1.00 31.50 H new ATOM 0 HG2 PRO A 447 6.646 -11.754 -4.725 1.00 45.25 H new ATOM 0 HG3 PRO A 447 5.871 -13.296 -4.420 1.00 45.25 H new ATOM 0 HD2 PRO A 447 5.190 -11.049 -3.029 1.00 44.24 H new ATOM 0 HD3 PRO A 447 5.096 -12.642 -2.304 1.00 44.24 H new ATOM 207 N ASP A 448 10.347 -10.993 -2.313 1.00 31.41 N ATOM 208 CA ASP A 448 11.346 -9.985 -2.682 1.00 63.23 C ATOM 209 C ASP A 448 11.988 -10.275 -4.055 1.00 23.40 C ATOM 210 O ASP A 448 12.550 -9.379 -4.687 1.00 35.22 O ATOM 211 CB ASP A 448 12.419 -9.912 -1.593 1.00 13.43 C ATOM 212 CG ASP A 448 13.134 -11.240 -1.396 1.00 12.43 C ATOM 213 OD1 ASP A 448 12.472 -12.226 -0.999 1.00 61.10 O ATOM 214 OD2 ASP A 448 14.357 -11.306 -1.641 1.00 60.11 O ATOM 0 H ASP A 448 10.670 -11.663 -1.615 1.00 31.41 H new ATOM 0 HA ASP A 448 10.840 -9.023 -2.767 1.00 63.23 H new ATOM 0 HB2 ASP A 448 13.148 -9.145 -1.855 1.00 13.43 H new ATOM 0 HB3 ASP A 448 11.959 -9.607 -0.653 1.00 13.43 H new ATOM 219 N VAL A 449 11.924 -11.530 -4.501 1.00 3.12 N ATOM 220 CA VAL A 449 12.438 -11.921 -5.823 1.00 20.31 C ATOM 221 C VAL A 449 11.401 -12.753 -6.596 1.00 53.01 C ATOM 222 O VAL A 449 10.866 -13.735 -6.076 1.00 43.21 O ATOM 223 CB VAL A 449 13.758 -12.735 -5.713 1.00 74.33 C ATOM 224 CG1 VAL A 449 14.254 -13.163 -7.097 1.00 62.43 C ATOM 225 CG2 VAL A 449 14.833 -11.934 -4.981 1.00 11.33 C ATOM 0 H VAL A 449 11.520 -12.299 -3.967 1.00 3.12 H new ATOM 0 HA VAL A 449 12.640 -10.996 -6.363 1.00 20.31 H new ATOM 0 HB VAL A 449 13.549 -13.634 -5.133 1.00 74.33 H new ATOM 0 HG11 VAL A 449 15.179 -13.731 -6.993 1.00 62.43 H new ATOM 0 HG12 VAL A 449 13.499 -13.785 -7.578 1.00 62.43 H new ATOM 0 HG13 VAL A 449 14.438 -12.279 -7.707 1.00 62.43 H new ATOM 0 HG21 VAL A 449 15.747 -12.525 -4.917 1.00 11.33 H new ATOM 0 HG22 VAL A 449 15.035 -11.012 -5.527 1.00 11.33 H new ATOM 0 HG23 VAL A 449 14.486 -11.692 -3.976 1.00 11.33 H new ATOM 235 N VAL A 450 11.120 -12.358 -7.836 1.00 43.12 N ATOM 236 CA VAL A 450 10.139 -13.061 -8.675 1.00 73.31 C ATOM 237 C VAL A 450 10.666 -13.279 -10.105 1.00 32.24 C ATOM 238 O VAL A 450 11.553 -12.561 -10.571 1.00 75.51 O ATOM 239 CB VAL A 450 8.792 -12.293 -8.740 1.00 0.14 C ATOM 240 CG1 VAL A 450 8.142 -12.215 -7.358 1.00 52.14 C ATOM 241 CG2 VAL A 450 8.990 -10.896 -9.323 1.00 24.44 C ATOM 0 H VAL A 450 11.556 -11.554 -8.287 1.00 43.12 H new ATOM 0 HA VAL A 450 9.973 -14.032 -8.208 1.00 73.31 H new ATOM 0 HB VAL A 450 8.122 -12.844 -9.400 1.00 0.14 H new ATOM 0 HG11 VAL A 450 7.199 -11.672 -7.429 1.00 52.14 H new ATOM 0 HG12 VAL A 450 7.953 -13.223 -6.987 1.00 52.14 H new ATOM 0 HG13 VAL A 450 8.809 -11.695 -6.671 1.00 52.14 H new ATOM 0 HG21 VAL A 450 8.032 -10.377 -9.358 1.00 24.44 H new ATOM 0 HG22 VAL A 450 9.683 -10.335 -8.696 1.00 24.44 H new ATOM 0 HG23 VAL A 450 9.396 -10.977 -10.331 1.00 24.44 H new ATOM 251 N GLY A 451 10.121 -14.282 -10.788 1.00 41.54 N ATOM 252 CA GLY A 451 10.521 -14.570 -12.163 1.00 44.22 C ATOM 253 C GLY A 451 9.697 -13.812 -13.202 1.00 64.00 C ATOM 254 O GLY A 451 8.549 -13.437 -12.952 1.00 5.23 O ATOM 0 H GLY A 451 9.405 -14.906 -10.415 1.00 41.54 H new ATOM 0 HA2 GLY A 451 11.574 -14.317 -12.289 1.00 44.22 H new ATOM 0 HA3 GLY A 451 10.427 -15.641 -12.345 1.00 44.22 H new ATOM 258 N VAL A 452 10.283 -13.592 -14.377 1.00 33.24 N ATOM 259 CA VAL A 452 9.604 -12.882 -15.464 1.00 61.22 C ATOM 260 C VAL A 452 8.390 -13.673 -15.994 1.00 65.41 C ATOM 261 O VAL A 452 8.428 -14.901 -16.090 1.00 25.14 O ATOM 262 CB VAL A 452 10.582 -12.584 -16.633 1.00 23.23 C ATOM 263 CG1 VAL A 452 11.041 -13.874 -17.312 1.00 75.32 C ATOM 264 CG2 VAL A 452 9.952 -11.625 -17.642 1.00 14.44 C ATOM 0 H VAL A 452 11.230 -13.896 -14.603 1.00 33.24 H new ATOM 0 HA VAL A 452 9.246 -11.940 -15.049 1.00 61.22 H new ATOM 0 HB VAL A 452 11.464 -12.099 -16.215 1.00 23.23 H new ATOM 0 HG11 VAL A 452 11.725 -13.633 -18.126 1.00 75.32 H new ATOM 0 HG12 VAL A 452 11.551 -14.506 -16.585 1.00 75.32 H new ATOM 0 HG13 VAL A 452 10.175 -14.404 -17.710 1.00 75.32 H new ATOM 0 HG21 VAL A 452 10.657 -11.433 -18.450 1.00 14.44 H new ATOM 0 HG22 VAL A 452 9.045 -12.071 -18.050 1.00 14.44 H new ATOM 0 HG23 VAL A 452 9.704 -10.687 -17.146 1.00 14.44 H new ATOM 274 N ASN A 453 7.313 -12.951 -16.319 1.00 55.02 N ATOM 275 CA ASN A 453 6.071 -13.545 -16.856 1.00 32.43 C ATOM 276 C ASN A 453 5.366 -14.456 -15.828 1.00 25.42 C ATOM 277 O ASN A 453 4.390 -15.141 -16.155 1.00 54.34 O ATOM 278 CB ASN A 453 6.362 -14.333 -18.141 1.00 54.13 C ATOM 279 CG ASN A 453 7.097 -13.504 -19.179 1.00 50.43 C ATOM 280 OD1 ASN A 453 6.882 -12.304 -19.301 1.00 42.53 O ATOM 281 ND2 ASN A 453 7.985 -14.133 -19.921 1.00 3.11 N ATOM 0 H ASN A 453 7.271 -11.937 -16.219 1.00 55.02 H new ATOM 0 HA ASN A 453 5.396 -12.719 -17.082 1.00 32.43 H new ATOM 0 HB2 ASN A 453 6.957 -15.213 -17.897 1.00 54.13 H new ATOM 0 HB3 ASN A 453 5.423 -14.690 -18.565 1.00 54.13 H new ATOM 0 HD21 ASN A 453 8.518 -13.620 -20.623 1.00 3.11 H new ATOM 0 HD22 ASN A 453 8.139 -15.133 -19.794 1.00 3.11 H new ATOM 288 N LYS A 454 5.848 -14.445 -14.587 1.00 51.30 N ATOM 289 CA LYS A 454 5.264 -15.262 -13.517 1.00 51.44 C ATOM 290 C LYS A 454 4.265 -14.457 -12.678 1.00 44.01 C ATOM 291 O LYS A 454 4.193 -13.236 -12.782 1.00 10.14 O ATOM 292 CB LYS A 454 6.375 -15.826 -12.617 1.00 51.31 C ATOM 293 CG LYS A 454 7.298 -16.818 -13.323 1.00 41.51 C ATOM 294 CD LYS A 454 6.532 -18.034 -13.847 1.00 5.31 C ATOM 295 CE LYS A 454 5.840 -18.798 -12.723 1.00 34.32 C ATOM 296 NZ LYS A 454 5.045 -19.946 -13.231 1.00 0.12 N ATOM 0 H LYS A 454 6.644 -13.879 -14.294 1.00 51.30 H new ATOM 0 HA LYS A 454 4.723 -16.086 -13.982 1.00 51.44 H new ATOM 0 HB2 LYS A 454 6.972 -14.999 -12.232 1.00 51.31 H new ATOM 0 HB3 LYS A 454 5.919 -16.317 -11.757 1.00 51.31 H new ATOM 0 HG2 LYS A 454 7.800 -16.320 -14.152 1.00 41.51 H new ATOM 0 HG3 LYS A 454 8.074 -17.147 -12.632 1.00 41.51 H new ATOM 0 HD2 LYS A 454 5.789 -17.709 -14.576 1.00 5.31 H new ATOM 0 HD3 LYS A 454 7.220 -18.699 -14.368 1.00 5.31 H new ATOM 0 HE2 LYS A 454 6.588 -19.160 -12.018 1.00 34.32 H new ATOM 0 HE3 LYS A 454 5.186 -18.120 -12.174 1.00 34.32 H new ATOM 0 HZ1 LYS A 454 4.593 -20.436 -12.433 1.00 0.12 H new ATOM 0 HZ2 LYS A 454 4.313 -19.600 -13.884 1.00 0.12 H new ATOM 0 HZ3 LYS A 454 5.672 -20.607 -13.733 1.00 0.12 H new ATOM 310 N LEU A 455 3.482 -15.149 -11.855 1.00 61.22 N ATOM 311 CA LEU A 455 2.490 -14.494 -10.998 1.00 60.04 C ATOM 312 C LEU A 455 2.969 -14.426 -9.538 1.00 52.21 C ATOM 313 O LEU A 455 3.468 -15.413 -8.993 1.00 5.10 O ATOM 314 CB LEU A 455 1.153 -15.243 -11.073 1.00 61.43 C ATOM 315 CG LEU A 455 -0.027 -14.539 -10.387 1.00 24.21 C ATOM 316 CD1 LEU A 455 -0.311 -13.194 -11.052 1.00 62.20 C ATOM 317 CD2 LEU A 455 -1.271 -15.424 -10.404 1.00 3.52 C ATOM 0 H LEU A 455 3.513 -16.164 -11.761 1.00 61.22 H new ATOM 0 HA LEU A 455 2.356 -13.474 -11.359 1.00 60.04 H new ATOM 0 HB2 LEU A 455 0.901 -15.402 -12.122 1.00 61.43 H new ATOM 0 HB3 LEU A 455 1.280 -16.228 -10.623 1.00 61.43 H new ATOM 0 HG LEU A 455 0.244 -14.356 -9.347 1.00 24.21 H new ATOM 0 HD11 LEU A 455 -1.150 -12.711 -10.552 1.00 62.20 H new ATOM 0 HD12 LEU A 455 0.571 -12.558 -10.978 1.00 62.20 H new ATOM 0 HD13 LEU A 455 -0.557 -13.352 -12.102 1.00 62.20 H new ATOM 0 HD21 LEU A 455 -2.094 -14.905 -9.913 1.00 3.52 H new ATOM 0 HD22 LEU A 455 -1.546 -15.645 -11.435 1.00 3.52 H new ATOM 0 HD23 LEU A 455 -1.063 -16.355 -9.876 1.00 3.52 H new ATOM 329 N ALA A 456 2.817 -13.256 -8.915 1.00 24.31 N ATOM 330 CA ALA A 456 3.200 -13.066 -7.509 1.00 60.13 C ATOM 331 C ALA A 456 2.105 -12.335 -6.713 1.00 41.44 C ATOM 332 O ALA A 456 1.479 -11.399 -7.214 1.00 75.32 O ATOM 333 CB ALA A 456 4.515 -12.299 -7.425 1.00 22.12 C ATOM 0 H ALA A 456 2.431 -12.423 -9.360 1.00 24.31 H new ATOM 0 HA ALA A 456 3.328 -14.052 -7.063 1.00 60.13 H new ATOM 0 HB1 ALA A 456 4.791 -12.163 -6.379 1.00 22.12 H new ATOM 0 HB2 ALA A 456 5.297 -12.860 -7.936 1.00 22.12 H new ATOM 0 HB3 ALA A 456 4.399 -11.324 -7.899 1.00 22.12 H new ATOM 339 N GLU A 457 1.879 -12.770 -5.473 1.00 64.13 N ATOM 340 CA GLU A 457 0.894 -12.137 -4.582 1.00 70.52 C ATOM 341 C GLU A 457 1.567 -11.203 -3.570 1.00 2.44 C ATOM 342 O GLU A 457 2.608 -11.533 -2.999 1.00 65.53 O ATOM 343 CB GLU A 457 0.091 -13.201 -3.823 1.00 74.22 C ATOM 344 CG GLU A 457 -0.983 -13.885 -4.653 1.00 35.12 C ATOM 345 CD GLU A 457 -1.684 -14.993 -3.887 1.00 34.21 C ATOM 346 OE1 GLU A 457 -2.510 -14.676 -3.006 1.00 25.33 O ATOM 347 OE2 GLU A 457 -1.400 -16.180 -4.148 1.00 50.21 O ATOM 0 H GLU A 457 2.366 -13.563 -5.057 1.00 64.13 H new ATOM 0 HA GLU A 457 0.225 -11.549 -5.210 1.00 70.52 H new ATOM 0 HB2 GLU A 457 0.779 -13.958 -3.446 1.00 74.22 H new ATOM 0 HB3 GLU A 457 -0.378 -12.736 -2.956 1.00 74.22 H new ATOM 0 HG2 GLU A 457 -1.718 -13.146 -4.973 1.00 35.12 H new ATOM 0 HG3 GLU A 457 -0.533 -14.299 -5.556 1.00 35.12 H new ATOM 354 N TYR A 458 0.960 -10.042 -3.345 1.00 33.32 N ATOM 355 CA TYR A 458 1.448 -9.084 -2.348 1.00 53.42 C ATOM 356 C TYR A 458 0.315 -8.634 -1.413 1.00 14.51 C ATOM 357 O TYR A 458 -0.863 -8.663 -1.783 1.00 41.41 O ATOM 358 CB TYR A 458 2.090 -7.871 -3.039 1.00 62.21 C ATOM 359 CG TYR A 458 3.382 -8.207 -3.765 1.00 12.03 C ATOM 360 CD1 TYR A 458 3.368 -8.690 -5.071 1.00 70.30 C ATOM 361 CD2 TYR A 458 4.614 -8.056 -3.137 1.00 55.50 C ATOM 362 CE1 TYR A 458 4.543 -9.012 -5.725 1.00 23.45 C ATOM 363 CE2 TYR A 458 5.791 -8.372 -3.787 1.00 3.31 C ATOM 364 CZ TYR A 458 5.750 -8.852 -5.079 1.00 35.21 C ATOM 365 OH TYR A 458 6.918 -9.176 -5.726 1.00 63.14 O ATOM 0 H TYR A 458 0.123 -9.737 -3.842 1.00 33.32 H new ATOM 0 HA TYR A 458 2.206 -9.582 -1.743 1.00 53.42 H new ATOM 0 HB2 TYR A 458 1.380 -7.450 -3.751 1.00 62.21 H new ATOM 0 HB3 TYR A 458 2.290 -7.101 -2.294 1.00 62.21 H new ATOM 0 HD1 TYR A 458 2.424 -8.815 -5.581 1.00 70.30 H new ATOM 0 HD2 TYR A 458 4.651 -7.685 -2.123 1.00 55.50 H new ATOM 0 HE1 TYR A 458 4.515 -9.387 -6.737 1.00 23.45 H new ATOM 0 HE2 TYR A 458 6.739 -8.244 -3.286 1.00 3.31 H new ATOM 0 HH TYR A 458 7.562 -9.532 -5.079 1.00 63.14 H new ATOM 375 N GLU A 459 0.685 -8.205 -0.210 1.00 14.03 N ATOM 376 CA GLU A 459 -0.287 -7.819 0.819 1.00 55.31 C ATOM 377 C GLU A 459 -0.110 -6.356 1.233 1.00 42.31 C ATOM 378 O GLU A 459 0.989 -5.929 1.593 1.00 22.42 O ATOM 379 CB GLU A 459 -0.113 -8.691 2.073 1.00 15.12 C ATOM 380 CG GLU A 459 -0.290 -10.187 1.849 1.00 4.22 C ATOM 381 CD GLU A 459 -0.081 -10.978 3.130 1.00 4.52 C ATOM 382 OE1 GLU A 459 -1.039 -11.107 3.920 1.00 23.23 O ATOM 383 OE2 GLU A 459 1.053 -11.446 3.371 1.00 30.32 O ATOM 0 H GLU A 459 1.658 -8.114 0.082 1.00 14.03 H new ATOM 0 HA GLU A 459 -1.279 -7.959 0.390 1.00 55.31 H new ATOM 0 HB2 GLU A 459 0.882 -8.516 2.483 1.00 15.12 H new ATOM 0 HB3 GLU A 459 -0.830 -8.365 2.826 1.00 15.12 H new ATOM 0 HG2 GLU A 459 -1.290 -10.381 1.461 1.00 4.22 H new ATOM 0 HG3 GLU A 459 0.417 -10.527 1.092 1.00 4.22 H new ATOM 390 N VAL A 460 -1.197 -5.598 1.189 1.00 41.25 N ATOM 391 CA VAL A 460 -1.214 -4.239 1.721 1.00 62.42 C ATOM 392 C VAL A 460 -1.962 -4.208 3.063 1.00 71.40 C ATOM 393 O VAL A 460 -3.170 -4.443 3.120 1.00 40.12 O ATOM 394 CB VAL A 460 -1.894 -3.249 0.739 1.00 71.32 C ATOM 395 CG1 VAL A 460 -1.768 -1.810 1.240 1.00 3.14 C ATOM 396 CG2 VAL A 460 -1.316 -3.387 -0.669 1.00 20.01 C ATOM 0 H VAL A 460 -2.084 -5.902 0.788 1.00 41.25 H new ATOM 0 HA VAL A 460 -0.178 -3.930 1.862 1.00 62.42 H new ATOM 0 HB VAL A 460 -2.954 -3.500 0.693 1.00 71.32 H new ATOM 0 HG11 VAL A 460 -2.253 -1.135 0.534 1.00 3.14 H new ATOM 0 HG12 VAL A 460 -2.247 -1.721 2.215 1.00 3.14 H new ATOM 0 HG13 VAL A 460 -0.714 -1.547 1.329 1.00 3.14 H new ATOM 0 HG21 VAL A 460 -1.811 -2.681 -1.336 1.00 20.01 H new ATOM 0 HG22 VAL A 460 -0.247 -3.176 -0.646 1.00 20.01 H new ATOM 0 HG23 VAL A 460 -1.477 -4.403 -1.031 1.00 20.01 H new ATOM 406 N HIS A 461 -1.236 -3.934 4.140 1.00 2.14 N ATOM 407 CA HIS A 461 -1.836 -3.811 5.472 1.00 53.30 C ATOM 408 C HIS A 461 -2.147 -2.342 5.782 1.00 73.04 C ATOM 409 O HIS A 461 -1.243 -1.555 6.056 1.00 25.11 O ATOM 410 CB HIS A 461 -0.894 -4.392 6.539 1.00 10.21 C ATOM 411 CG HIS A 461 -0.789 -5.888 6.510 1.00 4.15 C ATOM 412 ND1 HIS A 461 -1.336 -6.699 7.481 1.00 21.14 N ATOM 413 CD2 HIS A 461 -0.175 -6.721 5.633 1.00 3.11 C ATOM 414 CE1 HIS A 461 -1.060 -7.958 7.207 1.00 30.45 C ATOM 415 NE2 HIS A 461 -0.361 -8.001 6.094 1.00 54.13 N ATOM 0 H HIS A 461 -0.226 -3.791 4.121 1.00 2.14 H new ATOM 0 HA HIS A 461 -2.768 -4.376 5.486 1.00 53.30 H new ATOM 0 HB2 HIS A 461 0.100 -3.965 6.403 1.00 10.21 H new ATOM 0 HB3 HIS A 461 -1.242 -4.081 7.524 1.00 10.21 H new ATOM 0 HD1 HIS A 461 -1.871 -6.375 8.287 1.00 21.14 H new ATOM 0 HD2 HIS A 461 0.360 -6.432 4.740 1.00 3.11 H new ATOM 0 HE1 HIS A 461 -1.358 -8.812 7.798 1.00 30.45 H new ATOM 424 N VAL A 462 -3.425 -1.981 5.720 1.00 72.13 N ATOM 425 CA VAL A 462 -3.860 -0.606 5.962 1.00 63.55 C ATOM 426 C VAL A 462 -4.542 -0.496 7.329 1.00 42.35 C ATOM 427 O VAL A 462 -5.472 -1.243 7.638 1.00 72.31 O ATOM 428 CB VAL A 462 -4.816 -0.108 4.842 1.00 12.12 C ATOM 429 CG1 VAL A 462 -4.130 -0.192 3.481 1.00 21.12 C ATOM 430 CG2 VAL A 462 -6.127 -0.894 4.826 1.00 14.12 C ATOM 0 H VAL A 462 -4.184 -2.626 5.502 1.00 72.13 H new ATOM 0 HA VAL A 462 -2.975 0.030 5.954 1.00 63.55 H new ATOM 0 HB VAL A 462 -5.058 0.933 5.055 1.00 12.12 H new ATOM 0 HG11 VAL A 462 -4.812 0.160 2.707 1.00 21.12 H new ATOM 0 HG12 VAL A 462 -3.235 0.430 3.486 1.00 21.12 H new ATOM 0 HG13 VAL A 462 -3.852 -1.226 3.277 1.00 21.12 H new ATOM 0 HG21 VAL A 462 -6.768 -0.516 4.030 1.00 14.12 H new ATOM 0 HG22 VAL A 462 -5.916 -1.949 4.652 1.00 14.12 H new ATOM 0 HG23 VAL A 462 -6.633 -0.778 5.785 1.00 14.12 H new ATOM 440 N LYS A 463 -4.067 0.422 8.156 1.00 11.42 N ATOM 441 CA LYS A 463 -4.568 0.548 9.524 1.00 61.13 C ATOM 442 C LYS A 463 -4.564 2.001 10.014 1.00 3.13 C ATOM 443 O LYS A 463 -3.818 2.843 9.513 1.00 31.11 O ATOM 444 CB LYS A 463 -3.723 -0.312 10.468 1.00 71.04 C ATOM 445 CG LYS A 463 -2.222 -0.112 10.285 1.00 62.11 C ATOM 446 CD LYS A 463 -1.439 -0.545 11.516 1.00 43.31 C ATOM 447 CE LYS A 463 -1.510 -2.048 11.732 1.00 43.54 C ATOM 448 NZ LYS A 463 -0.746 -2.477 12.929 1.00 34.11 N ATOM 0 H LYS A 463 -3.338 1.091 7.909 1.00 11.42 H new ATOM 0 HA LYS A 463 -5.602 0.203 9.523 1.00 61.13 H new ATOM 0 HB2 LYS A 463 -3.991 -0.079 11.498 1.00 71.04 H new ATOM 0 HB3 LYS A 463 -3.965 -1.362 10.306 1.00 71.04 H new ATOM 0 HG2 LYS A 463 -1.882 -0.681 9.420 1.00 62.11 H new ATOM 0 HG3 LYS A 463 -2.018 0.938 10.076 1.00 62.11 H new ATOM 0 HD2 LYS A 463 -0.397 -0.242 11.409 1.00 43.31 H new ATOM 0 HD3 LYS A 463 -1.831 -0.033 12.395 1.00 43.31 H new ATOM 0 HE2 LYS A 463 -2.552 -2.349 11.840 1.00 43.54 H new ATOM 0 HE3 LYS A 463 -1.120 -2.559 10.852 1.00 43.54 H new ATOM 0 HZ1 LYS A 463 -0.822 -3.508 13.038 1.00 34.11 H new ATOM 0 HZ2 LYS A 463 0.254 -2.213 12.816 1.00 34.11 H new ATOM 0 HZ3 LYS A 463 -1.133 -2.010 13.774 1.00 34.11 H new ATOM 462 N ASN A 464 -5.403 2.273 11.009 1.00 61.05 N ATOM 463 CA ASN A 464 -5.463 3.590 11.647 1.00 13.30 C ATOM 464 C ASN A 464 -5.003 3.478 13.107 1.00 44.10 C ATOM 465 O ASN A 464 -5.536 2.677 13.866 1.00 42.12 O ATOM 466 CB ASN A 464 -6.904 4.111 11.587 1.00 20.35 C ATOM 467 CG ASN A 464 -7.052 5.554 12.035 1.00 54.22 C ATOM 468 OD1 ASN A 464 -6.292 6.062 12.857 1.00 62.41 O ATOM 469 ND2 ASN A 464 -8.051 6.222 11.503 1.00 52.32 N ATOM 0 H ASN A 464 -6.058 1.593 11.396 1.00 61.05 H new ATOM 0 HA ASN A 464 -4.805 4.284 11.124 1.00 13.30 H new ATOM 0 HB2 ASN A 464 -7.272 4.018 10.565 1.00 20.35 H new ATOM 0 HB3 ASN A 464 -7.535 3.479 12.212 1.00 20.35 H new ATOM 0 HD21 ASN A 464 -8.215 7.193 11.770 1.00 52.32 H new ATOM 0 HD22 ASN A 464 -8.663 5.770 10.824 1.00 52.32 H new ATOM 476 N LEU A 465 -4.043 4.302 13.506 1.00 63.01 N ATOM 477 CA LEU A 465 -3.482 4.239 14.864 1.00 41.44 C ATOM 478 C LEU A 465 -3.822 5.497 15.683 1.00 42.41 C ATOM 479 O LEU A 465 -3.431 5.619 16.845 1.00 34.33 O ATOM 480 CB LEU A 465 -1.960 4.051 14.789 1.00 73.41 C ATOM 481 CG LEU A 465 -1.491 2.796 14.029 1.00 53.33 C ATOM 482 CD1 LEU A 465 0.032 2.749 13.941 1.00 1.22 C ATOM 483 CD2 LEU A 465 -2.037 1.528 14.687 1.00 35.22 C ATOM 0 H LEU A 465 -3.632 5.024 12.915 1.00 63.01 H new ATOM 0 HA LEU A 465 -3.932 3.386 15.373 1.00 41.44 H new ATOM 0 HB2 LEU A 465 -1.525 4.929 14.312 1.00 73.41 H new ATOM 0 HB3 LEU A 465 -1.564 4.011 15.804 1.00 73.41 H new ATOM 0 HG LEU A 465 -1.885 2.849 13.014 1.00 53.33 H new ATOM 0 HD11 LEU A 465 0.338 1.854 13.400 1.00 1.22 H new ATOM 0 HD12 LEU A 465 0.393 3.632 13.414 1.00 1.22 H new ATOM 0 HD13 LEU A 465 0.454 2.728 14.946 1.00 1.22 H new ATOM 0 HD21 LEU A 465 -1.693 0.654 14.134 1.00 35.22 H new ATOM 0 HD22 LEU A 465 -1.681 1.470 15.716 1.00 35.22 H new ATOM 0 HD23 LEU A 465 -3.127 1.555 14.681 1.00 35.22 H new ATOM 495 N GLY A 466 -4.564 6.419 15.074 1.00 54.44 N ATOM 496 CA GLY A 466 -4.936 7.657 15.755 1.00 10.33 C ATOM 497 C GLY A 466 -6.065 7.475 16.765 1.00 11.32 C ATOM 498 O GLY A 466 -6.249 8.303 17.657 1.00 0.04 O ATOM 0 H GLY A 466 -4.916 6.335 14.121 1.00 54.44 H new ATOM 0 HA2 GLY A 466 -4.061 8.059 16.267 1.00 10.33 H new ATOM 0 HA3 GLY A 466 -5.238 8.395 15.012 1.00 10.33 H new ATOM 502 N GLY A 467 -6.821 6.388 16.630 1.00 12.33 N ATOM 503 CA GLY A 467 -7.930 6.113 17.547 1.00 54.53 C ATOM 504 C GLY A 467 -9.259 6.743 17.119 1.00 73.31 C ATOM 505 O GLY A 467 -10.208 6.792 17.900 1.00 14.44 O ATOM 0 H GLY A 467 -6.690 5.687 15.901 1.00 12.33 H new ATOM 0 HA2 GLY A 467 -8.061 5.034 17.631 1.00 54.53 H new ATOM 0 HA3 GLY A 467 -7.668 6.480 18.539 1.00 54.53 H new ATOM 509 N ILE A 468 -9.326 7.212 15.873 1.00 42.32 N ATOM 510 CA ILE A 468 -10.564 7.766 15.300 1.00 60.21 C ATOM 511 C ILE A 468 -10.763 7.271 13.858 1.00 51.31 C ATOM 512 O ILE A 468 -9.834 7.301 13.053 1.00 42.13 O ATOM 513 CB ILE A 468 -10.563 9.320 15.341 1.00 62.13 C ATOM 514 CG1 ILE A 468 -11.723 9.897 14.503 1.00 72.42 C ATOM 515 CG2 ILE A 468 -9.221 9.878 14.870 1.00 2.11 C ATOM 516 CD1 ILE A 468 -11.828 11.408 14.559 1.00 44.35 C ATOM 0 H ILE A 468 -8.533 7.221 15.232 1.00 42.32 H new ATOM 0 HA ILE A 468 -11.396 7.414 15.910 1.00 60.21 H new ATOM 0 HB ILE A 468 -10.712 9.627 16.376 1.00 62.13 H new ATOM 0 HG12 ILE A 468 -11.596 9.590 13.465 1.00 72.42 H new ATOM 0 HG13 ILE A 468 -12.661 9.464 14.852 1.00 72.42 H new ATOM 0 HG21 ILE A 468 -9.246 10.967 14.908 1.00 2.11 H new ATOM 0 HG22 ILE A 468 -8.426 9.511 15.519 1.00 2.11 H new ATOM 0 HG23 ILE A 468 -9.032 9.555 13.846 1.00 2.11 H new ATOM 0 HD11 ILE A 468 -12.666 11.737 13.945 1.00 44.35 H new ATOM 0 HD12 ILE A 468 -11.987 11.724 15.590 1.00 44.35 H new ATOM 0 HD13 ILE A 468 -10.906 11.851 14.182 1.00 44.35 H new ATOM 528 N GLY A 469 -11.977 6.822 13.544 1.00 33.31 N ATOM 529 CA GLY A 469 -12.247 6.192 12.254 1.00 25.33 C ATOM 530 C GLY A 469 -12.411 7.167 11.086 1.00 21.13 C ATOM 531 O GLY A 469 -13.072 8.201 11.209 1.00 71.21 O ATOM 0 H GLY A 469 -12.786 6.883 14.163 1.00 33.31 H new ATOM 0 HA2 GLY A 469 -11.433 5.505 12.024 1.00 25.33 H new ATOM 0 HA3 GLY A 469 -13.154 5.594 12.340 1.00 25.33 H new ATOM 535 N VAL A 470 -11.819 6.817 9.941 1.00 33.05 N ATOM 536 CA VAL A 470 -11.921 7.620 8.716 1.00 20.12 C ATOM 537 C VAL A 470 -12.481 6.783 7.545 1.00 21.33 C ATOM 538 O VAL A 470 -11.840 5.840 7.079 1.00 3.21 O ATOM 539 CB VAL A 470 -10.538 8.196 8.305 1.00 31.12 C ATOM 540 CG1 VAL A 470 -10.662 9.097 7.075 1.00 53.42 C ATOM 541 CG2 VAL A 470 -9.894 8.951 9.470 1.00 52.12 C ATOM 0 H VAL A 470 -11.257 5.972 9.835 1.00 33.05 H new ATOM 0 HA VAL A 470 -12.604 8.442 8.932 1.00 20.12 H new ATOM 0 HB VAL A 470 -9.890 7.359 8.044 1.00 31.12 H new ATOM 0 HG11 VAL A 470 -9.679 9.487 6.809 1.00 53.42 H new ATOM 0 HG12 VAL A 470 -11.062 8.521 6.241 1.00 53.42 H new ATOM 0 HG13 VAL A 470 -11.333 9.926 7.298 1.00 53.42 H new ATOM 0 HG21 VAL A 470 -8.927 9.345 9.158 1.00 52.12 H new ATOM 0 HG22 VAL A 470 -10.541 9.775 9.772 1.00 52.12 H new ATOM 0 HG23 VAL A 470 -9.755 8.272 10.311 1.00 52.12 H new ATOM 551 N PRO A 471 -13.699 7.110 7.062 1.00 23.33 N ATOM 552 CA PRO A 471 -14.297 6.454 5.884 1.00 0.42 C ATOM 553 C PRO A 471 -13.821 7.068 4.552 1.00 22.52 C ATOM 554 O PRO A 471 -14.055 6.519 3.476 1.00 43.52 O ATOM 555 CB PRO A 471 -15.791 6.699 6.099 1.00 2.22 C ATOM 556 CG PRO A 471 -15.855 8.020 6.795 1.00 25.20 C ATOM 557 CD PRO A 471 -14.611 8.118 7.649 1.00 14.21 C ATOM 0 HA PRO A 471 -14.021 5.402 5.805 1.00 0.42 H new ATOM 0 HB2 PRO A 471 -16.330 6.722 5.152 1.00 2.22 H new ATOM 0 HB3 PRO A 471 -16.240 5.910 6.702 1.00 2.22 H new ATOM 0 HG2 PRO A 471 -15.895 8.836 6.074 1.00 25.20 H new ATOM 0 HG3 PRO A 471 -16.753 8.092 7.409 1.00 25.20 H new ATOM 0 HD2 PRO A 471 -14.179 9.118 7.613 1.00 14.21 H new ATOM 0 HD3 PRO A 471 -14.826 7.902 8.695 1.00 14.21 H new ATOM 565 N SER A 472 -13.144 8.206 4.646 1.00 55.14 N ATOM 566 CA SER A 472 -12.676 8.967 3.473 1.00 63.43 C ATOM 567 C SER A 472 -11.340 8.432 2.918 1.00 42.31 C ATOM 568 O SER A 472 -10.718 9.058 2.058 1.00 14.13 O ATOM 569 CB SER A 472 -12.535 10.453 3.837 1.00 73.14 C ATOM 570 OG SER A 472 -12.199 11.236 2.702 1.00 15.34 O ATOM 0 H SER A 472 -12.898 8.636 5.538 1.00 55.14 H new ATOM 0 HA SER A 472 -13.423 8.845 2.689 1.00 63.43 H new ATOM 0 HB2 SER A 472 -13.470 10.814 4.266 1.00 73.14 H new ATOM 0 HB3 SER A 472 -11.767 10.570 4.602 1.00 73.14 H new ATOM 0 HG SER A 472 -11.379 11.741 2.884 1.00 15.34 H new ATOM 576 N THR A 473 -10.914 7.263 3.389 1.00 72.53 N ATOM 577 CA THR A 473 -9.541 6.785 3.168 1.00 51.51 C ATOM 578 C THR A 473 -9.391 5.951 1.880 1.00 74.44 C ATOM 579 O THR A 473 -9.932 4.852 1.759 1.00 45.34 O ATOM 580 CB THR A 473 -9.078 5.919 4.366 1.00 1.12 C ATOM 581 OG1 THR A 473 -9.071 6.698 5.571 1.00 54.31 O ATOM 582 CG2 THR A 473 -7.694 5.333 4.132 1.00 44.24 C ATOM 0 H THR A 473 -11.497 6.623 3.928 1.00 72.53 H new ATOM 0 HA THR A 473 -8.922 7.677 3.066 1.00 51.51 H new ATOM 0 HB THR A 473 -9.785 5.096 4.466 1.00 1.12 H new ATOM 0 HG1 THR A 473 -9.914 6.563 6.053 1.00 54.31 H new ATOM 0 HG21 THR A 473 -7.403 4.732 4.993 1.00 44.24 H new ATOM 0 HG22 THR A 473 -7.710 4.706 3.241 1.00 44.24 H new ATOM 0 HG23 THR A 473 -6.975 6.141 3.994 1.00 44.24 H new ATOM 590 N LYS A 474 -8.639 6.492 0.917 1.00 11.13 N ATOM 591 CA LYS A 474 -8.308 5.775 -0.326 1.00 4.45 C ATOM 592 C LYS A 474 -6.857 5.254 -0.312 1.00 73.22 C ATOM 593 O LYS A 474 -5.925 5.996 0.004 1.00 13.33 O ATOM 594 CB LYS A 474 -8.515 6.686 -1.546 1.00 44.41 C ATOM 595 CG LYS A 474 -9.948 7.185 -1.710 1.00 41.34 C ATOM 596 CD LYS A 474 -10.132 7.963 -3.011 1.00 55.14 C ATOM 597 CE LYS A 474 -11.569 8.444 -3.190 1.00 52.03 C ATOM 598 NZ LYS A 474 -11.759 9.157 -4.485 1.00 51.11 N ATOM 0 H LYS A 474 -8.244 7.431 0.972 1.00 11.13 H new ATOM 0 HA LYS A 474 -8.979 4.919 -0.394 1.00 4.45 H new ATOM 0 HB2 LYS A 474 -7.849 7.545 -1.463 1.00 44.41 H new ATOM 0 HB3 LYS A 474 -8.225 6.143 -2.446 1.00 44.41 H new ATOM 0 HG2 LYS A 474 -10.632 6.337 -1.694 1.00 41.34 H new ATOM 0 HG3 LYS A 474 -10.210 7.822 -0.865 1.00 41.34 H new ATOM 0 HD2 LYS A 474 -9.459 8.820 -3.019 1.00 55.14 H new ATOM 0 HD3 LYS A 474 -9.853 7.331 -3.854 1.00 55.14 H new ATOM 0 HE2 LYS A 474 -12.246 7.591 -3.142 1.00 52.03 H new ATOM 0 HE3 LYS A 474 -11.835 9.108 -2.368 1.00 52.03 H new ATOM 0 HZ1 LYS A 474 -12.748 9.468 -4.568 1.00 51.11 H new ATOM 0 HZ2 LYS A 474 -11.132 9.986 -4.520 1.00 51.11 H new ATOM 0 HZ3 LYS A 474 -11.530 8.516 -5.271 1.00 51.11 H new ATOM 612 N VAL A 475 -6.681 3.977 -0.655 1.00 61.44 N ATOM 613 CA VAL A 475 -5.356 3.334 -0.692 1.00 11.43 C ATOM 614 C VAL A 475 -4.924 3.027 -2.139 1.00 43.21 C ATOM 615 O VAL A 475 -5.688 2.451 -2.913 1.00 14.31 O ATOM 616 CB VAL A 475 -5.366 2.014 0.119 1.00 32.21 C ATOM 617 CG1 VAL A 475 -3.980 1.365 0.131 1.00 53.45 C ATOM 618 CG2 VAL A 475 -5.869 2.261 1.540 1.00 45.43 C ATOM 0 H VAL A 475 -7.447 3.356 -0.915 1.00 61.44 H new ATOM 0 HA VAL A 475 -4.646 4.032 -0.249 1.00 11.43 H new ATOM 0 HB VAL A 475 -6.051 1.321 -0.369 1.00 32.21 H new ATOM 0 HG11 VAL A 475 -4.016 0.440 0.707 1.00 53.45 H new ATOM 0 HG12 VAL A 475 -3.673 1.144 -0.891 1.00 53.45 H new ATOM 0 HG13 VAL A 475 -3.262 2.048 0.586 1.00 53.45 H new ATOM 0 HG21 VAL A 475 -5.869 1.322 2.094 1.00 45.43 H new ATOM 0 HG22 VAL A 475 -5.215 2.977 2.038 1.00 45.43 H new ATOM 0 HG23 VAL A 475 -6.883 2.660 1.503 1.00 45.43 H new ATOM 628 N ARG A 476 -3.703 3.413 -2.505 1.00 4.44 N ATOM 629 CA ARG A 476 -3.185 3.160 -3.860 1.00 2.23 C ATOM 630 C ARG A 476 -1.836 2.422 -3.826 1.00 71.44 C ATOM 631 O ARG A 476 -1.072 2.538 -2.870 1.00 75.12 O ATOM 632 CB ARG A 476 -3.038 4.482 -4.635 1.00 4.51 C ATOM 633 CG ARG A 476 -4.364 5.192 -4.905 1.00 72.33 C ATOM 634 CD ARG A 476 -4.179 6.464 -5.730 1.00 53.05 C ATOM 635 NE ARG A 476 -5.449 7.152 -5.959 1.00 70.43 N ATOM 636 CZ ARG A 476 -5.644 8.436 -5.793 1.00 64.05 C ATOM 637 NH1 ARG A 476 -4.669 9.224 -5.461 1.00 51.34 N ATOM 638 NH2 ARG A 476 -6.823 8.931 -5.983 1.00 62.23 N ATOM 0 H ARG A 476 -3.052 3.900 -1.890 1.00 4.44 H new ATOM 0 HA ARG A 476 -3.906 2.521 -4.370 1.00 2.23 H new ATOM 0 HB2 ARG A 476 -2.387 5.151 -4.073 1.00 4.51 H new ATOM 0 HB3 ARG A 476 -2.544 4.281 -5.586 1.00 4.51 H new ATOM 0 HG2 ARG A 476 -5.037 4.514 -5.431 1.00 72.33 H new ATOM 0 HG3 ARG A 476 -4.840 5.442 -3.957 1.00 72.33 H new ATOM 0 HD2 ARG A 476 -3.490 7.134 -5.215 1.00 53.05 H new ATOM 0 HD3 ARG A 476 -3.724 6.213 -6.688 1.00 53.05 H new ATOM 0 HE ARG A 476 -6.241 6.590 -6.271 1.00 70.43 H new ATOM 0 HH11 ARG A 476 -3.731 8.846 -5.325 1.00 51.34 H new ATOM 0 HH12 ARG A 476 -4.840 10.222 -5.336 1.00 51.34 H new ATOM 0 HH21 ARG A 476 -7.593 8.322 -6.260 1.00 62.23 H new ATOM 0 HH22 ARG A 476 -6.983 9.930 -5.856 1.00 62.23 H new ATOM 652 N VAL A 477 -1.555 1.662 -4.887 1.00 42.14 N ATOM 653 CA VAL A 477 -0.280 0.943 -5.026 1.00 11.51 C ATOM 654 C VAL A 477 0.459 1.384 -6.296 1.00 33.44 C ATOM 655 O VAL A 477 -0.111 1.390 -7.387 1.00 32.10 O ATOM 656 CB VAL A 477 -0.490 -0.595 -5.074 1.00 25.45 C ATOM 657 CG1 VAL A 477 0.825 -1.318 -5.363 1.00 51.40 C ATOM 658 CG2 VAL A 477 -1.100 -1.095 -3.767 1.00 31.34 C ATOM 0 H VAL A 477 -2.196 1.526 -5.669 1.00 42.14 H new ATOM 0 HA VAL A 477 0.318 1.189 -4.148 1.00 11.51 H new ATOM 0 HB VAL A 477 -1.183 -0.816 -5.886 1.00 25.45 H new ATOM 0 HG11 VAL A 477 0.650 -2.394 -5.391 1.00 51.40 H new ATOM 0 HG12 VAL A 477 1.217 -0.989 -6.325 1.00 51.40 H new ATOM 0 HG13 VAL A 477 1.547 -1.088 -4.579 1.00 51.40 H new ATOM 0 HG21 VAL A 477 -1.239 -2.175 -3.820 1.00 31.34 H new ATOM 0 HG22 VAL A 477 -0.433 -0.856 -2.939 1.00 31.34 H new ATOM 0 HG23 VAL A 477 -2.064 -0.612 -3.607 1.00 31.34 H new ATOM 668 N TYR A 478 1.729 1.751 -6.146 1.00 1.31 N ATOM 669 CA TYR A 478 2.540 2.232 -7.266 1.00 52.42 C ATOM 670 C TYR A 478 3.753 1.326 -7.514 1.00 11.03 C ATOM 671 O TYR A 478 4.436 0.918 -6.578 1.00 51.12 O ATOM 672 CB TYR A 478 3.029 3.659 -6.981 1.00 11.21 C ATOM 673 CG TYR A 478 1.913 4.644 -6.684 1.00 22.34 C ATOM 674 CD1 TYR A 478 1.291 5.347 -7.709 1.00 55.01 C ATOM 675 CD2 TYR A 478 1.483 4.869 -5.380 1.00 3.44 C ATOM 676 CE1 TYR A 478 0.275 6.242 -7.444 1.00 21.23 C ATOM 677 CE2 TYR A 478 0.467 5.763 -5.110 1.00 13.03 C ATOM 678 CZ TYR A 478 -0.134 6.446 -6.145 1.00 31.35 C ATOM 679 OH TYR A 478 -1.147 7.335 -5.881 1.00 21.33 O ATOM 0 H TYR A 478 2.223 1.725 -5.254 1.00 1.31 H new ATOM 0 HA TYR A 478 1.913 2.220 -8.157 1.00 52.42 H new ATOM 0 HB2 TYR A 478 3.714 3.635 -6.134 1.00 11.21 H new ATOM 0 HB3 TYR A 478 3.597 4.016 -7.840 1.00 11.21 H new ATOM 0 HD1 TYR A 478 1.608 5.190 -8.729 1.00 55.01 H new ATOM 0 HD2 TYR A 478 1.952 4.336 -4.566 1.00 3.44 H new ATOM 0 HE1 TYR A 478 -0.198 6.780 -8.252 1.00 21.23 H new ATOM 0 HE2 TYR A 478 0.144 5.927 -4.092 1.00 13.03 H new ATOM 0 HH TYR A 478 -1.761 7.367 -6.644 1.00 21.33 H new ATOM 689 N ILE A 479 4.020 1.030 -8.781 1.00 32.31 N ATOM 690 CA ILE A 479 5.221 0.289 -9.175 1.00 52.12 C ATOM 691 C ILE A 479 6.212 1.231 -9.878 1.00 11.34 C ATOM 692 O ILE A 479 5.973 1.670 -11.006 1.00 31.33 O ATOM 693 CB ILE A 479 4.868 -0.898 -10.105 1.00 33.52 C ATOM 694 CG1 ILE A 479 3.856 -1.832 -9.415 1.00 42.15 C ATOM 695 CG2 ILE A 479 6.131 -1.666 -10.503 1.00 22.32 C ATOM 696 CD1 ILE A 479 3.387 -2.983 -10.280 1.00 73.04 C ATOM 0 H ILE A 479 3.418 1.293 -9.561 1.00 32.31 H new ATOM 0 HA ILE A 479 5.682 -0.114 -8.273 1.00 52.12 H new ATOM 0 HB ILE A 479 4.412 -0.504 -11.013 1.00 33.52 H new ATOM 0 HG12 ILE A 479 4.308 -2.234 -8.508 1.00 42.15 H new ATOM 0 HG13 ILE A 479 2.990 -1.247 -9.107 1.00 42.15 H new ATOM 0 HG21 ILE A 479 5.862 -2.496 -11.156 1.00 22.32 H new ATOM 0 HG22 ILE A 479 6.813 -0.997 -11.028 1.00 22.32 H new ATOM 0 HG23 ILE A 479 6.619 -2.052 -9.608 1.00 22.32 H new ATOM 0 HD11 ILE A 479 2.677 -3.593 -9.721 1.00 73.04 H new ATOM 0 HD12 ILE A 479 2.903 -2.592 -11.175 1.00 73.04 H new ATOM 0 HD13 ILE A 479 4.243 -3.594 -10.568 1.00 73.04 H new ATOM 708 N ASN A 480 7.309 1.556 -9.192 1.00 62.52 N ATOM 709 CA ASN A 480 8.281 2.551 -9.675 1.00 33.11 C ATOM 710 C ASN A 480 7.608 3.910 -9.944 1.00 72.14 C ATOM 711 O ASN A 480 8.016 4.657 -10.835 1.00 20.12 O ATOM 712 CB ASN A 480 9.005 2.049 -10.937 1.00 23.22 C ATOM 713 CG ASN A 480 9.925 0.877 -10.648 1.00 41.42 C ATOM 714 OD1 ASN A 480 10.399 0.709 -9.529 1.00 12.11 O ATOM 715 ND2 ASN A 480 10.207 0.068 -11.651 1.00 72.10 N ATOM 0 H ASN A 480 7.552 1.143 -8.292 1.00 62.52 H new ATOM 0 HA ASN A 480 9.021 2.692 -8.888 1.00 33.11 H new ATOM 0 HB2 ASN A 480 8.267 1.753 -11.683 1.00 23.22 H new ATOM 0 HB3 ASN A 480 9.585 2.865 -11.369 1.00 23.22 H new ATOM 0 HD21 ASN A 480 10.835 -0.723 -11.507 1.00 72.10 H new ATOM 0 HD22 ASN A 480 9.797 0.233 -12.570 1.00 72.10 H new ATOM 722 N GLY A 481 6.595 4.239 -9.141 1.00 43.50 N ATOM 723 CA GLY A 481 5.905 5.522 -9.271 1.00 41.35 C ATOM 724 C GLY A 481 4.582 5.436 -10.036 1.00 4.11 C ATOM 725 O GLY A 481 3.684 6.253 -9.823 1.00 1.05 O ATOM 0 H GLY A 481 6.236 3.639 -8.398 1.00 43.50 H new ATOM 0 HA2 GLY A 481 5.713 5.924 -8.276 1.00 41.35 H new ATOM 0 HA3 GLY A 481 6.562 6.228 -9.778 1.00 41.35 H new ATOM 729 N THR A 482 4.458 4.451 -10.924 1.00 22.42 N ATOM 730 CA THR A 482 3.250 4.294 -11.752 1.00 63.51 C ATOM 731 C THR A 482 2.128 3.572 -10.990 1.00 71.25 C ATOM 732 O THR A 482 2.349 2.512 -10.408 1.00 40.32 O ATOM 733 CB THR A 482 3.560 3.506 -13.052 1.00 60.14 C ATOM 734 OG1 THR A 482 4.580 4.178 -13.813 1.00 65.14 O ATOM 735 CG2 THR A 482 2.311 3.341 -13.917 1.00 2.31 C ATOM 0 H THR A 482 5.176 3.747 -11.093 1.00 22.42 H new ATOM 0 HA THR A 482 2.916 5.300 -12.006 1.00 63.51 H new ATOM 0 HB THR A 482 3.912 2.517 -12.759 1.00 60.14 H new ATOM 0 HG1 THR A 482 4.767 3.670 -14.630 1.00 65.14 H new ATOM 0 HG21 THR A 482 2.564 2.785 -14.819 1.00 2.31 H new ATOM 0 HG22 THR A 482 1.550 2.797 -13.357 1.00 2.31 H new ATOM 0 HG23 THR A 482 1.927 4.323 -14.192 1.00 2.31 H new ATOM 743 N LEU A 483 0.925 4.147 -10.997 1.00 24.41 N ATOM 744 CA LEU A 483 -0.223 3.551 -10.300 1.00 62.01 C ATOM 745 C LEU A 483 -0.641 2.208 -10.929 1.00 14.13 C ATOM 746 O LEU A 483 -0.969 2.133 -12.114 1.00 2.15 O ATOM 747 CB LEU A 483 -1.416 4.523 -10.296 1.00 50.13 C ATOM 748 CG LEU A 483 -2.679 4.008 -9.578 1.00 32.00 C ATOM 749 CD1 LEU A 483 -2.378 3.678 -8.119 1.00 75.33 C ATOM 750 CD2 LEU A 483 -3.814 5.027 -9.675 1.00 4.35 C ATOM 0 H LEU A 483 0.717 5.023 -11.476 1.00 24.41 H new ATOM 0 HA LEU A 483 0.087 3.358 -9.273 1.00 62.01 H new ATOM 0 HB2 LEU A 483 -1.104 5.455 -9.824 1.00 50.13 H new ATOM 0 HB3 LEU A 483 -1.675 4.760 -11.328 1.00 50.13 H new ATOM 0 HG LEU A 483 -2.999 3.093 -10.076 1.00 32.00 H new ATOM 0 HD11 LEU A 483 -3.284 3.317 -7.633 1.00 75.33 H new ATOM 0 HD12 LEU A 483 -1.609 2.907 -8.072 1.00 75.33 H new ATOM 0 HD13 LEU A 483 -2.025 4.574 -7.609 1.00 75.33 H new ATOM 0 HD21 LEU A 483 -4.694 4.641 -9.161 1.00 4.35 H new ATOM 0 HD22 LEU A 483 -3.504 5.963 -9.210 1.00 4.35 H new ATOM 0 HD23 LEU A 483 -4.055 5.205 -10.723 1.00 4.35 H new ATOM 762 N TYR A 484 -0.617 1.156 -10.116 1.00 62.34 N ATOM 763 CA TYR A 484 -1.011 -0.188 -10.549 1.00 45.40 C ATOM 764 C TYR A 484 -2.500 -0.464 -10.265 1.00 72.15 C ATOM 765 O TYR A 484 -3.216 -1.001 -11.115 1.00 30.35 O ATOM 766 CB TYR A 484 -0.131 -1.220 -9.823 1.00 32.21 C ATOM 767 CG TYR A 484 -0.547 -2.666 -10.031 1.00 1.13 C ATOM 768 CD1 TYR A 484 -0.156 -3.373 -11.164 1.00 3.34 C ATOM 769 CD2 TYR A 484 -1.328 -3.327 -9.086 1.00 1.45 C ATOM 770 CE1 TYR A 484 -0.531 -4.689 -11.346 1.00 14.12 C ATOM 771 CE2 TYR A 484 -1.704 -4.643 -9.263 1.00 52.02 C ATOM 772 CZ TYR A 484 -1.304 -5.319 -10.394 1.00 64.11 C ATOM 773 OH TYR A 484 -1.670 -6.634 -10.568 1.00 31.33 O ATOM 0 H TYR A 484 -0.325 1.207 -9.140 1.00 62.34 H new ATOM 0 HA TYR A 484 -0.869 -0.264 -11.627 1.00 45.40 H new ATOM 0 HB2 TYR A 484 0.899 -1.100 -10.160 1.00 32.21 H new ATOM 0 HB3 TYR A 484 -0.145 -1.002 -8.755 1.00 32.21 H new ATOM 0 HD1 TYR A 484 0.450 -2.885 -11.913 1.00 3.34 H new ATOM 0 HD2 TYR A 484 -1.645 -2.800 -8.198 1.00 1.45 H new ATOM 0 HE1 TYR A 484 -0.220 -5.223 -12.231 1.00 14.12 H new ATOM 0 HE2 TYR A 484 -2.309 -5.140 -8.519 1.00 52.02 H new ATOM 0 HH TYR A 484 -2.212 -6.926 -9.806 1.00 31.33 H new ATOM 783 N LYS A 485 -2.964 -0.081 -9.074 1.00 42.34 N ATOM 784 CA LYS A 485 -4.347 -0.351 -8.650 1.00 55.14 C ATOM 785 C LYS A 485 -4.748 0.562 -7.476 1.00 53.35 C ATOM 786 O LYS A 485 -3.886 1.029 -6.725 1.00 54.34 O ATOM 787 CB LYS A 485 -4.481 -1.832 -8.253 1.00 15.41 C ATOM 788 CG LYS A 485 -5.917 -2.311 -8.059 1.00 53.42 C ATOM 789 CD LYS A 485 -5.969 -3.808 -7.759 1.00 72.53 C ATOM 790 CE LYS A 485 -7.398 -4.325 -7.633 1.00 14.15 C ATOM 791 NZ LYS A 485 -8.154 -4.199 -8.909 1.00 10.23 N ATOM 0 H LYS A 485 -2.405 0.418 -8.382 1.00 42.34 H new ATOM 0 HA LYS A 485 -5.020 -0.140 -9.481 1.00 55.14 H new ATOM 0 HB2 LYS A 485 -4.008 -2.444 -9.021 1.00 15.41 H new ATOM 0 HB3 LYS A 485 -3.929 -1.998 -7.328 1.00 15.41 H new ATOM 0 HG2 LYS A 485 -6.379 -1.758 -7.241 1.00 53.42 H new ATOM 0 HG3 LYS A 485 -6.498 -2.098 -8.956 1.00 53.42 H new ATOM 0 HD2 LYS A 485 -5.457 -4.353 -8.552 1.00 72.53 H new ATOM 0 HD3 LYS A 485 -5.429 -4.010 -6.834 1.00 72.53 H new ATOM 0 HE2 LYS A 485 -7.379 -5.370 -7.325 1.00 14.15 H new ATOM 0 HE3 LYS A 485 -7.915 -3.771 -6.849 1.00 14.15 H new ATOM 0 HZ1 LYS A 485 -9.040 -4.740 -8.842 1.00 10.23 H new ATOM 0 HZ2 LYS A 485 -8.372 -3.198 -9.086 1.00 10.23 H new ATOM 0 HZ3 LYS A 485 -7.579 -4.572 -9.691 1.00 10.23 H new ATOM 805 N ASN A 486 -6.049 0.821 -7.324 1.00 20.31 N ATOM 806 CA ASN A 486 -6.540 1.710 -6.256 1.00 61.23 C ATOM 807 C ASN A 486 -7.793 1.146 -5.552 1.00 55.32 C ATOM 808 O ASN A 486 -8.618 0.469 -6.169 1.00 5.44 O ATOM 809 CB ASN A 486 -6.844 3.102 -6.831 1.00 32.33 C ATOM 810 CG ASN A 486 -7.986 3.092 -7.836 1.00 42.11 C ATOM 811 OD1 ASN A 486 -9.148 3.283 -7.483 1.00 25.14 O ATOM 812 ND2 ASN A 486 -7.671 2.866 -9.097 1.00 11.45 N ATOM 0 H ASN A 486 -6.781 0.433 -7.920 1.00 20.31 H new ATOM 0 HA ASN A 486 -5.752 1.783 -5.507 1.00 61.23 H new ATOM 0 HB2 ASN A 486 -7.091 3.780 -6.015 1.00 32.33 H new ATOM 0 HB3 ASN A 486 -5.948 3.495 -7.311 1.00 32.33 H new ATOM 0 HD21 ASN A 486 -8.401 2.846 -9.809 1.00 11.45 H new ATOM 0 HD22 ASN A 486 -6.698 2.711 -9.360 1.00 11.45 H new ATOM 819 N TRP A 487 -7.923 1.446 -4.259 1.00 20.10 N ATOM 820 CA TRP A 487 -9.096 1.050 -3.462 1.00 54.42 C ATOM 821 C TRP A 487 -9.618 2.236 -2.628 1.00 24.04 C ATOM 822 O TRP A 487 -8.838 3.077 -2.179 1.00 3.32 O ATOM 823 CB TRP A 487 -8.745 -0.092 -2.493 1.00 74.41 C ATOM 824 CG TRP A 487 -8.243 -1.352 -3.141 1.00 53.25 C ATOM 825 CD1 TRP A 487 -8.993 -2.356 -3.682 1.00 50.04 C ATOM 826 CD2 TRP A 487 -6.875 -1.752 -3.282 1.00 51.31 C ATOM 827 NE1 TRP A 487 -8.173 -3.352 -4.156 1.00 34.41 N ATOM 828 CE2 TRP A 487 -6.869 -3.002 -3.926 1.00 62.34 C ATOM 829 CE3 TRP A 487 -5.654 -1.169 -2.933 1.00 12.52 C ATOM 830 CZ2 TRP A 487 -5.691 -3.684 -4.222 1.00 1.44 C ATOM 831 CZ3 TRP A 487 -4.486 -1.843 -3.229 1.00 65.44 C ATOM 832 CH2 TRP A 487 -4.510 -3.090 -3.870 1.00 51.53 C ATOM 0 H TRP A 487 -7.223 1.968 -3.732 1.00 20.10 H new ATOM 0 HA TRP A 487 -9.861 0.720 -4.164 1.00 54.42 H new ATOM 0 HB2 TRP A 487 -7.987 0.265 -1.796 1.00 74.41 H new ATOM 0 HB3 TRP A 487 -9.631 -0.333 -1.905 1.00 74.41 H new ATOM 0 HD1 TRP A 487 -10.072 -2.366 -3.730 1.00 50.04 H new ATOM 0 HE1 TRP A 487 -8.485 -4.212 -4.606 1.00 34.41 H new ATOM 0 HE3 TRP A 487 -5.624 -0.208 -2.440 1.00 12.52 H new ATOM 0 HZ2 TRP A 487 -5.709 -4.647 -4.711 1.00 1.44 H new ATOM 0 HZ3 TRP A 487 -3.537 -1.402 -2.962 1.00 65.44 H new ATOM 0 HH2 TRP A 487 -3.579 -3.591 -4.090 1.00 51.53 H new ATOM 843 N THR A 488 -10.931 2.299 -2.419 1.00 32.35 N ATOM 844 CA THR A 488 -11.517 3.248 -1.451 1.00 25.11 C ATOM 845 C THR A 488 -12.173 2.480 -0.300 1.00 72.34 C ATOM 846 O THR A 488 -13.117 1.718 -0.514 1.00 72.42 O ATOM 847 CB THR A 488 -12.568 4.183 -2.106 1.00 74.34 C ATOM 848 OG1 THR A 488 -11.959 4.963 -3.146 1.00 24.13 O ATOM 849 CG2 THR A 488 -13.195 5.120 -1.073 1.00 52.01 C ATOM 0 H THR A 488 -11.613 1.712 -2.899 1.00 32.35 H new ATOM 0 HA THR A 488 -10.703 3.870 -1.077 1.00 25.11 H new ATOM 0 HB THR A 488 -13.352 3.555 -2.529 1.00 74.34 H new ATOM 0 HG1 THR A 488 -12.655 5.427 -3.657 1.00 24.13 H new ATOM 0 HG21 THR A 488 -13.927 5.763 -1.562 1.00 52.01 H new ATOM 0 HG22 THR A 488 -13.688 4.531 -0.300 1.00 52.01 H new ATOM 0 HG23 THR A 488 -12.417 5.735 -0.620 1.00 52.01 H new ATOM 857 N VAL A 489 -11.684 2.691 0.924 1.00 33.35 N ATOM 858 CA VAL A 489 -12.118 1.893 2.079 1.00 43.20 C ATOM 859 C VAL A 489 -12.354 2.752 3.331 1.00 2.11 C ATOM 860 O VAL A 489 -12.064 3.950 3.356 1.00 44.11 O ATOM 861 CB VAL A 489 -11.076 0.789 2.425 1.00 0.53 C ATOM 862 CG1 VAL A 489 -10.919 -0.207 1.275 1.00 63.31 C ATOM 863 CG2 VAL A 489 -9.728 1.410 2.789 1.00 22.53 C ATOM 0 H VAL A 489 -10.989 3.405 1.143 1.00 33.35 H new ATOM 0 HA VAL A 489 -13.063 1.435 1.787 1.00 43.20 H new ATOM 0 HB VAL A 489 -11.448 0.242 3.292 1.00 0.53 H new ATOM 0 HG11 VAL A 489 -10.185 -0.965 1.548 1.00 63.31 H new ATOM 0 HG12 VAL A 489 -11.878 -0.686 1.075 1.00 63.31 H new ATOM 0 HG13 VAL A 489 -10.583 0.319 0.381 1.00 63.31 H new ATOM 0 HG21 VAL A 489 -9.016 0.620 3.027 1.00 22.53 H new ATOM 0 HG22 VAL A 489 -9.356 1.992 1.946 1.00 22.53 H new ATOM 0 HG23 VAL A 489 -9.849 2.062 3.654 1.00 22.53 H new ATOM 873 N SER A 490 -12.896 2.121 4.368 1.00 21.24 N ATOM 874 CA SER A 490 -13.102 2.770 5.666 1.00 43.10 C ATOM 875 C SER A 490 -12.255 2.091 6.749 1.00 71.30 C ATOM 876 O SER A 490 -12.203 0.860 6.830 1.00 20.15 O ATOM 877 CB SER A 490 -14.586 2.708 6.059 1.00 54.22 C ATOM 878 OG SER A 490 -15.029 1.364 6.190 1.00 31.22 O ATOM 0 H SER A 490 -13.205 1.149 4.337 1.00 21.24 H new ATOM 0 HA SER A 490 -12.795 3.812 5.580 1.00 43.10 H new ATOM 0 HB2 SER A 490 -14.738 3.237 7.000 1.00 54.22 H new ATOM 0 HB3 SER A 490 -15.186 3.219 5.306 1.00 54.22 H new ATOM 0 HG SER A 490 -15.976 1.355 6.442 1.00 31.22 H new ATOM 884 N LEU A 491 -11.574 2.887 7.570 1.00 42.32 N ATOM 885 CA LEU A 491 -10.789 2.348 8.689 1.00 14.22 C ATOM 886 C LEU A 491 -11.219 2.979 10.018 1.00 55.21 C ATOM 887 O LEU A 491 -11.100 4.188 10.209 1.00 34.43 O ATOM 888 CB LEU A 491 -9.286 2.587 8.457 1.00 43.40 C ATOM 889 CG LEU A 491 -8.669 1.815 7.277 1.00 13.23 C ATOM 890 CD1 LEU A 491 -7.196 2.182 7.097 1.00 43.30 C ATOM 891 CD2 LEU A 491 -8.831 0.308 7.476 1.00 72.01 C ATOM 0 H LEU A 491 -11.547 3.903 7.486 1.00 42.32 H new ATOM 0 HA LEU A 491 -10.975 1.275 8.741 1.00 14.22 H new ATOM 0 HB2 LEU A 491 -9.126 3.653 8.295 1.00 43.40 H new ATOM 0 HB3 LEU A 491 -8.748 2.318 9.366 1.00 43.40 H new ATOM 0 HG LEU A 491 -9.201 2.099 6.369 1.00 13.23 H new ATOM 0 HD11 LEU A 491 -6.782 1.624 6.257 1.00 43.30 H new ATOM 0 HD12 LEU A 491 -7.109 3.251 6.901 1.00 43.30 H new ATOM 0 HD13 LEU A 491 -6.646 1.934 8.004 1.00 43.30 H new ATOM 0 HD21 LEU A 491 -8.389 -0.220 6.631 1.00 72.01 H new ATOM 0 HD22 LEU A 491 -8.330 0.006 8.396 1.00 72.01 H new ATOM 0 HD23 LEU A 491 -9.891 0.062 7.543 1.00 72.01 H new ATOM 903 N GLY A 492 -11.693 2.142 10.938 1.00 22.33 N ATOM 904 CA GLY A 492 -12.148 2.617 12.241 1.00 24.33 C ATOM 905 C GLY A 492 -11.012 2.854 13.238 1.00 53.45 C ATOM 906 O GLY A 492 -9.832 2.745 12.890 1.00 11.21 O ATOM 0 H GLY A 492 -11.772 1.134 10.805 1.00 22.33 H new ATOM 0 HA2 GLY A 492 -12.702 3.546 12.106 1.00 24.33 H new ATOM 0 HA3 GLY A 492 -12.843 1.890 12.661 1.00 24.33 H new ATOM 910 N PRO A 493 -11.345 3.176 14.504 1.00 32.51 N ATOM 911 CA PRO A 493 -10.339 3.428 15.550 1.00 31.31 C ATOM 912 C PRO A 493 -9.491 2.182 15.861 1.00 45.14 C ATOM 913 O PRO A 493 -9.964 1.240 16.497 1.00 21.42 O ATOM 914 CB PRO A 493 -11.180 3.846 16.768 1.00 31.54 C ATOM 915 CG PRO A 493 -12.539 3.289 16.510 1.00 2.31 C ATOM 916 CD PRO A 493 -12.721 3.307 15.016 1.00 33.41 C ATOM 0 HA PRO A 493 -9.615 4.184 15.247 1.00 31.31 H new ATOM 0 HB2 PRO A 493 -10.760 3.449 17.692 1.00 31.54 H new ATOM 0 HB3 PRO A 493 -11.211 4.931 16.872 1.00 31.54 H new ATOM 0 HG2 PRO A 493 -12.625 2.275 16.901 1.00 2.31 H new ATOM 0 HG3 PRO A 493 -13.305 3.887 17.003 1.00 2.31 H new ATOM 0 HD2 PRO A 493 -13.355 2.487 14.678 1.00 33.41 H new ATOM 0 HD3 PRO A 493 -13.189 4.232 14.679 1.00 33.41 H new ATOM 924 N LYS A 494 -8.235 2.197 15.398 1.00 55.30 N ATOM 925 CA LYS A 494 -7.317 1.057 15.540 1.00 33.10 C ATOM 926 C LYS A 494 -7.790 -0.158 14.723 1.00 52.43 C ATOM 927 O LYS A 494 -7.609 -1.310 15.123 1.00 13.35 O ATOM 928 CB LYS A 494 -7.114 0.702 17.023 1.00 75.40 C ATOM 929 CG LYS A 494 -6.451 1.824 17.818 1.00 13.44 C ATOM 930 CD LYS A 494 -6.192 1.424 19.266 1.00 4.53 C ATOM 931 CE LYS A 494 -5.425 2.508 20.015 1.00 42.51 C ATOM 932 NZ LYS A 494 -5.043 2.082 21.387 1.00 73.32 N ATOM 0 H LYS A 494 -7.826 2.997 14.915 1.00 55.30 H new ATOM 0 HA LYS A 494 -6.350 1.353 15.133 1.00 33.10 H new ATOM 0 HB2 LYS A 494 -8.080 0.468 17.471 1.00 75.40 H new ATOM 0 HB3 LYS A 494 -6.503 -0.198 17.095 1.00 75.40 H new ATOM 0 HG2 LYS A 494 -5.508 2.096 17.343 1.00 13.44 H new ATOM 0 HG3 LYS A 494 -7.087 2.709 17.795 1.00 13.44 H new ATOM 0 HD2 LYS A 494 -7.141 1.235 19.768 1.00 4.53 H new ATOM 0 HD3 LYS A 494 -5.627 0.492 19.292 1.00 4.53 H new ATOM 0 HE2 LYS A 494 -4.527 2.768 19.454 1.00 42.51 H new ATOM 0 HE3 LYS A 494 -6.036 3.408 20.073 1.00 42.51 H new ATOM 0 HZ1 LYS A 494 -4.524 2.851 21.857 1.00 73.32 H new ATOM 0 HZ2 LYS A 494 -5.900 1.858 21.932 1.00 73.32 H new ATOM 0 HZ3 LYS A 494 -4.437 1.238 21.333 1.00 73.32 H new ATOM 946 N GLU A 495 -8.364 0.119 13.553 1.00 51.01 N ATOM 947 CA GLU A 495 -8.843 -0.930 12.645 1.00 30.40 C ATOM 948 C GLU A 495 -7.790 -1.259 11.571 1.00 63.43 C ATOM 949 O GLU A 495 -7.099 -0.365 11.078 1.00 30.40 O ATOM 950 CB GLU A 495 -10.149 -0.470 11.980 1.00 12.14 C ATOM 951 CG GLU A 495 -10.775 -1.498 11.043 1.00 51.42 C ATOM 952 CD GLU A 495 -11.175 -2.778 11.756 1.00 64.33 C ATOM 953 OE1 GLU A 495 -12.269 -2.817 12.358 1.00 21.32 O ATOM 954 OE2 GLU A 495 -10.395 -3.749 11.723 1.00 0.30 O ATOM 0 H GLU A 495 -8.511 1.067 13.207 1.00 51.01 H new ATOM 0 HA GLU A 495 -9.024 -1.836 13.224 1.00 30.40 H new ATOM 0 HB2 GLU A 495 -10.870 -0.219 12.758 1.00 12.14 H new ATOM 0 HB3 GLU A 495 -9.954 0.444 11.419 1.00 12.14 H new ATOM 0 HG2 GLU A 495 -11.654 -1.062 10.568 1.00 51.42 H new ATOM 0 HG3 GLU A 495 -10.068 -1.736 10.248 1.00 51.42 H new ATOM 961 N GLU A 496 -7.679 -2.541 11.210 1.00 73.41 N ATOM 962 CA GLU A 496 -6.711 -2.987 10.194 1.00 41.01 C ATOM 963 C GLU A 496 -7.392 -3.832 9.101 1.00 51.33 C ATOM 964 O GLU A 496 -8.177 -4.735 9.396 1.00 20.32 O ATOM 965 CB GLU A 496 -5.582 -3.811 10.841 1.00 13.21 C ATOM 966 CG GLU A 496 -4.451 -4.172 9.876 1.00 65.20 C ATOM 967 CD GLU A 496 -3.474 -5.199 10.439 1.00 52.03 C ATOM 968 OE1 GLU A 496 -3.000 -5.021 11.582 1.00 4.44 O ATOM 969 OE2 GLU A 496 -3.170 -6.187 9.732 1.00 2.55 O ATOM 0 H GLU A 496 -8.246 -3.291 11.604 1.00 73.41 H new ATOM 0 HA GLU A 496 -6.291 -2.092 9.735 1.00 41.01 H new ATOM 0 HB2 GLU A 496 -5.168 -3.248 11.678 1.00 13.21 H new ATOM 0 HB3 GLU A 496 -6.004 -4.728 11.252 1.00 13.21 H new ATOM 0 HG2 GLU A 496 -4.882 -4.560 8.953 1.00 65.20 H new ATOM 0 HG3 GLU A 496 -3.903 -3.266 9.616 1.00 65.20 H new ATOM 976 N LYS A 497 -7.081 -3.529 7.842 1.00 22.12 N ATOM 977 CA LYS A 497 -7.594 -4.290 6.693 1.00 55.42 C ATOM 978 C LYS A 497 -6.448 -4.761 5.781 1.00 2.04 C ATOM 979 O LYS A 497 -5.538 -3.992 5.460 1.00 41.44 O ATOM 980 CB LYS A 497 -8.578 -3.436 5.888 1.00 51.12 C ATOM 981 CG LYS A 497 -9.894 -3.189 6.612 1.00 31.24 C ATOM 982 CD LYS A 497 -10.910 -2.480 5.724 1.00 33.45 C ATOM 983 CE LYS A 497 -12.305 -2.561 6.317 1.00 32.31 C ATOM 984 NZ LYS A 497 -12.436 -1.771 7.572 1.00 51.01 N ATOM 0 H LYS A 497 -6.470 -2.754 7.585 1.00 22.12 H new ATOM 0 HA LYS A 497 -8.110 -5.169 7.078 1.00 55.42 H new ATOM 0 HB2 LYS A 497 -8.113 -2.478 5.658 1.00 51.12 H new ATOM 0 HB3 LYS A 497 -8.781 -3.928 4.937 1.00 51.12 H new ATOM 0 HG2 LYS A 497 -10.307 -4.140 6.948 1.00 31.24 H new ATOM 0 HG3 LYS A 497 -9.710 -2.589 7.503 1.00 31.24 H new ATOM 0 HD2 LYS A 497 -10.624 -1.435 5.601 1.00 33.45 H new ATOM 0 HD3 LYS A 497 -10.907 -2.930 4.731 1.00 33.45 H new ATOM 0 HE2 LYS A 497 -13.029 -2.200 5.586 1.00 32.31 H new ATOM 0 HE3 LYS A 497 -12.550 -3.603 6.520 1.00 32.31 H new ATOM 0 HZ1 LYS A 497 -13.410 -1.845 7.928 1.00 51.01 H new ATOM 0 HZ2 LYS A 497 -11.777 -2.142 8.286 1.00 51.01 H new ATOM 0 HZ3 LYS A 497 -12.212 -0.774 7.379 1.00 51.01 H new ATOM 998 N VAL A 498 -6.486 -6.026 5.370 1.00 12.42 N ATOM 999 CA VAL A 498 -5.474 -6.565 4.454 1.00 11.31 C ATOM 1000 C VAL A 498 -6.015 -6.671 3.020 1.00 13.15 C ATOM 1001 O VAL A 498 -6.912 -7.468 2.736 1.00 12.44 O ATOM 1002 CB VAL A 498 -4.981 -7.960 4.911 1.00 14.24 C ATOM 1003 CG1 VAL A 498 -3.886 -8.484 3.980 1.00 43.23 C ATOM 1004 CG2 VAL A 498 -4.486 -7.910 6.355 1.00 52.34 C ATOM 0 H VAL A 498 -7.201 -6.697 5.652 1.00 12.42 H new ATOM 0 HA VAL A 498 -4.637 -5.867 4.470 1.00 11.31 H new ATOM 0 HB VAL A 498 -5.823 -8.650 4.862 1.00 14.24 H new ATOM 0 HG11 VAL A 498 -3.556 -9.465 4.322 1.00 43.23 H new ATOM 0 HG12 VAL A 498 -4.279 -8.566 2.967 1.00 43.23 H new ATOM 0 HG13 VAL A 498 -3.042 -7.795 3.987 1.00 43.23 H new ATOM 0 HG21 VAL A 498 -4.144 -8.900 6.657 1.00 52.34 H new ATOM 0 HG22 VAL A 498 -3.661 -7.202 6.433 1.00 52.34 H new ATOM 0 HG23 VAL A 498 -5.299 -7.592 7.008 1.00 52.34 H new ATOM 1014 N LEU A 499 -5.458 -5.866 2.121 1.00 60.34 N ATOM 1015 CA LEU A 499 -5.832 -5.889 0.701 1.00 20.32 C ATOM 1016 C LEU A 499 -4.747 -6.601 -0.126 1.00 51.11 C ATOM 1017 O LEU A 499 -3.575 -6.241 -0.053 1.00 34.41 O ATOM 1018 CB LEU A 499 -6.022 -4.450 0.189 1.00 52.23 C ATOM 1019 CG LEU A 499 -7.029 -3.592 0.984 1.00 63.15 C ATOM 1020 CD1 LEU A 499 -7.003 -2.143 0.503 1.00 52.42 C ATOM 1021 CD2 LEU A 499 -8.444 -4.167 0.882 1.00 23.11 C ATOM 0 H LEU A 499 -4.738 -5.181 2.349 1.00 60.34 H new ATOM 0 HA LEU A 499 -6.769 -6.436 0.593 1.00 20.32 H new ATOM 0 HB2 LEU A 499 -5.055 -3.948 0.200 1.00 52.23 H new ATOM 0 HB3 LEU A 499 -6.348 -4.492 -0.850 1.00 52.23 H new ATOM 0 HG LEU A 499 -6.731 -3.612 2.032 1.00 63.15 H new ATOM 0 HD11 LEU A 499 -7.720 -1.556 1.077 1.00 52.42 H new ATOM 0 HD12 LEU A 499 -6.003 -1.731 0.642 1.00 52.42 H new ATOM 0 HD13 LEU A 499 -7.267 -2.106 -0.554 1.00 52.42 H new ATOM 0 HD21 LEU A 499 -9.132 -3.543 1.451 1.00 23.11 H new ATOM 0 HD22 LEU A 499 -8.753 -4.189 -0.163 1.00 23.11 H new ATOM 0 HD23 LEU A 499 -8.455 -5.180 1.285 1.00 23.11 H new ATOM 1033 N THR A 500 -5.132 -7.604 -0.911 1.00 11.22 N ATOM 1034 CA THR A 500 -4.157 -8.382 -1.698 1.00 11.22 C ATOM 1035 C THR A 500 -4.329 -8.177 -3.205 1.00 14.43 C ATOM 1036 O THR A 500 -5.427 -7.906 -3.694 1.00 75.41 O ATOM 1037 CB THR A 500 -4.251 -9.902 -1.409 1.00 10.00 C ATOM 1038 OG1 THR A 500 -5.607 -10.355 -1.550 1.00 73.23 O ATOM 1039 CG2 THR A 500 -3.739 -10.244 -0.015 1.00 32.15 C ATOM 0 H THR A 500 -6.101 -7.901 -1.024 1.00 11.22 H new ATOM 0 HA THR A 500 -3.181 -8.009 -1.388 1.00 11.22 H new ATOM 0 HB THR A 500 -3.619 -10.411 -2.137 1.00 10.00 H new ATOM 0 HG1 THR A 500 -5.651 -11.317 -1.366 1.00 73.23 H new ATOM 0 HG21 THR A 500 -3.821 -11.318 0.149 1.00 32.15 H new ATOM 0 HG22 THR A 500 -2.695 -9.942 0.073 1.00 32.15 H new ATOM 0 HG23 THR A 500 -4.334 -9.716 0.731 1.00 32.15 H new ATOM 1047 N PHE A 501 -3.224 -8.311 -3.934 1.00 60.52 N ATOM 1048 CA PHE A 501 -3.242 -8.247 -5.395 1.00 21.35 C ATOM 1049 C PHE A 501 -2.180 -9.180 -5.997 1.00 2.13 C ATOM 1050 O PHE A 501 -1.124 -9.410 -5.399 1.00 33.15 O ATOM 1051 CB PHE A 501 -3.025 -6.801 -5.881 1.00 1.20 C ATOM 1052 CG PHE A 501 -1.692 -6.201 -5.492 1.00 51.21 C ATOM 1053 CD1 PHE A 501 -1.525 -5.584 -4.259 1.00 2.42 C ATOM 1054 CD2 PHE A 501 -0.611 -6.245 -6.363 1.00 31.45 C ATOM 1055 CE1 PHE A 501 -0.310 -5.026 -3.906 1.00 71.44 C ATOM 1056 CE2 PHE A 501 0.606 -5.690 -6.013 1.00 32.33 C ATOM 1057 CZ PHE A 501 0.756 -5.079 -4.783 1.00 22.05 C ATOM 0 H PHE A 501 -2.298 -8.466 -3.534 1.00 60.52 H new ATOM 0 HA PHE A 501 -4.223 -8.581 -5.734 1.00 21.35 H new ATOM 0 HB2 PHE A 501 -3.116 -6.779 -6.967 1.00 1.20 H new ATOM 0 HB3 PHE A 501 -3.822 -6.174 -5.482 1.00 1.20 H new ATOM 0 HD1 PHE A 501 -2.354 -5.539 -3.568 1.00 2.42 H new ATOM 0 HD2 PHE A 501 -0.723 -6.719 -7.327 1.00 31.45 H new ATOM 0 HE1 PHE A 501 -0.194 -4.549 -2.944 1.00 71.44 H new ATOM 0 HE2 PHE A 501 1.438 -5.734 -6.700 1.00 32.33 H new ATOM 0 HZ PHE A 501 1.705 -4.644 -4.508 1.00 22.05 H new ATOM 1067 N SER A 502 -2.464 -9.711 -7.182 1.00 24.22 N ATOM 1068 CA SER A 502 -1.525 -10.596 -7.882 1.00 54.32 C ATOM 1069 C SER A 502 -0.950 -9.902 -9.124 1.00 72.53 C ATOM 1070 O SER A 502 -1.673 -9.576 -10.069 1.00 31.15 O ATOM 1071 CB SER A 502 -2.212 -11.914 -8.278 1.00 74.12 C ATOM 1072 OG SER A 502 -3.302 -11.696 -9.163 1.00 73.43 O ATOM 0 H SER A 502 -3.337 -9.546 -7.683 1.00 24.22 H new ATOM 0 HA SER A 502 -0.705 -10.825 -7.202 1.00 54.32 H new ATOM 0 HB2 SER A 502 -1.486 -12.574 -8.752 1.00 74.12 H new ATOM 0 HB3 SER A 502 -2.568 -12.422 -7.382 1.00 74.12 H new ATOM 0 HG SER A 502 -3.174 -10.848 -9.637 1.00 73.43 H new ATOM 1078 N TRP A 503 0.358 -9.668 -9.107 1.00 63.14 N ATOM 1079 CA TRP A 503 1.045 -8.940 -10.180 1.00 55.10 C ATOM 1080 C TRP A 503 1.909 -9.875 -11.040 1.00 1.13 C ATOM 1081 O TRP A 503 2.589 -10.765 -10.524 1.00 54.20 O ATOM 1082 CB TRP A 503 1.905 -7.824 -9.567 1.00 3.20 C ATOM 1083 CG TRP A 503 2.768 -7.087 -10.554 1.00 61.55 C ATOM 1084 CD1 TRP A 503 2.376 -6.516 -11.732 1.00 32.23 C ATOM 1085 CD2 TRP A 503 4.173 -6.833 -10.433 1.00 15.42 C ATOM 1086 NE1 TRP A 503 3.453 -5.932 -12.354 1.00 51.21 N ATOM 1087 CE2 TRP A 503 4.567 -6.110 -11.575 1.00 21.23 C ATOM 1088 CE3 TRP A 503 5.137 -7.150 -9.472 1.00 53.43 C ATOM 1089 CZ2 TRP A 503 5.881 -5.699 -11.780 1.00 71.53 C ATOM 1090 CZ3 TRP A 503 6.441 -6.735 -9.674 1.00 4.13 C ATOM 1091 CH2 TRP A 503 6.802 -6.019 -10.821 1.00 51.34 C ATOM 0 H TRP A 503 0.974 -9.974 -8.354 1.00 63.14 H new ATOM 0 HA TRP A 503 0.292 -8.504 -10.837 1.00 55.10 H new ATOM 0 HB2 TRP A 503 1.249 -7.108 -9.072 1.00 3.20 H new ATOM 0 HB3 TRP A 503 2.544 -8.257 -8.797 1.00 3.20 H new ATOM 0 HD1 TRP A 503 1.367 -6.523 -12.118 1.00 32.23 H new ATOM 0 HE1 TRP A 503 3.428 -5.445 -13.250 1.00 51.21 H new ATOM 0 HE3 TRP A 503 4.869 -7.709 -8.588 1.00 53.43 H new ATOM 0 HZ2 TRP A 503 6.163 -5.147 -12.665 1.00 71.53 H new ATOM 0 HZ3 TRP A 503 7.193 -6.967 -8.934 1.00 4.13 H new ATOM 0 HH2 TRP A 503 7.829 -5.713 -10.952 1.00 51.34 H new ATOM 1102 N THR A 504 1.855 -9.683 -12.358 1.00 73.21 N ATOM 1103 CA THR A 504 2.694 -10.445 -13.295 1.00 74.13 C ATOM 1104 C THR A 504 3.789 -9.559 -13.912 1.00 33.34 C ATOM 1105 O THR A 504 3.521 -8.773 -14.825 1.00 54.10 O ATOM 1106 CB THR A 504 1.854 -11.067 -14.440 1.00 3.20 C ATOM 1107 OG1 THR A 504 0.845 -11.938 -13.904 1.00 5.41 O ATOM 1108 CG2 THR A 504 2.731 -11.853 -15.413 1.00 61.21 C ATOM 0 H THR A 504 1.238 -9.005 -12.806 1.00 73.21 H new ATOM 0 HA THR A 504 3.156 -11.244 -12.715 1.00 74.13 H new ATOM 0 HB THR A 504 1.383 -10.247 -14.981 1.00 3.20 H new ATOM 0 HG1 THR A 504 0.321 -12.322 -14.638 1.00 5.41 H new ATOM 0 HG21 THR A 504 2.110 -12.275 -16.203 1.00 61.21 H new ATOM 0 HG22 THR A 504 3.474 -11.187 -15.852 1.00 61.21 H new ATOM 0 HG23 THR A 504 3.236 -12.658 -14.879 1.00 61.21 H new ATOM 1116 N PRO A 505 5.039 -9.656 -13.419 1.00 54.11 N ATOM 1117 CA PRO A 505 6.165 -8.896 -13.978 1.00 53.21 C ATOM 1118 C PRO A 505 6.667 -9.473 -15.313 1.00 35.51 C ATOM 1119 O PRO A 505 7.514 -10.364 -15.342 1.00 14.25 O ATOM 1120 CB PRO A 505 7.237 -9.013 -12.888 1.00 20.11 C ATOM 1121 CG PRO A 505 6.949 -10.314 -12.217 1.00 62.01 C ATOM 1122 CD PRO A 505 5.452 -10.491 -12.269 1.00 21.24 C ATOM 0 HA PRO A 505 5.890 -7.868 -14.215 1.00 53.21 H new ATOM 0 HB2 PRO A 505 8.240 -9.000 -13.315 1.00 20.11 H new ATOM 0 HB3 PRO A 505 7.180 -8.183 -12.184 1.00 20.11 H new ATOM 0 HG2 PRO A 505 7.456 -11.135 -12.725 1.00 62.01 H new ATOM 0 HG3 PRO A 505 7.305 -10.308 -11.187 1.00 62.01 H new ATOM 0 HD2 PRO A 505 5.177 -11.536 -12.414 1.00 21.24 H new ATOM 0 HD3 PRO A 505 4.978 -10.162 -11.344 1.00 21.24 H new ATOM 1130 N THR A 506 6.129 -8.965 -16.419 1.00 3.41 N ATOM 1131 CA THR A 506 6.521 -9.420 -17.763 1.00 2.24 C ATOM 1132 C THR A 506 7.807 -8.738 -18.257 1.00 4.11 C ATOM 1133 O THR A 506 8.162 -8.832 -19.432 1.00 42.21 O ATOM 1134 CB THR A 506 5.393 -9.152 -18.785 1.00 41.33 C ATOM 1135 OG1 THR A 506 5.009 -7.769 -18.733 1.00 23.44 O ATOM 1136 CG2 THR A 506 4.177 -10.031 -18.510 1.00 52.14 C ATOM 0 H THR A 506 5.417 -8.235 -16.417 1.00 3.41 H new ATOM 0 HA THR A 506 6.706 -10.491 -17.682 1.00 2.24 H new ATOM 0 HB THR A 506 5.772 -9.393 -19.778 1.00 41.33 H new ATOM 0 HG1 THR A 506 4.295 -7.603 -19.383 1.00 23.44 H new ATOM 0 HG21 THR A 506 3.401 -9.819 -19.246 1.00 52.14 H new ATOM 0 HG22 THR A 506 4.464 -11.080 -18.577 1.00 52.14 H new ATOM 0 HG23 THR A 506 3.796 -9.823 -17.510 1.00 52.14 H new ATOM 1144 N GLN A 507 8.504 -8.062 -17.349 1.00 31.35 N ATOM 1145 CA GLN A 507 9.735 -7.339 -17.679 1.00 2.01 C ATOM 1146 C GLN A 507 10.750 -7.439 -16.524 1.00 31.34 C ATOM 1147 O GLN A 507 10.401 -7.198 -15.367 1.00 54.40 O ATOM 1148 CB GLN A 507 9.400 -5.867 -17.971 1.00 70.45 C ATOM 1149 CG GLN A 507 10.611 -4.993 -18.284 1.00 53.14 C ATOM 1150 CD GLN A 507 10.252 -3.522 -18.430 1.00 31.21 C ATOM 1151 OE1 GLN A 507 9.156 -3.170 -18.860 1.00 72.13 O ATOM 1152 NE2 GLN A 507 11.164 -2.652 -18.052 1.00 70.42 N ATOM 0 H GLN A 507 8.236 -7.998 -16.367 1.00 31.35 H new ATOM 0 HA GLN A 507 10.185 -7.789 -18.564 1.00 2.01 H new ATOM 0 HB2 GLN A 507 8.710 -5.825 -18.814 1.00 70.45 H new ATOM 0 HB3 GLN A 507 8.878 -5.448 -17.110 1.00 70.45 H new ATOM 0 HG2 GLN A 507 11.350 -5.105 -17.490 1.00 53.14 H new ATOM 0 HG3 GLN A 507 11.077 -5.342 -19.205 1.00 53.14 H new ATOM 0 HE21 GLN A 507 12.064 -2.977 -17.699 1.00 70.42 H new ATOM 0 HE22 GLN A 507 10.971 -1.652 -18.112 1.00 70.42 H new ATOM 1161 N GLU A 508 11.995 -7.794 -16.842 1.00 45.14 N ATOM 1162 CA GLU A 508 13.054 -7.921 -15.825 1.00 52.50 C ATOM 1163 C GLU A 508 13.622 -6.555 -15.391 1.00 4.42 C ATOM 1164 O GLU A 508 13.617 -5.592 -16.160 1.00 3.14 O ATOM 1165 CB GLU A 508 14.183 -8.848 -16.325 1.00 71.34 C ATOM 1166 CG GLU A 508 14.649 -8.604 -17.767 1.00 63.40 C ATOM 1167 CD GLU A 508 15.346 -7.266 -17.983 1.00 42.41 C ATOM 1168 OE1 GLU A 508 16.412 -7.035 -17.370 1.00 64.20 O ATOM 1169 OE2 GLU A 508 14.844 -6.445 -18.787 1.00 3.33 O ATOM 0 H GLU A 508 12.301 -8.000 -17.793 1.00 45.14 H new ATOM 0 HA GLU A 508 12.595 -8.369 -14.943 1.00 52.50 H new ATOM 0 HB2 GLU A 508 15.040 -8.738 -15.661 1.00 71.34 H new ATOM 0 HB3 GLU A 508 13.845 -9.881 -16.241 1.00 71.34 H new ATOM 0 HG2 GLU A 508 15.328 -9.405 -18.057 1.00 63.40 H new ATOM 0 HG3 GLU A 508 13.786 -8.662 -18.430 1.00 63.40 H new ATOM 1176 N GLY A 509 14.094 -6.475 -14.144 1.00 64.41 N ATOM 1177 CA GLY A 509 14.702 -5.240 -13.651 1.00 72.02 C ATOM 1178 C GLY A 509 14.393 -4.939 -12.186 1.00 3.31 C ATOM 1179 O GLY A 509 13.846 -5.777 -11.464 1.00 63.34 O ATOM 0 H GLY A 509 14.067 -7.238 -13.468 1.00 64.41 H new ATOM 0 HA2 GLY A 509 15.783 -5.303 -13.779 1.00 72.02 H new ATOM 0 HA3 GLY A 509 14.357 -4.407 -14.263 1.00 72.02 H new ATOM 1183 N MET A 510 14.753 -3.731 -11.751 1.00 71.33 N ATOM 1184 CA MET A 510 14.500 -3.272 -10.379 1.00 71.32 C ATOM 1185 C MET A 510 13.132 -2.576 -10.273 1.00 61.54 C ATOM 1186 O MET A 510 12.897 -1.542 -10.900 1.00 31.13 O ATOM 1187 CB MET A 510 15.613 -2.301 -9.939 1.00 72.51 C ATOM 1188 CG MET A 510 15.391 -1.637 -8.577 1.00 71.02 C ATOM 1189 SD MET A 510 16.051 -2.581 -7.180 1.00 70.43 S ATOM 1190 CE MET A 510 15.018 -4.048 -7.172 1.00 41.11 C ATOM 0 H MET A 510 15.227 -3.043 -12.336 1.00 71.33 H new ATOM 0 HA MET A 510 14.494 -4.143 -9.723 1.00 71.32 H new ATOM 0 HB2 MET A 510 16.558 -2.843 -9.912 1.00 72.51 H new ATOM 0 HB3 MET A 510 15.714 -1.522 -10.694 1.00 72.51 H new ATOM 0 HG2 MET A 510 15.853 -0.650 -8.586 1.00 71.02 H new ATOM 0 HG3 MET A 510 14.322 -1.487 -8.428 1.00 71.02 H new ATOM 0 HE1 MET A 510 14.911 -4.412 -6.150 1.00 41.11 H new ATOM 0 HE2 MET A 510 14.035 -3.803 -7.575 1.00 41.11 H new ATOM 0 HE3 MET A 510 15.480 -4.821 -7.786 1.00 41.11 H new ATOM 1200 N TYR A 511 12.231 -3.145 -9.478 1.00 54.53 N ATOM 1201 CA TYR A 511 10.907 -2.554 -9.259 1.00 60.24 C ATOM 1202 C TYR A 511 10.689 -2.208 -7.787 1.00 42.25 C ATOM 1203 O TYR A 511 11.148 -2.914 -6.897 1.00 25.14 O ATOM 1204 CB TYR A 511 9.807 -3.509 -9.741 1.00 20.15 C ATOM 1205 CG TYR A 511 9.843 -3.747 -11.235 1.00 34.20 C ATOM 1206 CD1 TYR A 511 10.687 -4.701 -11.789 1.00 14.51 C ATOM 1207 CD2 TYR A 511 9.038 -3.006 -12.093 1.00 73.42 C ATOM 1208 CE1 TYR A 511 10.728 -4.909 -13.151 1.00 52.01 C ATOM 1209 CE2 TYR A 511 9.075 -3.209 -13.455 1.00 45.45 C ATOM 1210 CZ TYR A 511 9.921 -4.161 -13.977 1.00 60.21 C ATOM 1211 OH TYR A 511 9.962 -4.365 -15.330 1.00 64.54 O ATOM 0 H TYR A 511 12.390 -4.016 -8.972 1.00 54.53 H new ATOM 0 HA TYR A 511 10.857 -1.631 -9.837 1.00 60.24 H new ATOM 0 HB2 TYR A 511 9.910 -4.463 -9.224 1.00 20.15 H new ATOM 0 HB3 TYR A 511 8.834 -3.101 -9.467 1.00 20.15 H new ATOM 0 HD1 TYR A 511 11.321 -5.289 -11.142 1.00 14.51 H new ATOM 0 HD2 TYR A 511 8.373 -2.259 -11.685 1.00 73.42 H new ATOM 0 HE1 TYR A 511 11.389 -5.654 -13.567 1.00 52.01 H new ATOM 0 HE2 TYR A 511 8.444 -2.625 -14.109 1.00 45.45 H new ATOM 0 HH TYR A 511 10.209 -5.296 -15.513 1.00 64.54 H new ATOM 1221 N ARG A 512 10.008 -1.104 -7.534 1.00 0.42 N ATOM 1222 CA ARG A 512 9.692 -0.692 -6.170 1.00 25.51 C ATOM 1223 C ARG A 512 8.180 -0.518 -5.992 1.00 62.50 C ATOM 1224 O ARG A 512 7.557 0.293 -6.677 1.00 61.34 O ATOM 1225 CB ARG A 512 10.409 0.620 -5.839 1.00 50.13 C ATOM 1226 CG ARG A 512 10.309 1.021 -4.371 1.00 71.52 C ATOM 1227 CD ARG A 512 10.805 2.442 -4.139 1.00 53.33 C ATOM 1228 NE ARG A 512 9.944 3.424 -4.791 1.00 42.33 N ATOM 1229 CZ ARG A 512 10.276 4.666 -5.011 1.00 13.31 C ATOM 1230 NH1 ARG A 512 11.436 5.113 -4.652 1.00 31.41 N ATOM 1231 NH2 ARG A 512 9.431 5.462 -5.583 1.00 12.32 N ATOM 0 H ARG A 512 9.660 -0.472 -8.255 1.00 0.42 H new ATOM 0 HA ARG A 512 10.034 -1.471 -5.488 1.00 25.51 H new ATOM 0 HB2 ARG A 512 11.461 0.527 -6.110 1.00 50.13 H new ATOM 0 HB3 ARG A 512 9.991 1.417 -6.453 1.00 50.13 H new ATOM 0 HG2 ARG A 512 9.273 0.939 -4.041 1.00 71.52 H new ATOM 0 HG3 ARG A 512 10.892 0.329 -3.764 1.00 71.52 H new ATOM 0 HD2 ARG A 512 10.843 2.645 -3.069 1.00 53.33 H new ATOM 0 HD3 ARG A 512 11.822 2.540 -4.519 1.00 53.33 H new ATOM 0 HE ARG A 512 9.020 3.118 -5.095 1.00 42.33 H new ATOM 0 HH11 ARG A 512 12.102 4.492 -4.192 1.00 31.41 H new ATOM 0 HH12 ARG A 512 11.685 6.086 -4.829 1.00 31.41 H new ATOM 0 HH21 ARG A 512 8.512 5.117 -5.859 1.00 12.32 H new ATOM 0 HH22 ARG A 512 9.684 6.434 -5.758 1.00 12.32 H new ATOM 1245 N ILE A 513 7.598 -1.279 -5.076 1.00 51.44 N ATOM 1246 CA ILE A 513 6.167 -1.185 -4.785 1.00 61.33 C ATOM 1247 C ILE A 513 5.914 -0.248 -3.594 1.00 53.22 C ATOM 1248 O ILE A 513 6.424 -0.469 -2.495 1.00 73.20 O ATOM 1249 CB ILE A 513 5.567 -2.583 -4.482 1.00 52.23 C ATOM 1250 CG1 ILE A 513 5.786 -3.525 -5.680 1.00 72.03 C ATOM 1251 CG2 ILE A 513 4.078 -2.476 -4.142 1.00 21.11 C ATOM 1252 CD1 ILE A 513 5.245 -4.927 -5.471 1.00 54.04 C ATOM 0 H ILE A 513 8.094 -1.973 -4.517 1.00 51.44 H new ATOM 0 HA ILE A 513 5.678 -0.777 -5.670 1.00 61.33 H new ATOM 0 HB ILE A 513 6.079 -2.998 -3.614 1.00 52.23 H new ATOM 0 HG12 ILE A 513 5.312 -3.092 -6.561 1.00 72.03 H new ATOM 0 HG13 ILE A 513 6.854 -3.586 -5.890 1.00 72.03 H new ATOM 0 HG21 ILE A 513 3.680 -3.469 -3.933 1.00 21.11 H new ATOM 0 HG22 ILE A 513 3.950 -1.842 -3.265 1.00 21.11 H new ATOM 0 HG23 ILE A 513 3.543 -2.040 -4.986 1.00 21.11 H new ATOM 0 HD11 ILE A 513 5.439 -5.528 -6.359 1.00 54.04 H new ATOM 0 HD12 ILE A 513 5.736 -5.382 -4.611 1.00 54.04 H new ATOM 0 HD13 ILE A 513 4.171 -4.880 -5.292 1.00 54.04 H new ATOM 1264 N ASN A 514 5.144 0.811 -3.830 1.00 52.30 N ATOM 1265 CA ASN A 514 4.794 1.775 -2.781 1.00 12.21 C ATOM 1266 C ASN A 514 3.276 1.826 -2.562 1.00 35.30 C ATOM 1267 O ASN A 514 2.508 1.918 -3.515 1.00 2.11 O ATOM 1268 CB ASN A 514 5.295 3.179 -3.147 1.00 24.22 C ATOM 1269 CG ASN A 514 6.799 3.240 -3.340 1.00 1.22 C ATOM 1270 OD1 ASN A 514 7.305 3.074 -4.444 1.00 12.10 O ATOM 1271 ND2 ASN A 514 7.526 3.474 -2.266 1.00 63.41 N ATOM 0 H ASN A 514 4.746 1.027 -4.744 1.00 52.30 H new ATOM 0 HA ASN A 514 5.276 1.445 -1.861 1.00 12.21 H new ATOM 0 HB2 ASN A 514 4.803 3.507 -4.063 1.00 24.22 H new ATOM 0 HB3 ASN A 514 5.006 3.878 -2.362 1.00 24.22 H new ATOM 0 HD21 ASN A 514 8.542 3.522 -2.339 1.00 63.41 H new ATOM 0 HD22 ASN A 514 7.072 3.608 -1.362 1.00 63.41 H new ATOM 1278 N ALA A 515 2.848 1.779 -1.306 1.00 33.24 N ATOM 1279 CA ALA A 515 1.426 1.923 -0.979 1.00 54.15 C ATOM 1280 C ALA A 515 1.170 3.236 -0.240 1.00 14.14 C ATOM 1281 O ALA A 515 1.933 3.619 0.649 1.00 73.03 O ATOM 1282 CB ALA A 515 0.924 0.749 -0.146 1.00 72.22 C ATOM 0 H ALA A 515 3.457 1.643 -0.499 1.00 33.24 H new ATOM 0 HA ALA A 515 0.875 1.934 -1.919 1.00 54.15 H new ATOM 0 HB1 ALA A 515 -0.134 0.888 0.079 1.00 72.22 H new ATOM 0 HB2 ALA A 515 1.058 -0.177 -0.705 1.00 72.22 H new ATOM 0 HB3 ALA A 515 1.489 0.696 0.785 1.00 72.22 H new ATOM 1288 N THR A 516 0.095 3.914 -0.615 1.00 5.31 N ATOM 1289 CA THR A 516 -0.274 5.198 -0.011 1.00 33.24 C ATOM 1290 C THR A 516 -1.687 5.139 0.581 1.00 4.24 C ATOM 1291 O THR A 516 -2.592 4.543 -0.004 1.00 44.43 O ATOM 1292 CB THR A 516 -0.215 6.340 -1.055 1.00 40.34 C ATOM 1293 OG1 THR A 516 -1.006 5.997 -2.202 1.00 12.24 O ATOM 1294 CG2 THR A 516 1.220 6.612 -1.498 1.00 73.51 C ATOM 0 H THR A 516 -0.547 3.597 -1.342 1.00 5.31 H new ATOM 0 HA THR A 516 0.444 5.399 0.784 1.00 33.24 H new ATOM 0 HB THR A 516 -0.611 7.241 -0.586 1.00 40.34 H new ATOM 0 HG1 THR A 516 -1.520 5.184 -2.013 1.00 12.24 H new ATOM 0 HG21 THR A 516 1.228 7.419 -2.231 1.00 73.51 H new ATOM 0 HG22 THR A 516 1.819 6.901 -0.634 1.00 73.51 H new ATOM 0 HG23 THR A 516 1.640 5.711 -1.946 1.00 73.51 H new ATOM 1302 N VAL A 517 -1.871 5.760 1.744 1.00 15.12 N ATOM 1303 CA VAL A 517 -3.171 5.767 2.424 1.00 32.32 C ATOM 1304 C VAL A 517 -3.750 7.191 2.512 1.00 32.34 C ATOM 1305 O VAL A 517 -3.015 8.157 2.735 1.00 31.24 O ATOM 1306 CB VAL A 517 -3.051 5.144 3.836 1.00 4.33 C ATOM 1307 CG1 VAL A 517 -2.133 5.971 4.727 1.00 55.35 C ATOM 1308 CG2 VAL A 517 -4.423 4.957 4.476 1.00 72.35 C ATOM 0 H VAL A 517 -1.137 6.267 2.239 1.00 15.12 H new ATOM 0 HA VAL A 517 -3.858 5.162 1.833 1.00 32.32 H new ATOM 0 HB VAL A 517 -2.602 4.157 3.725 1.00 4.33 H new ATOM 0 HG11 VAL A 517 -2.069 5.509 5.712 1.00 55.35 H new ATOM 0 HG12 VAL A 517 -1.139 6.017 4.282 1.00 55.35 H new ATOM 0 HG13 VAL A 517 -2.534 6.980 4.825 1.00 55.35 H new ATOM 0 HG21 VAL A 517 -4.306 4.518 5.467 1.00 72.35 H new ATOM 0 HG22 VAL A 517 -4.918 5.924 4.564 1.00 72.35 H new ATOM 0 HG23 VAL A 517 -5.027 4.295 3.855 1.00 72.35 H new ATOM 1318 N ASP A 518 -5.074 7.304 2.340 1.00 54.21 N ATOM 1319 CA ASP A 518 -5.752 8.602 2.201 1.00 34.33 C ATOM 1320 C ASP A 518 -5.015 9.479 1.174 1.00 35.13 C ATOM 1321 O ASP A 518 -4.546 10.580 1.473 1.00 43.12 O ATOM 1322 CB ASP A 518 -5.893 9.322 3.553 1.00 3.24 C ATOM 1323 CG ASP A 518 -6.804 10.543 3.465 1.00 72.14 C ATOM 1324 OD1 ASP A 518 -7.919 10.421 2.908 1.00 43.03 O ATOM 1325 OD2 ASP A 518 -6.419 11.626 3.945 1.00 51.32 O ATOM 0 H ASP A 518 -5.704 6.503 2.293 1.00 54.21 H new ATOM 0 HA ASP A 518 -6.762 8.417 1.837 1.00 34.33 H new ATOM 0 HB2 ASP A 518 -6.290 8.627 4.293 1.00 3.24 H new ATOM 0 HB3 ASP A 518 -4.908 9.631 3.903 1.00 3.24 H new ATOM 1330 N GLU A 519 -4.914 8.953 -0.041 1.00 35.32 N ATOM 1331 CA GLU A 519 -4.177 9.596 -1.133 1.00 32.33 C ATOM 1332 C GLU A 519 -4.648 11.029 -1.418 1.00 73.23 C ATOM 1333 O GLU A 519 -3.856 11.883 -1.827 1.00 14.44 O ATOM 1334 CB GLU A 519 -4.297 8.742 -2.403 1.00 72.45 C ATOM 1335 CG GLU A 519 -2.994 8.084 -2.828 1.00 61.20 C ATOM 1336 CD GLU A 519 -1.961 9.087 -3.314 1.00 52.11 C ATOM 1337 OE1 GLU A 519 -2.052 9.516 -4.485 1.00 3.22 O ATOM 1338 OE2 GLU A 519 -1.055 9.447 -2.542 1.00 11.32 O ATOM 0 H GLU A 519 -5.341 8.064 -0.302 1.00 35.32 H new ATOM 0 HA GLU A 519 -3.136 9.668 -0.819 1.00 32.33 H new ATOM 0 HB2 GLU A 519 -5.047 7.968 -2.239 1.00 72.45 H new ATOM 0 HB3 GLU A 519 -4.659 9.369 -3.218 1.00 72.45 H new ATOM 0 HG2 GLU A 519 -2.583 7.524 -1.988 1.00 61.20 H new ATOM 0 HG3 GLU A 519 -3.197 7.365 -3.621 1.00 61.20 H new ATOM 1345 N GLU A 520 -5.935 11.286 -1.225 1.00 13.12 N ATOM 1346 CA GLU A 520 -6.500 12.612 -1.486 1.00 34.52 C ATOM 1347 C GLU A 520 -6.159 13.603 -0.357 1.00 60.14 C ATOM 1348 O GLU A 520 -6.342 14.814 -0.509 1.00 2.30 O ATOM 1349 CB GLU A 520 -8.021 12.497 -1.657 1.00 11.31 C ATOM 1350 CG GLU A 520 -8.447 11.439 -2.676 1.00 24.21 C ATOM 1351 CD GLU A 520 -7.958 11.727 -4.089 1.00 24.40 C ATOM 1352 OE1 GLU A 520 -8.673 12.426 -4.837 1.00 42.12 O ATOM 1353 OE2 GLU A 520 -6.867 11.245 -4.470 1.00 11.21 O ATOM 0 H GLU A 520 -6.610 10.598 -0.890 1.00 13.12 H new ATOM 0 HA GLU A 520 -6.059 12.999 -2.405 1.00 34.52 H new ATOM 0 HB2 GLU A 520 -8.469 12.261 -0.692 1.00 11.31 H new ATOM 0 HB3 GLU A 520 -8.417 13.465 -1.964 1.00 11.31 H new ATOM 0 HG2 GLU A 520 -8.068 10.467 -2.360 1.00 24.21 H new ATOM 0 HG3 GLU A 520 -9.535 11.370 -2.683 1.00 24.21 H new ATOM 1360 N ASN A 521 -5.658 13.077 0.767 1.00 21.53 N ATOM 1361 CA ASN A 521 -5.300 13.886 1.942 1.00 64.11 C ATOM 1362 C ASN A 521 -6.489 14.741 2.399 1.00 62.23 C ATOM 1363 O ASN A 521 -6.499 15.966 2.256 1.00 41.24 O ATOM 1364 CB ASN A 521 -4.060 14.748 1.658 1.00 12.32 C ATOM 1365 CG ASN A 521 -3.553 15.479 2.891 1.00 35.54 C ATOM 1366 OD1 ASN A 521 -3.874 16.643 3.121 1.00 21.23 O ATOM 1367 ND2 ASN A 521 -2.781 14.798 3.710 1.00 34.43 N ATOM 0 H ASN A 521 -5.489 12.079 0.889 1.00 21.53 H new ATOM 0 HA ASN A 521 -5.048 13.209 2.759 1.00 64.11 H new ATOM 0 HB2 ASN A 521 -3.265 14.114 1.265 1.00 12.32 H new ATOM 0 HB3 ASN A 521 -4.299 15.476 0.883 1.00 12.32 H new ATOM 0 HD21 ASN A 521 -2.432 15.235 4.563 1.00 34.43 H new ATOM 0 HD22 ASN A 521 -2.532 13.833 3.492 1.00 34.43 H new ATOM 1374 N THR A 522 -7.498 14.066 2.937 1.00 54.12 N ATOM 1375 CA THR A 522 -8.759 14.711 3.322 1.00 3.30 C ATOM 1376 C THR A 522 -8.827 14.986 4.828 1.00 32.35 C ATOM 1377 O THR A 522 -9.760 15.633 5.309 1.00 34.24 O ATOM 1378 CB THR A 522 -9.972 13.836 2.926 1.00 23.41 C ATOM 1379 OG1 THR A 522 -9.920 12.569 3.608 1.00 23.12 O ATOM 1380 CG2 THR A 522 -10.012 13.601 1.418 1.00 72.13 C ATOM 0 H THR A 522 -7.471 13.063 3.120 1.00 54.12 H new ATOM 0 HA THR A 522 -8.794 15.660 2.788 1.00 3.30 H new ATOM 0 HB THR A 522 -10.876 14.369 3.220 1.00 23.41 H new ATOM 0 HG1 THR A 522 -9.192 12.027 3.237 1.00 23.12 H new ATOM 0 HG21 THR A 522 -10.875 12.983 1.169 1.00 72.13 H new ATOM 0 HG22 THR A 522 -10.090 14.558 0.903 1.00 72.13 H new ATOM 0 HG23 THR A 522 -9.100 13.094 1.105 1.00 72.13 H new ATOM 1388 N VAL A 523 -7.842 14.490 5.572 1.00 3.53 N ATOM 1389 CA VAL A 523 -7.809 14.674 7.025 1.00 72.45 C ATOM 1390 C VAL A 523 -6.383 14.958 7.537 1.00 31.13 C ATOM 1391 O VAL A 523 -5.407 14.417 7.022 1.00 65.24 O ATOM 1392 CB VAL A 523 -8.392 13.436 7.758 1.00 41.41 C ATOM 1393 CG1 VAL A 523 -7.556 12.184 7.485 1.00 1.44 C ATOM 1394 CG2 VAL A 523 -8.520 13.703 9.257 1.00 12.54 C ATOM 0 H VAL A 523 -7.057 13.958 5.196 1.00 3.53 H new ATOM 0 HA VAL A 523 -8.429 15.543 7.246 1.00 72.45 H new ATOM 0 HB VAL A 523 -9.392 13.252 7.364 1.00 41.41 H new ATOM 0 HG11 VAL A 523 -7.990 11.335 8.012 1.00 1.44 H new ATOM 0 HG12 VAL A 523 -7.546 11.980 6.414 1.00 1.44 H new ATOM 0 HG13 VAL A 523 -6.536 12.345 7.834 1.00 1.44 H new ATOM 0 HG21 VAL A 523 -8.931 12.822 9.750 1.00 12.54 H new ATOM 0 HG22 VAL A 523 -7.537 13.926 9.672 1.00 12.54 H new ATOM 0 HG23 VAL A 523 -9.184 14.552 9.420 1.00 12.54 H new ATOM 1404 N VAL A 524 -6.272 15.847 8.527 1.00 31.42 N ATOM 1405 CA VAL A 524 -4.984 16.149 9.168 1.00 64.14 C ATOM 1406 C VAL A 524 -4.676 15.122 10.268 1.00 31.40 C ATOM 1407 O VAL A 524 -5.425 15.000 11.242 1.00 61.22 O ATOM 1408 CB VAL A 524 -4.978 17.574 9.780 1.00 1.12 C ATOM 1409 CG1 VAL A 524 -3.640 17.868 10.463 1.00 24.22 C ATOM 1410 CG2 VAL A 524 -5.286 18.621 8.709 1.00 3.41 C ATOM 0 H VAL A 524 -7.060 16.373 8.905 1.00 31.42 H new ATOM 0 HA VAL A 524 -4.216 16.098 8.396 1.00 64.14 H new ATOM 0 HB VAL A 524 -5.760 17.623 10.538 1.00 1.12 H new ATOM 0 HG11 VAL A 524 -3.660 18.873 10.885 1.00 24.22 H new ATOM 0 HG12 VAL A 524 -3.471 17.144 11.260 1.00 24.22 H new ATOM 0 HG13 VAL A 524 -2.835 17.797 9.732 1.00 24.22 H new ATOM 0 HG21 VAL A 524 -5.277 19.614 9.158 1.00 3.41 H new ATOM 0 HG22 VAL A 524 -4.532 18.571 7.924 1.00 3.41 H new ATOM 0 HG23 VAL A 524 -6.269 18.425 8.281 1.00 3.41 H new ATOM 1420 N GLU A 525 -3.574 14.388 10.117 1.00 22.13 N ATOM 1421 CA GLU A 525 -3.259 13.280 11.025 1.00 65.41 C ATOM 1422 C GLU A 525 -2.048 13.567 11.927 1.00 41.21 C ATOM 1423 O GLU A 525 -1.369 14.588 11.783 1.00 73.33 O ATOM 1424 CB GLU A 525 -3.021 12.007 10.210 1.00 63.32 C ATOM 1425 CG GLU A 525 -4.165 11.676 9.257 1.00 21.04 C ATOM 1426 CD GLU A 525 -4.167 10.221 8.836 1.00 30.11 C ATOM 1427 OE1 GLU A 525 -3.476 9.876 7.856 1.00 44.11 O ATOM 1428 OE2 GLU A 525 -4.847 9.415 9.504 1.00 1.42 O ATOM 0 H GLU A 525 -2.886 14.538 9.379 1.00 22.13 H new ATOM 0 HA GLU A 525 -4.114 13.151 11.688 1.00 65.41 H new ATOM 0 HB2 GLU A 525 -2.101 12.118 9.637 1.00 63.32 H new ATOM 0 HB3 GLU A 525 -2.872 11.170 10.892 1.00 63.32 H new ATOM 0 HG2 GLU A 525 -5.114 11.913 9.738 1.00 21.04 H new ATOM 0 HG3 GLU A 525 -4.090 12.307 8.371 1.00 21.04 H new ATOM 1435 N LEU A 526 -1.781 12.642 12.852 1.00 23.30 N ATOM 1436 CA LEU A 526 -0.697 12.796 13.833 1.00 14.10 C ATOM 1437 C LEU A 526 0.689 12.831 13.170 1.00 24.24 C ATOM 1438 O LEU A 526 1.563 13.600 13.580 1.00 31.41 O ATOM 1439 CB LEU A 526 -0.758 11.650 14.852 1.00 43.34 C ATOM 1440 CG LEU A 526 -2.006 11.637 15.751 1.00 40.14 C ATOM 1441 CD1 LEU A 526 -2.065 10.355 16.580 1.00 44.35 C ATOM 1442 CD2 LEU A 526 -2.021 12.866 16.661 1.00 64.33 C ATOM 0 H LEU A 526 -2.304 11.771 12.945 1.00 23.30 H new ATOM 0 HA LEU A 526 -0.841 13.753 14.335 1.00 14.10 H new ATOM 0 HB2 LEU A 526 -0.708 10.704 14.313 1.00 43.34 H new ATOM 0 HB3 LEU A 526 0.127 11.702 15.487 1.00 43.34 H new ATOM 0 HG LEU A 526 -2.888 11.668 15.111 1.00 40.14 H new ATOM 0 HD11 LEU A 526 -2.956 10.368 17.208 1.00 44.35 H new ATOM 0 HD12 LEU A 526 -2.103 9.493 15.914 1.00 44.35 H new ATOM 0 HD13 LEU A 526 -1.178 10.288 17.210 1.00 44.35 H new ATOM 0 HD21 LEU A 526 -2.910 12.842 17.291 1.00 64.33 H new ATOM 0 HD22 LEU A 526 -1.131 12.864 17.290 1.00 64.33 H new ATOM 0 HD23 LEU A 526 -2.032 13.770 16.052 1.00 64.33 H new ATOM 1454 N ASN A 527 0.894 12.004 12.150 1.00 52.43 N ATOM 1455 CA ASN A 527 2.170 11.976 11.429 1.00 22.31 C ATOM 1456 C ASN A 527 1.961 11.690 9.935 1.00 23.50 C ATOM 1457 O ASN A 527 1.655 10.567 9.545 1.00 22.31 O ATOM 1458 CB ASN A 527 3.106 10.926 12.045 1.00 62.25 C ATOM 1459 CG ASN A 527 4.466 10.887 11.370 1.00 25.41 C ATOM 1460 OD1 ASN A 527 4.949 11.890 10.861 1.00 31.04 O ATOM 1461 ND2 ASN A 527 5.088 9.727 11.347 1.00 50.35 N ATOM 0 H ASN A 527 0.198 11.345 11.802 1.00 52.43 H new ATOM 0 HA ASN A 527 2.629 12.960 11.522 1.00 22.31 H new ATOM 0 HB2 ASN A 527 3.237 11.140 13.106 1.00 62.25 H new ATOM 0 HB3 ASN A 527 2.641 9.943 11.973 1.00 62.25 H new ATOM 0 HD21 ASN A 527 5.999 9.646 10.896 1.00 50.35 H new ATOM 0 HD22 ASN A 527 4.659 8.909 11.780 1.00 50.35 H new ATOM 1468 N GLU A 528 2.167 12.706 9.100 1.00 62.20 N ATOM 1469 CA GLU A 528 1.969 12.571 7.650 1.00 43.20 C ATOM 1470 C GLU A 528 3.209 11.970 6.956 1.00 60.12 C ATOM 1471 O GLU A 528 3.398 12.126 5.747 1.00 73.24 O ATOM 1472 CB GLU A 528 1.621 13.941 7.039 1.00 31.14 C ATOM 1473 CG GLU A 528 2.689 15.013 7.251 1.00 41.32 C ATOM 1474 CD GLU A 528 2.275 16.370 6.692 1.00 10.43 C ATOM 1475 OE1 GLU A 528 2.474 16.610 5.481 1.00 64.41 O ATOM 1476 OE2 GLU A 528 1.735 17.197 7.461 1.00 40.14 O ATOM 0 H GLU A 528 2.471 13.633 9.398 1.00 62.20 H new ATOM 0 HA GLU A 528 1.140 11.882 7.487 1.00 43.20 H new ATOM 0 HB2 GLU A 528 1.455 13.817 5.969 1.00 31.14 H new ATOM 0 HB3 GLU A 528 0.682 14.290 7.469 1.00 31.14 H new ATOM 0 HG2 GLU A 528 2.894 15.110 8.317 1.00 41.32 H new ATOM 0 HG3 GLU A 528 3.617 14.696 6.775 1.00 41.32 H new ATOM 1483 N ASN A 529 4.045 11.265 7.722 1.00 35.21 N ATOM 1484 CA ASN A 529 5.256 10.636 7.175 1.00 25.02 C ATOM 1485 C ASN A 529 5.130 9.101 7.077 1.00 11.10 C ATOM 1486 O ASN A 529 5.878 8.465 6.332 1.00 3.31 O ATOM 1487 CB ASN A 529 6.484 11.014 8.016 1.00 21.13 C ATOM 1488 CG ASN A 529 6.816 12.495 7.923 1.00 71.34 C ATOM 1489 OD1 ASN A 529 7.557 12.925 7.044 1.00 23.20 O ATOM 1490 ND2 ASN A 529 6.279 13.288 8.826 1.00 0.11 N ATOM 0 H ASN A 529 3.909 11.114 8.721 1.00 35.21 H new ATOM 0 HA ASN A 529 5.381 11.016 6.161 1.00 25.02 H new ATOM 0 HB2 ASN A 529 6.303 10.750 9.058 1.00 21.13 H new ATOM 0 HB3 ASN A 529 7.342 10.430 7.684 1.00 21.13 H new ATOM 0 HD21 ASN A 529 6.475 14.289 8.807 1.00 0.11 H new ATOM 0 HD22 ASN A 529 5.667 12.902 9.545 1.00 0.11 H new ATOM 1497 N ASN A 530 4.190 8.502 7.817 1.00 12.22 N ATOM 1498 CA ASN A 530 3.998 7.037 7.782 1.00 45.13 C ATOM 1499 C ASN A 530 2.824 6.616 6.878 1.00 40.41 C ATOM 1500 O ASN A 530 2.396 5.462 6.900 1.00 23.02 O ATOM 1501 CB ASN A 530 3.796 6.473 9.198 1.00 43.44 C ATOM 1502 CG ASN A 530 2.723 7.203 9.987 1.00 44.53 C ATOM 1503 OD1 ASN A 530 3.016 8.103 10.756 1.00 54.44 O ATOM 1504 ND2 ASN A 530 1.476 6.827 9.805 1.00 4.03 N ATOM 0 H ASN A 530 3.554 8.997 8.442 1.00 12.22 H new ATOM 0 HA ASN A 530 4.909 6.618 7.355 1.00 45.13 H new ATOM 0 HB2 ASN A 530 3.531 5.418 9.127 1.00 43.44 H new ATOM 0 HB3 ASN A 530 4.739 6.529 9.742 1.00 43.44 H new ATOM 0 HD21 ASN A 530 0.724 7.292 10.314 1.00 4.03 H new ATOM 0 HD22 ASN A 530 1.261 6.071 9.155 1.00 4.03 H new ATOM 1511 N ASN A 531 2.322 7.544 6.067 1.00 4.53 N ATOM 1512 CA ASN A 531 1.208 7.259 5.145 1.00 13.40 C ATOM 1513 C ASN A 531 1.668 6.492 3.891 1.00 62.44 C ATOM 1514 O ASN A 531 0.848 6.097 3.062 1.00 24.21 O ATOM 1515 CB ASN A 531 0.528 8.566 4.725 1.00 11.45 C ATOM 1516 CG ASN A 531 -0.064 9.310 5.906 1.00 44.45 C ATOM 1517 OD1 ASN A 531 0.622 10.076 6.568 1.00 53.13 O ATOM 1518 ND2 ASN A 531 -1.336 9.095 6.167 1.00 54.22 N ATOM 0 H ASN A 531 2.665 8.504 6.024 1.00 4.53 H new ATOM 0 HA ASN A 531 0.502 6.624 5.680 1.00 13.40 H new ATOM 0 HB2 ASN A 531 1.253 9.205 4.222 1.00 11.45 H new ATOM 0 HB3 ASN A 531 -0.259 8.348 4.003 1.00 11.45 H new ATOM 0 HD21 ASN A 531 -1.785 9.576 6.947 1.00 54.22 H new ATOM 0 HD22 ASN A 531 -1.873 8.448 5.590 1.00 54.22 H new ATOM 1525 N VAL A 532 2.981 6.287 3.756 1.00 2.35 N ATOM 1526 CA VAL A 532 3.548 5.603 2.581 1.00 45.10 C ATOM 1527 C VAL A 532 4.474 4.444 2.991 1.00 3.01 C ATOM 1528 O VAL A 532 5.334 4.598 3.861 1.00 22.25 O ATOM 1529 CB VAL A 532 4.351 6.587 1.684 1.00 20.52 C ATOM 1530 CG1 VAL A 532 4.842 5.895 0.408 1.00 34.33 C ATOM 1531 CG2 VAL A 532 3.516 7.825 1.350 1.00 72.12 C ATOM 0 H VAL A 532 3.674 6.583 4.443 1.00 2.35 H new ATOM 0 HA VAL A 532 2.702 5.206 2.019 1.00 45.10 H new ATOM 0 HB VAL A 532 5.228 6.912 2.244 1.00 20.52 H new ATOM 0 HG11 VAL A 532 5.400 6.607 -0.200 1.00 34.33 H new ATOM 0 HG12 VAL A 532 5.489 5.059 0.673 1.00 34.33 H new ATOM 0 HG13 VAL A 532 3.987 5.527 -0.158 1.00 34.33 H new ATOM 0 HG21 VAL A 532 4.099 8.498 0.722 1.00 72.12 H new ATOM 0 HG22 VAL A 532 2.614 7.523 0.818 1.00 72.12 H new ATOM 0 HG23 VAL A 532 3.240 8.337 2.272 1.00 72.12 H new ATOM 1541 N ALA A 533 4.299 3.288 2.353 1.00 21.04 N ATOM 1542 CA ALA A 533 5.170 2.128 2.590 1.00 45.01 C ATOM 1543 C ALA A 533 5.984 1.784 1.335 1.00 34.45 C ATOM 1544 O ALA A 533 5.478 1.878 0.216 1.00 24.15 O ATOM 1545 CB ALA A 533 4.344 0.924 3.030 1.00 65.31 C ATOM 0 H ALA A 533 3.562 3.125 1.666 1.00 21.04 H new ATOM 0 HA ALA A 533 5.867 2.387 3.387 1.00 45.01 H new ATOM 0 HB1 ALA A 533 5.004 0.073 3.201 1.00 65.31 H new ATOM 0 HB2 ALA A 533 3.814 1.164 3.952 1.00 65.31 H new ATOM 0 HB3 ALA A 533 3.623 0.673 2.252 1.00 65.31 H new ATOM 1551 N THR A 534 7.242 1.389 1.530 1.00 54.55 N ATOM 1552 CA THR A 534 8.148 1.079 0.413 1.00 4.55 C ATOM 1553 C THR A 534 8.703 -0.353 0.495 1.00 25.34 C ATOM 1554 O THR A 534 9.335 -0.730 1.483 1.00 42.00 O ATOM 1555 CB THR A 534 9.340 2.074 0.363 1.00 41.14 C ATOM 1556 OG1 THR A 534 8.874 3.398 0.057 1.00 23.10 O ATOM 1557 CG2 THR A 534 10.381 1.653 -0.671 1.00 54.35 C ATOM 0 H THR A 534 7.662 1.274 2.452 1.00 54.55 H new ATOM 0 HA THR A 534 7.552 1.172 -0.495 1.00 4.55 H new ATOM 0 HB THR A 534 9.810 2.068 1.347 1.00 41.14 H new ATOM 0 HG1 THR A 534 9.635 4.015 0.030 1.00 23.10 H new ATOM 0 HG21 THR A 534 11.199 2.373 -0.677 1.00 54.35 H new ATOM 0 HG22 THR A 534 10.768 0.666 -0.417 1.00 54.35 H new ATOM 0 HG23 THR A 534 9.920 1.619 -1.658 1.00 54.35 H new ATOM 1565 N PHE A 535 8.464 -1.139 -0.553 1.00 63.32 N ATOM 1566 CA PHE A 535 9.021 -2.497 -0.667 1.00 44.22 C ATOM 1567 C PHE A 535 9.519 -2.744 -2.102 1.00 41.01 C ATOM 1568 O PHE A 535 8.732 -2.722 -3.045 1.00 74.23 O ATOM 1569 CB PHE A 535 7.952 -3.538 -0.287 1.00 12.41 C ATOM 1570 CG PHE A 535 8.432 -4.973 -0.317 1.00 4.02 C ATOM 1571 CD1 PHE A 535 9.090 -5.525 0.777 1.00 21.23 C ATOM 1572 CD2 PHE A 535 8.215 -5.775 -1.431 1.00 22.51 C ATOM 1573 CE1 PHE A 535 9.521 -6.839 0.757 1.00 53.14 C ATOM 1574 CE2 PHE A 535 8.644 -7.090 -1.452 1.00 25.34 C ATOM 1575 CZ PHE A 535 9.297 -7.622 -0.359 1.00 15.45 C ATOM 0 H PHE A 535 7.884 -0.861 -1.345 1.00 63.32 H new ATOM 0 HA PHE A 535 9.864 -2.594 0.017 1.00 44.22 H new ATOM 0 HB2 PHE A 535 7.584 -3.313 0.714 1.00 12.41 H new ATOM 0 HB3 PHE A 535 7.107 -3.437 -0.968 1.00 12.41 H new ATOM 0 HD1 PHE A 535 9.267 -4.920 1.654 1.00 21.23 H new ATOM 0 HD2 PHE A 535 7.705 -5.367 -2.291 1.00 22.51 H new ATOM 0 HE1 PHE A 535 10.032 -7.253 1.613 1.00 53.14 H new ATOM 0 HE2 PHE A 535 8.468 -7.701 -2.325 1.00 25.34 H new ATOM 0 HZ PHE A 535 9.632 -8.648 -0.376 1.00 15.45 H new ATOM 1585 N ASP A 536 10.819 -2.974 -2.273 1.00 72.43 N ATOM 1586 CA ASP A 536 11.387 -3.168 -3.615 1.00 0.41 C ATOM 1587 C ASP A 536 11.558 -4.659 -3.968 1.00 75.32 C ATOM 1588 O ASP A 536 12.012 -5.465 -3.155 1.00 32.14 O ATOM 1589 CB ASP A 536 12.713 -2.410 -3.762 1.00 74.44 C ATOM 1590 CG ASP A 536 13.647 -2.620 -2.587 1.00 63.53 C ATOM 1591 OD1 ASP A 536 14.317 -3.668 -2.526 1.00 74.01 O ATOM 1592 OD2 ASP A 536 13.722 -1.727 -1.719 1.00 5.31 O ATOM 0 H ASP A 536 11.496 -3.031 -1.512 1.00 72.43 H new ATOM 0 HA ASP A 536 10.673 -2.755 -4.328 1.00 0.41 H new ATOM 0 HB2 ASP A 536 13.210 -2.732 -4.677 1.00 74.44 H new ATOM 0 HB3 ASP A 536 12.507 -1.345 -3.870 1.00 74.44 H new ATOM 1597 N VAL A 537 11.179 -5.000 -5.198 1.00 3.11 N ATOM 1598 CA VAL A 537 11.212 -6.378 -5.693 1.00 42.13 C ATOM 1599 C VAL A 537 12.175 -6.527 -6.883 1.00 64.24 C ATOM 1600 O VAL A 537 12.271 -5.644 -7.743 1.00 12.33 O ATOM 1601 CB VAL A 537 9.798 -6.832 -6.137 1.00 35.22 C ATOM 1602 CG1 VAL A 537 9.806 -8.290 -6.597 1.00 55.14 C ATOM 1603 CG2 VAL A 537 8.785 -6.619 -5.015 1.00 12.15 C ATOM 0 H VAL A 537 10.838 -4.326 -5.884 1.00 3.11 H new ATOM 0 HA VAL A 537 11.563 -7.004 -4.873 1.00 42.13 H new ATOM 0 HB VAL A 537 9.499 -6.218 -6.986 1.00 35.22 H new ATOM 0 HG11 VAL A 537 8.801 -8.581 -6.902 1.00 55.14 H new ATOM 0 HG12 VAL A 537 10.488 -8.402 -7.440 1.00 55.14 H new ATOM 0 HG13 VAL A 537 10.135 -8.928 -5.777 1.00 55.14 H new ATOM 0 HG21 VAL A 537 7.799 -6.944 -5.348 1.00 12.15 H new ATOM 0 HG22 VAL A 537 9.082 -7.199 -4.141 1.00 12.15 H new ATOM 0 HG23 VAL A 537 8.749 -5.561 -4.753 1.00 12.15 H new ATOM 1613 N SER A 538 12.880 -7.653 -6.929 1.00 33.03 N ATOM 1614 CA SER A 538 13.803 -7.956 -8.033 1.00 53.20 C ATOM 1615 C SER A 538 13.195 -8.991 -8.989 1.00 42.43 C ATOM 1616 O SER A 538 12.818 -10.088 -8.571 1.00 60.40 O ATOM 1617 CB SER A 538 15.136 -8.489 -7.487 1.00 10.15 C ATOM 1618 OG SER A 538 16.062 -8.729 -8.536 1.00 72.34 O ATOM 0 H SER A 538 12.834 -8.378 -6.213 1.00 33.03 H new ATOM 0 HA SER A 538 13.980 -7.031 -8.581 1.00 53.20 H new ATOM 0 HB2 SER A 538 15.557 -7.770 -6.784 1.00 10.15 H new ATOM 0 HB3 SER A 538 14.962 -9.412 -6.934 1.00 10.15 H new ATOM 0 HG SER A 538 16.902 -9.066 -8.160 1.00 72.34 H new ATOM 1624 N VAL A 539 13.092 -8.640 -10.271 1.00 2.34 N ATOM 1625 CA VAL A 539 12.540 -9.552 -11.286 1.00 3.04 C ATOM 1626 C VAL A 539 13.653 -10.177 -12.142 1.00 72.51 C ATOM 1627 O VAL A 539 14.411 -9.467 -12.808 1.00 3.15 O ATOM 1628 CB VAL A 539 11.534 -8.823 -12.213 1.00 54.32 C ATOM 1629 CG1 VAL A 539 10.921 -9.791 -13.227 1.00 13.12 C ATOM 1630 CG2 VAL A 539 10.446 -8.140 -11.386 1.00 13.24 C ATOM 0 H VAL A 539 13.382 -7.733 -10.636 1.00 2.34 H new ATOM 0 HA VAL A 539 12.019 -10.343 -10.747 1.00 3.04 H new ATOM 0 HB VAL A 539 12.075 -8.058 -12.769 1.00 54.32 H new ATOM 0 HG11 VAL A 539 10.219 -9.254 -13.865 1.00 13.12 H new ATOM 0 HG12 VAL A 539 11.711 -10.223 -13.841 1.00 13.12 H new ATOM 0 HG13 VAL A 539 10.395 -10.587 -12.699 1.00 13.12 H new ATOM 0 HG21 VAL A 539 9.748 -7.633 -12.052 1.00 13.24 H new ATOM 0 HG22 VAL A 539 9.911 -8.888 -10.800 1.00 13.24 H new ATOM 0 HG23 VAL A 539 10.902 -7.412 -10.715 1.00 13.24 H new ATOM 1640 N VAL A 540 13.736 -11.508 -12.129 1.00 72.52 N ATOM 1641 CA VAL A 540 14.782 -12.235 -12.863 1.00 41.44 C ATOM 1642 C VAL A 540 14.203 -13.092 -14.005 1.00 22.11 C ATOM 1643 O VAL A 540 13.021 -13.439 -14.008 1.00 3.15 O ATOM 1644 CB VAL A 540 15.597 -13.148 -11.910 1.00 52.41 C ATOM 1645 CG1 VAL A 540 16.329 -12.318 -10.856 1.00 4.31 C ATOM 1646 CG2 VAL A 540 14.691 -14.188 -11.249 1.00 54.30 C ATOM 0 H VAL A 540 13.091 -12.110 -11.617 1.00 72.52 H new ATOM 0 HA VAL A 540 15.436 -11.478 -13.296 1.00 41.44 H new ATOM 0 HB VAL A 540 16.344 -13.676 -12.503 1.00 52.41 H new ATOM 0 HG11 VAL A 540 16.894 -12.980 -10.199 1.00 4.31 H new ATOM 0 HG12 VAL A 540 17.012 -11.626 -11.348 1.00 4.31 H new ATOM 0 HG13 VAL A 540 15.604 -11.755 -10.268 1.00 4.31 H new ATOM 0 HG21 VAL A 540 15.284 -14.817 -10.585 1.00 54.30 H new ATOM 0 HG22 VAL A 540 13.916 -13.682 -10.673 1.00 54.30 H new ATOM 0 HG23 VAL A 540 14.227 -14.807 -12.017 1.00 54.30 H new ATOM 1656 N LEU A 541 15.056 -13.440 -14.968 1.00 51.33 N ATOM 1657 CA LEU A 541 14.657 -14.268 -16.118 1.00 65.35 C ATOM 1658 C LEU A 541 14.662 -15.772 -15.782 1.00 63.55 C ATOM 1659 O LEU A 541 14.340 -16.610 -16.631 1.00 71.34 O ATOM 1660 CB LEU A 541 15.604 -14.006 -17.299 1.00 63.10 C ATOM 1661 CG LEU A 541 15.624 -12.560 -17.819 1.00 33.33 C ATOM 1662 CD1 LEU A 541 16.690 -12.389 -18.900 1.00 63.01 C ATOM 1663 CD2 LEU A 541 14.248 -12.164 -18.353 1.00 23.33 C ATOM 0 H LEU A 541 16.037 -13.161 -14.979 1.00 51.33 H new ATOM 0 HA LEU A 541 13.637 -13.990 -16.382 1.00 65.35 H new ATOM 0 HB2 LEU A 541 16.615 -14.281 -17.000 1.00 63.10 H new ATOM 0 HB3 LEU A 541 15.324 -14.666 -18.120 1.00 63.10 H new ATOM 0 HG LEU A 541 15.874 -11.901 -16.988 1.00 33.33 H new ATOM 0 HD11 LEU A 541 16.687 -11.358 -19.254 1.00 63.01 H new ATOM 0 HD12 LEU A 541 17.670 -12.628 -18.486 1.00 63.01 H new ATOM 0 HD13 LEU A 541 16.475 -13.059 -19.732 1.00 63.01 H new ATOM 0 HD21 LEU A 541 14.281 -11.137 -18.717 1.00 23.33 H new ATOM 0 HD22 LEU A 541 13.969 -12.830 -19.170 1.00 23.33 H new ATOM 0 HD23 LEU A 541 13.511 -12.242 -17.554 1.00 23.33 H new ATOM 1675 N GLU A 542 15.009 -16.107 -14.543 1.00 52.25 N ATOM 1676 CA GLU A 542 15.171 -17.510 -14.122 1.00 73.44 C ATOM 1677 C GLU A 542 14.241 -17.885 -12.943 1.00 32.44 C ATOM 1678 O GLU A 542 14.576 -17.573 -11.779 1.00 37.63 O ATOM 1679 CB GLU A 542 16.648 -17.764 -13.764 1.00 11.44 C ATOM 1680 CG GLU A 542 17.286 -16.637 -12.955 1.00 55.12 C ATOM 1681 CD GLU A 542 18.719 -16.933 -12.555 1.00 14.32 C ATOM 1682 OE1 GLU A 542 19.629 -16.733 -13.387 1.00 15.40 O ATOM 1683 OE2 GLU A 542 18.943 -17.361 -11.401 1.00 30.55 O ATOM 0 H GLU A 542 15.186 -15.427 -13.803 1.00 52.25 H new ATOM 0 HA GLU A 542 14.880 -18.150 -14.955 1.00 73.44 H new ATOM 0 HB2 GLU A 542 16.721 -18.692 -13.197 1.00 11.44 H new ATOM 0 HB3 GLU A 542 17.216 -17.906 -14.683 1.00 11.44 H new ATOM 0 HG2 GLU A 542 17.260 -15.718 -13.540 1.00 55.12 H new ATOM 0 HG3 GLU A 542 16.693 -16.461 -12.058 1.00 55.12 H new