USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 991 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 503 ASN : amide:sc= -3.4! C(o=-3.4!,f=-5.7!) USER MOD Set 1.2: A 584 SER OG : rot -130:sc= 0 USER MOD Set 2.1: A 554 CYS SG : rot -50:sc= -1.35 USER MOD Set 2.2: A 555 CYS SG : rot 28:sc= -0.893 USER MOD Set 3.1: A 495 TYR OH : rot 180:sc= 0.371 USER MOD Set 3.2: A 501 HIS : no HD1:sc= 0 X(o=0.37,f=0.37) USER MOD Single : A 477 SER OG : rot -54:sc= 0.0012 USER MOD Single : A 478 SER OG : rot 180:sc= 0 USER MOD Single : A 480 SER OG : rot 58:sc= 0.251 USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 483 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00606) USER MOD Single : A 487 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 491 TYR OH : rot 180:sc= 0 USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 GLN : amide:sc= -0.18 K(o=-0.18,f=-2.6!) USER MOD Single : A 499 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 504 THR OG1 : rot 120:sc= 0.015 USER MOD Single : A 505 GLN : amide:sc= -0.296 K(o=-0.3,f=-1.2) USER MOD Single : A 506 GLN : amide:sc= 0.967 K(o=0.97,f=-7.5!) USER MOD Single : A 508 THR OG1 : rot 167:sc= 1.34 USER MOD Single : A 511 GLN : amide:sc= -0.332 X(o=-0.33,f=-0.0027) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 520 THR OG1 : rot 146:sc= 0.0162 USER MOD Single : A 527 SER OG : rot 180:sc= 0 USER MOD Single : A 528 TYR OH : rot 7:sc= 0.553 USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 535 HIS : no HD1:sc= -1.62! C(o=-1.6!,f=-1.9!) USER MOD Single : A 536 MET CE :methyl -158:sc= -1.01 (180deg=-1.8) USER MOD Single : A 537 MET CE :methyl -130:sc= -0.497 (180deg=-3.04!) USER MOD Single : A 539 LYS NZ :NH3+ -133:sc= -0.311 (180deg=-2.41!) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 GLN : amide:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 556 ASN : amide:sc= -0.31 X(o=-0.31,f=-0.0054) USER MOD Single : A 564 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 565 GLN : amide:sc= 0 X(o=0,f=-0.0032) USER MOD Single : A 567 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.1) USER MOD Single : A 569 MET CE :methyl -107:sc= -0.432 (180deg=-4.35!) USER MOD Single : A 570 HIS : no HD1:sc= -2.58! C(o=-2.6!,f=-4.4!) USER MOD Single : A 574 GLN :FLIP amide:sc= -0.227 F(o=-2,f=-0.23) USER MOD Single : A 575 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 579 MET CE :methyl -167:sc= -1.02 (180deg=-1.53) USER MOD Single : A 583 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 591 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 593 SER OG : rot 180:sc= 0 USER MOD Single : A 594 SER OG : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0 USER MOD Single : A 598 SER OG : rot 180:sc=-0.00197 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 476 29.605 -9.926 -9.419 1.00 0.00 N ATOM 2 CA GLY A 476 29.454 -11.366 -9.331 1.00 0.00 C ATOM 3 C GLY A 476 28.554 -11.922 -10.416 1.00 0.00 C ATOM 4 O GLY A 476 27.350 -11.665 -10.426 1.00 0.00 O ATOM 0 HA2 GLY A 476 30.435 -11.836 -9.401 1.00 0.00 H new ATOM 0 HA3 GLY A 476 29.045 -11.626 -8.355 1.00 0.00 H new ATOM 8 N SER A 477 29.138 -12.686 -11.334 1.00 0.00 N ATOM 9 CA SER A 477 28.381 -13.275 -12.432 1.00 0.00 C ATOM 10 C SER A 477 28.166 -14.768 -12.204 1.00 0.00 C ATOM 11 O SER A 477 28.287 -15.573 -13.127 1.00 0.00 O ATOM 12 CB SER A 477 29.109 -13.051 -13.759 1.00 0.00 C ATOM 13 OG SER A 477 28.212 -13.134 -14.853 1.00 0.00 O ATOM 0 H SER A 477 30.133 -12.911 -11.339 1.00 0.00 H new ATOM 0 HA SER A 477 27.407 -12.787 -12.472 1.00 0.00 H new ATOM 0 HB2 SER A 477 29.590 -12.073 -13.753 1.00 0.00 H new ATOM 0 HB3 SER A 477 29.898 -13.794 -13.874 1.00 0.00 H new ATOM 0 HG SER A 477 27.731 -13.987 -14.817 1.00 0.00 H new ATOM 19 N SER A 478 27.844 -15.130 -10.966 1.00 0.00 N ATOM 20 CA SER A 478 27.615 -16.527 -10.613 1.00 0.00 C ATOM 21 C SER A 478 26.123 -16.847 -10.604 1.00 0.00 C ATOM 22 O SER A 478 25.479 -16.829 -9.556 1.00 0.00 O ATOM 23 CB SER A 478 28.223 -16.835 -9.243 1.00 0.00 C ATOM 24 OG SER A 478 29.615 -16.570 -9.232 1.00 0.00 O ATOM 0 H SER A 478 27.736 -14.476 -10.191 1.00 0.00 H new ATOM 0 HA SER A 478 28.098 -17.151 -11.365 1.00 0.00 H new ATOM 0 HB2 SER A 478 27.729 -16.234 -8.479 1.00 0.00 H new ATOM 0 HB3 SER A 478 28.047 -17.880 -8.990 1.00 0.00 H new ATOM 0 HG SER A 478 29.980 -16.773 -8.345 1.00 0.00 H new ATOM 30 N GLY A 479 25.580 -17.140 -11.782 1.00 0.00 N ATOM 31 CA GLY A 479 24.168 -17.459 -11.889 1.00 0.00 C ATOM 32 C GLY A 479 23.296 -16.221 -11.951 1.00 0.00 C ATOM 33 O GLY A 479 22.601 -15.894 -10.989 1.00 0.00 O ATOM 0 H GLY A 479 26.092 -17.162 -12.664 1.00 0.00 H new ATOM 0 HA2 GLY A 479 24.002 -18.062 -12.782 1.00 0.00 H new ATOM 0 HA3 GLY A 479 23.870 -18.067 -11.034 1.00 0.00 H new ATOM 37 N SER A 480 23.334 -15.529 -13.085 1.00 0.00 N ATOM 38 CA SER A 480 22.545 -14.316 -13.266 1.00 0.00 C ATOM 39 C SER A 480 21.255 -14.615 -14.025 1.00 0.00 C ATOM 40 O SER A 480 20.839 -13.845 -14.890 1.00 0.00 O ATOM 41 CB SER A 480 23.359 -13.261 -14.017 1.00 0.00 C ATOM 42 OG SER A 480 23.488 -13.596 -15.388 1.00 0.00 O ATOM 0 H SER A 480 23.902 -15.787 -13.892 1.00 0.00 H new ATOM 0 HA SER A 480 22.285 -13.930 -12.280 1.00 0.00 H new ATOM 0 HB2 SER A 480 22.876 -12.289 -13.921 1.00 0.00 H new ATOM 0 HB3 SER A 480 24.348 -13.172 -13.567 1.00 0.00 H new ATOM 0 HG SER A 480 22.598 -13.693 -15.786 1.00 0.00 H new ATOM 48 N SER A 481 20.628 -15.739 -13.694 1.00 0.00 N ATOM 49 CA SER A 481 19.388 -16.144 -14.346 1.00 0.00 C ATOM 50 C SER A 481 18.308 -16.453 -13.314 1.00 0.00 C ATOM 51 O SER A 481 18.378 -17.458 -12.608 1.00 0.00 O ATOM 52 CB SER A 481 19.629 -17.367 -15.232 1.00 0.00 C ATOM 53 OG SER A 481 18.420 -17.816 -15.821 1.00 0.00 O ATOM 0 H SER A 481 20.958 -16.386 -12.978 1.00 0.00 H new ATOM 0 HA SER A 481 19.046 -15.317 -14.968 1.00 0.00 H new ATOM 0 HB2 SER A 481 20.347 -17.118 -16.013 1.00 0.00 H new ATOM 0 HB3 SER A 481 20.068 -18.169 -14.639 1.00 0.00 H new ATOM 0 HG SER A 481 18.601 -18.598 -16.384 1.00 0.00 H new ATOM 59 N GLY A 482 17.308 -15.580 -13.233 1.00 0.00 N ATOM 60 CA GLY A 482 16.227 -15.777 -12.285 1.00 0.00 C ATOM 61 C GLY A 482 14.979 -16.337 -12.938 1.00 0.00 C ATOM 62 O GLY A 482 15.039 -17.336 -13.655 1.00 0.00 O ATOM 0 H GLY A 482 17.227 -14.740 -13.807 1.00 0.00 H new ATOM 0 HA2 GLY A 482 16.557 -16.455 -11.498 1.00 0.00 H new ATOM 0 HA3 GLY A 482 15.988 -14.827 -11.808 1.00 0.00 H new ATOM 66 N LYS A 483 13.843 -15.695 -12.688 1.00 0.00 N ATOM 67 CA LYS A 483 12.574 -16.134 -13.255 1.00 0.00 C ATOM 68 C LYS A 483 11.483 -15.095 -13.017 1.00 0.00 C ATOM 69 O LYS A 483 11.357 -14.529 -11.931 1.00 0.00 O ATOM 70 CB LYS A 483 12.157 -17.475 -12.647 1.00 0.00 C ATOM 71 CG LYS A 483 11.049 -18.173 -13.416 1.00 0.00 C ATOM 72 CD LYS A 483 11.555 -18.742 -14.731 1.00 0.00 C ATOM 73 CE LYS A 483 12.262 -20.073 -14.528 1.00 0.00 C ATOM 74 NZ LYS A 483 11.296 -21.192 -14.343 1.00 0.00 N ATOM 0 H LYS A 483 13.776 -14.868 -12.095 1.00 0.00 H new ATOM 0 HA LYS A 483 12.708 -16.255 -14.330 1.00 0.00 H new ATOM 0 HB2 LYS A 483 13.027 -18.131 -12.604 1.00 0.00 H new ATOM 0 HB3 LYS A 483 11.829 -17.313 -11.620 1.00 0.00 H new ATOM 0 HG2 LYS A 483 10.633 -18.976 -12.807 1.00 0.00 H new ATOM 0 HG3 LYS A 483 10.240 -17.468 -13.611 1.00 0.00 H new ATOM 0 HD2 LYS A 483 10.718 -18.874 -15.417 1.00 0.00 H new ATOM 0 HD3 LYS A 483 12.240 -18.033 -15.196 1.00 0.00 H new ATOM 0 HE2 LYS A 483 12.898 -20.281 -15.388 1.00 0.00 H new ATOM 0 HE3 LYS A 483 12.914 -20.009 -13.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 483 11.815 -22.091 -14.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 483 10.752 -21.040 -13.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 483 10.646 -21.227 -15.154 1.00 0.00 H new ATOM 88 N PRO A 484 10.672 -14.838 -14.055 1.00 0.00 N ATOM 89 CA PRO A 484 9.576 -13.868 -13.982 1.00 0.00 C ATOM 90 C PRO A 484 8.438 -14.345 -13.085 1.00 0.00 C ATOM 91 O PRO A 484 7.585 -15.123 -13.511 1.00 0.00 O ATOM 92 CB PRO A 484 9.103 -13.758 -15.433 1.00 0.00 C ATOM 93 CG PRO A 484 9.490 -15.054 -16.057 1.00 0.00 C ATOM 94 CD PRO A 484 10.764 -15.476 -15.379 1.00 0.00 C ATOM 0 HA PRO A 484 9.899 -12.920 -13.551 1.00 0.00 H new ATOM 0 HB2 PRO A 484 8.026 -13.598 -15.487 1.00 0.00 H new ATOM 0 HB3 PRO A 484 9.576 -12.917 -15.941 1.00 0.00 H new ATOM 0 HG2 PRO A 484 8.709 -15.802 -15.920 1.00 0.00 H new ATOM 0 HG3 PRO A 484 9.638 -14.941 -17.131 1.00 0.00 H new ATOM 0 HD2 PRO A 484 10.836 -16.561 -15.298 1.00 0.00 H new ATOM 0 HD3 PRO A 484 11.643 -15.138 -15.928 1.00 0.00 H new ATOM 102 N ILE A 485 8.433 -13.873 -11.843 1.00 0.00 N ATOM 103 CA ILE A 485 7.399 -14.251 -10.888 1.00 0.00 C ATOM 104 C ILE A 485 6.303 -13.192 -10.817 1.00 0.00 C ATOM 105 O ILE A 485 6.357 -12.282 -9.990 1.00 0.00 O ATOM 106 CB ILE A 485 7.984 -14.462 -9.479 1.00 0.00 C ATOM 107 CG1 ILE A 485 9.034 -15.575 -9.501 1.00 0.00 C ATOM 108 CG2 ILE A 485 6.876 -14.791 -8.489 1.00 0.00 C ATOM 109 CD1 ILE A 485 10.083 -15.437 -8.420 1.00 0.00 C ATOM 0 H ILE A 485 9.133 -13.229 -11.475 1.00 0.00 H new ATOM 0 HA ILE A 485 6.972 -15.190 -11.240 1.00 0.00 H new ATOM 0 HB ILE A 485 8.467 -13.538 -9.160 1.00 0.00 H new ATOM 0 HG12 ILE A 485 8.534 -16.537 -9.390 1.00 0.00 H new ATOM 0 HG13 ILE A 485 9.525 -15.581 -10.474 1.00 0.00 H new ATOM 0 HG21 ILE A 485 7.305 -14.937 -7.498 1.00 0.00 H new ATOM 0 HG22 ILE A 485 6.161 -13.969 -8.457 1.00 0.00 H new ATOM 0 HG23 ILE A 485 6.367 -15.703 -8.802 1.00 0.00 H new ATOM 0 HD11 ILE A 485 10.794 -16.260 -8.496 1.00 0.00 H new ATOM 0 HD12 ILE A 485 10.609 -14.490 -8.542 1.00 0.00 H new ATOM 0 HD13 ILE A 485 9.603 -15.461 -7.442 1.00 0.00 H new ATOM 121 N PHE A 486 5.308 -13.320 -11.689 1.00 0.00 N ATOM 122 CA PHE A 486 4.198 -12.375 -11.725 1.00 0.00 C ATOM 123 C PHE A 486 2.860 -13.104 -11.642 1.00 0.00 C ATOM 124 O PHE A 486 2.026 -13.003 -12.543 1.00 0.00 O ATOM 125 CB PHE A 486 4.255 -11.537 -13.004 1.00 0.00 C ATOM 126 CG PHE A 486 3.684 -10.157 -12.842 1.00 0.00 C ATOM 127 CD1 PHE A 486 2.379 -9.979 -12.414 1.00 0.00 C ATOM 128 CD2 PHE A 486 4.453 -9.038 -13.119 1.00 0.00 C ATOM 129 CE1 PHE A 486 1.850 -8.711 -12.264 1.00 0.00 C ATOM 130 CE2 PHE A 486 3.930 -7.767 -12.971 1.00 0.00 C ATOM 131 CZ PHE A 486 2.627 -7.604 -12.544 1.00 0.00 C ATOM 0 H PHE A 486 5.248 -14.068 -12.380 1.00 0.00 H new ATOM 0 HA PHE A 486 4.287 -11.716 -10.862 1.00 0.00 H new ATOM 0 HB2 PHE A 486 5.292 -11.457 -13.330 1.00 0.00 H new ATOM 0 HB3 PHE A 486 3.712 -12.056 -13.794 1.00 0.00 H new ATOM 0 HD1 PHE A 486 1.767 -10.842 -12.195 1.00 0.00 H new ATOM 0 HD2 PHE A 486 5.472 -9.160 -13.454 1.00 0.00 H new ATOM 0 HE1 PHE A 486 0.831 -8.586 -11.929 1.00 0.00 H new ATOM 0 HE2 PHE A 486 4.540 -6.903 -13.189 1.00 0.00 H new ATOM 0 HZ PHE A 486 2.216 -6.612 -12.429 1.00 0.00 H new ATOM 141 N THR A 487 2.661 -13.842 -10.553 1.00 0.00 N ATOM 142 CA THR A 487 1.427 -14.590 -10.352 1.00 0.00 C ATOM 143 C THR A 487 0.683 -14.099 -9.115 1.00 0.00 C ATOM 144 O THR A 487 0.186 -14.897 -8.320 1.00 0.00 O ATOM 145 CB THR A 487 1.702 -16.098 -10.206 1.00 0.00 C ATOM 146 OG1 THR A 487 2.703 -16.507 -11.145 1.00 0.00 O ATOM 147 CG2 THR A 487 0.431 -16.904 -10.430 1.00 0.00 C ATOM 0 H THR A 487 3.339 -13.937 -9.797 1.00 0.00 H new ATOM 0 HA THR A 487 0.809 -14.425 -11.235 1.00 0.00 H new ATOM 0 HB THR A 487 2.058 -16.283 -9.192 1.00 0.00 H new ATOM 0 HG1 THR A 487 2.873 -17.467 -11.044 1.00 0.00 H new ATOM 0 HG21 THR A 487 0.650 -17.966 -10.322 1.00 0.00 H new ATOM 0 HG22 THR A 487 -0.319 -16.612 -9.696 1.00 0.00 H new ATOM 0 HG23 THR A 487 0.051 -16.712 -11.433 1.00 0.00 H new ATOM 155 N ASP A 488 0.608 -12.782 -8.959 1.00 0.00 N ATOM 156 CA ASP A 488 -0.078 -12.184 -7.819 1.00 0.00 C ATOM 157 C ASP A 488 0.306 -12.891 -6.523 1.00 0.00 C ATOM 158 O ASP A 488 -0.548 -13.171 -5.682 1.00 0.00 O ATOM 159 CB ASP A 488 -1.593 -12.246 -8.019 1.00 0.00 C ATOM 160 CG ASP A 488 -2.105 -11.134 -8.914 1.00 0.00 C ATOM 161 OD1 ASP A 488 -1.450 -10.848 -9.938 1.00 0.00 O ATOM 162 OD2 ASP A 488 -3.160 -10.549 -8.589 1.00 0.00 O ATOM 0 H ASP A 488 1.014 -12.108 -9.608 1.00 0.00 H new ATOM 0 HA ASP A 488 0.229 -11.140 -7.747 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -1.860 -13.210 -8.453 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -2.087 -12.185 -7.049 1.00 0.00 H new ATOM 167 N GLU A 489 1.595 -13.177 -6.370 1.00 0.00 N ATOM 168 CA GLU A 489 2.090 -13.852 -5.176 1.00 0.00 C ATOM 169 C GLU A 489 2.830 -12.876 -4.266 1.00 0.00 C ATOM 170 O GLU A 489 3.743 -12.175 -4.701 1.00 0.00 O ATOM 171 CB GLU A 489 3.017 -15.007 -5.564 1.00 0.00 C ATOM 172 CG GLU A 489 3.284 -15.980 -4.428 1.00 0.00 C ATOM 173 CD GLU A 489 2.012 -16.585 -3.867 1.00 0.00 C ATOM 174 OE1 GLU A 489 1.140 -16.984 -4.667 1.00 0.00 O ATOM 175 OE2 GLU A 489 1.889 -16.659 -2.626 1.00 0.00 O ATOM 0 H GLU A 489 2.315 -12.952 -7.057 1.00 0.00 H new ATOM 0 HA GLU A 489 1.233 -14.249 -4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 489 2.577 -15.550 -6.400 1.00 0.00 H new ATOM 0 HB3 GLU A 489 3.966 -14.599 -5.913 1.00 0.00 H new ATOM 0 HG2 GLU A 489 3.935 -16.778 -4.784 1.00 0.00 H new ATOM 0 HG3 GLU A 489 3.819 -15.464 -3.631 1.00 0.00 H new ATOM 182 N SER A 490 2.427 -12.836 -3.000 1.00 0.00 N ATOM 183 CA SER A 490 3.047 -11.943 -2.028 1.00 0.00 C ATOM 184 C SER A 490 3.737 -12.738 -0.923 1.00 0.00 C ATOM 185 O SER A 490 3.082 -13.405 -0.122 1.00 0.00 O ATOM 186 CB SER A 490 2.000 -11.008 -1.422 1.00 0.00 C ATOM 187 OG SER A 490 1.297 -10.305 -2.432 1.00 0.00 O ATOM 0 H SER A 490 1.674 -13.412 -2.623 1.00 0.00 H new ATOM 0 HA SER A 490 3.798 -11.347 -2.546 1.00 0.00 H new ATOM 0 HB2 SER A 490 1.298 -11.585 -0.820 1.00 0.00 H new ATOM 0 HB3 SER A 490 2.486 -10.299 -0.752 1.00 0.00 H new ATOM 0 HG SER A 490 0.632 -9.715 -2.018 1.00 0.00 H new ATOM 193 N TYR A 491 5.062 -12.660 -0.886 1.00 0.00 N ATOM 194 CA TYR A 491 5.842 -13.373 0.119 1.00 0.00 C ATOM 195 C TYR A 491 5.528 -12.856 1.519 1.00 0.00 C ATOM 196 O TYR A 491 5.045 -11.736 1.687 1.00 0.00 O ATOM 197 CB TYR A 491 7.337 -13.227 -0.168 1.00 0.00 C ATOM 198 CG TYR A 491 8.158 -14.416 0.277 1.00 0.00 C ATOM 199 CD1 TYR A 491 8.384 -15.488 -0.578 1.00 0.00 C ATOM 200 CD2 TYR A 491 8.707 -14.469 1.552 1.00 0.00 C ATOM 201 CE1 TYR A 491 9.133 -16.577 -0.175 1.00 0.00 C ATOM 202 CE2 TYR A 491 9.458 -15.553 1.963 1.00 0.00 C ATOM 203 CZ TYR A 491 9.668 -16.605 1.095 1.00 0.00 C ATOM 204 OH TYR A 491 10.415 -17.687 1.501 1.00 0.00 O ATOM 0 H TYR A 491 5.619 -12.110 -1.540 1.00 0.00 H new ATOM 0 HA TYR A 491 5.571 -14.428 0.072 1.00 0.00 H new ATOM 0 HB2 TYR A 491 7.480 -13.077 -1.238 1.00 0.00 H new ATOM 0 HB3 TYR A 491 7.709 -12.332 0.331 1.00 0.00 H new ATOM 0 HD1 TYR A 491 7.967 -15.470 -1.574 1.00 0.00 H new ATOM 0 HD2 TYR A 491 8.544 -13.648 2.234 1.00 0.00 H new ATOM 0 HE1 TYR A 491 9.298 -17.402 -0.852 1.00 0.00 H new ATOM 0 HE2 TYR A 491 9.878 -15.577 2.958 1.00 0.00 H new ATOM 0 HH TYR A 491 10.719 -17.548 2.422 1.00 0.00 H new ATOM 214 N LEU A 492 5.807 -13.681 2.523 1.00 0.00 N ATOM 215 CA LEU A 492 5.556 -13.309 3.911 1.00 0.00 C ATOM 216 C LEU A 492 6.724 -12.511 4.481 1.00 0.00 C ATOM 217 O LEU A 492 6.546 -11.397 4.971 1.00 0.00 O ATOM 218 CB LEU A 492 5.316 -14.560 4.759 1.00 0.00 C ATOM 219 CG LEU A 492 3.883 -15.093 4.778 1.00 0.00 C ATOM 220 CD1 LEU A 492 3.391 -15.352 3.363 1.00 0.00 C ATOM 221 CD2 LEU A 492 3.797 -16.361 5.615 1.00 0.00 C ATOM 0 H LEU A 492 6.207 -14.611 2.402 1.00 0.00 H new ATOM 0 HA LEU A 492 4.665 -12.682 3.938 1.00 0.00 H new ATOM 0 HB2 LEU A 492 5.972 -15.352 4.397 1.00 0.00 H new ATOM 0 HB3 LEU A 492 5.615 -14.342 5.784 1.00 0.00 H new ATOM 0 HG LEU A 492 3.241 -14.338 5.231 1.00 0.00 H new ATOM 0 HD11 LEU A 492 2.370 -15.731 3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 492 3.415 -14.423 2.794 1.00 0.00 H new ATOM 0 HD13 LEU A 492 4.035 -16.088 2.883 1.00 0.00 H new ATOM 0 HD21 LEU A 492 2.770 -16.726 5.617 1.00 0.00 H new ATOM 0 HD22 LEU A 492 4.452 -17.122 5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 492 4.107 -16.144 6.637 1.00 0.00 H new ATOM 233 N GLU A 493 7.919 -13.089 4.410 1.00 0.00 N ATOM 234 CA GLU A 493 9.117 -12.429 4.917 1.00 0.00 C ATOM 235 C GLU A 493 9.051 -10.924 4.680 1.00 0.00 C ATOM 236 O GLU A 493 9.587 -10.136 5.461 1.00 0.00 O ATOM 237 CB GLU A 493 10.366 -13.008 4.250 1.00 0.00 C ATOM 238 CG GLU A 493 11.658 -12.658 4.970 1.00 0.00 C ATOM 239 CD GLU A 493 11.672 -13.136 6.409 1.00 0.00 C ATOM 240 OE1 GLU A 493 10.949 -14.106 6.718 1.00 0.00 O ATOM 241 OE2 GLU A 493 12.406 -12.541 7.225 1.00 0.00 O ATOM 0 H GLU A 493 8.083 -14.011 4.007 1.00 0.00 H new ATOM 0 HA GLU A 493 9.172 -12.607 5.991 1.00 0.00 H new ATOM 0 HB2 GLU A 493 10.271 -14.093 4.199 1.00 0.00 H new ATOM 0 HB3 GLU A 493 10.422 -12.644 3.224 1.00 0.00 H new ATOM 0 HG2 GLU A 493 12.499 -13.101 4.436 1.00 0.00 H new ATOM 0 HG3 GLU A 493 11.800 -11.578 4.949 1.00 0.00 H new ATOM 248 N LEU A 494 8.392 -10.530 3.595 1.00 0.00 N ATOM 249 CA LEU A 494 8.256 -9.119 3.253 1.00 0.00 C ATOM 250 C LEU A 494 7.014 -8.518 3.904 1.00 0.00 C ATOM 251 O LEU A 494 7.040 -7.384 4.384 1.00 0.00 O ATOM 252 CB LEU A 494 8.183 -8.947 1.735 1.00 0.00 C ATOM 253 CG LEU A 494 6.783 -8.981 1.121 1.00 0.00 C ATOM 254 CD1 LEU A 494 6.163 -7.592 1.130 1.00 0.00 C ATOM 255 CD2 LEU A 494 6.835 -9.535 -0.295 1.00 0.00 C ATOM 0 H LEU A 494 7.944 -11.168 2.938 1.00 0.00 H new ATOM 0 HA LEU A 494 9.133 -8.593 3.631 1.00 0.00 H new ATOM 0 HB2 LEU A 494 8.649 -7.997 1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 494 8.780 -9.732 1.272 1.00 0.00 H new ATOM 0 HG LEU A 494 6.158 -9.640 1.724 1.00 0.00 H new ATOM 0 HD11 LEU A 494 5.167 -7.635 0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 494 6.090 -7.233 2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 494 6.787 -6.911 0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 494 5.830 -9.552 -0.716 1.00 0.00 H new ATOM 0 HD22 LEU A 494 7.476 -8.903 -0.910 1.00 0.00 H new ATOM 0 HD23 LEU A 494 7.237 -10.548 -0.275 1.00 0.00 H new ATOM 267 N TYR A 495 5.930 -9.285 3.918 1.00 0.00 N ATOM 268 CA TYR A 495 4.678 -8.828 4.510 1.00 0.00 C ATOM 269 C TYR A 495 4.834 -8.609 6.012 1.00 0.00 C ATOM 270 O TYR A 495 4.607 -7.509 6.516 1.00 0.00 O ATOM 271 CB TYR A 495 3.564 -9.842 4.244 1.00 0.00 C ATOM 272 CG TYR A 495 2.479 -9.839 5.297 1.00 0.00 C ATOM 273 CD1 TYR A 495 1.815 -8.666 5.636 1.00 0.00 C ATOM 274 CD2 TYR A 495 2.117 -11.009 5.952 1.00 0.00 C ATOM 275 CE1 TYR A 495 0.824 -8.659 6.598 1.00 0.00 C ATOM 276 CE2 TYR A 495 1.125 -11.012 6.914 1.00 0.00 C ATOM 277 CZ TYR A 495 0.482 -9.834 7.234 1.00 0.00 C ATOM 278 OH TYR A 495 -0.506 -9.831 8.191 1.00 0.00 O ATOM 0 H TYR A 495 5.893 -10.226 3.526 1.00 0.00 H new ATOM 0 HA TYR A 495 4.413 -7.877 4.048 1.00 0.00 H new ATOM 0 HB2 TYR A 495 3.117 -9.631 3.273 1.00 0.00 H new ATOM 0 HB3 TYR A 495 3.999 -10.840 4.185 1.00 0.00 H new ATOM 0 HD1 TYR A 495 2.078 -7.744 5.139 1.00 0.00 H new ATOM 0 HD2 TYR A 495 2.620 -11.933 5.705 1.00 0.00 H new ATOM 0 HE1 TYR A 495 0.320 -7.738 6.851 1.00 0.00 H new ATOM 0 HE2 TYR A 495 0.855 -11.931 7.412 1.00 0.00 H new ATOM 0 HH TYR A 495 -0.626 -10.739 8.541 1.00 0.00 H new ATOM 288 N ARG A 496 5.224 -9.663 6.720 1.00 0.00 N ATOM 289 CA ARG A 496 5.410 -9.588 8.164 1.00 0.00 C ATOM 290 C ARG A 496 6.878 -9.357 8.511 1.00 0.00 C ATOM 291 O ARG A 496 7.424 -10.003 9.406 1.00 0.00 O ATOM 292 CB ARG A 496 4.912 -10.871 8.831 1.00 0.00 C ATOM 293 CG ARG A 496 5.675 -12.115 8.405 1.00 0.00 C ATOM 294 CD ARG A 496 4.958 -13.384 8.837 1.00 0.00 C ATOM 295 NE ARG A 496 5.878 -14.508 8.990 1.00 0.00 N ATOM 296 CZ ARG A 496 5.634 -15.556 9.768 1.00 0.00 C ATOM 297 NH1 ARG A 496 4.505 -15.625 10.460 1.00 0.00 N ATOM 298 NH2 ARG A 496 6.521 -16.540 9.855 1.00 0.00 N ATOM 0 H ARG A 496 5.418 -10.580 6.317 1.00 0.00 H new ATOM 0 HA ARG A 496 4.829 -8.744 8.537 1.00 0.00 H new ATOM 0 HB2 ARG A 496 4.988 -10.761 9.913 1.00 0.00 H new ATOM 0 HB3 ARG A 496 3.856 -11.005 8.598 1.00 0.00 H new ATOM 0 HG2 ARG A 496 5.796 -12.115 7.322 1.00 0.00 H new ATOM 0 HG3 ARG A 496 6.675 -12.096 8.838 1.00 0.00 H new ATOM 0 HD2 ARG A 496 4.443 -13.206 9.781 1.00 0.00 H new ATOM 0 HD3 ARG A 496 4.195 -13.638 8.101 1.00 0.00 H new ATOM 0 HE ARG A 496 6.756 -14.487 8.471 1.00 0.00 H new ATOM 0 HH11 ARG A 496 3.821 -14.871 10.396 1.00 0.00 H new ATOM 0 HH12 ARG A 496 4.321 -16.432 11.057 1.00 0.00 H new ATOM 0 HH21 ARG A 496 7.391 -16.491 9.324 1.00 0.00 H new ATOM 0 HH22 ARG A 496 6.333 -17.345 10.453 1.00 0.00 H new ATOM 312 N LYS A 497 7.511 -8.432 7.798 1.00 0.00 N ATOM 313 CA LYS A 497 8.915 -8.114 8.030 1.00 0.00 C ATOM 314 C LYS A 497 9.077 -7.240 9.269 1.00 0.00 C ATOM 315 O LYS A 497 9.180 -6.017 9.167 1.00 0.00 O ATOM 316 CB LYS A 497 9.507 -7.404 6.811 1.00 0.00 C ATOM 317 CG LYS A 497 11.012 -7.216 6.887 1.00 0.00 C ATOM 318 CD LYS A 497 11.749 -8.526 6.666 1.00 0.00 C ATOM 319 CE LYS A 497 13.253 -8.350 6.809 1.00 0.00 C ATOM 320 NZ LYS A 497 13.694 -8.468 8.226 1.00 0.00 N ATOM 0 H LYS A 497 7.074 -7.889 7.054 1.00 0.00 H new ATOM 0 HA LYS A 497 9.451 -9.049 8.194 1.00 0.00 H new ATOM 0 HB2 LYS A 497 9.266 -7.976 5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 497 9.033 -6.429 6.703 1.00 0.00 H new ATOM 0 HG2 LYS A 497 11.327 -6.489 6.138 1.00 0.00 H new ATOM 0 HG3 LYS A 497 11.280 -6.807 7.861 1.00 0.00 H new ATOM 0 HD2 LYS A 497 11.398 -9.268 7.384 1.00 0.00 H new ATOM 0 HD3 LYS A 497 11.519 -8.911 5.672 1.00 0.00 H new ATOM 0 HE2 LYS A 497 13.765 -9.100 6.206 1.00 0.00 H new ATOM 0 HE3 LYS A 497 13.543 -7.374 6.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 14.725 -8.342 8.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 13.225 -7.737 8.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 13.440 -9.408 8.591 1.00 0.00 H new ATOM 334 N GLN A 498 9.100 -7.874 10.437 1.00 0.00 N ATOM 335 CA GLN A 498 9.251 -7.152 11.695 1.00 0.00 C ATOM 336 C GLN A 498 8.280 -5.978 11.769 1.00 0.00 C ATOM 337 O GLN A 498 8.635 -4.893 12.228 1.00 0.00 O ATOM 338 CB GLN A 498 10.688 -6.652 11.851 1.00 0.00 C ATOM 339 CG GLN A 498 11.657 -7.723 12.325 1.00 0.00 C ATOM 340 CD GLN A 498 12.802 -7.154 13.140 1.00 0.00 C ATOM 341 OE1 GLN A 498 12.797 -5.978 13.503 1.00 0.00 O ATOM 342 NE2 GLN A 498 13.792 -7.989 13.433 1.00 0.00 N ATOM 0 H GLN A 498 9.016 -8.885 10.538 1.00 0.00 H new ATOM 0 HA GLN A 498 9.023 -7.840 12.509 1.00 0.00 H new ATOM 0 HB2 GLN A 498 11.033 -6.259 10.895 1.00 0.00 H new ATOM 0 HB3 GLN A 498 10.701 -5.823 12.559 1.00 0.00 H new ATOM 0 HG2 GLN A 498 11.118 -8.456 12.925 1.00 0.00 H new ATOM 0 HG3 GLN A 498 12.059 -8.252 11.461 1.00 0.00 H new ATOM 0 HE21 GLN A 498 13.755 -8.956 13.112 1.00 0.00 H new ATOM 0 HE22 GLN A 498 14.589 -7.663 13.979 1.00 0.00 H new ATOM 351 N LYS A 499 7.052 -6.203 11.314 1.00 0.00 N ATOM 352 CA LYS A 499 6.028 -5.165 11.328 1.00 0.00 C ATOM 353 C LYS A 499 4.683 -5.734 11.769 1.00 0.00 C ATOM 354 O LYS A 499 4.297 -6.830 11.362 1.00 0.00 O ATOM 355 CB LYS A 499 5.896 -4.531 9.942 1.00 0.00 C ATOM 356 CG LYS A 499 7.104 -3.705 9.534 1.00 0.00 C ATOM 357 CD LYS A 499 7.080 -2.328 10.176 1.00 0.00 C ATOM 358 CE LYS A 499 8.436 -1.645 10.079 1.00 0.00 C ATOM 359 NZ LYS A 499 8.553 -0.506 11.031 1.00 0.00 N ATOM 0 H LYS A 499 6.742 -7.096 10.931 1.00 0.00 H new ATOM 0 HA LYS A 499 6.331 -4.400 12.043 1.00 0.00 H new ATOM 0 HB2 LYS A 499 5.739 -5.318 9.205 1.00 0.00 H new ATOM 0 HB3 LYS A 499 5.010 -3.897 9.925 1.00 0.00 H new ATOM 0 HG2 LYS A 499 8.017 -4.226 9.823 1.00 0.00 H new ATOM 0 HG3 LYS A 499 7.126 -3.601 8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 499 6.325 -1.711 9.689 1.00 0.00 H new ATOM 0 HD3 LYS A 499 6.791 -2.418 11.223 1.00 0.00 H new ATOM 0 HE2 LYS A 499 9.223 -2.371 10.283 1.00 0.00 H new ATOM 0 HE3 LYS A 499 8.589 -1.285 9.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 499 9.491 -0.067 10.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 499 7.818 0.199 10.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 499 8.432 -0.853 12.004 1.00 0.00 H new ATOM 373 N LYS A 500 3.972 -4.982 12.602 1.00 0.00 N ATOM 374 CA LYS A 500 2.669 -5.408 13.096 1.00 0.00 C ATOM 375 C LYS A 500 1.851 -6.057 11.984 1.00 0.00 C ATOM 376 O LYS A 500 1.824 -5.569 10.854 1.00 0.00 O ATOM 377 CB LYS A 500 1.905 -4.216 13.676 1.00 0.00 C ATOM 378 CG LYS A 500 0.772 -4.614 14.607 1.00 0.00 C ATOM 379 CD LYS A 500 -0.487 -4.967 13.833 1.00 0.00 C ATOM 380 CE LYS A 500 -1.740 -4.679 14.646 1.00 0.00 C ATOM 381 NZ LYS A 500 -1.941 -5.681 15.729 1.00 0.00 N ATOM 0 H LYS A 500 4.277 -4.073 12.949 1.00 0.00 H new ATOM 0 HA LYS A 500 2.830 -6.145 13.882 1.00 0.00 H new ATOM 0 HB2 LYS A 500 2.602 -3.577 14.218 1.00 0.00 H new ATOM 0 HB3 LYS A 500 1.499 -3.622 12.857 1.00 0.00 H new ATOM 0 HG2 LYS A 500 1.079 -5.467 15.212 1.00 0.00 H new ATOM 0 HG3 LYS A 500 0.560 -3.795 15.295 1.00 0.00 H new ATOM 0 HD2 LYS A 500 -0.516 -4.398 12.904 1.00 0.00 H new ATOM 0 HD3 LYS A 500 -0.464 -6.022 13.560 1.00 0.00 H new ATOM 0 HE2 LYS A 500 -1.669 -3.682 15.082 1.00 0.00 H new ATOM 0 HE3 LYS A 500 -2.608 -4.678 13.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 -2.805 -5.450 16.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 -2.034 -6.629 15.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 -1.124 -5.665 16.373 1.00 0.00 H new ATOM 395 N HIS A 501 1.184 -7.159 12.312 1.00 0.00 N ATOM 396 CA HIS A 501 0.363 -7.874 11.341 1.00 0.00 C ATOM 397 C HIS A 501 -0.710 -6.959 10.759 1.00 0.00 C ATOM 398 O HIS A 501 -1.220 -6.070 11.442 1.00 0.00 O ATOM 399 CB HIS A 501 -0.288 -9.094 11.992 1.00 0.00 C ATOM 400 CG HIS A 501 0.665 -10.223 12.237 1.00 0.00 C ATOM 401 ND1 HIS A 501 1.121 -11.054 11.235 1.00 0.00 N ATOM 402 CD2 HIS A 501 1.251 -10.655 13.378 1.00 0.00 C ATOM 403 CE1 HIS A 501 1.945 -11.950 11.750 1.00 0.00 C ATOM 404 NE2 HIS A 501 2.041 -11.729 13.049 1.00 0.00 N ATOM 0 H HIS A 501 1.196 -7.576 13.243 1.00 0.00 H new ATOM 0 HA HIS A 501 1.010 -8.207 10.530 1.00 0.00 H new ATOM 0 HB2 HIS A 501 -0.735 -8.794 12.940 1.00 0.00 H new ATOM 0 HB3 HIS A 501 -1.099 -9.446 11.355 1.00 0.00 H new ATOM 0 HD2 HIS A 501 1.121 -10.233 14.364 1.00 0.00 H new ATOM 0 HE1 HIS A 501 2.453 -12.730 11.202 1.00 0.00 H new ATOM 0 HE2 HIS A 501 2.610 -12.269 13.702 1.00 0.00 H new ATOM 412 N LEU A 502 -1.049 -7.182 9.494 1.00 0.00 N ATOM 413 CA LEU A 502 -2.062 -6.378 8.820 1.00 0.00 C ATOM 414 C LEU A 502 -3.456 -6.947 9.057 1.00 0.00 C ATOM 415 O LEU A 502 -3.614 -8.138 9.323 1.00 0.00 O ATOM 416 CB LEU A 502 -1.773 -6.313 7.319 1.00 0.00 C ATOM 417 CG LEU A 502 -0.549 -5.495 6.905 1.00 0.00 C ATOM 418 CD1 LEU A 502 -0.240 -5.705 5.431 1.00 0.00 C ATOM 419 CD2 LEU A 502 -0.768 -4.019 7.202 1.00 0.00 C ATOM 0 H LEU A 502 -0.637 -7.913 8.914 1.00 0.00 H new ATOM 0 HA LEU A 502 -2.027 -5.371 9.235 1.00 0.00 H new ATOM 0 HB2 LEU A 502 -1.647 -7.331 6.949 1.00 0.00 H new ATOM 0 HB3 LEU A 502 -2.648 -5.898 6.819 1.00 0.00 H new ATOM 0 HG LEU A 502 0.307 -5.838 7.486 1.00 0.00 H new ATOM 0 HD11 LEU A 502 0.634 -5.115 5.155 1.00 0.00 H new ATOM 0 HD12 LEU A 502 -0.038 -6.760 5.248 1.00 0.00 H new ATOM 0 HD13 LEU A 502 -1.094 -5.390 4.832 1.00 0.00 H new ATOM 0 HD21 LEU A 502 0.113 -3.453 6.901 1.00 0.00 H new ATOM 0 HD22 LEU A 502 -1.636 -3.661 6.648 1.00 0.00 H new ATOM 0 HD23 LEU A 502 -0.938 -3.884 8.270 1.00 0.00 H new ATOM 431 N ASN A 503 -4.466 -6.088 8.956 1.00 0.00 N ATOM 432 CA ASN A 503 -5.848 -6.506 9.158 1.00 0.00 C ATOM 433 C ASN A 503 -6.456 -7.023 7.857 1.00 0.00 C ATOM 434 O ASN A 503 -5.803 -7.029 6.813 1.00 0.00 O ATOM 435 CB ASN A 503 -6.682 -5.342 9.696 1.00 0.00 C ATOM 436 CG ASN A 503 -7.868 -5.811 10.518 1.00 0.00 C ATOM 437 OD1 ASN A 503 -9.015 -5.480 10.217 1.00 0.00 O ATOM 438 ND2 ASN A 503 -7.595 -6.585 11.561 1.00 0.00 N ATOM 0 H ASN A 503 -4.353 -5.099 8.736 1.00 0.00 H new ATOM 0 HA ASN A 503 -5.853 -7.315 9.888 1.00 0.00 H new ATOM 0 HB2 ASN A 503 -6.050 -4.699 10.309 1.00 0.00 H new ATOM 0 HB3 ASN A 503 -7.038 -4.738 8.862 1.00 0.00 H new ATOM 0 HD21 ASN A 503 -8.352 -6.931 12.151 1.00 0.00 H new ATOM 0 HD22 ASN A 503 -6.629 -6.834 11.772 1.00 0.00 H new ATOM 445 N THR A 504 -7.711 -7.455 7.927 1.00 0.00 N ATOM 446 CA THR A 504 -8.408 -7.973 6.757 1.00 0.00 C ATOM 447 C THR A 504 -8.355 -6.981 5.601 1.00 0.00 C ATOM 448 O THR A 504 -7.776 -7.266 4.553 1.00 0.00 O ATOM 449 CB THR A 504 -9.880 -8.295 7.075 1.00 0.00 C ATOM 450 OG1 THR A 504 -9.957 -9.161 8.213 1.00 0.00 O ATOM 451 CG2 THR A 504 -10.561 -8.951 5.884 1.00 0.00 C ATOM 0 H THR A 504 -8.266 -7.456 8.783 1.00 0.00 H new ATOM 0 HA THR A 504 -7.898 -8.892 6.468 1.00 0.00 H new ATOM 0 HB THR A 504 -10.394 -7.359 7.296 1.00 0.00 H new ATOM 0 HG1 THR A 504 -10.469 -8.722 8.924 1.00 0.00 H new ATOM 0 HG21 THR A 504 -11.600 -9.169 6.133 1.00 0.00 H new ATOM 0 HG22 THR A 504 -10.527 -8.277 5.028 1.00 0.00 H new ATOM 0 HG23 THR A 504 -10.045 -9.879 5.635 1.00 0.00 H new ATOM 459 N GLN A 505 -8.961 -5.815 5.800 1.00 0.00 N ATOM 460 CA GLN A 505 -8.982 -4.780 4.773 1.00 0.00 C ATOM 461 C GLN A 505 -7.566 -4.379 4.375 1.00 0.00 C ATOM 462 O GLN A 505 -7.233 -4.333 3.191 1.00 0.00 O ATOM 463 CB GLN A 505 -9.752 -3.555 5.269 1.00 0.00 C ATOM 464 CG GLN A 505 -11.244 -3.619 4.988 1.00 0.00 C ATOM 465 CD GLN A 505 -11.980 -2.380 5.456 1.00 0.00 C ATOM 466 OE1 GLN A 505 -11.555 -1.710 6.398 1.00 0.00 O ATOM 467 NE2 GLN A 505 -13.092 -2.067 4.800 1.00 0.00 N ATOM 0 H GLN A 505 -9.444 -5.563 6.663 1.00 0.00 H new ATOM 0 HA GLN A 505 -9.485 -5.185 3.895 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -9.597 -3.449 6.343 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -9.340 -2.662 4.798 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -11.403 -3.748 3.917 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -11.665 -4.495 5.481 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -13.408 -2.650 4.025 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -13.630 -1.244 5.071 1.00 0.00 H new ATOM 476 N GLN A 506 -6.736 -4.090 5.372 1.00 0.00 N ATOM 477 CA GLN A 506 -5.355 -3.691 5.126 1.00 0.00 C ATOM 478 C GLN A 506 -4.673 -4.659 4.165 1.00 0.00 C ATOM 479 O GLN A 506 -4.085 -4.247 3.164 1.00 0.00 O ATOM 480 CB GLN A 506 -4.578 -3.627 6.442 1.00 0.00 C ATOM 481 CG GLN A 506 -5.172 -2.659 7.452 1.00 0.00 C ATOM 482 CD GLN A 506 -4.296 -2.484 8.677 1.00 0.00 C ATOM 483 OE1 GLN A 506 -3.960 -3.453 9.358 1.00 0.00 O ATOM 484 NE2 GLN A 506 -3.920 -1.243 8.963 1.00 0.00 N ATOM 0 H GLN A 506 -6.996 -4.125 6.358 1.00 0.00 H new ATOM 0 HA GLN A 506 -5.364 -2.701 4.670 1.00 0.00 H new ATOM 0 HB2 GLN A 506 -4.543 -4.623 6.883 1.00 0.00 H new ATOM 0 HB3 GLN A 506 -3.549 -3.335 6.233 1.00 0.00 H new ATOM 0 HG2 GLN A 506 -5.322 -1.690 6.976 1.00 0.00 H new ATOM 0 HG3 GLN A 506 -6.154 -3.018 7.760 1.00 0.00 H new ATOM 0 HE21 GLN A 506 -4.222 -0.469 8.371 1.00 0.00 H new ATOM 0 HE22 GLN A 506 -3.329 -1.063 9.775 1.00 0.00 H new ATOM 493 N LEU A 507 -4.754 -5.948 4.476 1.00 0.00 N ATOM 494 CA LEU A 507 -4.143 -6.976 3.640 1.00 0.00 C ATOM 495 C LEU A 507 -4.645 -6.879 2.203 1.00 0.00 C ATOM 496 O LEU A 507 -3.855 -6.853 1.258 1.00 0.00 O ATOM 497 CB LEU A 507 -4.445 -8.366 4.204 1.00 0.00 C ATOM 498 CG LEU A 507 -3.612 -8.795 5.412 1.00 0.00 C ATOM 499 CD1 LEU A 507 -4.278 -9.955 6.136 1.00 0.00 C ATOM 500 CD2 LEU A 507 -2.202 -9.173 4.981 1.00 0.00 C ATOM 0 H LEU A 507 -5.236 -6.306 5.300 1.00 0.00 H new ATOM 0 HA LEU A 507 -3.065 -6.816 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 507 -5.498 -8.402 4.483 1.00 0.00 H new ATOM 0 HB3 LEU A 507 -4.300 -9.098 3.409 1.00 0.00 H new ATOM 0 HG LEU A 507 -3.547 -7.953 6.101 1.00 0.00 H new ATOM 0 HD11 LEU A 507 -3.670 -10.246 6.993 1.00 0.00 H new ATOM 0 HD12 LEU A 507 -5.267 -9.650 6.479 1.00 0.00 H new ATOM 0 HD13 LEU A 507 -4.375 -10.801 5.456 1.00 0.00 H new ATOM 0 HD21 LEU A 507 -1.624 -9.476 5.854 1.00 0.00 H new ATOM 0 HD22 LEU A 507 -2.248 -9.999 4.272 1.00 0.00 H new ATOM 0 HD23 LEU A 507 -1.724 -8.315 4.508 1.00 0.00 H new ATOM 512 N THR A 508 -5.964 -6.823 2.044 1.00 0.00 N ATOM 513 CA THR A 508 -6.571 -6.726 0.723 1.00 0.00 C ATOM 514 C THR A 508 -5.923 -5.620 -0.101 1.00 0.00 C ATOM 515 O THR A 508 -5.658 -5.793 -1.290 1.00 0.00 O ATOM 516 CB THR A 508 -8.085 -6.460 0.819 1.00 0.00 C ATOM 517 OG1 THR A 508 -8.686 -7.372 1.745 1.00 0.00 O ATOM 518 CG2 THR A 508 -8.747 -6.603 -0.543 1.00 0.00 C ATOM 0 H THR A 508 -6.632 -6.843 2.815 1.00 0.00 H new ATOM 0 HA THR A 508 -6.408 -7.684 0.230 1.00 0.00 H new ATOM 0 HB THR A 508 -8.230 -5.438 1.171 1.00 0.00 H new ATOM 0 HG1 THR A 508 -9.595 -7.072 1.957 1.00 0.00 H new ATOM 0 HG21 THR A 508 -9.816 -6.411 -0.450 1.00 0.00 H new ATOM 0 HG22 THR A 508 -8.308 -5.887 -1.238 1.00 0.00 H new ATOM 0 HG23 THR A 508 -8.592 -7.614 -0.919 1.00 0.00 H new ATOM 526 N ALA A 509 -5.670 -4.483 0.539 1.00 0.00 N ATOM 527 CA ALA A 509 -5.050 -3.349 -0.135 1.00 0.00 C ATOM 528 C ALA A 509 -3.649 -3.700 -0.624 1.00 0.00 C ATOM 529 O ALA A 509 -3.306 -3.458 -1.781 1.00 0.00 O ATOM 530 CB ALA A 509 -5.001 -2.145 0.794 1.00 0.00 C ATOM 0 H ALA A 509 -5.885 -4.323 1.523 1.00 0.00 H new ATOM 0 HA ALA A 509 -5.658 -3.098 -1.005 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -4.536 -1.306 0.277 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.014 -1.872 1.090 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -4.418 -2.393 1.681 1.00 0.00 H new ATOM 536 N PHE A 510 -2.843 -4.270 0.265 1.00 0.00 N ATOM 537 CA PHE A 510 -1.477 -4.653 -0.076 1.00 0.00 C ATOM 538 C PHE A 510 -1.449 -5.482 -1.357 1.00 0.00 C ATOM 539 O PHE A 510 -0.603 -5.270 -2.225 1.00 0.00 O ATOM 540 CB PHE A 510 -0.846 -5.444 1.071 1.00 0.00 C ATOM 541 CG PHE A 510 0.637 -5.635 0.923 1.00 0.00 C ATOM 542 CD1 PHE A 510 1.510 -4.583 1.146 1.00 0.00 C ATOM 543 CD2 PHE A 510 1.157 -6.867 0.560 1.00 0.00 C ATOM 544 CE1 PHE A 510 2.874 -4.755 1.009 1.00 0.00 C ATOM 545 CE2 PHE A 510 2.521 -7.046 0.422 1.00 0.00 C ATOM 546 CZ PHE A 510 3.380 -5.989 0.648 1.00 0.00 C ATOM 0 H PHE A 510 -3.111 -4.477 1.227 1.00 0.00 H new ATOM 0 HA PHE A 510 -0.900 -3.743 -0.241 1.00 0.00 H new ATOM 0 HB2 PHE A 510 -1.046 -4.929 2.010 1.00 0.00 H new ATOM 0 HB3 PHE A 510 -1.325 -6.421 1.135 1.00 0.00 H new ATOM 0 HD1 PHE A 510 1.120 -3.617 1.430 1.00 0.00 H new ATOM 0 HD2 PHE A 510 0.489 -7.697 0.383 1.00 0.00 H new ATOM 0 HE1 PHE A 510 3.544 -3.926 1.184 1.00 0.00 H new ATOM 0 HE2 PHE A 510 2.914 -8.011 0.138 1.00 0.00 H new ATOM 0 HZ PHE A 510 4.446 -6.127 0.543 1.00 0.00 H new ATOM 556 N GLN A 511 -2.378 -6.426 -1.465 1.00 0.00 N ATOM 557 CA GLN A 511 -2.458 -7.287 -2.638 1.00 0.00 C ATOM 558 C GLN A 511 -2.756 -6.472 -3.892 1.00 0.00 C ATOM 559 O GLN A 511 -2.083 -6.618 -4.914 1.00 0.00 O ATOM 560 CB GLN A 511 -3.537 -8.354 -2.441 1.00 0.00 C ATOM 561 CG GLN A 511 -3.202 -9.364 -1.356 1.00 0.00 C ATOM 562 CD GLN A 511 -4.395 -10.212 -0.960 1.00 0.00 C ATOM 563 OE1 GLN A 511 -4.719 -11.197 -1.625 1.00 0.00 O ATOM 564 NE2 GLN A 511 -5.056 -9.834 0.128 1.00 0.00 N ATOM 0 H GLN A 511 -3.085 -6.614 -0.755 1.00 0.00 H new ATOM 0 HA GLN A 511 -1.492 -7.776 -2.765 1.00 0.00 H new ATOM 0 HB2 GLN A 511 -4.479 -7.865 -2.192 1.00 0.00 H new ATOM 0 HB3 GLN A 511 -3.691 -8.882 -3.382 1.00 0.00 H new ATOM 0 HG2 GLN A 511 -2.399 -10.013 -1.705 1.00 0.00 H new ATOM 0 HG3 GLN A 511 -2.828 -8.838 -0.478 1.00 0.00 H new ATOM 0 HE21 GLN A 511 -4.753 -9.011 0.649 1.00 0.00 H new ATOM 0 HE22 GLN A 511 -5.867 -10.367 0.443 1.00 0.00 H new ATOM 573 N LEU A 512 -3.767 -5.614 -3.809 1.00 0.00 N ATOM 574 CA LEU A 512 -4.154 -4.776 -4.938 1.00 0.00 C ATOM 575 C LEU A 512 -2.978 -3.930 -5.416 1.00 0.00 C ATOM 576 O LEU A 512 -2.642 -3.928 -6.602 1.00 0.00 O ATOM 577 CB LEU A 512 -5.323 -3.869 -4.548 1.00 0.00 C ATOM 578 CG LEU A 512 -6.665 -4.566 -4.319 1.00 0.00 C ATOM 579 CD1 LEU A 512 -7.615 -3.657 -3.555 1.00 0.00 C ATOM 580 CD2 LEU A 512 -7.279 -4.989 -5.645 1.00 0.00 C ATOM 0 H LEU A 512 -4.333 -5.481 -2.971 1.00 0.00 H new ATOM 0 HA LEU A 512 -4.464 -5.429 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 512 -5.054 -3.334 -3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 512 -5.453 -3.121 -5.330 1.00 0.00 H new ATOM 0 HG LEU A 512 -6.491 -5.460 -3.721 1.00 0.00 H new ATOM 0 HD11 LEU A 512 -8.565 -4.170 -3.401 1.00 0.00 H new ATOM 0 HD12 LEU A 512 -7.179 -3.404 -2.589 1.00 0.00 H new ATOM 0 HD13 LEU A 512 -7.784 -2.744 -4.127 1.00 0.00 H new ATOM 0 HD21 LEU A 512 -8.233 -5.483 -5.463 1.00 0.00 H new ATOM 0 HD22 LEU A 512 -7.439 -4.110 -6.269 1.00 0.00 H new ATOM 0 HD23 LEU A 512 -6.605 -5.678 -6.155 1.00 0.00 H new ATOM 592 N LEU A 513 -2.354 -3.214 -4.488 1.00 0.00 N ATOM 593 CA LEU A 513 -1.213 -2.366 -4.814 1.00 0.00 C ATOM 594 C LEU A 513 -0.061 -3.194 -5.375 1.00 0.00 C ATOM 595 O LEU A 513 0.386 -2.972 -6.500 1.00 0.00 O ATOM 596 CB LEU A 513 -0.750 -1.601 -3.573 1.00 0.00 C ATOM 597 CG LEU A 513 -1.683 -0.495 -3.078 1.00 0.00 C ATOM 598 CD1 LEU A 513 -1.312 -0.077 -1.664 1.00 0.00 C ATOM 599 CD2 LEU A 513 -1.639 0.700 -4.019 1.00 0.00 C ATOM 0 H LEU A 513 -2.619 -3.204 -3.503 1.00 0.00 H new ATOM 0 HA LEU A 513 -1.528 -1.653 -5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -0.606 -2.316 -2.763 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.223 -1.159 -3.786 1.00 0.00 H new ATOM 0 HG LEU A 513 -2.701 -0.884 -3.064 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -1.987 0.711 -1.329 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -1.396 -0.935 -0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -0.287 0.293 -1.651 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -2.309 1.477 -3.651 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -0.622 1.089 -4.065 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -1.955 0.390 -5.015 1.00 0.00 H new ATOM 611 N PHE A 514 0.413 -4.150 -4.583 1.00 0.00 N ATOM 612 CA PHE A 514 1.512 -5.013 -5.001 1.00 0.00 C ATOM 613 C PHE A 514 1.377 -5.392 -6.472 1.00 0.00 C ATOM 614 O PHE A 514 2.325 -5.267 -7.246 1.00 0.00 O ATOM 615 CB PHE A 514 1.553 -6.276 -4.138 1.00 0.00 C ATOM 616 CG PHE A 514 2.700 -7.189 -4.466 1.00 0.00 C ATOM 617 CD1 PHE A 514 2.744 -7.860 -5.677 1.00 0.00 C ATOM 618 CD2 PHE A 514 3.734 -7.376 -3.562 1.00 0.00 C ATOM 619 CE1 PHE A 514 3.798 -8.700 -5.982 1.00 0.00 C ATOM 620 CE2 PHE A 514 4.790 -8.215 -3.862 1.00 0.00 C ATOM 621 CZ PHE A 514 4.822 -8.879 -5.073 1.00 0.00 C ATOM 0 H PHE A 514 0.054 -4.347 -3.649 1.00 0.00 H new ATOM 0 HA PHE A 514 2.443 -4.462 -4.871 1.00 0.00 H new ATOM 0 HB2 PHE A 514 1.617 -5.988 -3.089 1.00 0.00 H new ATOM 0 HB3 PHE A 514 0.618 -6.822 -4.262 1.00 0.00 H new ATOM 0 HD1 PHE A 514 1.945 -7.725 -6.391 1.00 0.00 H new ATOM 0 HD2 PHE A 514 3.714 -6.860 -2.613 1.00 0.00 H new ATOM 0 HE1 PHE A 514 3.821 -9.216 -6.930 1.00 0.00 H new ATOM 0 HE2 PHE A 514 5.590 -8.352 -3.150 1.00 0.00 H new ATOM 0 HZ PHE A 514 5.646 -9.536 -5.308 1.00 0.00 H new ATOM 631 N ALA A 515 0.191 -5.857 -6.850 1.00 0.00 N ATOM 632 CA ALA A 515 -0.070 -6.254 -8.229 1.00 0.00 C ATOM 633 C ALA A 515 0.137 -5.084 -9.185 1.00 0.00 C ATOM 634 O ALA A 515 0.826 -5.213 -10.197 1.00 0.00 O ATOM 635 CB ALA A 515 -1.483 -6.803 -8.361 1.00 0.00 C ATOM 0 H ALA A 515 -0.604 -5.968 -6.221 1.00 0.00 H new ATOM 0 HA ALA A 515 0.639 -7.038 -8.497 1.00 0.00 H new ATOM 0 HB1 ALA A 515 -1.665 -7.095 -9.395 1.00 0.00 H new ATOM 0 HB2 ALA A 515 -1.598 -7.672 -7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 515 -2.200 -6.036 -8.070 1.00 0.00 H new ATOM 641 N TRP A 516 -0.464 -3.946 -8.859 1.00 0.00 N ATOM 642 CA TRP A 516 -0.346 -2.754 -9.690 1.00 0.00 C ATOM 643 C TRP A 516 1.115 -2.347 -9.854 1.00 0.00 C ATOM 644 O TRP A 516 1.635 -2.301 -10.968 1.00 0.00 O ATOM 645 CB TRP A 516 -1.144 -1.600 -9.081 1.00 0.00 C ATOM 646 CG TRP A 516 -0.813 -0.267 -9.680 1.00 0.00 C ATOM 647 CD1 TRP A 516 -1.339 0.274 -10.818 1.00 0.00 C ATOM 648 CD2 TRP A 516 0.120 0.693 -9.171 1.00 0.00 C ATOM 649 NE1 TRP A 516 -0.788 1.512 -11.048 1.00 0.00 N ATOM 650 CE2 TRP A 516 0.109 1.792 -10.052 1.00 0.00 C ATOM 651 CE3 TRP A 516 0.963 0.731 -8.057 1.00 0.00 C ATOM 652 CZ2 TRP A 516 0.908 2.915 -9.851 1.00 0.00 C ATOM 653 CZ3 TRP A 516 1.755 1.846 -7.860 1.00 0.00 C ATOM 654 CH2 TRP A 516 1.723 2.925 -8.752 1.00 0.00 C ATOM 0 H TRP A 516 -1.038 -3.823 -8.025 1.00 0.00 H new ATOM 0 HA TRP A 516 -0.752 -2.987 -10.674 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.208 -1.795 -9.212 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -0.956 -1.565 -8.008 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -2.079 -0.201 -11.445 1.00 0.00 H new ATOM 0 HE1 TRP A 516 -1.011 2.123 -11.833 1.00 0.00 H new ATOM 0 HE3 TRP A 516 0.995 -0.096 -7.363 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.885 3.748 -10.538 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 2.411 1.886 -7.003 1.00 0.00 H new ATOM 0 HH2 TRP A 516 2.354 3.782 -8.569 1.00 0.00 H new ATOM 665 N ARG A 517 1.771 -2.053 -8.736 1.00 0.00 N ATOM 666 CA ARG A 517 3.172 -1.649 -8.756 1.00 0.00 C ATOM 667 C ARG A 517 3.984 -2.549 -9.683 1.00 0.00 C ATOM 668 O ARG A 517 4.720 -2.068 -10.544 1.00 0.00 O ATOM 669 CB ARG A 517 3.758 -1.693 -7.344 1.00 0.00 C ATOM 670 CG ARG A 517 5.182 -1.168 -7.259 1.00 0.00 C ATOM 671 CD ARG A 517 5.816 -1.493 -5.915 1.00 0.00 C ATOM 672 NE ARG A 517 6.197 -2.899 -5.815 1.00 0.00 N ATOM 673 CZ ARG A 517 6.893 -3.401 -4.801 1.00 0.00 C ATOM 674 NH1 ARG A 517 7.281 -2.616 -3.805 1.00 0.00 N ATOM 675 NH2 ARG A 517 7.202 -4.691 -4.781 1.00 0.00 N ATOM 0 H ARG A 517 1.355 -2.087 -7.805 1.00 0.00 H new ATOM 0 HA ARG A 517 3.224 -0.627 -9.132 1.00 0.00 H new ATOM 0 HB2 ARG A 517 3.124 -1.108 -6.678 1.00 0.00 H new ATOM 0 HB3 ARG A 517 3.737 -2.721 -6.983 1.00 0.00 H new ATOM 0 HG2 ARG A 517 5.780 -1.604 -8.060 1.00 0.00 H new ATOM 0 HG3 ARG A 517 5.183 -0.089 -7.412 1.00 0.00 H new ATOM 0 HD2 ARG A 517 6.697 -0.868 -5.769 1.00 0.00 H new ATOM 0 HD3 ARG A 517 5.116 -1.249 -5.116 1.00 0.00 H new ATOM 0 HE ARG A 517 5.913 -3.530 -6.564 1.00 0.00 H new ATOM 0 HH11 ARG A 517 7.045 -1.624 -3.816 1.00 0.00 H new ATOM 0 HH12 ARG A 517 7.815 -3.005 -3.028 1.00 0.00 H new ATOM 0 HH21 ARG A 517 6.905 -5.298 -5.545 1.00 0.00 H new ATOM 0 HH22 ARG A 517 7.736 -5.075 -4.002 1.00 0.00 H new ATOM 689 N ASP A 518 3.844 -3.858 -9.500 1.00 0.00 N ATOM 690 CA ASP A 518 4.564 -4.825 -10.320 1.00 0.00 C ATOM 691 C ASP A 518 4.195 -4.672 -11.792 1.00 0.00 C ATOM 692 O ASP A 518 5.045 -4.801 -12.673 1.00 0.00 O ATOM 693 CB ASP A 518 4.260 -6.249 -9.851 1.00 0.00 C ATOM 694 CG ASP A 518 5.297 -7.249 -10.325 1.00 0.00 C ATOM 695 OD1 ASP A 518 5.967 -6.972 -11.342 1.00 0.00 O ATOM 696 OD2 ASP A 518 5.439 -8.307 -9.678 1.00 0.00 O ATOM 0 H ASP A 518 3.239 -4.273 -8.792 1.00 0.00 H new ATOM 0 HA ASP A 518 5.631 -4.634 -10.210 1.00 0.00 H new ATOM 0 HB2 ASP A 518 4.213 -6.267 -8.762 1.00 0.00 H new ATOM 0 HB3 ASP A 518 3.278 -6.547 -10.218 1.00 0.00 H new ATOM 701 N LYS A 519 2.922 -4.396 -12.051 1.00 0.00 N ATOM 702 CA LYS A 519 2.438 -4.225 -13.416 1.00 0.00 C ATOM 703 C LYS A 519 3.130 -3.046 -14.094 1.00 0.00 C ATOM 704 O LYS A 519 3.760 -3.201 -15.141 1.00 0.00 O ATOM 705 CB LYS A 519 0.923 -4.011 -13.420 1.00 0.00 C ATOM 706 CG LYS A 519 0.363 -3.646 -14.784 1.00 0.00 C ATOM 707 CD LYS A 519 -0.881 -2.783 -14.663 1.00 0.00 C ATOM 708 CE LYS A 519 -0.526 -1.320 -14.443 1.00 0.00 C ATOM 709 NZ LYS A 519 -1.734 -0.450 -14.439 1.00 0.00 N ATOM 0 H LYS A 519 2.206 -4.286 -11.333 1.00 0.00 H new ATOM 0 HA LYS A 519 2.672 -5.132 -13.974 1.00 0.00 H new ATOM 0 HB2 LYS A 519 0.435 -4.920 -13.068 1.00 0.00 H new ATOM 0 HB3 LYS A 519 0.674 -3.221 -12.711 1.00 0.00 H new ATOM 0 HG2 LYS A 519 1.121 -3.114 -15.359 1.00 0.00 H new ATOM 0 HG3 LYS A 519 0.124 -4.555 -15.335 1.00 0.00 H new ATOM 0 HD2 LYS A 519 -1.482 -2.881 -15.567 1.00 0.00 H new ATOM 0 HD3 LYS A 519 -1.493 -3.139 -13.834 1.00 0.00 H new ATOM 0 HE2 LYS A 519 0.001 -1.213 -13.495 1.00 0.00 H new ATOM 0 HE3 LYS A 519 0.156 -0.990 -15.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 -1.449 0.539 -14.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 -2.224 -0.532 -15.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 -2.374 -0.748 -13.675 1.00 0.00 H new ATOM 723 N THR A 520 3.011 -1.868 -13.490 1.00 0.00 N ATOM 724 CA THR A 520 3.624 -0.664 -14.035 1.00 0.00 C ATOM 725 C THR A 520 5.136 -0.821 -14.150 1.00 0.00 C ATOM 726 O THR A 520 5.763 -0.253 -15.044 1.00 0.00 O ATOM 727 CB THR A 520 3.312 0.569 -13.166 1.00 0.00 C ATOM 728 OG1 THR A 520 1.903 0.656 -12.927 1.00 0.00 O ATOM 729 CG2 THR A 520 3.797 1.843 -13.840 1.00 0.00 C ATOM 0 H THR A 520 2.495 -1.722 -12.622 1.00 0.00 H new ATOM 0 HA THR A 520 3.200 -0.516 -15.028 1.00 0.00 H new ATOM 0 HB THR A 520 3.835 0.458 -12.216 1.00 0.00 H new ATOM 0 HG1 THR A 520 1.745 1.030 -12.035 1.00 0.00 H new ATOM 0 HG21 THR A 520 3.565 2.700 -13.208 1.00 0.00 H new ATOM 0 HG22 THR A 520 4.875 1.786 -13.994 1.00 0.00 H new ATOM 0 HG23 THR A 520 3.299 1.958 -14.803 1.00 0.00 H new ATOM 737 N ALA A 521 5.717 -1.596 -13.240 1.00 0.00 N ATOM 738 CA ALA A 521 7.155 -1.830 -13.241 1.00 0.00 C ATOM 739 C ALA A 521 7.664 -2.115 -14.650 1.00 0.00 C ATOM 740 O ALA A 521 8.655 -1.532 -15.092 1.00 0.00 O ATOM 741 CB ALA A 521 7.504 -2.982 -12.310 1.00 0.00 C ATOM 0 H ALA A 521 5.213 -2.073 -12.492 1.00 0.00 H new ATOM 0 HA ALA A 521 7.645 -0.925 -12.881 1.00 0.00 H new ATOM 0 HB1 ALA A 521 8.582 -3.145 -12.321 1.00 0.00 H new ATOM 0 HB2 ALA A 521 7.184 -2.740 -11.296 1.00 0.00 H new ATOM 0 HB3 ALA A 521 6.997 -3.887 -12.645 1.00 0.00 H new ATOM 747 N ARG A 522 6.981 -3.014 -15.351 1.00 0.00 N ATOM 748 CA ARG A 522 7.365 -3.377 -16.709 1.00 0.00 C ATOM 749 C ARG A 522 7.236 -2.181 -17.649 1.00 0.00 C ATOM 750 O ARG A 522 8.225 -1.712 -18.212 1.00 0.00 O ATOM 751 CB ARG A 522 6.500 -4.532 -17.216 1.00 0.00 C ATOM 752 CG ARG A 522 6.660 -5.811 -16.410 1.00 0.00 C ATOM 753 CD ARG A 522 5.749 -6.913 -16.928 1.00 0.00 C ATOM 754 NE ARG A 522 6.237 -7.484 -18.181 1.00 0.00 N ATOM 755 CZ ARG A 522 5.469 -8.157 -19.030 1.00 0.00 C ATOM 756 NH1 ARG A 522 4.184 -8.343 -18.763 1.00 0.00 N ATOM 757 NH2 ARG A 522 5.986 -8.645 -20.150 1.00 0.00 N ATOM 0 H ARG A 522 6.158 -3.504 -15.000 1.00 0.00 H new ATOM 0 HA ARG A 522 8.408 -3.694 -16.692 1.00 0.00 H new ATOM 0 HB2 ARG A 522 5.454 -4.228 -17.195 1.00 0.00 H new ATOM 0 HB3 ARG A 522 6.752 -4.734 -18.257 1.00 0.00 H new ATOM 0 HG2 ARG A 522 7.697 -6.143 -16.455 1.00 0.00 H new ATOM 0 HG3 ARG A 522 6.434 -5.613 -15.362 1.00 0.00 H new ATOM 0 HD2 ARG A 522 5.670 -7.700 -16.178 1.00 0.00 H new ATOM 0 HD3 ARG A 522 4.746 -6.513 -17.078 1.00 0.00 H new ATOM 0 HE ARG A 522 7.221 -7.359 -18.417 1.00 0.00 H new ATOM 0 HH11 ARG A 522 3.782 -7.969 -17.903 1.00 0.00 H new ATOM 0 HH12 ARG A 522 3.597 -8.860 -19.417 1.00 0.00 H new ATOM 0 HH21 ARG A 522 6.974 -8.503 -20.360 1.00 0.00 H new ATOM 0 HH22 ARG A 522 5.395 -9.162 -20.802 1.00 0.00 H new ATOM 771 N ARG A 523 6.011 -1.693 -17.812 1.00 0.00 N ATOM 772 CA ARG A 523 5.752 -0.554 -18.684 1.00 0.00 C ATOM 773 C ARG A 523 6.842 0.503 -18.535 1.00 0.00 C ATOM 774 O ARG A 523 7.334 1.045 -19.524 1.00 0.00 O ATOM 775 CB ARG A 523 4.386 0.058 -18.368 1.00 0.00 C ATOM 776 CG ARG A 523 3.226 -0.901 -18.579 1.00 0.00 C ATOM 777 CD ARG A 523 2.788 -0.935 -20.034 1.00 0.00 C ATOM 778 NE ARG A 523 2.221 0.340 -20.465 1.00 0.00 N ATOM 779 CZ ARG A 523 1.505 0.488 -21.574 1.00 0.00 C ATOM 780 NH1 ARG A 523 1.270 -0.553 -22.360 1.00 0.00 N ATOM 781 NH2 ARG A 523 1.022 1.681 -21.899 1.00 0.00 N ATOM 0 H ARG A 523 5.182 -2.069 -17.352 1.00 0.00 H new ATOM 0 HA ARG A 523 5.753 -0.910 -19.714 1.00 0.00 H new ATOM 0 HB2 ARG A 523 4.381 0.399 -17.333 1.00 0.00 H new ATOM 0 HB3 ARG A 523 4.238 0.938 -18.994 1.00 0.00 H new ATOM 0 HG2 ARG A 523 3.518 -1.902 -18.263 1.00 0.00 H new ATOM 0 HG3 ARG A 523 2.386 -0.601 -17.952 1.00 0.00 H new ATOM 0 HD2 ARG A 523 3.642 -1.183 -20.664 1.00 0.00 H new ATOM 0 HD3 ARG A 523 2.050 -1.725 -20.172 1.00 0.00 H new ATOM 0 HE ARG A 523 2.384 1.162 -19.883 1.00 0.00 H new ATOM 0 HH11 ARG A 523 1.639 -1.471 -22.114 1.00 0.00 H new ATOM 0 HH12 ARG A 523 0.720 -0.436 -23.211 1.00 0.00 H new ATOM 0 HH21 ARG A 523 1.201 2.485 -21.297 1.00 0.00 H new ATOM 0 HH22 ARG A 523 0.472 1.794 -22.751 1.00 0.00 H new ATOM 795 N GLU A 524 7.213 0.792 -17.291 1.00 0.00 N ATOM 796 CA GLU A 524 8.243 1.785 -17.013 1.00 0.00 C ATOM 797 C GLU A 524 9.635 1.207 -17.252 1.00 0.00 C ATOM 798 O GLU A 524 10.545 1.913 -17.689 1.00 0.00 O ATOM 799 CB GLU A 524 8.127 2.283 -15.571 1.00 0.00 C ATOM 800 CG GLU A 524 6.842 3.045 -15.292 1.00 0.00 C ATOM 801 CD GLU A 524 6.689 4.272 -16.169 1.00 0.00 C ATOM 802 OE1 GLU A 524 7.564 5.161 -16.105 1.00 0.00 O ATOM 803 OE2 GLU A 524 5.694 4.343 -16.921 1.00 0.00 O ATOM 0 H GLU A 524 6.815 0.352 -16.461 1.00 0.00 H new ATOM 0 HA GLU A 524 8.095 2.624 -17.693 1.00 0.00 H new ATOM 0 HB2 GLU A 524 8.188 1.430 -14.895 1.00 0.00 H new ATOM 0 HB3 GLU A 524 8.977 2.928 -15.349 1.00 0.00 H new ATOM 0 HG2 GLU A 524 5.990 2.383 -15.448 1.00 0.00 H new ATOM 0 HG3 GLU A 524 6.823 3.347 -14.245 1.00 0.00 H new ATOM 810 N ASP A 525 9.793 -0.079 -16.963 1.00 0.00 N ATOM 811 CA ASP A 525 11.073 -0.753 -17.146 1.00 0.00 C ATOM 812 C ASP A 525 12.097 -0.262 -16.128 1.00 0.00 C ATOM 813 O ASP A 525 13.252 -0.010 -16.468 1.00 0.00 O ATOM 814 CB ASP A 525 11.596 -0.523 -18.565 1.00 0.00 C ATOM 815 CG ASP A 525 12.606 -1.572 -18.987 1.00 0.00 C ATOM 816 OD1 ASP A 525 12.469 -2.736 -18.555 1.00 0.00 O ATOM 817 OD2 ASP A 525 13.533 -1.229 -19.750 1.00 0.00 O ATOM 0 H ASP A 525 9.050 -0.677 -16.601 1.00 0.00 H new ATOM 0 HA ASP A 525 10.918 -1.821 -16.992 1.00 0.00 H new ATOM 0 HB2 ASP A 525 10.759 -0.528 -19.263 1.00 0.00 H new ATOM 0 HB3 ASP A 525 12.055 0.464 -18.624 1.00 0.00 H new ATOM 822 N GLU A 526 11.663 -0.127 -14.878 1.00 0.00 N ATOM 823 CA GLU A 526 12.543 0.336 -13.811 1.00 0.00 C ATOM 824 C GLU A 526 12.509 -0.622 -12.624 1.00 0.00 C ATOM 825 O GLU A 526 11.666 -1.516 -12.558 1.00 0.00 O ATOM 826 CB GLU A 526 12.137 1.741 -13.359 1.00 0.00 C ATOM 827 CG GLU A 526 12.361 2.809 -14.417 1.00 0.00 C ATOM 828 CD GLU A 526 13.809 2.898 -14.858 1.00 0.00 C ATOM 829 OE1 GLU A 526 14.695 2.959 -13.980 1.00 0.00 O ATOM 830 OE2 GLU A 526 14.056 2.907 -16.082 1.00 0.00 O ATOM 0 H GLU A 526 10.709 -0.331 -14.580 1.00 0.00 H new ATOM 0 HA GLU A 526 13.560 0.367 -14.201 1.00 0.00 H new ATOM 0 HB2 GLU A 526 11.083 1.733 -13.080 1.00 0.00 H new ATOM 0 HB3 GLU A 526 12.702 2.003 -12.465 1.00 0.00 H new ATOM 0 HG2 GLU A 526 11.734 2.595 -15.282 1.00 0.00 H new ATOM 0 HG3 GLU A 526 12.044 3.776 -14.025 1.00 0.00 H new ATOM 837 N SER A 527 13.432 -0.427 -11.688 1.00 0.00 N ATOM 838 CA SER A 527 13.512 -1.276 -10.505 1.00 0.00 C ATOM 839 C SER A 527 12.266 -1.119 -9.639 1.00 0.00 C ATOM 840 O SER A 527 11.756 -0.012 -9.460 1.00 0.00 O ATOM 841 CB SER A 527 14.760 -0.934 -9.689 1.00 0.00 C ATOM 842 OG SER A 527 14.837 -1.728 -8.518 1.00 0.00 O ATOM 0 H SER A 527 14.135 0.311 -11.726 1.00 0.00 H new ATOM 0 HA SER A 527 13.576 -2.313 -10.836 1.00 0.00 H new ATOM 0 HB2 SER A 527 15.651 -1.091 -10.298 1.00 0.00 H new ATOM 0 HB3 SER A 527 14.742 0.121 -9.416 1.00 0.00 H new ATOM 0 HG SER A 527 15.644 -1.491 -8.015 1.00 0.00 H new ATOM 848 N TYR A 528 11.781 -2.233 -9.104 1.00 0.00 N ATOM 849 CA TYR A 528 10.593 -2.221 -8.258 1.00 0.00 C ATOM 850 C TYR A 528 10.635 -1.054 -7.276 1.00 0.00 C ATOM 851 O TYR A 528 9.644 -0.350 -7.089 1.00 0.00 O ATOM 852 CB TYR A 528 10.472 -3.541 -7.494 1.00 0.00 C ATOM 853 CG TYR A 528 10.001 -4.695 -8.350 1.00 0.00 C ATOM 854 CD1 TYR A 528 8.688 -4.761 -8.801 1.00 0.00 C ATOM 855 CD2 TYR A 528 10.869 -5.719 -8.709 1.00 0.00 C ATOM 856 CE1 TYR A 528 8.254 -5.814 -9.582 1.00 0.00 C ATOM 857 CE2 TYR A 528 10.444 -6.775 -9.491 1.00 0.00 C ATOM 858 CZ TYR A 528 9.135 -6.818 -9.926 1.00 0.00 C ATOM 859 OH TYR A 528 8.707 -7.869 -10.704 1.00 0.00 O ATOM 0 H TYR A 528 12.192 -3.157 -9.241 1.00 0.00 H new ATOM 0 HA TYR A 528 9.721 -2.100 -8.901 1.00 0.00 H new ATOM 0 HB2 TYR A 528 11.441 -3.792 -7.062 1.00 0.00 H new ATOM 0 HB3 TYR A 528 9.778 -3.408 -6.664 1.00 0.00 H new ATOM 0 HD1 TYR A 528 7.996 -3.976 -8.536 1.00 0.00 H new ATOM 0 HD2 TYR A 528 11.894 -5.689 -8.370 1.00 0.00 H new ATOM 0 HE1 TYR A 528 7.230 -5.851 -9.922 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.132 -7.563 -9.761 1.00 0.00 H new ATOM 0 HH TYR A 528 7.791 -7.698 -11.009 1.00 0.00 H new ATOM 869 N GLY A 529 11.792 -0.857 -6.651 1.00 0.00 N ATOM 870 CA GLY A 529 11.944 0.225 -5.696 1.00 0.00 C ATOM 871 C GLY A 529 11.497 1.561 -6.257 1.00 0.00 C ATOM 872 O GLY A 529 10.477 2.108 -5.837 1.00 0.00 O ATOM 0 H GLY A 529 12.626 -1.427 -6.789 1.00 0.00 H new ATOM 0 HA2 GLY A 529 11.366 -0.001 -4.800 1.00 0.00 H new ATOM 0 HA3 GLY A 529 12.989 0.293 -5.392 1.00 0.00 H new ATOM 876 N TYR A 530 12.262 2.088 -7.206 1.00 0.00 N ATOM 877 CA TYR A 530 11.941 3.369 -7.823 1.00 0.00 C ATOM 878 C TYR A 530 10.431 3.557 -7.935 1.00 0.00 C ATOM 879 O TYR A 530 9.871 4.515 -7.402 1.00 0.00 O ATOM 880 CB TYR A 530 12.583 3.468 -9.207 1.00 0.00 C ATOM 881 CG TYR A 530 11.943 4.509 -10.098 1.00 0.00 C ATOM 882 CD1 TYR A 530 12.339 5.840 -10.040 1.00 0.00 C ATOM 883 CD2 TYR A 530 10.943 4.162 -10.998 1.00 0.00 C ATOM 884 CE1 TYR A 530 11.757 6.794 -10.852 1.00 0.00 C ATOM 885 CE2 TYR A 530 10.356 5.110 -11.814 1.00 0.00 C ATOM 886 CZ TYR A 530 10.766 6.424 -11.737 1.00 0.00 C ATOM 887 OH TYR A 530 10.184 7.371 -12.548 1.00 0.00 O ATOM 0 H TYR A 530 13.109 1.648 -7.565 1.00 0.00 H new ATOM 0 HA TYR A 530 12.341 4.159 -7.188 1.00 0.00 H new ATOM 0 HB2 TYR A 530 13.641 3.702 -9.092 1.00 0.00 H new ATOM 0 HB3 TYR A 530 12.523 2.496 -9.697 1.00 0.00 H new ATOM 0 HD1 TYR A 530 13.115 6.133 -9.348 1.00 0.00 H new ATOM 0 HD2 TYR A 530 10.619 3.134 -11.061 1.00 0.00 H new ATOM 0 HE1 TYR A 530 12.076 7.824 -10.794 1.00 0.00 H new ATOM 0 HE2 TYR A 530 9.580 4.823 -12.508 1.00 0.00 H new ATOM 0 HH TYR A 530 9.505 6.946 -13.113 1.00 0.00 H new ATOM 897 N VAL A 531 9.777 2.634 -8.633 1.00 0.00 N ATOM 898 CA VAL A 531 8.332 2.695 -8.816 1.00 0.00 C ATOM 899 C VAL A 531 7.626 3.024 -7.505 1.00 0.00 C ATOM 900 O VAL A 531 6.949 4.047 -7.391 1.00 0.00 O ATOM 901 CB VAL A 531 7.779 1.366 -9.364 1.00 0.00 C ATOM 902 CG1 VAL A 531 6.274 1.456 -9.565 1.00 0.00 C ATOM 903 CG2 VAL A 531 8.477 0.994 -10.663 1.00 0.00 C ATOM 0 H VAL A 531 10.225 1.835 -9.081 1.00 0.00 H new ATOM 0 HA VAL A 531 8.138 3.487 -9.539 1.00 0.00 H new ATOM 0 HB VAL A 531 7.978 0.581 -8.634 1.00 0.00 H new ATOM 0 HG11 VAL A 531 5.901 0.508 -9.953 1.00 0.00 H new ATOM 0 HG12 VAL A 531 5.792 1.673 -8.612 1.00 0.00 H new ATOM 0 HG13 VAL A 531 6.049 2.252 -10.275 1.00 0.00 H new ATOM 0 HG21 VAL A 531 8.074 0.052 -11.036 1.00 0.00 H new ATOM 0 HG22 VAL A 531 8.312 1.778 -11.402 1.00 0.00 H new ATOM 0 HG23 VAL A 531 9.546 0.885 -10.483 1.00 0.00 H new ATOM 913 N LEU A 532 7.788 2.151 -6.517 1.00 0.00 N ATOM 914 CA LEU A 532 7.167 2.349 -5.212 1.00 0.00 C ATOM 915 C LEU A 532 7.861 1.509 -4.145 1.00 0.00 C ATOM 916 O LEU A 532 7.899 0.280 -4.215 1.00 0.00 O ATOM 917 CB LEU A 532 5.681 1.990 -5.273 1.00 0.00 C ATOM 918 CG LEU A 532 4.878 2.235 -3.994 1.00 0.00 C ATOM 919 CD1 LEU A 532 4.642 3.723 -3.788 1.00 0.00 C ATOM 920 CD2 LEU A 532 3.555 1.485 -4.044 1.00 0.00 C ATOM 0 H LEU A 532 8.344 1.299 -6.595 1.00 0.00 H new ATOM 0 HA LEU A 532 7.270 3.400 -4.944 1.00 0.00 H new ATOM 0 HB2 LEU A 532 5.223 2.561 -6.081 1.00 0.00 H new ATOM 0 HB3 LEU A 532 5.593 0.936 -5.537 1.00 0.00 H new ATOM 0 HG LEU A 532 5.454 1.860 -3.148 1.00 0.00 H new ATOM 0 HD11 LEU A 532 4.069 3.877 -2.873 1.00 0.00 H new ATOM 0 HD12 LEU A 532 5.601 4.236 -3.707 1.00 0.00 H new ATOM 0 HD13 LEU A 532 4.087 4.124 -4.636 1.00 0.00 H new ATOM 0 HD21 LEU A 532 2.997 1.670 -3.126 1.00 0.00 H new ATOM 0 HD22 LEU A 532 2.973 1.830 -4.899 1.00 0.00 H new ATOM 0 HD23 LEU A 532 3.746 0.416 -4.143 1.00 0.00 H new ATOM 932 N PRO A 533 8.422 2.184 -3.131 1.00 0.00 N ATOM 933 CA PRO A 533 9.123 1.520 -2.029 1.00 0.00 C ATOM 934 C PRO A 533 8.173 0.750 -1.118 1.00 0.00 C ATOM 935 O PRO A 533 6.956 0.913 -1.195 1.00 0.00 O ATOM 936 CB PRO A 533 9.770 2.680 -1.268 1.00 0.00 C ATOM 937 CG PRO A 533 8.916 3.860 -1.581 1.00 0.00 C ATOM 938 CD PRO A 533 8.416 3.649 -2.984 1.00 0.00 C ATOM 0 HA PRO A 533 9.836 0.778 -2.389 1.00 0.00 H new ATOM 0 HB2 PRO A 533 9.798 2.484 -0.196 1.00 0.00 H new ATOM 0 HB3 PRO A 533 10.799 2.840 -1.589 1.00 0.00 H new ATOM 0 HG2 PRO A 533 8.086 3.938 -0.879 1.00 0.00 H new ATOM 0 HG3 PRO A 533 9.486 4.786 -1.505 1.00 0.00 H new ATOM 0 HD2 PRO A 533 7.417 4.063 -3.121 1.00 0.00 H new ATOM 0 HD3 PRO A 533 9.063 4.129 -3.718 1.00 0.00 H new ATOM 946 N ASN A 534 8.737 -0.090 -0.256 1.00 0.00 N ATOM 947 CA ASN A 534 7.939 -0.885 0.670 1.00 0.00 C ATOM 948 C ASN A 534 7.306 -0.002 1.741 1.00 0.00 C ATOM 949 O ASN A 534 6.083 0.058 1.869 1.00 0.00 O ATOM 950 CB ASN A 534 8.805 -1.962 1.327 1.00 0.00 C ATOM 951 CG ASN A 534 9.242 -3.031 0.345 1.00 0.00 C ATOM 952 OD1 ASN A 534 10.329 -2.955 -0.228 1.00 0.00 O ATOM 953 ND2 ASN A 534 8.396 -4.035 0.147 1.00 0.00 N ATOM 0 H ASN A 534 9.743 -0.238 -0.180 1.00 0.00 H new ATOM 0 HA ASN A 534 7.141 -1.365 0.103 1.00 0.00 H new ATOM 0 HB2 ASN A 534 9.686 -1.496 1.769 1.00 0.00 H new ATOM 0 HB3 ASN A 534 8.248 -2.426 2.141 1.00 0.00 H new ATOM 0 HD21 ASN A 534 8.637 -4.784 -0.502 1.00 0.00 H new ATOM 0 HD22 ASN A 534 7.505 -4.057 0.644 1.00 0.00 H new ATOM 960 N HIS A 535 8.148 0.684 2.507 1.00 0.00 N ATOM 961 CA HIS A 535 7.671 1.566 3.567 1.00 0.00 C ATOM 962 C HIS A 535 6.459 2.368 3.102 1.00 0.00 C ATOM 963 O HIS A 535 5.455 2.459 3.809 1.00 0.00 O ATOM 964 CB HIS A 535 8.785 2.515 4.009 1.00 0.00 C ATOM 965 CG HIS A 535 8.883 3.755 3.174 1.00 0.00 C ATOM 966 ND1 HIS A 535 9.670 3.841 2.045 1.00 0.00 N ATOM 967 CD2 HIS A 535 8.286 4.962 3.307 1.00 0.00 C ATOM 968 CE1 HIS A 535 9.554 5.048 1.521 1.00 0.00 C ATOM 969 NE2 HIS A 535 8.719 5.748 2.268 1.00 0.00 N ATOM 0 H HIS A 535 9.163 0.647 2.414 1.00 0.00 H new ATOM 0 HA HIS A 535 7.373 0.948 4.414 1.00 0.00 H new ATOM 0 HB2 HIS A 535 8.618 2.799 5.048 1.00 0.00 H new ATOM 0 HB3 HIS A 535 9.737 1.986 3.972 1.00 0.00 H new ATOM 0 HD2 HIS A 535 7.597 5.253 4.086 1.00 0.00 H new ATOM 0 HE1 HIS A 535 10.056 5.402 0.633 1.00 0.00 H new ATOM 0 HE2 HIS A 535 8.441 6.715 2.100 1.00 0.00 H new ATOM 977 N MET A 536 6.560 2.947 1.910 1.00 0.00 N ATOM 978 CA MET A 536 5.471 3.740 1.352 1.00 0.00 C ATOM 979 C MET A 536 4.239 2.875 1.106 1.00 0.00 C ATOM 980 O MET A 536 3.147 3.186 1.581 1.00 0.00 O ATOM 981 CB MET A 536 5.912 4.403 0.045 1.00 0.00 C ATOM 982 CG MET A 536 4.870 5.340 -0.543 1.00 0.00 C ATOM 983 SD MET A 536 5.549 6.424 -1.814 1.00 0.00 S ATOM 984 CE MET A 536 6.735 7.366 -0.857 1.00 0.00 C ATOM 0 H MET A 536 7.384 2.882 1.312 1.00 0.00 H new ATOM 0 HA MET A 536 5.211 4.514 2.074 1.00 0.00 H new ATOM 0 HB2 MET A 536 6.831 4.961 0.222 1.00 0.00 H new ATOM 0 HB3 MET A 536 6.145 3.628 -0.685 1.00 0.00 H new ATOM 0 HG2 MET A 536 4.057 4.752 -0.969 1.00 0.00 H new ATOM 0 HG3 MET A 536 4.441 5.946 0.255 1.00 0.00 H new ATOM 0 HE1 MET A 536 6.949 8.306 -1.366 1.00 0.00 H new ATOM 0 HE2 MET A 536 6.323 7.574 0.131 1.00 0.00 H new ATOM 0 HE3 MET A 536 7.656 6.792 -0.753 1.00 0.00 H new ATOM 994 N MET A 537 4.422 1.790 0.361 1.00 0.00 N ATOM 995 CA MET A 537 3.324 0.880 0.054 1.00 0.00 C ATOM 996 C MET A 537 2.547 0.521 1.316 1.00 0.00 C ATOM 997 O MET A 537 1.340 0.752 1.401 1.00 0.00 O ATOM 998 CB MET A 537 3.858 -0.391 -0.610 1.00 0.00 C ATOM 999 CG MET A 537 2.773 -1.399 -0.951 1.00 0.00 C ATOM 1000 SD MET A 537 3.180 -2.394 -2.399 1.00 0.00 S ATOM 1001 CE MET A 537 4.492 -3.423 -1.745 1.00 0.00 C ATOM 0 H MET A 537 5.319 1.519 -0.041 1.00 0.00 H new ATOM 0 HA MET A 537 2.648 1.385 -0.636 1.00 0.00 H new ATOM 0 HB2 MET A 537 4.390 -0.119 -1.522 1.00 0.00 H new ATOM 0 HB3 MET A 537 4.584 -0.861 0.054 1.00 0.00 H new ATOM 0 HG2 MET A 537 2.612 -2.057 -0.097 1.00 0.00 H new ATOM 0 HG3 MET A 537 1.836 -0.872 -1.129 1.00 0.00 H new ATOM 0 HE1 MET A 537 5.348 -3.392 -2.419 1.00 0.00 H new ATOM 0 HE2 MET A 537 4.789 -3.054 -0.763 1.00 0.00 H new ATOM 0 HE3 MET A 537 4.138 -4.450 -1.654 1.00 0.00 H new ATOM 1011 N LEU A 538 3.244 -0.046 2.294 1.00 0.00 N ATOM 1012 CA LEU A 538 2.619 -0.438 3.552 1.00 0.00 C ATOM 1013 C LEU A 538 1.808 0.713 4.139 1.00 0.00 C ATOM 1014 O LEU A 538 0.607 0.583 4.376 1.00 0.00 O ATOM 1015 CB LEU A 538 3.682 -0.890 4.554 1.00 0.00 C ATOM 1016 CG LEU A 538 4.203 -2.318 4.382 1.00 0.00 C ATOM 1017 CD1 LEU A 538 5.530 -2.493 5.105 1.00 0.00 C ATOM 1018 CD2 LEU A 538 3.180 -3.324 4.890 1.00 0.00 C ATOM 0 H LEU A 538 4.243 -0.245 2.240 1.00 0.00 H new ATOM 0 HA LEU A 538 1.943 -1.269 3.349 1.00 0.00 H new ATOM 0 HB2 LEU A 538 4.528 -0.206 4.489 1.00 0.00 H new ATOM 0 HB3 LEU A 538 3.270 -0.793 5.559 1.00 0.00 H new ATOM 0 HG LEU A 538 4.365 -2.500 3.319 1.00 0.00 H new ATOM 0 HD11 LEU A 538 5.885 -3.515 4.972 1.00 0.00 H new ATOM 0 HD12 LEU A 538 6.262 -1.798 4.695 1.00 0.00 H new ATOM 0 HD13 LEU A 538 5.395 -2.292 6.168 1.00 0.00 H new ATOM 0 HD21 LEU A 538 3.568 -4.334 4.760 1.00 0.00 H new ATOM 0 HD22 LEU A 538 2.986 -3.143 5.947 1.00 0.00 H new ATOM 0 HD23 LEU A 538 2.253 -3.216 4.327 1.00 0.00 H new ATOM 1030 N LYS A 539 2.472 1.840 4.369 1.00 0.00 N ATOM 1031 CA LYS A 539 1.813 3.017 4.925 1.00 0.00 C ATOM 1032 C LYS A 539 0.454 3.240 4.269 1.00 0.00 C ATOM 1033 O LYS A 539 -0.541 3.483 4.952 1.00 0.00 O ATOM 1034 CB LYS A 539 2.692 4.255 4.736 1.00 0.00 C ATOM 1035 CG LYS A 539 2.028 5.546 5.182 1.00 0.00 C ATOM 1036 CD LYS A 539 2.976 6.728 5.072 1.00 0.00 C ATOM 1037 CE LYS A 539 2.470 7.924 5.864 1.00 0.00 C ATOM 1038 NZ LYS A 539 1.167 8.422 5.345 1.00 0.00 N ATOM 0 H LYS A 539 3.466 1.964 4.179 1.00 0.00 H new ATOM 0 HA LYS A 539 1.659 2.848 5.991 1.00 0.00 H new ATOM 0 HB2 LYS A 539 3.619 4.121 5.294 1.00 0.00 H new ATOM 0 HB3 LYS A 539 2.963 4.340 3.684 1.00 0.00 H new ATOM 0 HG2 LYS A 539 1.143 5.730 4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 539 1.690 5.445 6.213 1.00 0.00 H new ATOM 0 HD2 LYS A 539 3.962 6.440 5.436 1.00 0.00 H new ATOM 0 HD3 LYS A 539 3.092 7.007 4.025 1.00 0.00 H new ATOM 0 HE2 LYS A 539 2.361 7.645 6.912 1.00 0.00 H new ATOM 0 HE3 LYS A 539 3.208 8.725 5.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 539 1.205 9.457 5.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 539 0.976 7.993 4.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 539 0.408 8.165 6.008 1.00 0.00 H new ATOM 1052 N ILE A 540 0.421 3.154 2.944 1.00 0.00 N ATOM 1053 CA ILE A 540 -0.817 3.344 2.198 1.00 0.00 C ATOM 1054 C ILE A 540 -1.789 2.195 2.443 1.00 0.00 C ATOM 1055 O ILE A 540 -2.938 2.411 2.827 1.00 0.00 O ATOM 1056 CB ILE A 540 -0.550 3.463 0.686 1.00 0.00 C ATOM 1057 CG1 ILE A 540 0.365 4.655 0.399 1.00 0.00 C ATOM 1058 CG2 ILE A 540 -1.861 3.600 -0.074 1.00 0.00 C ATOM 1059 CD1 ILE A 540 0.957 4.642 -0.993 1.00 0.00 C ATOM 0 H ILE A 540 1.237 2.954 2.365 1.00 0.00 H new ATOM 0 HA ILE A 540 -1.261 4.274 2.555 1.00 0.00 H new ATOM 0 HB ILE A 540 -0.049 2.556 0.348 1.00 0.00 H new ATOM 0 HG12 ILE A 540 -0.200 5.577 0.536 1.00 0.00 H new ATOM 0 HG13 ILE A 540 1.174 4.665 1.129 1.00 0.00 H new ATOM 0 HG21 ILE A 540 -1.656 3.683 -1.141 1.00 0.00 H new ATOM 0 HG22 ILE A 540 -2.481 2.722 0.109 1.00 0.00 H new ATOM 0 HG23 ILE A 540 -2.387 4.493 0.265 1.00 0.00 H new ATOM 0 HD11 ILE A 540 1.594 5.516 -1.125 1.00 0.00 H new ATOM 0 HD12 ILE A 540 1.550 3.737 -1.128 1.00 0.00 H new ATOM 0 HD13 ILE A 540 0.154 4.663 -1.730 1.00 0.00 H new ATOM 1071 N ALA A 541 -1.318 0.972 2.220 1.00 0.00 N ATOM 1072 CA ALA A 541 -2.144 -0.212 2.420 1.00 0.00 C ATOM 1073 C ALA A 541 -2.807 -0.194 3.793 1.00 0.00 C ATOM 1074 O ALA A 541 -3.946 -0.632 3.948 1.00 0.00 O ATOM 1075 CB ALA A 541 -1.309 -1.473 2.252 1.00 0.00 C ATOM 0 H ALA A 541 -0.369 0.776 1.901 1.00 0.00 H new ATOM 0 HA ALA A 541 -2.931 -0.207 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 541 -1.939 -2.349 2.404 1.00 0.00 H new ATOM 0 HB2 ALA A 541 -0.888 -1.499 1.247 1.00 0.00 H new ATOM 0 HB3 ALA A 541 -0.502 -1.475 2.984 1.00 0.00 H new ATOM 1081 N GLU A 542 -2.085 0.315 4.787 1.00 0.00 N ATOM 1082 CA GLU A 542 -2.604 0.388 6.147 1.00 0.00 C ATOM 1083 C GLU A 542 -3.526 1.593 6.314 1.00 0.00 C ATOM 1084 O GLU A 542 -4.595 1.490 6.913 1.00 0.00 O ATOM 1085 CB GLU A 542 -1.453 0.470 7.152 1.00 0.00 C ATOM 1086 CG GLU A 542 -0.455 -0.669 7.029 1.00 0.00 C ATOM 1087 CD GLU A 542 0.731 -0.509 7.959 1.00 0.00 C ATOM 1088 OE1 GLU A 542 0.521 -0.108 9.124 1.00 0.00 O ATOM 1089 OE2 GLU A 542 1.869 -0.784 7.524 1.00 0.00 O ATOM 0 H GLU A 542 -1.140 0.682 4.675 1.00 0.00 H new ATOM 0 HA GLU A 542 -3.180 -0.518 6.338 1.00 0.00 H new ATOM 0 HB2 GLU A 542 -0.930 1.416 7.016 1.00 0.00 H new ATOM 0 HB3 GLU A 542 -1.863 0.475 8.162 1.00 0.00 H new ATOM 0 HG2 GLU A 542 -0.957 -1.612 7.246 1.00 0.00 H new ATOM 0 HG3 GLU A 542 -0.100 -0.726 6.000 1.00 0.00 H new ATOM 1096 N GLU A 543 -3.101 2.734 5.779 1.00 0.00 N ATOM 1097 CA GLU A 543 -3.888 3.958 5.870 1.00 0.00 C ATOM 1098 C GLU A 543 -5.286 3.751 5.296 1.00 0.00 C ATOM 1099 O GLU A 543 -6.286 4.112 5.920 1.00 0.00 O ATOM 1100 CB GLU A 543 -3.185 5.098 5.130 1.00 0.00 C ATOM 1101 CG GLU A 543 -2.126 5.802 5.961 1.00 0.00 C ATOM 1102 CD GLU A 543 -2.704 6.491 7.182 1.00 0.00 C ATOM 1103 OE1 GLU A 543 -3.602 7.342 7.013 1.00 0.00 O ATOM 1104 OE2 GLU A 543 -2.259 6.179 8.306 1.00 0.00 O ATOM 0 H GLU A 543 -2.218 2.836 5.279 1.00 0.00 H new ATOM 0 HA GLU A 543 -3.982 4.221 6.924 1.00 0.00 H new ATOM 0 HB2 GLU A 543 -2.722 4.702 4.226 1.00 0.00 H new ATOM 0 HB3 GLU A 543 -3.930 5.828 4.813 1.00 0.00 H new ATOM 0 HG2 GLU A 543 -1.377 5.076 6.279 1.00 0.00 H new ATOM 0 HG3 GLU A 543 -1.614 6.538 5.342 1.00 0.00 H new ATOM 1111 N LEU A 544 -5.350 3.167 4.105 1.00 0.00 N ATOM 1112 CA LEU A 544 -6.625 2.911 3.445 1.00 0.00 C ATOM 1113 C LEU A 544 -7.352 4.217 3.139 1.00 0.00 C ATOM 1114 O LEU A 544 -8.517 4.404 3.492 1.00 0.00 O ATOM 1115 CB LEU A 544 -7.505 2.017 4.321 1.00 0.00 C ATOM 1116 CG LEU A 544 -6.953 0.624 4.625 1.00 0.00 C ATOM 1117 CD1 LEU A 544 -7.994 -0.216 5.350 1.00 0.00 C ATOM 1118 CD2 LEU A 544 -6.508 -0.065 3.343 1.00 0.00 C ATOM 0 H LEU A 544 -4.533 2.862 3.576 1.00 0.00 H new ATOM 0 HA LEU A 544 -6.422 2.400 2.504 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -7.682 2.530 5.266 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -8.473 1.904 3.833 1.00 0.00 H new ATOM 0 HG LEU A 544 -6.085 0.732 5.276 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -7.584 -1.204 5.558 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -8.264 0.269 6.288 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -8.881 -0.316 4.724 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -6.118 -1.055 3.579 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -7.358 -0.161 2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -5.729 0.527 2.863 1.00 0.00 H new ATOM 1130 N PRO A 545 -6.651 5.141 2.466 1.00 0.00 N ATOM 1131 CA PRO A 545 -7.211 6.444 2.095 1.00 0.00 C ATOM 1132 C PRO A 545 -8.282 6.329 1.016 1.00 0.00 C ATOM 1133 O PRO A 545 -7.974 6.180 -0.166 1.00 0.00 O ATOM 1134 CB PRO A 545 -5.998 7.213 1.565 1.00 0.00 C ATOM 1135 CG PRO A 545 -5.056 6.158 1.096 1.00 0.00 C ATOM 1136 CD PRO A 545 -5.258 4.985 2.014 1.00 0.00 C ATOM 0 HA PRO A 545 -7.707 6.929 2.936 1.00 0.00 H new ATOM 0 HB2 PRO A 545 -6.278 7.883 0.752 1.00 0.00 H new ATOM 0 HB3 PRO A 545 -5.548 7.828 2.344 1.00 0.00 H new ATOM 0 HG2 PRO A 545 -5.261 5.884 0.061 1.00 0.00 H new ATOM 0 HG3 PRO A 545 -4.025 6.510 1.134 1.00 0.00 H new ATOM 0 HD2 PRO A 545 -5.108 4.038 1.495 1.00 0.00 H new ATOM 0 HD3 PRO A 545 -4.560 5.005 2.851 1.00 0.00 H new ATOM 1144 N LYS A 546 -9.542 6.400 1.431 1.00 0.00 N ATOM 1145 CA LYS A 546 -10.661 6.306 0.500 1.00 0.00 C ATOM 1146 C LYS A 546 -10.511 7.315 -0.634 1.00 0.00 C ATOM 1147 O LYS A 546 -10.980 7.083 -1.748 1.00 0.00 O ATOM 1148 CB LYS A 546 -11.983 6.540 1.234 1.00 0.00 C ATOM 1149 CG LYS A 546 -12.026 7.847 2.008 1.00 0.00 C ATOM 1150 CD LYS A 546 -12.559 8.984 1.153 1.00 0.00 C ATOM 1151 CE LYS A 546 -14.058 8.855 0.926 1.00 0.00 C ATOM 1152 NZ LYS A 546 -14.841 9.439 2.050 1.00 0.00 N ATOM 0 H LYS A 546 -9.814 6.522 2.406 1.00 0.00 H new ATOM 0 HA LYS A 546 -10.663 5.303 0.073 1.00 0.00 H new ATOM 0 HB2 LYS A 546 -12.798 6.529 0.510 1.00 0.00 H new ATOM 0 HB3 LYS A 546 -12.158 5.714 1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 546 -12.655 7.728 2.890 1.00 0.00 H new ATOM 0 HG3 LYS A 546 -11.025 8.095 2.362 1.00 0.00 H new ATOM 0 HD2 LYS A 546 -12.344 9.937 1.637 1.00 0.00 H new ATOM 0 HD3 LYS A 546 -12.044 8.991 0.193 1.00 0.00 H new ATOM 0 HE2 LYS A 546 -14.329 9.355 -0.004 1.00 0.00 H new ATOM 0 HE3 LYS A 546 -14.319 7.803 0.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 546 -15.857 9.331 1.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 546 -14.602 8.945 2.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 546 -14.612 10.449 2.145 1.00 0.00 H new ATOM 1166 N GLU A 547 -9.854 8.433 -0.343 1.00 0.00 N ATOM 1167 CA GLU A 547 -9.643 9.476 -1.340 1.00 0.00 C ATOM 1168 C GLU A 547 -8.257 9.355 -1.968 1.00 0.00 C ATOM 1169 O GLU A 547 -7.338 8.768 -1.397 1.00 0.00 O ATOM 1170 CB GLU A 547 -9.808 10.859 -0.706 1.00 0.00 C ATOM 1171 CG GLU A 547 -11.231 11.390 -0.768 1.00 0.00 C ATOM 1172 CD GLU A 547 -11.289 12.905 -0.749 1.00 0.00 C ATOM 1173 OE1 GLU A 547 -10.537 13.537 -1.521 1.00 0.00 O ATOM 1174 OE2 GLU A 547 -12.085 13.459 0.038 1.00 0.00 O ATOM 0 H GLU A 547 -9.459 8.640 0.574 1.00 0.00 H new ATOM 0 HA GLU A 547 -10.391 9.351 -2.123 1.00 0.00 H new ATOM 0 HB2 GLU A 547 -9.491 10.812 0.336 1.00 0.00 H new ATOM 0 HB3 GLU A 547 -9.144 11.562 -1.209 1.00 0.00 H new ATOM 0 HG2 GLU A 547 -11.713 11.023 -1.674 1.00 0.00 H new ATOM 0 HG3 GLU A 547 -11.798 10.998 0.076 1.00 0.00 H new ATOM 1181 N PRO A 548 -8.103 9.923 -3.174 1.00 0.00 N ATOM 1182 CA PRO A 548 -6.834 9.892 -3.907 1.00 0.00 C ATOM 1183 C PRO A 548 -5.766 10.761 -3.252 1.00 0.00 C ATOM 1184 O PRO A 548 -4.572 10.572 -3.485 1.00 0.00 O ATOM 1185 CB PRO A 548 -7.207 10.448 -5.284 1.00 0.00 C ATOM 1186 CG PRO A 548 -8.406 11.298 -5.037 1.00 0.00 C ATOM 1187 CD PRO A 548 -9.156 10.639 -3.914 1.00 0.00 C ATOM 0 HA PRO A 548 -6.405 8.891 -3.939 1.00 0.00 H new ATOM 0 HB2 PRO A 548 -6.390 11.030 -5.711 1.00 0.00 H new ATOM 0 HB3 PRO A 548 -7.428 9.646 -5.988 1.00 0.00 H new ATOM 0 HG2 PRO A 548 -8.116 12.314 -4.769 1.00 0.00 H new ATOM 0 HG3 PRO A 548 -9.025 11.369 -5.931 1.00 0.00 H new ATOM 0 HD2 PRO A 548 -9.662 11.371 -3.285 1.00 0.00 H new ATOM 0 HD3 PRO A 548 -9.920 9.957 -4.287 1.00 0.00 H new ATOM 1195 N GLN A 549 -6.203 11.713 -2.434 1.00 0.00 N ATOM 1196 CA GLN A 549 -5.283 12.610 -1.746 1.00 0.00 C ATOM 1197 C GLN A 549 -4.400 11.841 -0.769 1.00 0.00 C ATOM 1198 O GLN A 549 -3.182 12.011 -0.750 1.00 0.00 O ATOM 1199 CB GLN A 549 -6.059 13.699 -1.003 1.00 0.00 C ATOM 1200 CG GLN A 549 -5.283 14.997 -0.843 1.00 0.00 C ATOM 1201 CD GLN A 549 -5.412 15.907 -2.049 1.00 0.00 C ATOM 1202 OE1 GLN A 549 -6.518 16.252 -2.465 1.00 0.00 O ATOM 1203 NE2 GLN A 549 -4.278 16.300 -2.617 1.00 0.00 N ATOM 0 H GLN A 549 -7.188 11.883 -2.232 1.00 0.00 H new ATOM 0 HA GLN A 549 -4.643 13.077 -2.495 1.00 0.00 H new ATOM 0 HB2 GLN A 549 -6.986 13.903 -1.539 1.00 0.00 H new ATOM 0 HB3 GLN A 549 -6.336 13.327 -0.017 1.00 0.00 H new ATOM 0 HG2 GLN A 549 -5.639 15.522 0.043 1.00 0.00 H new ATOM 0 HG3 GLN A 549 -4.230 14.768 -0.676 1.00 0.00 H new ATOM 0 HE21 GLN A 549 -3.383 15.989 -2.238 1.00 0.00 H new ATOM 0 HE22 GLN A 549 -4.301 16.913 -3.432 1.00 0.00 H new ATOM 1212 N GLY A 550 -5.024 10.994 0.044 1.00 0.00 N ATOM 1213 CA GLY A 550 -4.280 10.212 1.014 1.00 0.00 C ATOM 1214 C GLY A 550 -3.097 9.494 0.394 1.00 0.00 C ATOM 1215 O GLY A 550 -2.060 9.325 1.036 1.00 0.00 O ATOM 0 H GLY A 550 -6.032 10.835 0.048 1.00 0.00 H new ATOM 0 HA2 GLY A 550 -3.927 10.867 1.811 1.00 0.00 H new ATOM 0 HA3 GLY A 550 -4.945 9.481 1.474 1.00 0.00 H new ATOM 1219 N ILE A 551 -3.253 9.069 -0.855 1.00 0.00 N ATOM 1220 CA ILE A 551 -2.189 8.365 -1.560 1.00 0.00 C ATOM 1221 C ILE A 551 -1.095 9.329 -2.009 1.00 0.00 C ATOM 1222 O ILE A 551 0.040 8.923 -2.257 1.00 0.00 O ATOM 1223 CB ILE A 551 -2.730 7.612 -2.789 1.00 0.00 C ATOM 1224 CG1 ILE A 551 -3.844 6.649 -2.375 1.00 0.00 C ATOM 1225 CG2 ILE A 551 -1.606 6.862 -3.489 1.00 0.00 C ATOM 1226 CD1 ILE A 551 -5.225 7.265 -2.421 1.00 0.00 C ATOM 0 H ILE A 551 -4.106 9.200 -1.400 1.00 0.00 H new ATOM 0 HA ILE A 551 -1.769 7.644 -0.858 1.00 0.00 H new ATOM 0 HB ILE A 551 -3.145 8.339 -3.488 1.00 0.00 H new ATOM 0 HG12 ILE A 551 -3.822 5.778 -3.030 1.00 0.00 H new ATOM 0 HG13 ILE A 551 -3.648 6.293 -1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 551 -2.005 6.335 -4.356 1.00 0.00 H new ATOM 0 HG22 ILE A 551 -0.844 7.570 -3.814 1.00 0.00 H new ATOM 0 HG23 ILE A 551 -1.163 6.143 -2.799 1.00 0.00 H new ATOM 0 HD11 ILE A 551 -5.964 6.525 -2.115 1.00 0.00 H new ATOM 0 HD12 ILE A 551 -5.265 8.119 -1.745 1.00 0.00 H new ATOM 0 HD13 ILE A 551 -5.442 7.596 -3.437 1.00 0.00 H new ATOM 1238 N ILE A 552 -1.445 10.607 -2.109 1.00 0.00 N ATOM 1239 CA ILE A 552 -0.493 11.629 -2.525 1.00 0.00 C ATOM 1240 C ILE A 552 0.235 12.224 -1.324 1.00 0.00 C ATOM 1241 O ILE A 552 1.426 12.523 -1.393 1.00 0.00 O ATOM 1242 CB ILE A 552 -1.187 12.762 -3.303 1.00 0.00 C ATOM 1243 CG1 ILE A 552 -1.866 12.208 -4.557 1.00 0.00 C ATOM 1244 CG2 ILE A 552 -0.183 13.844 -3.672 1.00 0.00 C ATOM 1245 CD1 ILE A 552 -2.559 13.266 -5.387 1.00 0.00 C ATOM 0 H ILE A 552 -2.381 10.959 -1.908 1.00 0.00 H new ATOM 0 HA ILE A 552 0.229 11.140 -3.179 1.00 0.00 H new ATOM 0 HB ILE A 552 -1.951 13.205 -2.665 1.00 0.00 H new ATOM 0 HG12 ILE A 552 -1.120 11.706 -5.173 1.00 0.00 H new ATOM 0 HG13 ILE A 552 -2.595 11.454 -4.262 1.00 0.00 H new ATOM 0 HG21 ILE A 552 -0.689 14.638 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 552 0.258 14.256 -2.764 1.00 0.00 H new ATOM 0 HG23 ILE A 552 0.602 13.415 -4.295 1.00 0.00 H new ATOM 0 HD11 ILE A 552 -3.018 12.801 -6.260 1.00 0.00 H new ATOM 0 HD12 ILE A 552 -3.329 13.752 -4.788 1.00 0.00 H new ATOM 0 HD13 ILE A 552 -1.830 14.008 -5.713 1.00 0.00 H new ATOM 1257 N ALA A 553 -0.490 12.390 -0.222 1.00 0.00 N ATOM 1258 CA ALA A 553 0.087 12.945 0.996 1.00 0.00 C ATOM 1259 C ALA A 553 1.133 12.005 1.585 1.00 0.00 C ATOM 1260 O ALA A 553 2.217 12.437 1.979 1.00 0.00 O ATOM 1261 CB ALA A 553 -1.006 13.229 2.016 1.00 0.00 C ATOM 0 H ALA A 553 -1.478 12.148 -0.148 1.00 0.00 H new ATOM 0 HA ALA A 553 0.582 13.882 0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 553 -0.561 13.643 2.921 1.00 0.00 H new ATOM 0 HB2 ALA A 553 -1.715 13.945 1.600 1.00 0.00 H new ATOM 0 HB3 ALA A 553 -1.526 12.303 2.259 1.00 0.00 H new ATOM 1267 N CYS A 554 0.801 10.721 1.643 1.00 0.00 N ATOM 1268 CA CYS A 554 1.712 9.719 2.187 1.00 0.00 C ATOM 1269 C CYS A 554 3.125 9.922 1.650 1.00 0.00 C ATOM 1270 O CYS A 554 4.107 9.719 2.366 1.00 0.00 O ATOM 1271 CB CYS A 554 1.220 8.312 1.845 1.00 0.00 C ATOM 1272 SG CYS A 554 1.317 7.904 0.086 1.00 0.00 S ATOM 0 H CYS A 554 -0.092 10.348 1.320 1.00 0.00 H new ATOM 0 HA CYS A 554 1.734 9.834 3.271 1.00 0.00 H new ATOM 0 HB2 CYS A 554 1.807 7.586 2.408 1.00 0.00 H new ATOM 0 HB3 CYS A 554 0.186 8.210 2.174 1.00 0.00 H new ATOM 0 HG CYS A 554 0.759 8.849 -0.610 1.00 0.00 H new ATOM 1278 N CYS A 555 3.221 10.321 0.387 1.00 0.00 N ATOM 1279 CA CYS A 555 4.514 10.548 -0.248 1.00 0.00 C ATOM 1280 C CYS A 555 4.829 12.039 -0.321 1.00 0.00 C ATOM 1281 O CYS A 555 3.985 12.843 -0.713 1.00 0.00 O ATOM 1282 CB CYS A 555 4.531 9.941 -1.651 1.00 0.00 C ATOM 1283 SG CYS A 555 2.970 10.111 -2.548 1.00 0.00 S ATOM 0 H CYS A 555 2.418 10.494 -0.218 1.00 0.00 H new ATOM 0 HA CYS A 555 5.279 10.063 0.358 1.00 0.00 H new ATOM 0 HB2 CYS A 555 5.324 10.414 -2.230 1.00 0.00 H new ATOM 0 HB3 CYS A 555 4.780 8.883 -1.574 1.00 0.00 H new ATOM 0 HG CYS A 555 2.343 11.171 -2.131 1.00 0.00 H new ATOM 1289 N ASN A 556 6.050 12.400 0.060 1.00 0.00 N ATOM 1290 CA ASN A 556 6.476 13.794 0.040 1.00 0.00 C ATOM 1291 C ASN A 556 7.997 13.898 -0.025 1.00 0.00 C ATOM 1292 O ASN A 556 8.707 13.573 0.927 1.00 0.00 O ATOM 1293 CB ASN A 556 5.956 14.526 1.279 1.00 0.00 C ATOM 1294 CG ASN A 556 6.166 16.026 1.194 1.00 0.00 C ATOM 1295 OD1 ASN A 556 5.253 16.773 0.842 1.00 0.00 O ATOM 1296 ND2 ASN A 556 7.373 16.474 1.518 1.00 0.00 N ATOM 0 H ASN A 556 6.762 11.746 0.386 1.00 0.00 H new ATOM 0 HA ASN A 556 6.059 14.262 -0.852 1.00 0.00 H new ATOM 0 HB2 ASN A 556 4.893 14.317 1.402 1.00 0.00 H new ATOM 0 HB3 ASN A 556 6.461 14.141 2.164 1.00 0.00 H new ATOM 0 HD21 ASN A 556 7.573 17.473 1.481 1.00 0.00 H new ATOM 0 HD22 ASN A 556 8.100 15.819 1.804 1.00 0.00 H new ATOM 1303 N PRO A 557 8.510 14.362 -1.174 1.00 0.00 N ATOM 1304 CA PRO A 557 7.675 14.751 -2.314 1.00 0.00 C ATOM 1305 C PRO A 557 7.009 13.552 -2.981 1.00 0.00 C ATOM 1306 O PRO A 557 7.302 12.403 -2.650 1.00 0.00 O ATOM 1307 CB PRO A 557 8.668 15.413 -3.272 1.00 0.00 C ATOM 1308 CG PRO A 557 9.986 14.809 -2.929 1.00 0.00 C ATOM 1309 CD PRO A 557 9.946 14.541 -1.450 1.00 0.00 C ATOM 0 HA PRO A 557 6.853 15.401 -2.014 1.00 0.00 H new ATOM 0 HB2 PRO A 557 8.403 15.221 -4.312 1.00 0.00 H new ATOM 0 HB3 PRO A 557 8.683 16.495 -3.142 1.00 0.00 H new ATOM 0 HG2 PRO A 557 10.151 13.888 -3.488 1.00 0.00 H new ATOM 0 HG3 PRO A 557 10.803 15.485 -3.181 1.00 0.00 H new ATOM 0 HD2 PRO A 557 10.520 13.652 -1.187 1.00 0.00 H new ATOM 0 HD3 PRO A 557 10.364 15.370 -0.880 1.00 0.00 H new ATOM 1317 N VAL A 558 6.113 13.827 -3.924 1.00 0.00 N ATOM 1318 CA VAL A 558 5.407 12.770 -4.639 1.00 0.00 C ATOM 1319 C VAL A 558 6.091 12.451 -5.963 1.00 0.00 C ATOM 1320 O VAL A 558 6.475 13.341 -6.722 1.00 0.00 O ATOM 1321 CB VAL A 558 3.942 13.159 -4.911 1.00 0.00 C ATOM 1322 CG1 VAL A 558 3.207 12.022 -5.605 1.00 0.00 C ATOM 1323 CG2 VAL A 558 3.243 13.544 -3.616 1.00 0.00 C ATOM 0 H VAL A 558 5.859 14.772 -4.210 1.00 0.00 H new ATOM 0 HA VAL A 558 5.428 11.887 -4.001 1.00 0.00 H new ATOM 0 HB VAL A 558 3.932 14.024 -5.574 1.00 0.00 H new ATOM 0 HG11 VAL A 558 2.173 12.315 -5.789 1.00 0.00 H new ATOM 0 HG12 VAL A 558 3.695 11.799 -6.554 1.00 0.00 H new ATOM 0 HG13 VAL A 558 3.225 11.136 -4.970 1.00 0.00 H new ATOM 0 HG21 VAL A 558 2.209 13.816 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 558 3.262 12.700 -2.927 1.00 0.00 H new ATOM 0 HG23 VAL A 558 3.756 14.393 -3.164 1.00 0.00 H new ATOM 1333 N PRO A 559 6.249 11.150 -6.249 1.00 0.00 N ATOM 1334 CA PRO A 559 6.887 10.682 -7.483 1.00 0.00 C ATOM 1335 C PRO A 559 6.030 10.950 -8.716 1.00 0.00 C ATOM 1336 O PRO A 559 4.820 11.157 -8.627 1.00 0.00 O ATOM 1337 CB PRO A 559 7.039 9.176 -7.255 1.00 0.00 C ATOM 1338 CG PRO A 559 5.970 8.831 -6.277 1.00 0.00 C ATOM 1339 CD PRO A 559 5.816 10.035 -5.390 1.00 0.00 C ATOM 0 HA PRO A 559 7.829 11.195 -7.674 1.00 0.00 H new ATOM 0 HB2 PRO A 559 6.919 8.621 -8.185 1.00 0.00 H new ATOM 0 HB3 PRO A 559 8.027 8.933 -6.864 1.00 0.00 H new ATOM 0 HG2 PRO A 559 5.035 8.600 -6.787 1.00 0.00 H new ATOM 0 HG3 PRO A 559 6.243 7.950 -5.696 1.00 0.00 H new ATOM 0 HD2 PRO A 559 4.785 10.160 -5.058 1.00 0.00 H new ATOM 0 HD3 PRO A 559 6.432 9.955 -4.494 1.00 0.00 H new ATOM 1347 N PRO A 560 6.670 10.947 -9.895 1.00 0.00 N ATOM 1348 CA PRO A 560 5.985 11.187 -11.168 1.00 0.00 C ATOM 1349 C PRO A 560 5.062 10.037 -11.555 1.00 0.00 C ATOM 1350 O PRO A 560 4.361 10.104 -12.566 1.00 0.00 O ATOM 1351 CB PRO A 560 7.135 11.310 -12.171 1.00 0.00 C ATOM 1352 CG PRO A 560 8.254 10.538 -11.562 1.00 0.00 C ATOM 1353 CD PRO A 560 8.112 10.707 -10.075 1.00 0.00 C ATOM 0 HA PRO A 560 5.342 12.066 -11.126 1.00 0.00 H new ATOM 0 HB2 PRO A 560 6.857 10.904 -13.143 1.00 0.00 H new ATOM 0 HB3 PRO A 560 7.413 12.352 -12.329 1.00 0.00 H new ATOM 0 HG2 PRO A 560 8.200 9.486 -11.842 1.00 0.00 H new ATOM 0 HG3 PRO A 560 9.218 10.911 -11.907 1.00 0.00 H new ATOM 0 HD2 PRO A 560 8.442 9.819 -9.536 1.00 0.00 H new ATOM 0 HD3 PRO A 560 8.707 11.542 -9.707 1.00 0.00 H new ATOM 1361 N LEU A 561 5.064 8.984 -10.746 1.00 0.00 N ATOM 1362 CA LEU A 561 4.225 7.818 -11.004 1.00 0.00 C ATOM 1363 C LEU A 561 2.925 7.897 -10.210 1.00 0.00 C ATOM 1364 O LEU A 561 1.862 8.172 -10.766 1.00 0.00 O ATOM 1365 CB LEU A 561 4.977 6.535 -10.647 1.00 0.00 C ATOM 1366 CG LEU A 561 6.201 6.213 -11.506 1.00 0.00 C ATOM 1367 CD1 LEU A 561 6.938 5.004 -10.952 1.00 0.00 C ATOM 1368 CD2 LEU A 561 5.790 5.974 -12.951 1.00 0.00 C ATOM 0 H LEU A 561 5.637 8.913 -9.905 1.00 0.00 H new ATOM 0 HA LEU A 561 3.980 7.805 -12.066 1.00 0.00 H new ATOM 0 HB2 LEU A 561 5.296 6.602 -9.607 1.00 0.00 H new ATOM 0 HB3 LEU A 561 4.281 5.699 -10.714 1.00 0.00 H new ATOM 0 HG LEU A 561 6.876 7.068 -11.478 1.00 0.00 H new ATOM 0 HD11 LEU A 561 7.806 4.790 -11.576 1.00 0.00 H new ATOM 0 HD12 LEU A 561 7.266 5.213 -9.934 1.00 0.00 H new ATOM 0 HD13 LEU A 561 6.271 4.142 -10.949 1.00 0.00 H new ATOM 0 HD21 LEU A 561 6.673 5.746 -13.548 1.00 0.00 H new ATOM 0 HD22 LEU A 561 5.095 5.136 -12.998 1.00 0.00 H new ATOM 0 HD23 LEU A 561 5.307 6.868 -13.345 1.00 0.00 H new ATOM 1380 N VAL A 562 3.019 7.656 -8.906 1.00 0.00 N ATOM 1381 CA VAL A 562 1.851 7.703 -8.034 1.00 0.00 C ATOM 1382 C VAL A 562 0.907 8.829 -8.440 1.00 0.00 C ATOM 1383 O VAL A 562 -0.314 8.676 -8.396 1.00 0.00 O ATOM 1384 CB VAL A 562 2.257 7.894 -6.561 1.00 0.00 C ATOM 1385 CG1 VAL A 562 1.026 8.075 -5.686 1.00 0.00 C ATOM 1386 CG2 VAL A 562 3.094 6.717 -6.082 1.00 0.00 C ATOM 0 H VAL A 562 3.892 7.426 -8.430 1.00 0.00 H new ATOM 0 HA VAL A 562 1.338 6.747 -8.140 1.00 0.00 H new ATOM 0 HB VAL A 562 2.863 8.797 -6.484 1.00 0.00 H new ATOM 0 HG11 VAL A 562 1.333 8.208 -4.649 1.00 0.00 H new ATOM 0 HG12 VAL A 562 0.471 8.953 -6.016 1.00 0.00 H new ATOM 0 HG13 VAL A 562 0.390 7.193 -5.765 1.00 0.00 H new ATOM 0 HG21 VAL A 562 3.372 6.869 -5.039 1.00 0.00 H new ATOM 0 HG22 VAL A 562 2.515 5.798 -6.173 1.00 0.00 H new ATOM 0 HG23 VAL A 562 3.995 6.640 -6.690 1.00 0.00 H new ATOM 1396 N ARG A 563 1.480 9.960 -8.837 1.00 0.00 N ATOM 1397 CA ARG A 563 0.690 11.113 -9.250 1.00 0.00 C ATOM 1398 C ARG A 563 0.044 10.870 -10.611 1.00 0.00 C ATOM 1399 O ARG A 563 -1.123 11.199 -10.822 1.00 0.00 O ATOM 1400 CB ARG A 563 1.567 12.366 -9.307 1.00 0.00 C ATOM 1401 CG ARG A 563 0.777 13.656 -9.457 1.00 0.00 C ATOM 1402 CD ARG A 563 0.314 14.185 -8.109 1.00 0.00 C ATOM 1403 NE ARG A 563 -0.364 15.473 -8.230 1.00 0.00 N ATOM 1404 CZ ARG A 563 -0.596 16.280 -7.201 1.00 0.00 C ATOM 1405 NH1 ARG A 563 -0.207 15.935 -5.981 1.00 0.00 N ATOM 1406 NH2 ARG A 563 -1.218 17.437 -7.391 1.00 0.00 N ATOM 0 H ARG A 563 2.489 10.102 -8.881 1.00 0.00 H new ATOM 0 HA ARG A 563 -0.099 11.263 -8.513 1.00 0.00 H new ATOM 0 HB2 ARG A 563 2.167 12.421 -8.399 1.00 0.00 H new ATOM 0 HB3 ARG A 563 2.261 12.276 -10.143 1.00 0.00 H new ATOM 0 HG2 ARG A 563 1.394 14.406 -9.951 1.00 0.00 H new ATOM 0 HG3 ARG A 563 -0.088 13.482 -10.097 1.00 0.00 H new ATOM 0 HD2 ARG A 563 -0.360 13.463 -7.648 1.00 0.00 H new ATOM 0 HD3 ARG A 563 1.173 14.288 -7.446 1.00 0.00 H new ATOM 0 HE ARG A 563 -0.676 15.769 -9.155 1.00 0.00 H new ATOM 0 HH11 ARG A 563 0.272 15.047 -5.830 1.00 0.00 H new ATOM 0 HH12 ARG A 563 -0.387 16.557 -5.193 1.00 0.00 H new ATOM 0 HH21 ARG A 563 -1.518 17.707 -8.328 1.00 0.00 H new ATOM 0 HH22 ARG A 563 -1.396 18.056 -6.600 1.00 0.00 H new ATOM 1420 N GLN A 564 0.810 10.291 -11.529 1.00 0.00 N ATOM 1421 CA GLN A 564 0.312 10.005 -12.869 1.00 0.00 C ATOM 1422 C GLN A 564 -0.797 8.959 -12.826 1.00 0.00 C ATOM 1423 O GLN A 564 -1.859 9.144 -13.420 1.00 0.00 O ATOM 1424 CB GLN A 564 1.452 9.519 -13.767 1.00 0.00 C ATOM 1425 CG GLN A 564 1.003 9.146 -15.171 1.00 0.00 C ATOM 1426 CD GLN A 564 2.147 9.142 -16.167 1.00 0.00 C ATOM 1427 OE1 GLN A 564 2.076 9.786 -17.213 1.00 0.00 O ATOM 1428 NE2 GLN A 564 3.209 8.413 -15.845 1.00 0.00 N ATOM 0 H GLN A 564 1.778 10.011 -11.370 1.00 0.00 H new ATOM 0 HA GLN A 564 -0.098 10.927 -13.281 1.00 0.00 H new ATOM 0 HB2 GLN A 564 2.210 10.299 -13.832 1.00 0.00 H new ATOM 0 HB3 GLN A 564 1.925 8.653 -13.304 1.00 0.00 H new ATOM 0 HG2 GLN A 564 0.540 8.159 -15.150 1.00 0.00 H new ATOM 0 HG3 GLN A 564 0.239 9.849 -15.503 1.00 0.00 H new ATOM 0 HE21 GLN A 564 3.225 7.895 -14.967 1.00 0.00 H new ATOM 0 HE22 GLN A 564 4.009 8.371 -16.476 1.00 0.00 H new ATOM 1437 N GLN A 565 -0.543 7.863 -12.119 1.00 0.00 N ATOM 1438 CA GLN A 565 -1.521 6.788 -12.000 1.00 0.00 C ATOM 1439 C GLN A 565 -2.270 6.878 -10.675 1.00 0.00 C ATOM 1440 O GLN A 565 -2.786 5.879 -10.173 1.00 0.00 O ATOM 1441 CB GLN A 565 -0.831 5.427 -12.118 1.00 0.00 C ATOM 1442 CG GLN A 565 0.032 5.288 -13.361 1.00 0.00 C ATOM 1443 CD GLN A 565 -0.749 4.789 -14.561 1.00 0.00 C ATOM 1444 OE1 GLN A 565 -1.539 5.525 -15.152 1.00 0.00 O ATOM 1445 NE2 GLN A 565 -0.532 3.531 -14.927 1.00 0.00 N ATOM 0 H GLN A 565 0.331 7.696 -11.620 1.00 0.00 H new ATOM 0 HA GLN A 565 -2.241 6.894 -12.811 1.00 0.00 H new ATOM 0 HB2 GLN A 565 -0.211 5.265 -11.236 1.00 0.00 H new ATOM 0 HB3 GLN A 565 -1.589 4.644 -12.123 1.00 0.00 H new ATOM 0 HG2 GLN A 565 0.478 6.254 -13.599 1.00 0.00 H new ATOM 0 HG3 GLN A 565 0.852 4.600 -13.154 1.00 0.00 H new ATOM 0 HE21 GLN A 565 0.132 2.956 -14.408 1.00 0.00 H new ATOM 0 HE22 GLN A 565 -1.029 3.140 -15.727 1.00 0.00 H new ATOM 1454 N ILE A 566 -2.325 8.081 -10.113 1.00 0.00 N ATOM 1455 CA ILE A 566 -3.012 8.301 -8.846 1.00 0.00 C ATOM 1456 C ILE A 566 -4.443 7.777 -8.899 1.00 0.00 C ATOM 1457 O ILE A 566 -4.968 7.277 -7.905 1.00 0.00 O ATOM 1458 CB ILE A 566 -3.038 9.795 -8.472 1.00 0.00 C ATOM 1459 CG1 ILE A 566 -3.697 9.989 -7.105 1.00 0.00 C ATOM 1460 CG2 ILE A 566 -3.771 10.595 -9.538 1.00 0.00 C ATOM 1461 CD1 ILE A 566 -3.103 9.120 -6.019 1.00 0.00 C ATOM 0 H ILE A 566 -1.902 8.918 -10.515 1.00 0.00 H new ATOM 0 HA ILE A 566 -2.455 7.754 -8.085 1.00 0.00 H new ATOM 0 HB ILE A 566 -2.012 10.158 -8.415 1.00 0.00 H new ATOM 0 HG12 ILE A 566 -3.606 11.035 -6.812 1.00 0.00 H new ATOM 0 HG13 ILE A 566 -4.762 9.773 -7.190 1.00 0.00 H new ATOM 0 HG21 ILE A 566 -3.781 11.649 -9.259 1.00 0.00 H new ATOM 0 HG22 ILE A 566 -3.263 10.477 -10.495 1.00 0.00 H new ATOM 0 HG23 ILE A 566 -4.795 10.233 -9.625 1.00 0.00 H new ATOM 0 HD11 ILE A 566 -3.619 9.310 -5.078 1.00 0.00 H new ATOM 0 HD12 ILE A 566 -3.217 8.070 -6.290 1.00 0.00 H new ATOM 0 HD13 ILE A 566 -2.044 9.352 -5.906 1.00 0.00 H new ATOM 1473 N ASN A 567 -5.068 7.894 -10.066 1.00 0.00 N ATOM 1474 CA ASN A 567 -6.439 7.430 -10.249 1.00 0.00 C ATOM 1475 C ASN A 567 -6.545 5.931 -9.989 1.00 0.00 C ATOM 1476 O ASN A 567 -7.423 5.480 -9.253 1.00 0.00 O ATOM 1477 CB ASN A 567 -6.922 7.749 -11.665 1.00 0.00 C ATOM 1478 CG ASN A 567 -6.619 9.179 -12.071 1.00 0.00 C ATOM 1479 OD1 ASN A 567 -6.948 10.123 -11.353 1.00 0.00 O ATOM 1480 ND2 ASN A 567 -5.990 9.344 -13.229 1.00 0.00 N ATOM 0 H ASN A 567 -4.647 8.306 -10.899 1.00 0.00 H new ATOM 0 HA ASN A 567 -7.072 7.951 -9.530 1.00 0.00 H new ATOM 0 HB2 ASN A 567 -6.448 7.066 -12.370 1.00 0.00 H new ATOM 0 HB3 ASN A 567 -7.996 7.576 -11.727 1.00 0.00 H new ATOM 0 HD21 ASN A 567 -5.761 10.283 -13.556 1.00 0.00 H new ATOM 0 HD22 ASN A 567 -5.736 8.532 -13.792 1.00 0.00 H new ATOM 1487 N GLU A 568 -5.645 5.165 -10.597 1.00 0.00 N ATOM 1488 CA GLU A 568 -5.639 3.716 -10.430 1.00 0.00 C ATOM 1489 C GLU A 568 -5.432 3.337 -8.967 1.00 0.00 C ATOM 1490 O GLU A 568 -6.196 2.553 -8.404 1.00 0.00 O ATOM 1491 CB GLU A 568 -4.541 3.087 -11.291 1.00 0.00 C ATOM 1492 CG GLU A 568 -4.403 1.586 -11.099 1.00 0.00 C ATOM 1493 CD GLU A 568 -5.435 0.799 -11.884 1.00 0.00 C ATOM 1494 OE1 GLU A 568 -6.636 1.123 -11.775 1.00 0.00 O ATOM 1495 OE2 GLU A 568 -5.041 -0.140 -12.606 1.00 0.00 O ATOM 0 H GLU A 568 -4.911 5.523 -11.209 1.00 0.00 H new ATOM 0 HA GLU A 568 -6.608 3.335 -10.752 1.00 0.00 H new ATOM 0 HB2 GLU A 568 -4.751 3.293 -12.341 1.00 0.00 H new ATOM 0 HB3 GLU A 568 -3.589 3.564 -11.057 1.00 0.00 H new ATOM 0 HG2 GLU A 568 -3.404 1.275 -11.405 1.00 0.00 H new ATOM 0 HG3 GLU A 568 -4.500 1.349 -10.040 1.00 0.00 H new ATOM 1502 N MET A 569 -4.394 3.900 -8.357 1.00 0.00 N ATOM 1503 CA MET A 569 -4.087 3.622 -6.958 1.00 0.00 C ATOM 1504 C MET A 569 -5.315 3.838 -6.079 1.00 0.00 C ATOM 1505 O MET A 569 -5.707 2.955 -5.316 1.00 0.00 O ATOM 1506 CB MET A 569 -2.939 4.512 -6.479 1.00 0.00 C ATOM 1507 CG MET A 569 -1.685 4.397 -7.330 1.00 0.00 C ATOM 1508 SD MET A 569 -0.256 5.193 -6.572 1.00 0.00 S ATOM 1509 CE MET A 569 0.408 3.843 -5.600 1.00 0.00 C ATOM 0 H MET A 569 -3.752 4.551 -8.809 1.00 0.00 H new ATOM 0 HA MET A 569 -3.784 2.578 -6.879 1.00 0.00 H new ATOM 0 HB2 MET A 569 -3.272 5.550 -6.476 1.00 0.00 H new ATOM 0 HB3 MET A 569 -2.694 4.252 -5.449 1.00 0.00 H new ATOM 0 HG2 MET A 569 -1.462 3.344 -7.500 1.00 0.00 H new ATOM 0 HG3 MET A 569 -1.871 4.845 -8.306 1.00 0.00 H new ATOM 0 HE1 MET A 569 0.207 4.022 -4.544 1.00 0.00 H new ATOM 0 HE2 MET A 569 -0.063 2.909 -5.906 1.00 0.00 H new ATOM 0 HE3 MET A 569 1.484 3.776 -5.758 1.00 0.00 H new ATOM 1519 N HIS A 570 -5.917 5.018 -6.191 1.00 0.00 N ATOM 1520 CA HIS A 570 -7.101 5.349 -5.405 1.00 0.00 C ATOM 1521 C HIS A 570 -8.161 4.260 -5.535 1.00 0.00 C ATOM 1522 O HIS A 570 -8.713 3.795 -4.537 1.00 0.00 O ATOM 1523 CB HIS A 570 -7.676 6.693 -5.854 1.00 0.00 C ATOM 1524 CG HIS A 570 -9.067 6.944 -5.359 1.00 0.00 C ATOM 1525 ND1 HIS A 570 -9.977 7.729 -6.036 1.00 0.00 N ATOM 1526 CD2 HIS A 570 -9.704 6.507 -4.247 1.00 0.00 C ATOM 1527 CE1 HIS A 570 -11.112 7.765 -5.362 1.00 0.00 C ATOM 1528 NE2 HIS A 570 -10.973 7.031 -4.272 1.00 0.00 N ATOM 0 H HIS A 570 -5.605 5.760 -6.817 1.00 0.00 H new ATOM 0 HA HIS A 570 -6.805 5.420 -4.358 1.00 0.00 H new ATOM 0 HB2 HIS A 570 -7.024 7.493 -5.503 1.00 0.00 H new ATOM 0 HB3 HIS A 570 -7.674 6.734 -6.943 1.00 0.00 H new ATOM 0 HD2 HIS A 570 -9.291 5.866 -3.483 1.00 0.00 H new ATOM 0 HE1 HIS A 570 -12.002 8.303 -5.652 1.00 0.00 H new ATOM 0 HE2 HIS A 570 -11.692 6.878 -3.564 1.00 0.00 H new ATOM 1536 N LEU A 571 -8.442 3.859 -6.769 1.00 0.00 N ATOM 1537 CA LEU A 571 -9.437 2.824 -7.029 1.00 0.00 C ATOM 1538 C LEU A 571 -9.151 1.573 -6.205 1.00 0.00 C ATOM 1539 O LEU A 571 -10.055 0.994 -5.601 1.00 0.00 O ATOM 1540 CB LEU A 571 -9.459 2.473 -8.518 1.00 0.00 C ATOM 1541 CG LEU A 571 -10.031 3.541 -9.451 1.00 0.00 C ATOM 1542 CD1 LEU A 571 -9.774 3.173 -10.904 1.00 0.00 C ATOM 1543 CD2 LEU A 571 -11.521 3.724 -9.202 1.00 0.00 C ATOM 0 H LEU A 571 -7.995 4.234 -7.606 1.00 0.00 H new ATOM 0 HA LEU A 571 -10.413 3.212 -6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 571 -8.439 2.252 -8.834 1.00 0.00 H new ATOM 0 HB3 LEU A 571 -10.038 1.559 -8.647 1.00 0.00 H new ATOM 0 HG LEU A 571 -9.529 4.486 -9.242 1.00 0.00 H new ATOM 0 HD11 LEU A 571 -10.188 3.944 -11.553 1.00 0.00 H new ATOM 0 HD12 LEU A 571 -8.700 3.093 -11.075 1.00 0.00 H new ATOM 0 HD13 LEU A 571 -10.249 2.218 -11.127 1.00 0.00 H new ATOM 0 HD21 LEU A 571 -11.911 4.488 -9.875 1.00 0.00 H new ATOM 0 HD22 LEU A 571 -12.039 2.782 -9.383 1.00 0.00 H new ATOM 0 HD23 LEU A 571 -11.682 4.034 -8.169 1.00 0.00 H new ATOM 1555 N LEU A 572 -7.888 1.163 -6.181 1.00 0.00 N ATOM 1556 CA LEU A 572 -7.481 -0.018 -5.428 1.00 0.00 C ATOM 1557 C LEU A 572 -7.851 0.121 -3.954 1.00 0.00 C ATOM 1558 O LEU A 572 -8.425 -0.791 -3.359 1.00 0.00 O ATOM 1559 CB LEU A 572 -5.975 -0.243 -5.568 1.00 0.00 C ATOM 1560 CG LEU A 572 -5.436 -0.307 -6.998 1.00 0.00 C ATOM 1561 CD1 LEU A 572 -3.918 -0.398 -6.993 1.00 0.00 C ATOM 1562 CD2 LEU A 572 -6.040 -1.489 -7.743 1.00 0.00 C ATOM 0 H LEU A 572 -7.128 1.631 -6.674 1.00 0.00 H new ATOM 0 HA LEU A 572 -8.010 -0.879 -5.837 1.00 0.00 H new ATOM 0 HB2 LEU A 572 -5.458 0.559 -5.042 1.00 0.00 H new ATOM 0 HB3 LEU A 572 -5.718 -1.174 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 572 -5.723 0.609 -7.515 1.00 0.00 H new ATOM 0 HD11 LEU A 572 -3.553 -0.443 -8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 572 -3.503 0.480 -6.498 1.00 0.00 H new ATOM 0 HD13 LEU A 572 -3.609 -1.296 -6.459 1.00 0.00 H new ATOM 0 HD21 LEU A 572 -5.645 -1.519 -8.759 1.00 0.00 H new ATOM 0 HD22 LEU A 572 -5.784 -2.414 -7.227 1.00 0.00 H new ATOM 0 HD23 LEU A 572 -7.124 -1.381 -7.778 1.00 0.00 H new ATOM 1574 N ILE A 573 -7.519 1.269 -3.373 1.00 0.00 N ATOM 1575 CA ILE A 573 -7.820 1.529 -1.971 1.00 0.00 C ATOM 1576 C ILE A 573 -9.307 1.349 -1.684 1.00 0.00 C ATOM 1577 O ILE A 573 -9.687 0.807 -0.647 1.00 0.00 O ATOM 1578 CB ILE A 573 -7.397 2.952 -1.559 1.00 0.00 C ATOM 1579 CG1 ILE A 573 -5.912 3.172 -1.852 1.00 0.00 C ATOM 1580 CG2 ILE A 573 -7.692 3.186 -0.085 1.00 0.00 C ATOM 1581 CD1 ILE A 573 -5.007 2.166 -1.176 1.00 0.00 C ATOM 0 H ILE A 573 -7.042 2.033 -3.851 1.00 0.00 H new ATOM 0 HA ILE A 573 -7.251 0.806 -1.387 1.00 0.00 H new ATOM 0 HB ILE A 573 -7.973 3.670 -2.143 1.00 0.00 H new ATOM 0 HG12 ILE A 573 -5.752 3.126 -2.929 1.00 0.00 H new ATOM 0 HG13 ILE A 573 -5.631 4.175 -1.530 1.00 0.00 H new ATOM 0 HG21 ILE A 573 -7.388 4.196 0.191 1.00 0.00 H new ATOM 0 HG22 ILE A 573 -8.760 3.067 0.096 1.00 0.00 H new ATOM 0 HG23 ILE A 573 -7.140 2.463 0.516 1.00 0.00 H new ATOM 0 HD11 ILE A 573 -3.969 2.383 -1.428 1.00 0.00 H new ATOM 0 HD12 ILE A 573 -5.138 2.227 -0.096 1.00 0.00 H new ATOM 0 HD13 ILE A 573 -5.261 1.162 -1.516 1.00 0.00 H new ATOM 1593 N GLN A 574 -10.142 1.807 -2.611 1.00 0.00 N ATOM 1594 CA GLN A 574 -11.587 1.696 -2.458 1.00 0.00 C ATOM 1595 C GLN A 574 -12.032 0.238 -2.530 1.00 0.00 C ATOM 1596 O GLN A 574 -12.942 -0.178 -1.814 1.00 0.00 O ATOM 1597 CB GLN A 574 -12.300 2.512 -3.538 1.00 0.00 C ATOM 1598 CG GLN A 574 -11.957 3.993 -3.507 1.00 0.00 C ATOM 1599 CD GLN A 574 -12.832 4.774 -2.546 1.00 0.00 C ATOM 1600 OE1 GLN A 574 -12.625 4.563 -1.252 1.00 0.00 O flip ATOM 1601 NE2 GLN A 574 -13.684 5.559 -2.963 1.00 0.00 N flip ATOM 0 H GLN A 574 -9.842 2.258 -3.475 1.00 0.00 H new ATOM 0 HA GLN A 574 -11.854 2.091 -1.478 1.00 0.00 H new ATOM 0 HB2 GLN A 574 -12.042 2.108 -4.517 1.00 0.00 H new ATOM 0 HB3 GLN A 574 -13.377 2.394 -3.419 1.00 0.00 H new ATOM 0 HG2 GLN A 574 -10.912 4.114 -3.222 1.00 0.00 H new ATOM 0 HG3 GLN A 574 -12.064 4.408 -4.509 1.00 0.00 H new ATOM 0 HE21 GLN A 574 -13.809 5.690 -3.967 1.00 0.00 H new ATOM 0 HE22 GLN A 574 -14.265 6.078 -2.305 1.00 0.00 H new ATOM 1610 N GLN A 575 -11.383 -0.531 -3.398 1.00 0.00 N ATOM 1611 CA GLN A 575 -11.713 -1.941 -3.564 1.00 0.00 C ATOM 1612 C GLN A 575 -11.450 -2.716 -2.276 1.00 0.00 C ATOM 1613 O GLN A 575 -12.228 -3.591 -1.898 1.00 0.00 O ATOM 1614 CB GLN A 575 -10.901 -2.546 -4.711 1.00 0.00 C ATOM 1615 CG GLN A 575 -11.291 -2.011 -6.080 1.00 0.00 C ATOM 1616 CD GLN A 575 -10.602 -2.746 -7.212 1.00 0.00 C ATOM 1617 OE1 GLN A 575 -9.735 -2.193 -7.889 1.00 0.00 O ATOM 1618 NE2 GLN A 575 -10.983 -4.000 -7.423 1.00 0.00 N ATOM 0 H GLN A 575 -10.626 -0.201 -3.997 1.00 0.00 H new ATOM 0 HA GLN A 575 -12.774 -2.014 -3.802 1.00 0.00 H new ATOM 0 HB2 GLN A 575 -9.843 -2.348 -4.540 1.00 0.00 H new ATOM 0 HB3 GLN A 575 -11.028 -3.629 -4.703 1.00 0.00 H new ATOM 0 HG2 GLN A 575 -12.371 -2.092 -6.203 1.00 0.00 H new ATOM 0 HG3 GLN A 575 -11.043 -0.951 -6.136 1.00 0.00 H new ATOM 0 HE21 GLN A 575 -11.706 -4.419 -6.838 1.00 0.00 H new ATOM 0 HE22 GLN A 575 -10.553 -4.545 -8.171 1.00 0.00 H new ATOM 1627 N ALA A 576 -10.349 -2.388 -1.608 1.00 0.00 N ATOM 1628 CA ALA A 576 -9.985 -3.052 -0.363 1.00 0.00 C ATOM 1629 C ALA A 576 -10.963 -2.701 0.753 1.00 0.00 C ATOM 1630 O ALA A 576 -11.364 -3.564 1.534 1.00 0.00 O ATOM 1631 CB ALA A 576 -8.566 -2.679 0.039 1.00 0.00 C ATOM 0 H ALA A 576 -9.694 -1.666 -1.908 1.00 0.00 H new ATOM 0 HA ALA A 576 -10.033 -4.129 -0.527 1.00 0.00 H new ATOM 0 HB1 ALA A 576 -8.308 -3.182 0.971 1.00 0.00 H new ATOM 0 HB2 ALA A 576 -7.873 -2.987 -0.744 1.00 0.00 H new ATOM 0 HB3 ALA A 576 -8.499 -1.600 0.179 1.00 0.00 H new ATOM 1637 N ARG A 577 -11.341 -1.429 0.822 1.00 0.00 N ATOM 1638 CA ARG A 577 -12.271 -0.963 1.844 1.00 0.00 C ATOM 1639 C ARG A 577 -13.681 -1.480 1.573 1.00 0.00 C ATOM 1640 O ARG A 577 -14.398 -1.868 2.495 1.00 0.00 O ATOM 1641 CB ARG A 577 -12.278 0.566 1.899 1.00 0.00 C ATOM 1642 CG ARG A 577 -11.049 1.157 2.570 1.00 0.00 C ATOM 1643 CD ARG A 577 -11.340 2.531 3.153 1.00 0.00 C ATOM 1644 NE ARG A 577 -12.328 2.473 4.226 1.00 0.00 N ATOM 1645 CZ ARG A 577 -12.887 3.549 4.770 1.00 0.00 C ATOM 1646 NH1 ARG A 577 -12.556 4.760 4.342 1.00 0.00 N ATOM 1647 NH2 ARG A 577 -13.779 3.415 5.743 1.00 0.00 N ATOM 0 H ARG A 577 -11.018 -0.703 0.183 1.00 0.00 H new ATOM 0 HA ARG A 577 -11.939 -1.353 2.806 1.00 0.00 H new ATOM 0 HB2 ARG A 577 -12.351 0.957 0.884 1.00 0.00 H new ATOM 0 HB3 ARG A 577 -13.168 0.898 2.433 1.00 0.00 H new ATOM 0 HG2 ARG A 577 -10.709 0.489 3.361 1.00 0.00 H new ATOM 0 HG3 ARG A 577 -10.238 1.232 1.846 1.00 0.00 H new ATOM 0 HD2 ARG A 577 -10.416 2.966 3.534 1.00 0.00 H new ATOM 0 HD3 ARG A 577 -11.701 3.191 2.364 1.00 0.00 H new ATOM 0 HE ARG A 577 -12.605 1.556 4.578 1.00 0.00 H new ATOM 0 HH11 ARG A 577 -11.871 4.867 3.594 1.00 0.00 H new ATOM 0 HH12 ARG A 577 -12.986 5.584 4.761 1.00 0.00 H new ATOM 0 HH21 ARG A 577 -14.036 2.485 6.074 1.00 0.00 H new ATOM 0 HH22 ARG A 577 -14.207 4.242 6.160 1.00 0.00 H new ATOM 1661 N GLU A 578 -14.071 -1.481 0.302 1.00 0.00 N ATOM 1662 CA GLU A 578 -15.395 -1.948 -0.090 1.00 0.00 C ATOM 1663 C GLU A 578 -15.795 -3.184 0.711 1.00 0.00 C ATOM 1664 O GLU A 578 -16.881 -3.238 1.288 1.00 0.00 O ATOM 1665 CB GLU A 578 -15.427 -2.265 -1.586 1.00 0.00 C ATOM 1666 CG GLU A 578 -15.823 -1.080 -2.451 1.00 0.00 C ATOM 1667 CD GLU A 578 -15.940 -1.442 -3.919 1.00 0.00 C ATOM 1668 OE1 GLU A 578 -14.904 -1.772 -4.534 1.00 0.00 O ATOM 1669 OE2 GLU A 578 -17.068 -1.396 -4.453 1.00 0.00 O ATOM 0 H GLU A 578 -13.489 -1.164 -0.473 1.00 0.00 H new ATOM 0 HA GLU A 578 -16.109 -1.152 0.121 1.00 0.00 H new ATOM 0 HB2 GLU A 578 -14.443 -2.617 -1.895 1.00 0.00 H new ATOM 0 HB3 GLU A 578 -16.127 -3.082 -1.761 1.00 0.00 H new ATOM 0 HG2 GLU A 578 -16.776 -0.682 -2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 578 -15.085 -0.287 -2.334 1.00 0.00 H new ATOM 1676 N MET A 579 -14.909 -4.174 0.741 1.00 0.00 N ATOM 1677 CA MET A 579 -15.169 -5.410 1.472 1.00 0.00 C ATOM 1678 C MET A 579 -15.120 -5.171 2.978 1.00 0.00 C ATOM 1679 O MET A 579 -14.368 -4.332 3.474 1.00 0.00 O ATOM 1680 CB MET A 579 -14.150 -6.482 1.081 1.00 0.00 C ATOM 1681 CG MET A 579 -12.707 -6.019 1.190 1.00 0.00 C ATOM 1682 SD MET A 579 -11.537 -7.390 1.216 1.00 0.00 S ATOM 1683 CE MET A 579 -11.942 -8.152 2.786 1.00 0.00 C ATOM 0 H MET A 579 -14.006 -4.145 0.268 1.00 0.00 H new ATOM 0 HA MET A 579 -16.169 -5.756 1.209 1.00 0.00 H new ATOM 0 HB2 MET A 579 -14.292 -7.355 1.718 1.00 0.00 H new ATOM 0 HB3 MET A 579 -14.344 -6.800 0.057 1.00 0.00 H new ATOM 0 HG2 MET A 579 -12.475 -5.365 0.350 1.00 0.00 H new ATOM 0 HG3 MET A 579 -12.587 -5.427 2.097 1.00 0.00 H new ATOM 0 HE1 MET A 579 -11.163 -8.865 3.056 1.00 0.00 H new ATOM 0 HE2 MET A 579 -12.013 -7.384 3.556 1.00 0.00 H new ATOM 0 HE3 MET A 579 -12.897 -8.671 2.703 1.00 0.00 H new ATOM 1693 N PRO A 580 -15.941 -5.925 3.724 1.00 0.00 N ATOM 1694 CA PRO A 580 -16.010 -5.813 5.184 1.00 0.00 C ATOM 1695 C PRO A 580 -14.750 -6.337 5.865 1.00 0.00 C ATOM 1696 O PRO A 580 -13.798 -6.749 5.201 1.00 0.00 O ATOM 1697 CB PRO A 580 -17.216 -6.681 5.550 1.00 0.00 C ATOM 1698 CG PRO A 580 -17.326 -7.665 4.437 1.00 0.00 C ATOM 1699 CD PRO A 580 -16.865 -6.944 3.200 1.00 0.00 C ATOM 0 HA PRO A 580 -16.099 -4.777 5.510 1.00 0.00 H new ATOM 0 HB2 PRO A 580 -17.068 -7.181 6.507 1.00 0.00 H new ATOM 0 HB3 PRO A 580 -18.122 -6.082 5.640 1.00 0.00 H new ATOM 0 HG2 PRO A 580 -16.709 -8.543 4.630 1.00 0.00 H new ATOM 0 HG3 PRO A 580 -18.352 -8.015 4.325 1.00 0.00 H new ATOM 0 HD2 PRO A 580 -16.367 -7.619 2.504 1.00 0.00 H new ATOM 0 HD3 PRO A 580 -17.699 -6.492 2.664 1.00 0.00 H new ATOM 1707 N LEU A 581 -14.751 -6.319 7.194 1.00 0.00 N ATOM 1708 CA LEU A 581 -13.607 -6.793 7.966 1.00 0.00 C ATOM 1709 C LEU A 581 -13.872 -8.184 8.533 1.00 0.00 C ATOM 1710 O LEU A 581 -14.766 -8.369 9.360 1.00 0.00 O ATOM 1711 CB LEU A 581 -13.294 -5.817 9.102 1.00 0.00 C ATOM 1712 CG LEU A 581 -12.741 -4.455 8.683 1.00 0.00 C ATOM 1713 CD1 LEU A 581 -13.136 -3.386 9.691 1.00 0.00 C ATOM 1714 CD2 LEU A 581 -11.228 -4.516 8.533 1.00 0.00 C ATOM 0 H LEU A 581 -15.530 -5.982 7.759 1.00 0.00 H new ATOM 0 HA LEU A 581 -12.747 -6.851 7.298 1.00 0.00 H new ATOM 0 HB2 LEU A 581 -14.206 -5.655 9.677 1.00 0.00 H new ATOM 0 HB3 LEU A 581 -12.575 -6.289 9.771 1.00 0.00 H new ATOM 0 HG LEU A 581 -13.171 -4.192 7.717 1.00 0.00 H new ATOM 0 HD11 LEU A 581 -12.734 -2.423 9.377 1.00 0.00 H new ATOM 0 HD12 LEU A 581 -14.223 -3.324 9.749 1.00 0.00 H new ATOM 0 HD13 LEU A 581 -12.735 -3.644 10.671 1.00 0.00 H new ATOM 0 HD21 LEU A 581 -10.852 -3.537 8.234 1.00 0.00 H new ATOM 0 HD22 LEU A 581 -10.779 -4.802 9.484 1.00 0.00 H new ATOM 0 HD23 LEU A 581 -10.967 -5.252 7.773 1.00 0.00 H new ATOM 1726 N LEU A 582 -13.089 -9.158 8.085 1.00 0.00 N ATOM 1727 CA LEU A 582 -13.237 -10.533 8.550 1.00 0.00 C ATOM 1728 C LEU A 582 -12.563 -10.726 9.904 1.00 0.00 C ATOM 1729 O LEU A 582 -11.892 -9.825 10.411 1.00 0.00 O ATOM 1730 CB LEU A 582 -12.642 -11.504 7.529 1.00 0.00 C ATOM 1731 CG LEU A 582 -13.163 -11.376 6.097 1.00 0.00 C ATOM 1732 CD1 LEU A 582 -12.379 -12.282 5.160 1.00 0.00 C ATOM 1733 CD2 LEU A 582 -14.648 -11.703 6.039 1.00 0.00 C ATOM 0 H LEU A 582 -12.345 -9.022 7.400 1.00 0.00 H new ATOM 0 HA LEU A 582 -14.301 -10.740 8.662 1.00 0.00 H new ATOM 0 HB2 LEU A 582 -11.561 -11.367 7.514 1.00 0.00 H new ATOM 0 HB3 LEU A 582 -12.830 -12.521 7.873 1.00 0.00 H new ATOM 0 HG LEU A 582 -13.025 -10.345 5.772 1.00 0.00 H new ATOM 0 HD11 LEU A 582 -12.764 -12.177 4.146 1.00 0.00 H new ATOM 0 HD12 LEU A 582 -11.326 -12.001 5.179 1.00 0.00 H new ATOM 0 HD13 LEU A 582 -12.484 -13.318 5.483 1.00 0.00 H new ATOM 0 HD21 LEU A 582 -15.002 -11.607 5.013 1.00 0.00 H new ATOM 0 HD22 LEU A 582 -14.809 -12.724 6.384 1.00 0.00 H new ATOM 0 HD23 LEU A 582 -15.198 -11.013 6.679 1.00 0.00 H new ATOM 1745 N LYS A 583 -12.743 -11.907 10.487 1.00 0.00 N ATOM 1746 CA LYS A 583 -12.150 -12.220 11.781 1.00 0.00 C ATOM 1747 C LYS A 583 -10.674 -11.838 11.811 1.00 0.00 C ATOM 1748 O LYS A 583 -10.029 -11.732 10.767 1.00 0.00 O ATOM 1749 CB LYS A 583 -12.308 -13.711 12.090 1.00 0.00 C ATOM 1750 CG LYS A 583 -13.671 -14.075 12.653 1.00 0.00 C ATOM 1751 CD LYS A 583 -13.753 -13.788 14.143 1.00 0.00 C ATOM 1752 CE LYS A 583 -15.179 -13.482 14.573 1.00 0.00 C ATOM 1753 NZ LYS A 583 -15.223 -12.760 15.875 1.00 0.00 N ATOM 0 H LYS A 583 -13.295 -12.663 10.083 1.00 0.00 H new ATOM 0 HA LYS A 583 -12.672 -11.640 12.541 1.00 0.00 H new ATOM 0 HB2 LYS A 583 -12.137 -14.283 11.178 1.00 0.00 H new ATOM 0 HB3 LYS A 583 -11.539 -14.009 12.802 1.00 0.00 H new ATOM 0 HG2 LYS A 583 -14.444 -13.512 12.130 1.00 0.00 H new ATOM 0 HG3 LYS A 583 -13.870 -15.132 12.473 1.00 0.00 H new ATOM 0 HD2 LYS A 583 -13.380 -14.647 14.701 1.00 0.00 H new ATOM 0 HD3 LYS A 583 -13.109 -12.944 14.388 1.00 0.00 H new ATOM 0 HE2 LYS A 583 -15.668 -12.880 13.807 1.00 0.00 H new ATOM 0 HE3 LYS A 583 -15.741 -14.412 14.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 583 -16.212 -12.570 16.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 583 -14.779 -13.345 16.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 583 -14.708 -11.860 15.791 1.00 0.00 H new ATOM 1767 N SER A 584 -10.144 -11.633 13.012 1.00 0.00 N ATOM 1768 CA SER A 584 -8.744 -11.260 13.177 1.00 0.00 C ATOM 1769 C SER A 584 -8.310 -11.406 14.632 1.00 0.00 C ATOM 1770 O SER A 584 -9.138 -11.608 15.520 1.00 0.00 O ATOM 1771 CB SER A 584 -8.519 -9.821 12.708 1.00 0.00 C ATOM 1772 OG SER A 584 -9.404 -8.928 13.360 1.00 0.00 O ATOM 0 H SER A 584 -10.663 -11.719 13.886 1.00 0.00 H new ATOM 0 HA SER A 584 -8.141 -11.932 12.567 1.00 0.00 H new ATOM 0 HB2 SER A 584 -7.489 -9.527 12.908 1.00 0.00 H new ATOM 0 HB3 SER A 584 -8.665 -9.760 11.630 1.00 0.00 H new ATOM 0 HG SER A 584 -9.845 -8.360 12.694 1.00 0.00 H new ATOM 1778 N GLU A 585 -7.005 -11.304 14.867 1.00 0.00 N ATOM 1779 CA GLU A 585 -6.461 -11.425 16.215 1.00 0.00 C ATOM 1780 C GLU A 585 -6.057 -10.060 16.764 1.00 0.00 C ATOM 1781 O GLU A 585 -4.909 -9.638 16.625 1.00 0.00 O ATOM 1782 CB GLU A 585 -5.255 -12.367 16.218 1.00 0.00 C ATOM 1783 CG GLU A 585 -4.773 -12.734 17.612 1.00 0.00 C ATOM 1784 CD GLU A 585 -5.829 -13.463 18.420 1.00 0.00 C ATOM 1785 OE1 GLU A 585 -6.066 -14.659 18.148 1.00 0.00 O ATOM 1786 OE2 GLU A 585 -6.419 -12.837 19.326 1.00 0.00 O ATOM 0 H GLU A 585 -6.306 -11.138 14.143 1.00 0.00 H new ATOM 0 HA GLU A 585 -7.238 -11.839 16.858 1.00 0.00 H new ATOM 0 HB2 GLU A 585 -5.516 -13.279 15.681 1.00 0.00 H new ATOM 0 HB3 GLU A 585 -4.437 -11.898 15.671 1.00 0.00 H new ATOM 0 HG2 GLU A 585 -3.885 -13.361 17.532 1.00 0.00 H new ATOM 0 HG3 GLU A 585 -4.477 -11.828 18.141 1.00 0.00 H new ATOM 1793 N VAL A 586 -7.009 -9.374 17.387 1.00 0.00 N ATOM 1794 CA VAL A 586 -6.753 -8.057 17.958 1.00 0.00 C ATOM 1795 C VAL A 586 -7.907 -7.610 18.849 1.00 0.00 C ATOM 1796 O VAL A 586 -9.071 -7.683 18.457 1.00 0.00 O ATOM 1797 CB VAL A 586 -6.531 -7.002 16.858 1.00 0.00 C ATOM 1798 CG1 VAL A 586 -7.772 -6.867 15.989 1.00 0.00 C ATOM 1799 CG2 VAL A 586 -6.152 -5.663 17.473 1.00 0.00 C ATOM 0 H VAL A 586 -7.965 -9.708 17.509 1.00 0.00 H new ATOM 0 HA VAL A 586 -5.847 -8.143 18.558 1.00 0.00 H new ATOM 0 HB VAL A 586 -5.707 -7.331 16.224 1.00 0.00 H new ATOM 0 HG11 VAL A 586 -7.596 -6.117 15.218 1.00 0.00 H new ATOM 0 HG12 VAL A 586 -7.994 -7.825 15.520 1.00 0.00 H new ATOM 0 HG13 VAL A 586 -8.617 -6.561 16.606 1.00 0.00 H new ATOM 0 HG21 VAL A 586 -5.999 -4.929 16.682 1.00 0.00 H new ATOM 0 HG22 VAL A 586 -6.953 -5.325 18.131 1.00 0.00 H new ATOM 0 HG23 VAL A 586 -5.233 -5.774 18.048 1.00 0.00 H new ATOM 1809 N ALA A 587 -7.575 -7.148 20.050 1.00 0.00 N ATOM 1810 CA ALA A 587 -8.584 -6.687 20.996 1.00 0.00 C ATOM 1811 C ALA A 587 -8.451 -5.189 21.253 1.00 0.00 C ATOM 1812 O ALA A 587 -7.580 -4.754 22.006 1.00 0.00 O ATOM 1813 CB ALA A 587 -8.475 -7.460 22.301 1.00 0.00 C ATOM 0 H ALA A 587 -6.616 -7.083 20.391 1.00 0.00 H new ATOM 0 HA ALA A 587 -9.566 -6.869 20.560 1.00 0.00 H new ATOM 0 HB1 ALA A 587 -9.234 -7.106 22.998 1.00 0.00 H new ATOM 0 HB2 ALA A 587 -8.627 -8.522 22.109 1.00 0.00 H new ATOM 0 HB3 ALA A 587 -7.486 -7.307 22.733 1.00 0.00 H new ATOM 1819 N ALA A 588 -9.320 -4.406 20.623 1.00 0.00 N ATOM 1820 CA ALA A 588 -9.301 -2.958 20.786 1.00 0.00 C ATOM 1821 C ALA A 588 -10.240 -2.518 21.904 1.00 0.00 C ATOM 1822 O ALA A 588 -11.136 -3.260 22.303 1.00 0.00 O ATOM 1823 CB ALA A 588 -9.676 -2.275 19.479 1.00 0.00 C ATOM 0 H ALA A 588 -10.046 -4.750 19.995 1.00 0.00 H new ATOM 0 HA ALA A 588 -8.289 -2.662 21.061 1.00 0.00 H new ATOM 0 HB1 ALA A 588 -9.658 -1.194 19.615 1.00 0.00 H new ATOM 0 HB2 ALA A 588 -8.962 -2.555 18.704 1.00 0.00 H new ATOM 0 HB3 ALA A 588 -10.677 -2.586 19.180 1.00 0.00 H new ATOM 1829 N GLY A 589 -10.028 -1.305 22.406 1.00 0.00 N ATOM 1830 CA GLY A 589 -10.864 -0.788 23.474 1.00 0.00 C ATOM 1831 C GLY A 589 -10.448 0.602 23.914 1.00 0.00 C ATOM 1832 O GLY A 589 -10.195 0.837 25.095 1.00 0.00 O ATOM 0 H GLY A 589 -9.293 -0.672 22.092 1.00 0.00 H new ATOM 0 HA2 GLY A 589 -11.901 -0.765 23.141 1.00 0.00 H new ATOM 0 HA3 GLY A 589 -10.818 -1.465 24.327 1.00 0.00 H new ATOM 1836 N VAL A 590 -10.376 1.526 22.961 1.00 0.00 N ATOM 1837 CA VAL A 590 -9.987 2.900 23.256 1.00 0.00 C ATOM 1838 C VAL A 590 -10.605 3.872 22.257 1.00 0.00 C ATOM 1839 O VAL A 590 -10.516 3.675 21.045 1.00 0.00 O ATOM 1840 CB VAL A 590 -8.456 3.066 23.238 1.00 0.00 C ATOM 1841 CG1 VAL A 590 -7.810 2.184 24.295 1.00 0.00 C ATOM 1842 CG2 VAL A 590 -7.902 2.750 21.856 1.00 0.00 C ATOM 0 H VAL A 590 -10.582 1.348 21.978 1.00 0.00 H new ATOM 0 HA VAL A 590 -10.357 3.127 24.256 1.00 0.00 H new ATOM 0 HB VAL A 590 -8.218 4.104 23.471 1.00 0.00 H new ATOM 0 HG11 VAL A 590 -6.728 2.315 24.267 1.00 0.00 H new ATOM 0 HG12 VAL A 590 -8.184 2.463 25.280 1.00 0.00 H new ATOM 0 HG13 VAL A 590 -8.054 1.140 24.097 1.00 0.00 H new ATOM 0 HG21 VAL A 590 -6.819 2.872 21.861 1.00 0.00 H new ATOM 0 HG22 VAL A 590 -8.150 1.722 21.591 1.00 0.00 H new ATOM 0 HG23 VAL A 590 -8.340 3.429 21.124 1.00 0.00 H new ATOM 1852 N LYS A 591 -11.231 4.924 22.774 1.00 0.00 N ATOM 1853 CA LYS A 591 -11.863 5.930 21.929 1.00 0.00 C ATOM 1854 C LYS A 591 -12.333 7.121 22.760 1.00 0.00 C ATOM 1855 O LYS A 591 -13.123 6.968 23.692 1.00 0.00 O ATOM 1856 CB LYS A 591 -13.047 5.322 21.175 1.00 0.00 C ATOM 1857 CG LYS A 591 -13.843 6.336 20.371 1.00 0.00 C ATOM 1858 CD LYS A 591 -13.192 6.616 19.027 1.00 0.00 C ATOM 1859 CE LYS A 591 -12.201 7.767 19.117 1.00 0.00 C ATOM 1860 NZ LYS A 591 -12.089 8.505 17.829 1.00 0.00 N ATOM 0 H LYS A 591 -11.314 5.102 23.775 1.00 0.00 H new ATOM 0 HA LYS A 591 -11.123 6.280 21.209 1.00 0.00 H new ATOM 0 HB2 LYS A 591 -12.679 4.546 20.503 1.00 0.00 H new ATOM 0 HB3 LYS A 591 -13.711 4.836 21.890 1.00 0.00 H new ATOM 0 HG2 LYS A 591 -14.856 5.964 20.215 1.00 0.00 H new ATOM 0 HG3 LYS A 591 -13.927 7.264 20.936 1.00 0.00 H new ATOM 0 HD2 LYS A 591 -12.680 5.720 18.676 1.00 0.00 H new ATOM 0 HD3 LYS A 591 -13.961 6.853 18.291 1.00 0.00 H new ATOM 0 HE2 LYS A 591 -12.513 8.454 19.903 1.00 0.00 H new ATOM 0 HE3 LYS A 591 -11.222 7.382 19.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 591 -11.404 9.281 17.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 591 -11.767 7.855 17.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 591 -13.018 8.895 17.570 1.00 0.00 H new ATOM 1874 N LYS A 592 -11.844 8.307 22.414 1.00 0.00 N ATOM 1875 CA LYS A 592 -12.215 9.524 23.125 1.00 0.00 C ATOM 1876 C LYS A 592 -13.339 10.257 22.399 1.00 0.00 C ATOM 1877 O LYS A 592 -13.561 10.046 21.207 1.00 0.00 O ATOM 1878 CB LYS A 592 -11.002 10.446 23.270 1.00 0.00 C ATOM 1879 CG LYS A 592 -10.078 10.061 24.412 1.00 0.00 C ATOM 1880 CD LYS A 592 -8.705 10.694 24.257 1.00 0.00 C ATOM 1881 CE LYS A 592 -8.650 12.069 24.903 1.00 0.00 C ATOM 1882 NZ LYS A 592 -7.623 12.940 24.267 1.00 0.00 N ATOM 0 H LYS A 592 -11.189 8.451 21.645 1.00 0.00 H new ATOM 0 HA LYS A 592 -12.569 9.241 24.116 1.00 0.00 H new ATOM 0 HB2 LYS A 592 -10.437 10.438 22.338 1.00 0.00 H new ATOM 0 HB3 LYS A 592 -11.349 11.468 23.423 1.00 0.00 H new ATOM 0 HG2 LYS A 592 -10.519 10.373 25.359 1.00 0.00 H new ATOM 0 HG3 LYS A 592 -9.977 8.976 24.450 1.00 0.00 H new ATOM 0 HD2 LYS A 592 -7.952 10.048 24.709 1.00 0.00 H new ATOM 0 HD3 LYS A 592 -8.459 10.778 23.198 1.00 0.00 H new ATOM 0 HE2 LYS A 592 -9.628 12.545 24.827 1.00 0.00 H new ATOM 0 HE3 LYS A 592 -8.429 11.963 25.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 592 -7.617 13.868 24.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 592 -6.686 12.498 24.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 592 -7.848 13.063 23.259 1.00 0.00 H new ATOM 1896 N SER A 593 -14.044 11.118 23.126 1.00 0.00 N ATOM 1897 CA SER A 593 -15.147 11.880 22.551 1.00 0.00 C ATOM 1898 C SER A 593 -14.708 13.302 22.217 1.00 0.00 C ATOM 1899 O SER A 593 -14.884 13.770 21.092 1.00 0.00 O ATOM 1900 CB SER A 593 -16.330 11.914 23.520 1.00 0.00 C ATOM 1901 OG SER A 593 -16.914 10.630 23.657 1.00 0.00 O ATOM 0 H SER A 593 -13.871 11.305 24.114 1.00 0.00 H new ATOM 0 HA SER A 593 -15.455 11.387 21.629 1.00 0.00 H new ATOM 0 HB2 SER A 593 -15.996 12.271 24.494 1.00 0.00 H new ATOM 0 HB3 SER A 593 -17.078 12.621 23.161 1.00 0.00 H new ATOM 0 HG SER A 593 -17.667 10.678 24.283 1.00 0.00 H new ATOM 1907 N SER A 594 -14.135 13.986 23.202 1.00 0.00 N ATOM 1908 CA SER A 594 -13.674 15.356 23.015 1.00 0.00 C ATOM 1909 C SER A 594 -12.897 15.840 24.236 1.00 0.00 C ATOM 1910 O SER A 594 -13.001 15.265 25.319 1.00 0.00 O ATOM 1911 CB SER A 594 -14.861 16.285 22.751 1.00 0.00 C ATOM 1912 OG SER A 594 -15.785 16.248 23.824 1.00 0.00 O ATOM 0 H SER A 594 -13.979 13.613 24.138 1.00 0.00 H new ATOM 0 HA SER A 594 -13.009 15.374 22.152 1.00 0.00 H new ATOM 0 HB2 SER A 594 -14.504 17.305 22.609 1.00 0.00 H new ATOM 0 HB3 SER A 594 -15.359 15.990 21.827 1.00 0.00 H new ATOM 0 HG SER A 594 -16.533 16.851 23.632 1.00 0.00 H new ATOM 1918 N GLY A 595 -12.118 16.902 24.052 1.00 0.00 N ATOM 1919 CA GLY A 595 -11.335 17.446 25.146 1.00 0.00 C ATOM 1920 C GLY A 595 -11.903 18.748 25.674 1.00 0.00 C ATOM 1921 O GLY A 595 -12.375 19.597 24.917 1.00 0.00 O ATOM 0 H GLY A 595 -12.015 17.395 23.165 1.00 0.00 H new ATOM 0 HA2 GLY A 595 -11.292 16.717 25.955 1.00 0.00 H new ATOM 0 HA3 GLY A 595 -10.311 17.610 24.810 1.00 0.00 H new ATOM 1925 N PRO A 596 -11.863 18.920 27.004 1.00 0.00 N ATOM 1926 CA PRO A 596 -12.374 20.125 27.662 1.00 0.00 C ATOM 1927 C PRO A 596 -11.512 21.351 27.380 1.00 0.00 C ATOM 1928 O PRO A 596 -10.385 21.453 27.864 1.00 0.00 O ATOM 1929 CB PRO A 596 -12.322 19.767 29.150 1.00 0.00 C ATOM 1930 CG PRO A 596 -11.258 18.729 29.252 1.00 0.00 C ATOM 1931 CD PRO A 596 -11.314 17.950 27.967 1.00 0.00 C ATOM 0 HA PRO A 596 -13.370 20.390 27.307 1.00 0.00 H new ATOM 0 HB2 PRO A 596 -12.084 20.639 29.759 1.00 0.00 H new ATOM 0 HB3 PRO A 596 -13.282 19.386 29.500 1.00 0.00 H new ATOM 0 HG2 PRO A 596 -10.278 19.187 29.388 1.00 0.00 H new ATOM 0 HG3 PRO A 596 -11.428 18.079 30.110 1.00 0.00 H new ATOM 0 HD2 PRO A 596 -10.327 17.600 27.666 1.00 0.00 H new ATOM 0 HD3 PRO A 596 -11.950 17.070 28.058 1.00 0.00 H new ATOM 1939 N SER A 597 -12.049 22.278 26.593 1.00 0.00 N ATOM 1940 CA SER A 597 -11.326 23.495 26.243 1.00 0.00 C ATOM 1941 C SER A 597 -11.703 24.639 27.180 1.00 0.00 C ATOM 1942 O SER A 597 -12.627 24.519 27.984 1.00 0.00 O ATOM 1943 CB SER A 597 -11.620 23.890 24.795 1.00 0.00 C ATOM 1944 OG SER A 597 -11.292 22.838 23.904 1.00 0.00 O ATOM 0 H SER A 597 -12.982 22.209 26.186 1.00 0.00 H new ATOM 0 HA SER A 597 -10.259 23.297 26.349 1.00 0.00 H new ATOM 0 HB2 SER A 597 -12.675 24.144 24.691 1.00 0.00 H new ATOM 0 HB3 SER A 597 -11.050 24.782 24.535 1.00 0.00 H new ATOM 0 HG SER A 597 -11.490 23.114 22.985 1.00 0.00 H new ATOM 1950 N SER A 598 -10.980 25.749 27.070 1.00 0.00 N ATOM 1951 CA SER A 598 -11.235 26.914 27.909 1.00 0.00 C ATOM 1952 C SER A 598 -10.852 28.200 27.183 1.00 0.00 C ATOM 1953 O SER A 598 -9.747 28.326 26.659 1.00 0.00 O ATOM 1954 CB SER A 598 -10.455 26.804 29.221 1.00 0.00 C ATOM 1955 OG SER A 598 -10.860 25.666 29.961 1.00 0.00 O ATOM 0 H SER A 598 -10.213 25.866 26.408 1.00 0.00 H new ATOM 0 HA SER A 598 -12.302 26.946 28.130 1.00 0.00 H new ATOM 0 HB2 SER A 598 -9.388 26.743 29.009 1.00 0.00 H new ATOM 0 HB3 SER A 598 -10.611 27.703 29.817 1.00 0.00 H new ATOM 0 HG SER A 598 -10.346 25.617 30.794 1.00 0.00 H new ATOM 1961 N GLY A 599 -11.778 29.155 27.157 1.00 0.00 N ATOM 1962 CA GLY A 599 -11.520 30.419 26.493 1.00 0.00 C ATOM 1963 C GLY A 599 -12.130 31.596 27.229 1.00 0.00 C ATOM 1964 O GLY A 599 -11.462 32.602 27.467 1.00 0.00 O ATOM 0 H GLY A 599 -12.701 29.075 27.584 1.00 0.00 H new ATOM 0 HA2 GLY A 599 -10.444 30.567 26.406 1.00 0.00 H new ATOM 0 HA3 GLY A 599 -11.919 30.382 25.480 1.00 0.00 H new TER 1968 GLY A 599