USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 842 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 472 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 522 THR OG1 : rot 180:sc= -1.55! USER MOD Set 2.1: A 514 ASN : amide:sc= -1.31 K(o=-2,f=-5.2!) USER MOD Set 2.2: A 534 THR OG1 : rot 180:sc= -0.721 USER MOD Set 3.1: A 484 TYR OH : rot 36:sc= 0.824 USER MOD Set 3.2: A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 441 THR OG1 : rot 114:sc= 0.577 USER MOD Set 4.2: A 530 ASN : amide:sc= -2.52! K(o=-1.9!,f=-2.5) USER MOD Single : A 435 MET CE :methyl -161:sc= 0 (180deg=-0.527) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -2.91! C(o=-2.9!,f=-2.1!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -138:sc= 0.934 USER MOD Single : A 461 HIS : no HE2:sc= 0.94 K(o=0.94,f=-2.9!) USER MOD Single : A 463 LYS NZ :NH3+ -109:sc= 1.69 (180deg=0.822) USER MOD Single : A 464 ASN : amide:sc= -0.0575 K(o=-0.058,f=-8.8!) USER MOD Single : A 473 THR OG1 : rot 180:sc= 0 USER MOD Single : A 474 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.011) USER MOD Single : A 478 TYR OH : rot -136:sc= -0.116 USER MOD Single : A 480 ASN : amide:sc= -0.0221 K(o=-0.022,f=-4.7!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 486 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.83) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 30:sc= 0.501 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0.019 K(o=0.019,f=-7!) USER MOD Single : A 510 MET CE :methyl -162:sc= -0.55 (180deg=-0.584) USER MOD Single : A 511 TYR OH : rot 27:sc= 1.03 USER MOD Single : A 516 THR OG1 : rot -80:sc=-0.00535 USER MOD Single : A 521 ASN : amide:sc= -0.0006 X(o=-0.0006,f=-0.23) USER MOD Single : A 527 ASN : amide:sc= -1.22 K(o=-1.2,f=-2.2) USER MOD Single : A 529 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 531 ASN : amide:sc= -0.606 K(o=-0.61,f=-4.6!) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -11.850 17.936 18.543 1.00 61.22 N ATOM 2 CA MET A 435 -11.363 17.676 17.158 1.00 64.10 C ATOM 3 C MET A 435 -10.226 16.643 17.165 1.00 3.42 C ATOM 4 O MET A 435 -9.116 16.931 17.617 1.00 73.22 O ATOM 5 CB MET A 435 -10.883 18.988 16.513 1.00 11.44 C ATOM 6 CG MET A 435 -10.471 18.850 15.050 1.00 1.23 C ATOM 7 SD MET A 435 -9.879 20.403 14.352 1.00 22.33 S ATOM 8 CE MET A 435 -9.558 19.919 12.657 1.00 74.21 C ATOM 0 HA MET A 435 -12.189 17.272 16.572 1.00 64.10 H new ATOM 0 HB2 MET A 435 -11.679 19.729 16.587 1.00 11.44 H new ATOM 0 HB3 MET A 435 -10.037 19.372 17.083 1.00 11.44 H new ATOM 0 HG2 MET A 435 -9.689 18.096 14.965 1.00 1.23 H new ATOM 0 HG3 MET A 435 -11.321 18.494 14.468 1.00 1.23 H new ATOM 0 HE1 MET A 435 -8.888 20.643 12.193 1.00 74.21 H new ATOM 0 HE2 MET A 435 -9.094 18.933 12.642 1.00 74.21 H new ATOM 0 HE3 MET A 435 -10.497 19.886 12.104 1.00 74.21 H new ATOM 20 N GLU A 436 -10.509 15.442 16.663 1.00 53.45 N ATOM 21 CA GLU A 436 -9.552 14.332 16.714 1.00 64.42 C ATOM 22 C GLU A 436 -8.732 14.219 15.421 1.00 65.01 C ATOM 23 O GLU A 436 -9.223 14.505 14.326 1.00 43.12 O ATOM 24 CB GLU A 436 -10.281 13.001 16.966 1.00 4.44 C ATOM 25 CG GLU A 436 -11.099 12.949 18.256 1.00 75.13 C ATOM 26 CD GLU A 436 -12.264 13.930 18.268 1.00 23.02 C ATOM 27 OE1 GLU A 436 -13.187 13.771 17.445 1.00 22.41 O ATOM 28 OE2 GLU A 436 -12.256 14.871 19.094 1.00 1.41 O ATOM 0 H GLU A 436 -11.395 15.210 16.215 1.00 53.45 H new ATOM 0 HA GLU A 436 -8.869 14.542 17.537 1.00 64.42 H new ATOM 0 HB2 GLU A 436 -10.944 12.802 16.124 1.00 4.44 H new ATOM 0 HB3 GLU A 436 -9.544 12.198 16.988 1.00 4.44 H new ATOM 0 HG2 GLU A 436 -11.482 11.938 18.395 1.00 75.13 H new ATOM 0 HG3 GLU A 436 -10.445 13.161 19.102 1.00 75.13 H new ATOM 35 N PHE A 437 -7.478 13.796 15.555 1.00 22.13 N ATOM 36 CA PHE A 437 -6.614 13.553 14.398 1.00 12.32 C ATOM 37 C PHE A 437 -6.180 12.080 14.354 1.00 53.24 C ATOM 38 O PHE A 437 -5.467 11.610 15.243 1.00 53.42 O ATOM 39 CB PHE A 437 -5.379 14.464 14.442 1.00 54.01 C ATOM 40 CG PHE A 437 -5.711 15.921 14.640 1.00 70.52 C ATOM 41 CD1 PHE A 437 -6.256 16.667 13.607 1.00 61.31 C ATOM 42 CD2 PHE A 437 -5.482 16.545 15.859 1.00 51.02 C ATOM 43 CE1 PHE A 437 -6.564 18.001 13.782 1.00 4.10 C ATOM 44 CE2 PHE A 437 -5.790 17.881 16.039 1.00 71.12 C ATOM 45 CZ PHE A 437 -6.332 18.609 15.000 1.00 64.42 C ATOM 0 H PHE A 437 -7.034 13.613 16.455 1.00 22.13 H new ATOM 0 HA PHE A 437 -7.181 13.781 13.496 1.00 12.32 H new ATOM 0 HB2 PHE A 437 -4.724 14.136 15.250 1.00 54.01 H new ATOM 0 HB3 PHE A 437 -4.821 14.350 13.513 1.00 54.01 H new ATOM 0 HD1 PHE A 437 -6.442 16.198 12.652 1.00 61.31 H new ATOM 0 HD2 PHE A 437 -5.058 15.980 16.676 1.00 51.02 H new ATOM 0 HE1 PHE A 437 -6.986 18.569 12.966 1.00 4.10 H new ATOM 0 HE2 PHE A 437 -5.606 18.354 16.992 1.00 71.12 H new ATOM 0 HZ PHE A 437 -6.574 19.652 15.139 1.00 64.42 H new ATOM 55 N PRO A 438 -6.626 11.322 13.336 1.00 51.23 N ATOM 56 CA PRO A 438 -6.266 9.904 13.195 1.00 13.41 C ATOM 57 C PRO A 438 -4.821 9.681 12.720 1.00 3.42 C ATOM 58 O PRO A 438 -4.127 10.611 12.308 1.00 23.42 O ATOM 59 CB PRO A 438 -7.252 9.398 12.140 1.00 61.43 C ATOM 60 CG PRO A 438 -7.556 10.598 11.309 1.00 35.35 C ATOM 61 CD PRO A 438 -7.523 11.773 12.252 1.00 53.32 C ATOM 0 HA PRO A 438 -6.320 9.385 14.152 1.00 13.41 H new ATOM 0 HB2 PRO A 438 -6.816 8.599 11.540 1.00 61.43 H new ATOM 0 HB3 PRO A 438 -8.154 8.995 12.600 1.00 61.43 H new ATOM 0 HG2 PRO A 438 -6.823 10.717 10.511 1.00 35.35 H new ATOM 0 HG3 PRO A 438 -8.532 10.506 10.833 1.00 35.35 H new ATOM 0 HD2 PRO A 438 -7.142 12.669 11.763 1.00 53.32 H new ATOM 0 HD3 PRO A 438 -8.517 12.014 12.628 1.00 53.32 H new ATOM 69 N ASP A 439 -4.380 8.431 12.784 1.00 74.03 N ATOM 70 CA ASP A 439 -3.059 8.040 12.291 1.00 3.30 C ATOM 71 C ASP A 439 -3.191 6.838 11.344 1.00 42.52 C ATOM 72 O ASP A 439 -3.296 5.696 11.784 1.00 41.24 O ATOM 73 CB ASP A 439 -2.138 7.712 13.472 1.00 10.51 C ATOM 74 CG ASP A 439 -0.724 7.356 13.043 1.00 62.21 C ATOM 75 OD1 ASP A 439 -0.003 8.250 12.551 1.00 4.15 O ATOM 76 OD2 ASP A 439 -0.325 6.187 13.208 1.00 52.12 O ATOM 0 H ASP A 439 -4.922 7.661 13.176 1.00 74.03 H new ATOM 0 HA ASP A 439 -2.619 8.867 11.734 1.00 3.30 H new ATOM 0 HB2 ASP A 439 -2.102 8.568 14.146 1.00 10.51 H new ATOM 0 HB3 ASP A 439 -2.561 6.880 14.035 1.00 10.51 H new ATOM 81 N LEU A 440 -3.242 7.111 10.045 1.00 61.31 N ATOM 82 CA LEU A 440 -3.429 6.061 9.039 1.00 33.30 C ATOM 83 C LEU A 440 -2.080 5.575 8.491 1.00 22.00 C ATOM 84 O LEU A 440 -1.372 6.315 7.809 1.00 32.32 O ATOM 85 CB LEU A 440 -4.312 6.582 7.894 1.00 4.52 C ATOM 86 CG LEU A 440 -5.717 7.065 8.308 1.00 23.21 C ATOM 87 CD1 LEU A 440 -6.473 7.623 7.106 1.00 21.23 C ATOM 88 CD2 LEU A 440 -6.510 5.933 8.961 1.00 45.41 C ATOM 0 H LEU A 440 -3.157 8.051 9.659 1.00 61.31 H new ATOM 0 HA LEU A 440 -3.924 5.215 9.515 1.00 33.30 H new ATOM 0 HB2 LEU A 440 -3.793 7.406 7.404 1.00 4.52 H new ATOM 0 HB3 LEU A 440 -4.422 5.790 7.154 1.00 4.52 H new ATOM 0 HG LEU A 440 -5.597 7.865 9.039 1.00 23.21 H new ATOM 0 HD11 LEU A 440 -7.461 7.958 7.421 1.00 21.23 H new ATOM 0 HD12 LEU A 440 -5.921 8.465 6.688 1.00 21.23 H new ATOM 0 HD13 LEU A 440 -6.578 6.846 6.349 1.00 21.23 H new ATOM 0 HD21 LEU A 440 -7.497 6.297 9.245 1.00 45.41 H new ATOM 0 HD22 LEU A 440 -6.616 5.109 8.255 1.00 45.41 H new ATOM 0 HD23 LEU A 440 -5.983 5.585 9.849 1.00 45.41 H new ATOM 100 N THR A 441 -1.732 4.328 8.790 1.00 43.13 N ATOM 101 CA THR A 441 -0.446 3.759 8.366 1.00 71.10 C ATOM 102 C THR A 441 -0.631 2.492 7.522 1.00 73.41 C ATOM 103 O THR A 441 -1.635 1.782 7.651 1.00 13.22 O ATOM 104 CB THR A 441 0.453 3.432 9.581 1.00 40.11 C ATOM 105 OG1 THR A 441 1.687 2.840 9.147 1.00 13.32 O ATOM 106 CG2 THR A 441 -0.255 2.500 10.561 1.00 62.21 C ATOM 0 H THR A 441 -2.319 3.687 9.324 1.00 43.13 H new ATOM 0 HA THR A 441 0.039 4.519 7.753 1.00 71.10 H new ATOM 0 HB THR A 441 0.667 4.369 10.096 1.00 40.11 H new ATOM 0 HG1 THR A 441 2.431 3.443 9.356 1.00 13.32 H new ATOM 0 HG21 THR A 441 0.404 2.290 11.404 1.00 62.21 H new ATOM 0 HG22 THR A 441 -1.166 2.977 10.923 1.00 62.21 H new ATOM 0 HG23 THR A 441 -0.509 1.567 10.057 1.00 62.21 H new ATOM 114 N VAL A 442 0.346 2.214 6.658 1.00 43.01 N ATOM 115 CA VAL A 442 0.284 1.062 5.748 1.00 62.53 C ATOM 116 C VAL A 442 1.570 0.215 5.808 1.00 55.33 C ATOM 117 O VAL A 442 2.658 0.727 6.087 1.00 21.03 O ATOM 118 CB VAL A 442 0.041 1.515 4.281 1.00 35.15 C ATOM 119 CG1 VAL A 442 -1.267 2.291 4.159 1.00 34.43 C ATOM 120 CG2 VAL A 442 1.210 2.350 3.763 1.00 3.34 C ATOM 0 H VAL A 442 1.195 2.772 6.567 1.00 43.01 H new ATOM 0 HA VAL A 442 -0.555 0.450 6.080 1.00 62.53 H new ATOM 0 HB VAL A 442 -0.035 0.619 3.665 1.00 35.15 H new ATOM 0 HG11 VAL A 442 -1.414 2.597 3.123 1.00 34.43 H new ATOM 0 HG12 VAL A 442 -2.097 1.657 4.471 1.00 34.43 H new ATOM 0 HG13 VAL A 442 -1.226 3.175 4.796 1.00 34.43 H new ATOM 0 HG21 VAL A 442 1.013 2.653 2.735 1.00 3.34 H new ATOM 0 HG22 VAL A 442 1.328 3.236 4.386 1.00 3.34 H new ATOM 0 HG23 VAL A 442 2.124 1.757 3.798 1.00 3.34 H new ATOM 130 N GLU A 443 1.430 -1.086 5.557 1.00 54.03 N ATOM 131 CA GLU A 443 2.572 -2.013 5.517 1.00 15.35 C ATOM 132 C GLU A 443 2.542 -2.865 4.240 1.00 12.32 C ATOM 133 O GLU A 443 1.469 -3.244 3.767 1.00 44.15 O ATOM 134 CB GLU A 443 2.547 -2.946 6.735 1.00 3.43 C ATOM 135 CG GLU A 443 2.680 -2.241 8.081 1.00 4.31 C ATOM 136 CD GLU A 443 2.606 -3.211 9.250 1.00 35.34 C ATOM 137 OE1 GLU A 443 1.488 -3.651 9.591 1.00 12.15 O ATOM 138 OE2 GLU A 443 3.662 -3.551 9.822 1.00 5.04 O ATOM 0 H GLU A 443 0.530 -1.530 5.376 1.00 54.03 H new ATOM 0 HA GLU A 443 3.483 -1.415 5.529 1.00 15.35 H new ATOM 0 HB2 GLU A 443 1.613 -3.508 6.726 1.00 3.43 H new ATOM 0 HB3 GLU A 443 3.356 -3.670 6.638 1.00 3.43 H new ATOM 0 HG2 GLU A 443 3.629 -1.705 8.116 1.00 4.31 H new ATOM 0 HG3 GLU A 443 1.890 -1.497 8.179 1.00 4.31 H new ATOM 145 N ILE A 444 3.719 -3.175 3.694 1.00 43.53 N ATOM 146 CA ILE A 444 3.821 -4.028 2.499 1.00 33.43 C ATOM 147 C ILE A 444 4.565 -5.337 2.812 1.00 74.14 C ATOM 148 O ILE A 444 5.656 -5.324 3.383 1.00 65.54 O ATOM 149 CB ILE A 444 4.553 -3.310 1.334 1.00 64.40 C ATOM 150 CG1 ILE A 444 3.876 -1.969 1.009 1.00 51.11 C ATOM 151 CG2 ILE A 444 4.591 -4.206 0.092 1.00 35.42 C ATOM 152 CD1 ILE A 444 4.552 -1.197 -0.109 1.00 53.25 C ATOM 0 H ILE A 444 4.616 -2.851 4.056 1.00 43.53 H new ATOM 0 HA ILE A 444 2.798 -4.248 2.193 1.00 33.43 H new ATOM 0 HB ILE A 444 5.577 -3.108 1.647 1.00 64.40 H new ATOM 0 HG12 ILE A 444 2.838 -2.154 0.734 1.00 51.11 H new ATOM 0 HG13 ILE A 444 3.863 -1.352 1.908 1.00 51.11 H new ATOM 0 HG21 ILE A 444 5.108 -3.687 -0.715 1.00 35.42 H new ATOM 0 HG22 ILE A 444 5.119 -5.130 0.326 1.00 35.42 H new ATOM 0 HG23 ILE A 444 3.573 -4.439 -0.220 1.00 35.42 H new ATOM 0 HD11 ILE A 444 4.018 -0.263 -0.281 1.00 53.25 H new ATOM 0 HD12 ILE A 444 5.583 -0.979 0.171 1.00 53.25 H new ATOM 0 HD13 ILE A 444 4.542 -1.794 -1.021 1.00 53.25 H new ATOM 164 N LYS A 445 3.969 -6.463 2.428 1.00 2.31 N ATOM 165 CA LYS A 445 4.586 -7.781 2.620 1.00 71.13 C ATOM 166 C LYS A 445 4.472 -8.634 1.344 1.00 20.44 C ATOM 167 O LYS A 445 3.431 -8.650 0.696 1.00 21.52 O ATOM 168 CB LYS A 445 3.918 -8.507 3.802 1.00 14.25 C ATOM 169 CG LYS A 445 4.535 -9.867 4.129 1.00 23.00 C ATOM 170 CD LYS A 445 6.033 -9.751 4.391 1.00 12.30 C ATOM 171 CE LYS A 445 6.668 -11.093 4.722 1.00 74.11 C ATOM 172 NZ LYS A 445 8.140 -10.981 4.868 1.00 30.30 N ATOM 0 H LYS A 445 3.054 -6.493 1.979 1.00 2.31 H new ATOM 0 HA LYS A 445 5.644 -7.635 2.839 1.00 71.13 H new ATOM 0 HB2 LYS A 445 3.978 -7.871 4.685 1.00 14.25 H new ATOM 0 HB3 LYS A 445 2.860 -8.644 3.579 1.00 14.25 H new ATOM 0 HG2 LYS A 445 4.043 -10.290 5.005 1.00 23.00 H new ATOM 0 HG3 LYS A 445 4.361 -10.555 3.302 1.00 23.00 H new ATOM 0 HD2 LYS A 445 6.521 -9.327 3.513 1.00 12.30 H new ATOM 0 HD3 LYS A 445 6.203 -9.058 5.215 1.00 12.30 H new ATOM 0 HE2 LYS A 445 6.239 -11.481 5.646 1.00 74.11 H new ATOM 0 HE3 LYS A 445 6.434 -11.811 3.936 1.00 74.11 H new ATOM 0 HZ1 LYS A 445 8.539 -11.915 5.093 1.00 30.30 H new ATOM 0 HZ2 LYS A 445 8.552 -10.634 3.978 1.00 30.30 H new ATOM 0 HZ3 LYS A 445 8.363 -10.315 5.635 1.00 30.30 H new ATOM 186 N GLY A 446 5.544 -9.337 0.977 1.00 30.43 N ATOM 187 CA GLY A 446 5.489 -10.205 -0.198 1.00 1.12 C ATOM 188 C GLY A 446 6.858 -10.662 -0.700 1.00 61.34 C ATOM 189 O GLY A 446 7.884 -10.351 -0.093 1.00 32.41 O ATOM 0 H GLY A 446 6.441 -9.324 1.463 1.00 30.43 H new ATOM 0 HA2 GLY A 446 4.889 -11.084 0.040 1.00 1.12 H new ATOM 0 HA3 GLY A 446 4.976 -9.678 -1.002 1.00 1.12 H new ATOM 193 N PRO A 447 6.896 -11.413 -1.819 1.00 22.34 N ATOM 194 CA PRO A 447 8.154 -11.928 -2.395 1.00 64.33 C ATOM 195 C PRO A 447 9.015 -10.828 -3.046 1.00 34.23 C ATOM 196 O PRO A 447 8.604 -10.195 -4.023 1.00 24.13 O ATOM 197 CB PRO A 447 7.668 -12.935 -3.447 1.00 52.40 C ATOM 198 CG PRO A 447 6.314 -12.445 -3.847 1.00 73.52 C ATOM 199 CD PRO A 447 5.715 -11.822 -2.610 1.00 14.00 C ATOM 0 HA PRO A 447 8.802 -12.360 -1.633 1.00 64.33 H new ATOM 0 HB2 PRO A 447 8.344 -12.972 -4.301 1.00 52.40 H new ATOM 0 HB3 PRO A 447 7.618 -13.943 -3.036 1.00 52.40 H new ATOM 0 HG2 PRO A 447 6.386 -11.717 -4.655 1.00 73.52 H new ATOM 0 HG3 PRO A 447 5.694 -13.265 -4.210 1.00 73.52 H new ATOM 0 HD2 PRO A 447 5.083 -10.969 -2.857 1.00 14.00 H new ATOM 0 HD3 PRO A 447 5.093 -12.532 -2.064 1.00 14.00 H new ATOM 207 N ASP A 448 10.212 -10.612 -2.505 1.00 5.50 N ATOM 208 CA ASP A 448 11.124 -9.575 -3.010 1.00 1.13 C ATOM 209 C ASP A 448 11.744 -9.938 -4.377 1.00 55.10 C ATOM 210 O ASP A 448 12.055 -9.055 -5.172 1.00 3.31 O ATOM 211 CB ASP A 448 12.218 -9.300 -1.972 1.00 51.15 C ATOM 212 CG ASP A 448 12.794 -10.579 -1.393 1.00 41.13 C ATOM 213 OD1 ASP A 448 13.770 -11.110 -1.955 1.00 50.25 O ATOM 214 OD2 ASP A 448 12.255 -11.068 -0.378 1.00 64.12 O ATOM 0 H ASP A 448 10.579 -11.141 -1.714 1.00 5.50 H new ATOM 0 HA ASP A 448 10.536 -8.671 -3.171 1.00 1.13 H new ATOM 0 HB2 ASP A 448 13.017 -8.720 -2.434 1.00 51.15 H new ATOM 0 HB3 ASP A 448 11.807 -8.691 -1.166 1.00 51.15 H new ATOM 219 N VAL A 449 11.936 -11.229 -4.648 1.00 62.15 N ATOM 220 CA VAL A 449 12.474 -11.677 -5.948 1.00 42.44 C ATOM 221 C VAL A 449 11.496 -12.619 -6.668 1.00 35.11 C ATOM 222 O VAL A 449 11.114 -13.663 -6.133 1.00 24.12 O ATOM 223 CB VAL A 449 13.845 -12.387 -5.792 1.00 20.51 C ATOM 224 CG1 VAL A 449 14.369 -12.872 -7.145 1.00 50.35 C ATOM 225 CG2 VAL A 449 14.861 -11.459 -5.124 1.00 50.40 C ATOM 0 H VAL A 449 11.731 -11.985 -3.994 1.00 62.15 H new ATOM 0 HA VAL A 449 12.611 -10.778 -6.549 1.00 42.44 H new ATOM 0 HB VAL A 449 13.701 -13.258 -5.153 1.00 20.51 H new ATOM 0 HG11 VAL A 449 15.331 -13.366 -7.007 1.00 50.35 H new ATOM 0 HG12 VAL A 449 13.659 -13.576 -7.579 1.00 50.35 H new ATOM 0 HG13 VAL A 449 14.491 -12.020 -7.814 1.00 50.35 H new ATOM 0 HG21 VAL A 449 15.815 -11.976 -5.024 1.00 50.40 H new ATOM 0 HG22 VAL A 449 14.994 -10.566 -5.734 1.00 50.40 H new ATOM 0 HG23 VAL A 449 14.498 -11.173 -4.137 1.00 50.40 H new ATOM 235 N VAL A 450 11.104 -12.255 -7.892 1.00 71.45 N ATOM 236 CA VAL A 450 10.134 -13.044 -8.671 1.00 25.04 C ATOM 237 C VAL A 450 10.601 -13.266 -10.121 1.00 51.43 C ATOM 238 O VAL A 450 11.499 -12.577 -10.614 1.00 25.14 O ATOM 239 CB VAL A 450 8.735 -12.372 -8.686 1.00 12.31 C ATOM 240 CG1 VAL A 450 8.172 -12.250 -7.271 1.00 24.33 C ATOM 241 CG2 VAL A 450 8.791 -11.005 -9.369 1.00 55.20 C ATOM 0 H VAL A 450 11.441 -11.419 -8.369 1.00 71.45 H new ATOM 0 HA VAL A 450 10.063 -14.012 -8.175 1.00 25.04 H new ATOM 0 HB VAL A 450 8.064 -13.009 -9.262 1.00 12.31 H new ATOM 0 HG11 VAL A 450 7.191 -11.776 -7.309 1.00 24.33 H new ATOM 0 HG12 VAL A 450 8.078 -13.242 -6.830 1.00 24.33 H new ATOM 0 HG13 VAL A 450 8.844 -11.645 -6.663 1.00 24.33 H new ATOM 0 HG21 VAL A 450 7.798 -10.556 -9.366 1.00 55.20 H new ATOM 0 HG22 VAL A 450 9.484 -10.358 -8.831 1.00 55.20 H new ATOM 0 HG23 VAL A 450 9.131 -11.126 -10.397 1.00 55.20 H new ATOM 251 N GLY A 451 9.984 -14.236 -10.797 1.00 33.14 N ATOM 252 CA GLY A 451 10.327 -14.531 -12.184 1.00 4.43 C ATOM 253 C GLY A 451 9.472 -13.766 -13.194 1.00 50.05 C ATOM 254 O GLY A 451 8.354 -13.342 -12.890 1.00 25.13 O ATOM 0 H GLY A 451 9.249 -14.826 -10.407 1.00 33.14 H new ATOM 0 HA2 GLY A 451 11.377 -14.290 -12.351 1.00 4.43 H new ATOM 0 HA3 GLY A 451 10.214 -15.601 -12.359 1.00 4.43 H new ATOM 258 N VAL A 452 9.999 -13.601 -14.401 1.00 63.12 N ATOM 259 CA VAL A 452 9.301 -12.876 -15.466 1.00 53.53 C ATOM 260 C VAL A 452 8.074 -13.662 -15.988 1.00 41.52 C ATOM 261 O VAL A 452 8.115 -14.886 -16.124 1.00 34.03 O ATOM 262 CB VAL A 452 10.270 -12.570 -16.639 1.00 41.41 C ATOM 263 CG1 VAL A 452 10.698 -13.854 -17.348 1.00 23.54 C ATOM 264 CG2 VAL A 452 9.654 -11.577 -17.620 1.00 31.34 C ATOM 0 H VAL A 452 10.914 -13.961 -14.672 1.00 63.12 H new ATOM 0 HA VAL A 452 8.943 -11.939 -15.040 1.00 53.53 H new ATOM 0 HB VAL A 452 11.164 -12.108 -16.219 1.00 41.41 H new ATOM 0 HG11 VAL A 452 11.376 -13.610 -18.165 1.00 23.54 H new ATOM 0 HG12 VAL A 452 11.205 -14.509 -16.639 1.00 23.54 H new ATOM 0 HG13 VAL A 452 9.819 -14.360 -17.746 1.00 23.54 H new ATOM 0 HG21 VAL A 452 10.357 -11.383 -18.430 1.00 31.34 H new ATOM 0 HG22 VAL A 452 8.734 -11.993 -18.030 1.00 31.34 H new ATOM 0 HG23 VAL A 452 9.431 -10.644 -17.102 1.00 31.34 H new ATOM 274 N ASN A 453 6.982 -12.943 -16.265 1.00 62.33 N ATOM 275 CA ASN A 453 5.727 -13.542 -16.752 1.00 35.55 C ATOM 276 C ASN A 453 5.129 -14.552 -15.754 1.00 5.34 C ATOM 277 O ASN A 453 4.362 -15.437 -16.139 1.00 12.14 O ATOM 278 CB ASN A 453 5.925 -14.211 -18.122 1.00 41.04 C ATOM 279 CG ASN A 453 6.352 -13.223 -19.192 1.00 43.11 C ATOM 280 OD1 ASN A 453 5.523 -12.542 -19.783 1.00 42.55 O ATOM 281 ND2 ASN A 453 7.637 -13.151 -19.470 1.00 3.51 N ATOM 0 H ASN A 453 6.939 -11.929 -16.159 1.00 62.33 H new ATOM 0 HA ASN A 453 5.017 -12.722 -16.857 1.00 35.55 H new ATOM 0 HB2 ASN A 453 6.677 -14.996 -18.035 1.00 41.04 H new ATOM 0 HB3 ASN A 453 4.996 -14.692 -18.426 1.00 41.04 H new ATOM 0 HD21 ASN A 453 7.967 -12.515 -20.196 1.00 3.51 H new ATOM 0 HD22 ASN A 453 8.303 -13.732 -18.960 1.00 3.51 H new ATOM 288 N LYS A 454 5.462 -14.406 -14.472 1.00 63.21 N ATOM 289 CA LYS A 454 4.924 -15.292 -13.427 1.00 12.14 C ATOM 290 C LYS A 454 3.859 -14.584 -12.573 1.00 53.21 C ATOM 291 O LYS A 454 3.594 -13.392 -12.744 1.00 20.10 O ATOM 292 CB LYS A 454 6.059 -15.810 -12.528 1.00 74.03 C ATOM 293 CG LYS A 454 7.153 -16.562 -13.283 1.00 53.43 C ATOM 294 CD LYS A 454 6.597 -17.720 -14.114 1.00 1.12 C ATOM 295 CE LYS A 454 5.891 -18.766 -13.256 1.00 0.50 C ATOM 296 NZ LYS A 454 5.444 -19.930 -14.065 1.00 71.44 N ATOM 0 H LYS A 454 6.099 -13.687 -14.128 1.00 63.21 H new ATOM 0 HA LYS A 454 4.446 -16.135 -13.927 1.00 12.14 H new ATOM 0 HB2 LYS A 454 6.508 -14.966 -12.004 1.00 74.03 H new ATOM 0 HB3 LYS A 454 5.636 -16.469 -11.769 1.00 74.03 H new ATOM 0 HG2 LYS A 454 7.681 -15.869 -13.938 1.00 53.43 H new ATOM 0 HG3 LYS A 454 7.883 -16.947 -12.571 1.00 53.43 H new ATOM 0 HD2 LYS A 454 5.898 -17.330 -14.854 1.00 1.12 H new ATOM 0 HD3 LYS A 454 7.411 -18.194 -14.663 1.00 1.12 H new ATOM 0 HE2 LYS A 454 6.565 -19.107 -12.470 1.00 0.50 H new ATOM 0 HE3 LYS A 454 5.030 -18.313 -12.764 1.00 0.50 H new ATOM 0 HZ1 LYS A 454 4.969 -20.619 -13.448 1.00 71.44 H new ATOM 0 HZ2 LYS A 454 4.782 -19.608 -14.800 1.00 71.44 H new ATOM 0 HZ3 LYS A 454 6.268 -20.378 -14.514 1.00 71.44 H new ATOM 310 N LEU A 455 3.252 -15.328 -11.648 1.00 3.23 N ATOM 311 CA LEU A 455 2.197 -14.787 -10.782 1.00 21.45 C ATOM 312 C LEU A 455 2.715 -14.536 -9.354 1.00 25.10 C ATOM 313 O LEU A 455 3.168 -15.460 -8.678 1.00 50.24 O ATOM 314 CB LEU A 455 1.008 -15.761 -10.736 1.00 62.25 C ATOM 315 CG LEU A 455 -0.226 -15.249 -9.974 1.00 32.14 C ATOM 316 CD1 LEU A 455 -0.818 -14.032 -10.679 1.00 2.23 C ATOM 317 CD2 LEU A 455 -1.270 -16.355 -9.818 1.00 33.55 C ATOM 0 H LEU A 455 3.471 -16.309 -11.477 1.00 3.23 H new ATOM 0 HA LEU A 455 1.876 -13.833 -11.200 1.00 21.45 H new ATOM 0 HB2 LEU A 455 0.712 -15.997 -11.758 1.00 62.25 H new ATOM 0 HB3 LEU A 455 1.339 -16.692 -10.276 1.00 62.25 H new ATOM 0 HG LEU A 455 0.088 -14.947 -8.975 1.00 32.14 H new ATOM 0 HD11 LEU A 455 -1.691 -13.681 -10.128 1.00 2.23 H new ATOM 0 HD12 LEU A 455 -0.072 -13.238 -10.722 1.00 2.23 H new ATOM 0 HD13 LEU A 455 -1.114 -14.306 -11.691 1.00 2.23 H new ATOM 0 HD21 LEU A 455 -2.133 -15.967 -9.276 1.00 33.55 H new ATOM 0 HD22 LEU A 455 -1.585 -16.699 -10.803 1.00 33.55 H new ATOM 0 HD23 LEU A 455 -0.838 -17.188 -9.264 1.00 33.55 H new ATOM 329 N ALA A 456 2.649 -13.286 -8.899 1.00 74.42 N ATOM 330 CA ALA A 456 3.075 -12.935 -7.539 1.00 71.30 C ATOM 331 C ALA A 456 2.000 -12.125 -6.800 1.00 41.31 C ATOM 332 O ALA A 456 1.446 -11.170 -7.345 1.00 14.33 O ATOM 333 CB ALA A 456 4.385 -12.155 -7.591 1.00 12.24 C ATOM 0 H ALA A 456 2.306 -12.498 -9.449 1.00 74.42 H new ATOM 0 HA ALA A 456 3.227 -13.861 -6.984 1.00 71.30 H new ATOM 0 HB1 ALA A 456 4.696 -11.898 -6.578 1.00 12.24 H new ATOM 0 HB2 ALA A 456 5.154 -12.767 -8.062 1.00 12.24 H new ATOM 0 HB3 ALA A 456 4.242 -11.242 -8.170 1.00 12.24 H new ATOM 339 N GLU A 457 1.705 -12.510 -5.558 1.00 23.24 N ATOM 340 CA GLU A 457 0.741 -11.776 -4.728 1.00 41.04 C ATOM 341 C GLU A 457 1.427 -11.091 -3.541 1.00 23.40 C ATOM 342 O GLU A 457 2.318 -11.656 -2.903 1.00 51.12 O ATOM 343 CB GLU A 457 -0.375 -12.703 -4.214 1.00 11.00 C ATOM 344 CG GLU A 457 -1.469 -12.975 -5.238 1.00 11.22 C ATOM 345 CD GLU A 457 -2.579 -13.868 -4.704 1.00 61.55 C ATOM 346 OE1 GLU A 457 -2.314 -15.056 -4.421 1.00 35.52 O ATOM 347 OE2 GLU A 457 -3.727 -13.391 -4.570 1.00 51.53 O ATOM 0 H GLU A 457 2.117 -13.324 -5.102 1.00 23.24 H new ATOM 0 HA GLU A 457 0.298 -11.010 -5.364 1.00 41.04 H new ATOM 0 HB2 GLU A 457 0.066 -13.651 -3.907 1.00 11.00 H new ATOM 0 HB3 GLU A 457 -0.824 -12.258 -3.326 1.00 11.00 H new ATOM 0 HG2 GLU A 457 -1.898 -12.027 -5.563 1.00 11.22 H new ATOM 0 HG3 GLU A 457 -1.027 -13.442 -6.118 1.00 11.22 H new ATOM 354 N TYR A 458 0.990 -9.872 -3.247 1.00 31.11 N ATOM 355 CA TYR A 458 1.518 -9.103 -2.116 1.00 12.13 C ATOM 356 C TYR A 458 0.392 -8.725 -1.143 1.00 3.32 C ATOM 357 O TYR A 458 -0.779 -8.667 -1.525 1.00 24.14 O ATOM 358 CB TYR A 458 2.232 -7.834 -2.610 1.00 23.42 C ATOM 359 CG TYR A 458 3.469 -8.101 -3.461 1.00 65.22 C ATOM 360 CD1 TYR A 458 3.354 -8.503 -4.789 1.00 23.21 C ATOM 361 CD2 TYR A 458 4.749 -7.948 -2.936 1.00 10.14 C ATOM 362 CE1 TYR A 458 4.474 -8.749 -5.563 1.00 5.11 C ATOM 363 CE2 TYR A 458 5.871 -8.191 -3.704 1.00 3.23 C ATOM 364 CZ TYR A 458 5.729 -8.592 -5.016 1.00 52.14 C ATOM 365 OH TYR A 458 6.846 -8.835 -5.783 1.00 23.35 O ATOM 0 H TYR A 458 0.266 -9.388 -3.778 1.00 31.11 H new ATOM 0 HA TYR A 458 2.239 -9.729 -1.590 1.00 12.13 H new ATOM 0 HB2 TYR A 458 1.528 -7.238 -3.190 1.00 23.42 H new ATOM 0 HB3 TYR A 458 2.522 -7.235 -1.747 1.00 23.42 H new ATOM 0 HD1 TYR A 458 2.373 -8.625 -5.223 1.00 23.21 H new ATOM 0 HD2 TYR A 458 4.867 -7.634 -1.910 1.00 10.14 H new ATOM 0 HE1 TYR A 458 4.365 -9.063 -6.591 1.00 5.11 H new ATOM 0 HE2 TYR A 458 6.856 -8.067 -3.279 1.00 3.23 H new ATOM 0 HH TYR A 458 7.509 -9.322 -5.250 1.00 23.35 H new ATOM 375 N GLU A 459 0.761 -8.452 0.106 1.00 41.24 N ATOM 376 CA GLU A 459 -0.201 -8.187 1.182 1.00 25.32 C ATOM 377 C GLU A 459 0.022 -6.795 1.792 1.00 72.21 C ATOM 378 O GLU A 459 1.142 -6.444 2.171 1.00 4.51 O ATOM 379 CB GLU A 459 -0.052 -9.257 2.276 1.00 75.24 C ATOM 380 CG GLU A 459 -0.180 -10.688 1.763 1.00 63.34 C ATOM 381 CD GLU A 459 0.148 -11.720 2.828 1.00 61.53 C ATOM 382 OE1 GLU A 459 -0.746 -12.054 3.638 1.00 54.52 O ATOM 383 OE2 GLU A 459 1.303 -12.195 2.871 1.00 73.03 O ATOM 0 H GLU A 459 1.735 -8.407 0.405 1.00 41.24 H new ATOM 0 HA GLU A 459 -1.206 -8.220 0.762 1.00 25.32 H new ATOM 0 HB2 GLU A 459 0.920 -9.139 2.756 1.00 75.24 H new ATOM 0 HB3 GLU A 459 -0.809 -9.087 3.042 1.00 75.24 H new ATOM 0 HG2 GLU A 459 -1.196 -10.852 1.404 1.00 63.34 H new ATOM 0 HG3 GLU A 459 0.486 -10.826 0.911 1.00 63.34 H new ATOM 390 N VAL A 460 -1.047 -6.008 1.888 1.00 52.50 N ATOM 391 CA VAL A 460 -0.971 -4.653 2.448 1.00 44.02 C ATOM 392 C VAL A 460 -1.784 -4.538 3.747 1.00 52.33 C ATOM 393 O VAL A 460 -2.998 -4.747 3.751 1.00 74.32 O ATOM 394 CB VAL A 460 -1.488 -3.596 1.438 1.00 31.31 C ATOM 395 CG1 VAL A 460 -1.298 -2.181 1.986 1.00 1.51 C ATOM 396 CG2 VAL A 460 -0.799 -3.757 0.084 1.00 10.12 C ATOM 0 H VAL A 460 -1.981 -6.283 1.585 1.00 52.50 H new ATOM 0 HA VAL A 460 0.080 -4.462 2.664 1.00 44.02 H new ATOM 0 HB VAL A 460 -2.556 -3.759 1.293 1.00 31.31 H new ATOM 0 HG11 VAL A 460 -1.668 -1.457 1.260 1.00 1.51 H new ATOM 0 HG12 VAL A 460 -1.852 -2.075 2.919 1.00 1.51 H new ATOM 0 HG13 VAL A 460 -0.239 -2.001 2.170 1.00 1.51 H new ATOM 0 HG21 VAL A 460 -1.177 -3.005 -0.608 1.00 10.12 H new ATOM 0 HG22 VAL A 460 0.277 -3.630 0.206 1.00 10.12 H new ATOM 0 HG23 VAL A 460 -1.004 -4.751 -0.313 1.00 10.12 H new ATOM 406 N HIS A 461 -1.109 -4.208 4.845 1.00 23.21 N ATOM 407 CA HIS A 461 -1.778 -4.002 6.138 1.00 33.10 C ATOM 408 C HIS A 461 -2.063 -2.510 6.379 1.00 10.50 C ATOM 409 O HIS A 461 -1.154 -1.739 6.684 1.00 53.14 O ATOM 410 CB HIS A 461 -0.918 -4.560 7.282 1.00 23.53 C ATOM 411 CG HIS A 461 -0.822 -6.057 7.309 1.00 13.45 C ATOM 412 ND1 HIS A 461 -1.471 -6.834 8.246 1.00 21.32 N ATOM 413 CD2 HIS A 461 -0.140 -6.924 6.520 1.00 55.04 C ATOM 414 CE1 HIS A 461 -1.187 -8.102 8.040 1.00 65.45 C ATOM 415 NE2 HIS A 461 -0.384 -8.188 6.999 1.00 21.21 N ATOM 0 H HIS A 461 -0.098 -4.076 4.871 1.00 23.21 H new ATOM 0 HA HIS A 461 -2.728 -4.536 6.113 1.00 33.10 H new ATOM 0 HB2 HIS A 461 0.087 -4.145 7.202 1.00 23.53 H new ATOM 0 HB3 HIS A 461 -1.330 -4.217 8.231 1.00 23.53 H new ATOM 0 HD1 HIS A 461 -2.078 -6.480 8.985 1.00 21.32 H new ATOM 0 HD2 HIS A 461 0.479 -6.668 5.673 1.00 55.04 H new ATOM 0 HE1 HIS A 461 -1.551 -8.933 8.626 1.00 65.45 H new ATOM 424 N VAL A 462 -3.323 -2.109 6.225 1.00 70.12 N ATOM 425 CA VAL A 462 -3.725 -0.710 6.429 1.00 43.35 C ATOM 426 C VAL A 462 -4.513 -0.549 7.739 1.00 71.54 C ATOM 427 O VAL A 462 -5.513 -1.229 7.961 1.00 0.44 O ATOM 428 CB VAL A 462 -4.566 -0.184 5.230 1.00 72.13 C ATOM 429 CG1 VAL A 462 -3.795 -0.359 3.922 1.00 52.23 C ATOM 430 CG2 VAL A 462 -5.928 -0.881 5.142 1.00 54.45 C ATOM 0 H VAL A 462 -4.087 -2.730 5.959 1.00 70.12 H new ATOM 0 HA VAL A 462 -2.814 -0.115 6.496 1.00 43.35 H new ATOM 0 HB VAL A 462 -4.749 0.878 5.397 1.00 72.13 H new ATOM 0 HG11 VAL A 462 -4.396 0.013 3.093 1.00 52.23 H new ATOM 0 HG12 VAL A 462 -2.861 0.200 3.973 1.00 52.23 H new ATOM 0 HG13 VAL A 462 -3.577 -1.416 3.766 1.00 52.23 H new ATOM 0 HG21 VAL A 462 -6.485 -0.486 4.292 1.00 54.45 H new ATOM 0 HG22 VAL A 462 -5.780 -1.953 5.012 1.00 54.45 H new ATOM 0 HG23 VAL A 462 -6.489 -0.700 6.059 1.00 54.45 H new ATOM 440 N LYS A 463 -4.061 0.344 8.616 1.00 54.33 N ATOM 441 CA LYS A 463 -4.689 0.495 9.938 1.00 41.50 C ATOM 442 C LYS A 463 -4.788 1.952 10.399 1.00 43.52 C ATOM 443 O LYS A 463 -4.064 2.832 9.929 1.00 34.22 O ATOM 444 CB LYS A 463 -3.931 -0.319 10.995 1.00 65.24 C ATOM 445 CG LYS A 463 -2.419 -0.313 10.818 1.00 43.21 C ATOM 446 CD LYS A 463 -1.704 -0.760 12.089 1.00 53.41 C ATOM 447 CE LYS A 463 -0.294 -1.255 11.805 1.00 63.52 C ATOM 448 NZ LYS A 463 -0.301 -2.547 11.071 1.00 1.40 N ATOM 0 H LYS A 463 -3.273 0.969 8.445 1.00 54.33 H new ATOM 0 HA LYS A 463 -5.706 0.117 9.829 1.00 41.50 H new ATOM 0 HB2 LYS A 463 -4.172 0.074 11.983 1.00 65.24 H new ATOM 0 HB3 LYS A 463 -4.285 -1.349 10.967 1.00 65.24 H new ATOM 0 HG2 LYS A 463 -2.146 -0.973 9.995 1.00 43.21 H new ATOM 0 HG3 LYS A 463 -2.088 0.689 10.547 1.00 43.21 H new ATOM 0 HD2 LYS A 463 -1.662 0.071 12.793 1.00 53.41 H new ATOM 0 HD3 LYS A 463 -2.277 -1.554 12.568 1.00 53.41 H new ATOM 0 HE2 LYS A 463 0.243 -0.508 11.221 1.00 63.52 H new ATOM 0 HE3 LYS A 463 0.246 -1.373 12.744 1.00 63.52 H new ATOM 0 HZ1 LYS A 463 0.018 -3.308 11.704 1.00 1.40 H new ATOM 0 HZ2 LYS A 463 -1.265 -2.753 10.740 1.00 1.40 H new ATOM 0 HZ3 LYS A 463 0.339 -2.485 10.254 1.00 1.40 H new ATOM 462 N ASN A 464 -5.709 2.178 11.331 1.00 13.42 N ATOM 463 CA ASN A 464 -5.894 3.478 11.972 1.00 54.14 C ATOM 464 C ASN A 464 -5.386 3.411 13.425 1.00 4.52 C ATOM 465 O ASN A 464 -5.778 2.526 14.178 1.00 41.43 O ATOM 466 CB ASN A 464 -7.389 3.834 11.945 1.00 14.43 C ATOM 467 CG ASN A 464 -7.695 5.253 12.389 1.00 14.44 C ATOM 468 OD1 ASN A 464 -6.973 5.853 13.182 1.00 63.34 O ATOM 469 ND2 ASN A 464 -8.785 5.795 11.886 1.00 53.31 N ATOM 0 H ASN A 464 -6.352 1.461 11.666 1.00 13.42 H new ATOM 0 HA ASN A 464 -5.330 4.244 11.440 1.00 54.14 H new ATOM 0 HB2 ASN A 464 -7.767 3.692 10.933 1.00 14.43 H new ATOM 0 HB3 ASN A 464 -7.929 3.139 12.588 1.00 14.43 H new ATOM 0 HD21 ASN A 464 -9.053 6.742 12.152 1.00 53.31 H new ATOM 0 HD22 ASN A 464 -9.361 5.267 11.230 1.00 53.31 H new ATOM 476 N LEU A 465 -4.531 4.350 13.818 1.00 5.30 N ATOM 477 CA LEU A 465 -3.937 4.339 15.165 1.00 71.34 C ATOM 478 C LEU A 465 -4.303 5.603 15.963 1.00 51.10 C ATOM 479 O LEU A 465 -3.679 5.909 16.982 1.00 72.44 O ATOM 480 CB LEU A 465 -2.411 4.194 15.059 1.00 52.44 C ATOM 481 CG LEU A 465 -1.924 2.906 14.369 1.00 75.21 C ATOM 482 CD1 LEU A 465 -0.398 2.852 14.317 1.00 4.23 C ATOM 483 CD2 LEU A 465 -2.481 1.668 15.074 1.00 4.22 C ATOM 0 H LEU A 465 -4.230 5.128 13.231 1.00 5.30 H new ATOM 0 HA LEU A 465 -4.346 3.486 15.706 1.00 71.34 H new ATOM 0 HB2 LEU A 465 -2.017 5.051 14.513 1.00 52.44 H new ATOM 0 HB3 LEU A 465 -1.987 4.233 16.062 1.00 52.44 H new ATOM 0 HG LEU A 465 -2.297 2.916 13.345 1.00 75.21 H new ATOM 0 HD11 LEU A 465 -0.083 1.932 13.825 1.00 4.23 H new ATOM 0 HD12 LEU A 465 -0.022 3.709 13.758 1.00 4.23 H new ATOM 0 HD13 LEU A 465 0.002 2.876 15.331 1.00 4.23 H new ATOM 0 HD21 LEU A 465 -2.124 0.770 14.569 1.00 4.22 H new ATOM 0 HD22 LEU A 465 -2.146 1.659 16.111 1.00 4.22 H new ATOM 0 HD23 LEU A 465 -3.570 1.692 15.044 1.00 4.22 H new ATOM 495 N GLY A 466 -5.329 6.321 15.508 1.00 74.31 N ATOM 496 CA GLY A 466 -5.771 7.532 16.201 1.00 25.04 C ATOM 497 C GLY A 466 -7.008 7.314 17.071 1.00 4.22 C ATOM 498 O GLY A 466 -7.368 8.170 17.879 1.00 43.14 O ATOM 0 H GLY A 466 -5.865 6.089 14.672 1.00 74.31 H new ATOM 0 HA2 GLY A 466 -4.958 7.903 16.825 1.00 25.04 H new ATOM 0 HA3 GLY A 466 -5.986 8.306 15.464 1.00 25.04 H new ATOM 502 N GLY A 467 -7.667 6.169 16.898 1.00 10.51 N ATOM 503 CA GLY A 467 -8.854 5.850 17.695 1.00 34.21 C ATOM 504 C GLY A 467 -10.126 6.554 17.215 1.00 2.25 C ATOM 505 O GLY A 467 -11.088 6.698 17.968 1.00 71.45 O ATOM 0 H GLY A 467 -7.404 5.453 16.221 1.00 10.51 H new ATOM 0 HA2 GLY A 467 -9.016 4.772 17.674 1.00 34.21 H new ATOM 0 HA3 GLY A 467 -8.668 6.124 18.733 1.00 34.21 H new ATOM 509 N ILE A 468 -10.130 6.985 15.957 1.00 12.13 N ATOM 510 CA ILE A 468 -11.297 7.645 15.354 1.00 51.15 C ATOM 511 C ILE A 468 -11.583 7.087 13.952 1.00 72.25 C ATOM 512 O ILE A 468 -10.675 6.957 13.133 1.00 12.31 O ATOM 513 CB ILE A 468 -11.097 9.187 15.277 1.00 64.10 C ATOM 514 CG1 ILE A 468 -12.163 9.835 14.370 1.00 5.23 C ATOM 515 CG2 ILE A 468 -9.691 9.530 14.786 1.00 73.42 C ATOM 516 CD1 ILE A 468 -12.089 11.348 14.302 1.00 0.22 C ATOM 0 H ILE A 468 -9.334 6.891 15.326 1.00 12.13 H new ATOM 0 HA ILE A 468 -12.153 7.438 15.996 1.00 51.15 H new ATOM 0 HB ILE A 468 -11.214 9.591 16.282 1.00 64.10 H new ATOM 0 HG12 ILE A 468 -12.059 9.432 13.362 1.00 5.23 H new ATOM 0 HG13 ILE A 468 -13.151 9.547 14.728 1.00 5.23 H new ATOM 0 HG21 ILE A 468 -9.576 10.613 14.741 1.00 73.42 H new ATOM 0 HG22 ILE A 468 -8.954 9.115 15.474 1.00 73.42 H new ATOM 0 HG23 ILE A 468 -9.539 9.107 13.793 1.00 73.42 H new ATOM 0 HD11 ILE A 468 -12.873 11.721 13.643 1.00 0.22 H new ATOM 0 HD12 ILE A 468 -12.225 11.764 15.300 1.00 0.22 H new ATOM 0 HD13 ILE A 468 -11.116 11.648 13.913 1.00 0.22 H new ATOM 528 N GLY A 469 -12.850 6.769 13.683 1.00 64.12 N ATOM 529 CA GLY A 469 -13.234 6.201 12.393 1.00 3.52 C ATOM 530 C GLY A 469 -13.061 7.166 11.222 1.00 4.13 C ATOM 531 O GLY A 469 -13.450 8.333 11.307 1.00 72.33 O ATOM 0 H GLY A 469 -13.622 6.895 14.337 1.00 64.12 H new ATOM 0 HA2 GLY A 469 -12.638 5.308 12.207 1.00 3.52 H new ATOM 0 HA3 GLY A 469 -14.276 5.885 12.441 1.00 3.52 H new ATOM 535 N VAL A 470 -12.481 6.674 10.125 1.00 2.51 N ATOM 536 CA VAL A 470 -12.201 7.497 8.943 1.00 42.30 C ATOM 537 C VAL A 470 -12.696 6.822 7.646 1.00 11.41 C ATOM 538 O VAL A 470 -12.220 5.746 7.275 1.00 34.23 O ATOM 539 CB VAL A 470 -10.680 7.777 8.813 1.00 45.40 C ATOM 540 CG1 VAL A 470 -10.386 8.667 7.608 1.00 14.22 C ATOM 541 CG2 VAL A 470 -10.135 8.405 10.093 1.00 12.04 C ATOM 0 H VAL A 470 -12.193 5.700 10.029 1.00 2.51 H new ATOM 0 HA VAL A 470 -12.739 8.435 9.079 1.00 42.30 H new ATOM 0 HB VAL A 470 -10.176 6.823 8.657 1.00 45.40 H new ATOM 0 HG11 VAL A 470 -9.313 8.847 7.542 1.00 14.22 H new ATOM 0 HG12 VAL A 470 -10.728 8.173 6.699 1.00 14.22 H new ATOM 0 HG13 VAL A 470 -10.907 9.618 7.722 1.00 14.22 H new ATOM 0 HG21 VAL A 470 -9.067 8.593 9.980 1.00 12.04 H new ATOM 0 HG22 VAL A 470 -10.651 9.346 10.285 1.00 12.04 H new ATOM 0 HG23 VAL A 470 -10.297 7.725 10.929 1.00 12.04 H new ATOM 551 N PRO A 471 -13.674 7.438 6.949 1.00 55.30 N ATOM 552 CA PRO A 471 -14.140 6.971 5.627 1.00 15.11 C ATOM 553 C PRO A 471 -13.221 7.431 4.479 1.00 14.20 C ATOM 554 O PRO A 471 -13.322 6.956 3.346 1.00 33.34 O ATOM 555 CB PRO A 471 -15.518 7.630 5.506 1.00 64.01 C ATOM 556 CG PRO A 471 -15.393 8.904 6.275 1.00 45.10 C ATOM 557 CD PRO A 471 -14.435 8.622 7.410 1.00 11.33 C ATOM 0 HA PRO A 471 -14.153 5.884 5.553 1.00 15.11 H new ATOM 0 HB2 PRO A 471 -15.777 7.819 4.464 1.00 64.01 H new ATOM 0 HB3 PRO A 471 -16.300 6.993 5.918 1.00 64.01 H new ATOM 0 HG2 PRO A 471 -15.018 9.706 5.640 1.00 45.10 H new ATOM 0 HG3 PRO A 471 -16.363 9.225 6.655 1.00 45.10 H new ATOM 0 HD2 PRO A 471 -13.778 9.471 7.598 1.00 11.33 H new ATOM 0 HD3 PRO A 471 -14.966 8.418 8.340 1.00 11.33 H new ATOM 565 N SER A 472 -12.314 8.343 4.802 1.00 71.31 N ATOM 566 CA SER A 472 -11.430 8.998 3.820 1.00 41.43 C ATOM 567 C SER A 472 -10.217 8.135 3.432 1.00 44.24 C ATOM 568 O SER A 472 -9.291 8.613 2.778 1.00 32.21 O ATOM 569 CB SER A 472 -10.947 10.342 4.377 1.00 25.44 C ATOM 570 OG SER A 472 -12.042 11.196 4.682 1.00 12.14 O ATOM 0 H SER A 472 -12.162 8.659 5.760 1.00 71.31 H new ATOM 0 HA SER A 472 -12.018 9.148 2.914 1.00 41.43 H new ATOM 0 HB2 SER A 472 -10.353 10.174 5.275 1.00 25.44 H new ATOM 0 HB3 SER A 472 -10.296 10.827 3.650 1.00 25.44 H new ATOM 0 HG SER A 472 -11.706 12.045 5.037 1.00 12.14 H new ATOM 576 N THR A 473 -10.227 6.861 3.810 1.00 54.40 N ATOM 577 CA THR A 473 -9.032 6.013 3.691 1.00 61.11 C ATOM 578 C THR A 473 -8.952 5.322 2.319 1.00 33.02 C ATOM 579 O THR A 473 -9.551 4.271 2.082 1.00 54.22 O ATOM 580 CB THR A 473 -9.016 4.928 4.799 1.00 42.40 C ATOM 581 OG1 THR A 473 -9.043 5.546 6.095 1.00 32.23 O ATOM 582 CG2 THR A 473 -7.784 4.031 4.689 1.00 20.45 C ATOM 0 H THR A 473 -11.042 6.389 4.200 1.00 54.40 H new ATOM 0 HA THR A 473 -8.170 6.670 3.802 1.00 61.11 H new ATOM 0 HB THR A 473 -9.903 4.308 4.667 1.00 42.40 H new ATOM 0 HG1 THR A 473 -9.034 4.853 6.788 1.00 32.23 H new ATOM 0 HG21 THR A 473 -7.807 3.283 5.481 1.00 20.45 H new ATOM 0 HG22 THR A 473 -7.782 3.533 3.720 1.00 20.45 H new ATOM 0 HG23 THR A 473 -6.883 4.637 4.787 1.00 20.45 H new ATOM 590 N LYS A 474 -8.212 5.952 1.408 1.00 74.23 N ATOM 591 CA LYS A 474 -7.964 5.405 0.068 1.00 21.32 C ATOM 592 C LYS A 474 -6.519 4.889 -0.046 1.00 42.14 C ATOM 593 O LYS A 474 -5.571 5.624 0.229 1.00 14.42 O ATOM 594 CB LYS A 474 -8.204 6.489 -0.992 1.00 43.15 C ATOM 595 CG LYS A 474 -9.555 7.188 -0.871 1.00 33.41 C ATOM 596 CD LYS A 474 -9.694 8.309 -1.897 1.00 34.20 C ATOM 597 CE LYS A 474 -10.980 9.108 -1.707 1.00 22.13 C ATOM 598 NZ LYS A 474 -12.200 8.285 -1.922 1.00 44.11 N ATOM 0 H LYS A 474 -7.767 6.855 1.574 1.00 74.23 H new ATOM 0 HA LYS A 474 -8.650 4.574 -0.097 1.00 21.32 H new ATOM 0 HB2 LYS A 474 -7.413 7.235 -0.919 1.00 43.15 H new ATOM 0 HB3 LYS A 474 -8.127 6.038 -1.981 1.00 43.15 H new ATOM 0 HG2 LYS A 474 -10.356 6.462 -1.012 1.00 33.41 H new ATOM 0 HG3 LYS A 474 -9.667 7.596 0.134 1.00 33.41 H new ATOM 0 HD2 LYS A 474 -8.837 8.979 -1.819 1.00 34.20 H new ATOM 0 HD3 LYS A 474 -9.677 7.885 -2.901 1.00 34.20 H new ATOM 0 HE2 LYS A 474 -11.000 9.524 -0.700 1.00 22.13 H new ATOM 0 HE3 LYS A 474 -10.987 9.949 -2.400 1.00 22.13 H new ATOM 0 HZ1 LYS A 474 -13.045 8.882 -1.815 1.00 44.11 H new ATOM 0 HZ2 LYS A 474 -12.181 7.880 -2.880 1.00 44.11 H new ATOM 0 HZ3 LYS A 474 -12.228 7.516 -1.222 1.00 44.11 H new ATOM 612 N VAL A 475 -6.350 3.634 -0.461 1.00 73.41 N ATOM 613 CA VAL A 475 -5.014 3.019 -0.567 1.00 71.21 C ATOM 614 C VAL A 475 -4.572 2.872 -2.035 1.00 43.02 C ATOM 615 O VAL A 475 -5.262 2.246 -2.837 1.00 32.25 O ATOM 616 CB VAL A 475 -4.997 1.621 0.105 1.00 20.05 C ATOM 617 CG1 VAL A 475 -3.591 1.015 0.083 1.00 33.32 C ATOM 618 CG2 VAL A 475 -5.537 1.706 1.534 1.00 14.45 C ATOM 0 H VAL A 475 -7.117 3.018 -0.731 1.00 73.41 H new ATOM 0 HA VAL A 475 -4.318 3.683 -0.054 1.00 71.21 H new ATOM 0 HB VAL A 475 -5.649 0.961 -0.467 1.00 20.05 H new ATOM 0 HG11 VAL A 475 -3.609 0.035 0.561 1.00 33.32 H new ATOM 0 HG12 VAL A 475 -3.257 0.909 -0.949 1.00 33.32 H new ATOM 0 HG13 VAL A 475 -2.905 1.668 0.622 1.00 33.32 H new ATOM 0 HG21 VAL A 475 -5.518 0.716 1.990 1.00 14.45 H new ATOM 0 HG22 VAL A 475 -4.917 2.386 2.117 1.00 14.45 H new ATOM 0 HG23 VAL A 475 -6.562 2.076 1.514 1.00 14.45 H new ATOM 628 N ARG A 476 -3.421 3.453 -2.383 1.00 3.11 N ATOM 629 CA ARG A 476 -2.874 3.341 -3.747 1.00 50.43 C ATOM 630 C ARG A 476 -1.535 2.581 -3.753 1.00 34.34 C ATOM 631 O ARG A 476 -0.754 2.676 -2.808 1.00 21.34 O ATOM 632 CB ARG A 476 -2.666 4.729 -4.375 1.00 21.12 C ATOM 633 CG ARG A 476 -3.924 5.595 -4.447 1.00 32.23 C ATOM 634 CD ARG A 476 -3.692 6.830 -5.316 1.00 12.31 C ATOM 635 NE ARG A 476 -4.803 7.784 -5.269 1.00 54.22 N ATOM 636 CZ ARG A 476 -5.488 8.168 -6.317 1.00 10.20 C ATOM 637 NH1 ARG A 476 -5.271 7.640 -7.481 1.00 54.05 N ATOM 638 NH2 ARG A 476 -6.384 9.092 -6.198 1.00 53.53 N ATOM 0 H ARG A 476 -2.848 4.005 -1.745 1.00 3.11 H new ATOM 0 HA ARG A 476 -3.602 2.784 -4.336 1.00 50.43 H new ATOM 0 HB2 ARG A 476 -1.907 5.262 -3.802 1.00 21.12 H new ATOM 0 HB3 ARG A 476 -2.272 4.601 -5.383 1.00 21.12 H new ATOM 0 HG2 ARG A 476 -4.749 5.010 -4.853 1.00 32.23 H new ATOM 0 HG3 ARG A 476 -4.216 5.903 -3.443 1.00 32.23 H new ATOM 0 HD2 ARG A 476 -2.779 7.329 -4.991 1.00 12.31 H new ATOM 0 HD3 ARG A 476 -3.534 6.516 -6.348 1.00 12.31 H new ATOM 0 HE ARG A 476 -5.059 8.174 -4.362 1.00 54.22 H new ATOM 0 HH11 ARG A 476 -4.560 6.917 -7.588 1.00 54.05 H new ATOM 0 HH12 ARG A 476 -5.811 7.948 -8.289 1.00 54.05 H new ATOM 0 HH21 ARG A 476 -6.557 9.521 -5.289 1.00 53.53 H new ATOM 0 HH22 ARG A 476 -6.918 9.392 -7.013 1.00 53.53 H new ATOM 652 N VAL A 477 -1.274 1.834 -4.829 1.00 63.33 N ATOM 653 CA VAL A 477 -0.003 1.107 -4.991 1.00 72.23 C ATOM 654 C VAL A 477 0.729 1.540 -6.272 1.00 35.42 C ATOM 655 O VAL A 477 0.193 1.425 -7.379 1.00 10.11 O ATOM 656 CB VAL A 477 -0.227 -0.428 -5.024 1.00 34.42 C ATOM 657 CG1 VAL A 477 1.074 -1.174 -5.332 1.00 22.11 C ATOM 658 CG2 VAL A 477 -0.818 -0.911 -3.701 1.00 52.22 C ATOM 0 H VAL A 477 -1.925 1.714 -5.605 1.00 63.33 H new ATOM 0 HA VAL A 477 0.613 1.356 -4.127 1.00 72.23 H new ATOM 0 HB VAL A 477 -0.935 -0.645 -5.824 1.00 34.42 H new ATOM 0 HG11 VAL A 477 0.883 -2.247 -5.348 1.00 22.11 H new ATOM 0 HG12 VAL A 477 1.453 -0.858 -6.304 1.00 22.11 H new ATOM 0 HG13 VAL A 477 1.813 -0.948 -4.564 1.00 22.11 H new ATOM 0 HG21 VAL A 477 -0.968 -1.990 -3.742 1.00 52.22 H new ATOM 0 HG22 VAL A 477 -0.133 -0.671 -2.887 1.00 52.22 H new ATOM 0 HG23 VAL A 477 -1.774 -0.418 -3.528 1.00 52.22 H new ATOM 668 N TYR A 478 1.959 2.029 -6.113 1.00 14.02 N ATOM 669 CA TYR A 478 2.767 2.513 -7.242 1.00 33.44 C ATOM 670 C TYR A 478 3.983 1.610 -7.503 1.00 24.24 C ATOM 671 O TYR A 478 4.617 1.123 -6.571 1.00 11.13 O ATOM 672 CB TYR A 478 3.258 3.943 -6.968 1.00 71.14 C ATOM 673 CG TYR A 478 2.149 4.958 -6.764 1.00 54.44 C ATOM 674 CD1 TYR A 478 1.590 5.632 -7.845 1.00 64.04 C ATOM 675 CD2 TYR A 478 1.666 5.248 -5.492 1.00 64.03 C ATOM 676 CE1 TYR A 478 0.585 6.563 -7.664 1.00 23.20 C ATOM 677 CE2 TYR A 478 0.660 6.176 -5.305 1.00 55.03 C ATOM 678 CZ TYR A 478 0.123 6.831 -6.392 1.00 32.24 C ATOM 679 OH TYR A 478 -0.876 7.760 -6.205 1.00 21.43 O ATOM 0 H TYR A 478 2.424 2.102 -5.208 1.00 14.02 H new ATOM 0 HA TYR A 478 2.129 2.497 -8.125 1.00 33.44 H new ATOM 0 HB2 TYR A 478 3.892 3.933 -6.082 1.00 71.14 H new ATOM 0 HB3 TYR A 478 3.881 4.266 -7.802 1.00 71.14 H new ATOM 0 HD1 TYR A 478 1.948 5.424 -8.843 1.00 64.04 H new ATOM 0 HD2 TYR A 478 2.085 4.739 -4.636 1.00 64.03 H new ATOM 0 HE1 TYR A 478 0.163 7.078 -8.514 1.00 23.20 H new ATOM 0 HE2 TYR A 478 0.296 6.387 -4.311 1.00 55.03 H new ATOM 0 HH TYR A 478 -0.653 8.330 -5.440 1.00 21.43 H new ATOM 689 N ILE A 479 4.301 1.393 -8.779 1.00 70.35 N ATOM 690 CA ILE A 479 5.492 0.631 -9.175 1.00 65.55 C ATOM 691 C ILE A 479 6.386 1.462 -10.114 1.00 11.20 C ATOM 692 O ILE A 479 6.000 1.759 -11.247 1.00 44.22 O ATOM 693 CB ILE A 479 5.106 -0.700 -9.875 1.00 74.52 C ATOM 694 CG1 ILE A 479 4.195 -1.543 -8.963 1.00 45.31 C ATOM 695 CG2 ILE A 479 6.359 -1.487 -10.262 1.00 22.21 C ATOM 696 CD1 ILE A 479 3.774 -2.870 -9.565 1.00 11.24 C ATOM 0 H ILE A 479 3.747 1.736 -9.564 1.00 70.35 H new ATOM 0 HA ILE A 479 6.044 0.399 -8.264 1.00 65.55 H new ATOM 0 HB ILE A 479 4.556 -0.464 -10.786 1.00 74.52 H new ATOM 0 HG12 ILE A 479 4.714 -1.731 -8.023 1.00 45.31 H new ATOM 0 HG13 ILE A 479 3.302 -0.965 -8.725 1.00 45.31 H new ATOM 0 HG21 ILE A 479 6.068 -2.417 -10.751 1.00 22.21 H new ATOM 0 HG22 ILE A 479 6.966 -0.892 -10.945 1.00 22.21 H new ATOM 0 HG23 ILE A 479 6.937 -1.714 -9.366 1.00 22.21 H new ATOM 0 HD11 ILE A 479 3.135 -3.403 -8.861 1.00 11.24 H new ATOM 0 HD12 ILE A 479 3.226 -2.692 -10.490 1.00 11.24 H new ATOM 0 HD13 ILE A 479 4.659 -3.470 -9.777 1.00 11.24 H new ATOM 708 N ASN A 480 7.571 1.851 -9.628 1.00 20.24 N ATOM 709 CA ASN A 480 8.508 2.697 -10.395 1.00 71.21 C ATOM 710 C ASN A 480 7.843 3.985 -10.926 1.00 63.42 C ATOM 711 O ASN A 480 8.185 4.471 -12.007 1.00 70.14 O ATOM 712 CB ASN A 480 9.123 1.916 -11.569 1.00 4.03 C ATOM 713 CG ASN A 480 10.104 0.845 -11.124 1.00 33.02 C ATOM 714 OD1 ASN A 480 10.674 0.918 -10.040 1.00 62.22 O ATOM 715 ND2 ASN A 480 10.336 -0.138 -11.969 1.00 65.01 N ATOM 0 H ASN A 480 7.910 1.594 -8.701 1.00 20.24 H new ATOM 0 HA ASN A 480 9.295 2.988 -9.699 1.00 71.21 H new ATOM 0 HB2 ASN A 480 8.324 1.451 -12.146 1.00 4.03 H new ATOM 0 HB3 ASN A 480 9.633 2.613 -12.234 1.00 4.03 H new ATOM 0 HD21 ASN A 480 11.007 -0.868 -11.730 1.00 65.01 H new ATOM 0 HD22 ASN A 480 9.845 -0.169 -12.862 1.00 65.01 H new ATOM 722 N GLY A 481 6.914 4.543 -10.153 1.00 54.00 N ATOM 723 CA GLY A 481 6.238 5.776 -10.562 1.00 24.40 C ATOM 724 C GLY A 481 4.959 5.543 -11.369 1.00 21.40 C ATOM 725 O GLY A 481 4.327 6.496 -11.833 1.00 1.23 O ATOM 0 H GLY A 481 6.614 4.169 -9.253 1.00 54.00 H new ATOM 0 HA2 GLY A 481 5.994 6.357 -9.673 1.00 24.40 H new ATOM 0 HA3 GLY A 481 6.927 6.376 -11.156 1.00 24.40 H new ATOM 729 N THR A 482 4.580 4.280 -11.549 1.00 61.35 N ATOM 730 CA THR A 482 3.344 3.930 -12.273 1.00 61.31 C ATOM 731 C THR A 482 2.286 3.348 -11.327 1.00 62.05 C ATOM 732 O THR A 482 2.528 2.337 -10.671 1.00 23.21 O ATOM 733 CB THR A 482 3.613 2.896 -13.398 1.00 11.23 C ATOM 734 OG1 THR A 482 4.593 3.401 -14.318 1.00 71.34 O ATOM 735 CG2 THR A 482 2.333 2.559 -14.159 1.00 52.02 C ATOM 0 H THR A 482 5.106 3.476 -11.206 1.00 61.35 H new ATOM 0 HA THR A 482 2.975 4.857 -12.712 1.00 61.31 H new ATOM 0 HB THR A 482 3.988 1.988 -12.926 1.00 11.23 H new ATOM 0 HG1 THR A 482 4.754 2.738 -15.021 1.00 71.34 H new ATOM 0 HG21 THR A 482 2.555 1.832 -14.940 1.00 52.02 H new ATOM 0 HG22 THR A 482 1.600 2.139 -13.470 1.00 52.02 H new ATOM 0 HG23 THR A 482 1.929 3.465 -14.611 1.00 52.02 H new ATOM 743 N LEU A 483 1.114 3.976 -11.260 1.00 2.33 N ATOM 744 CA LEU A 483 0.020 3.457 -10.429 1.00 51.23 C ATOM 745 C LEU A 483 -0.451 2.092 -10.946 1.00 4.02 C ATOM 746 O LEU A 483 -0.972 1.981 -12.058 1.00 60.41 O ATOM 747 CB LEU A 483 -1.165 4.439 -10.397 1.00 50.31 C ATOM 748 CG LEU A 483 -2.374 3.981 -9.552 1.00 44.51 C ATOM 749 CD1 LEU A 483 -1.986 3.818 -8.082 1.00 72.42 C ATOM 750 CD2 LEU A 483 -3.545 4.954 -9.694 1.00 21.10 C ATOM 0 H LEU A 483 0.895 4.836 -11.763 1.00 2.33 H new ATOM 0 HA LEU A 483 0.402 3.340 -9.415 1.00 51.23 H new ATOM 0 HB2 LEU A 483 -0.813 5.396 -10.011 1.00 50.31 H new ATOM 0 HB3 LEU A 483 -1.501 4.612 -11.419 1.00 50.31 H new ATOM 0 HG LEU A 483 -2.692 3.009 -9.930 1.00 44.51 H new ATOM 0 HD11 LEU A 483 -2.856 3.495 -7.510 1.00 72.42 H new ATOM 0 HD12 LEU A 483 -1.196 3.072 -7.995 1.00 72.42 H new ATOM 0 HD13 LEU A 483 -1.629 4.771 -7.692 1.00 72.42 H new ATOM 0 HD21 LEU A 483 -4.382 4.607 -9.088 1.00 21.10 H new ATOM 0 HD22 LEU A 483 -3.239 5.944 -9.356 1.00 21.10 H new ATOM 0 HD23 LEU A 483 -3.850 5.006 -10.739 1.00 21.10 H new ATOM 762 N TYR A 484 -0.254 1.053 -10.141 1.00 22.33 N ATOM 763 CA TYR A 484 -0.665 -0.303 -10.515 1.00 11.54 C ATOM 764 C TYR A 484 -2.147 -0.559 -10.186 1.00 64.13 C ATOM 765 O TYR A 484 -2.884 -1.105 -11.006 1.00 62.35 O ATOM 766 CB TYR A 484 0.234 -1.334 -9.802 1.00 54.45 C ATOM 767 CG TYR A 484 -0.388 -2.715 -9.670 1.00 51.24 C ATOM 768 CD1 TYR A 484 -0.479 -3.580 -10.760 1.00 11.41 C ATOM 769 CD2 TYR A 484 -0.911 -3.141 -8.455 1.00 40.11 C ATOM 770 CE1 TYR A 484 -1.070 -4.826 -10.632 1.00 45.24 C ATOM 771 CE2 TYR A 484 -1.504 -4.377 -8.326 1.00 42.12 C ATOM 772 CZ TYR A 484 -1.582 -5.215 -9.413 1.00 61.53 C ATOM 773 OH TYR A 484 -2.183 -6.446 -9.280 1.00 32.24 O ATOM 0 H TYR A 484 0.188 1.120 -9.224 1.00 22.33 H new ATOM 0 HA TYR A 484 -0.550 -0.408 -11.594 1.00 11.54 H new ATOM 0 HB2 TYR A 484 1.173 -1.421 -10.349 1.00 54.45 H new ATOM 0 HB3 TYR A 484 0.478 -0.961 -8.807 1.00 54.45 H new ATOM 0 HD1 TYR A 484 -0.083 -3.274 -11.717 1.00 11.41 H new ATOM 0 HD2 TYR A 484 -0.851 -2.490 -7.595 1.00 40.11 H new ATOM 0 HE1 TYR A 484 -1.129 -5.489 -11.483 1.00 45.24 H new ATOM 0 HE2 TYR A 484 -1.907 -4.687 -7.373 1.00 42.12 H new ATOM 0 HH TYR A 484 -1.715 -7.101 -9.840 1.00 32.24 H new ATOM 783 N LYS A 485 -2.579 -0.156 -8.990 1.00 34.21 N ATOM 784 CA LYS A 485 -3.967 -0.373 -8.555 1.00 20.14 C ATOM 785 C LYS A 485 -4.267 0.368 -7.240 1.00 34.34 C ATOM 786 O LYS A 485 -3.351 0.726 -6.493 1.00 54.25 O ATOM 787 CB LYS A 485 -4.236 -1.884 -8.412 1.00 72.03 C ATOM 788 CG LYS A 485 -5.671 -2.249 -8.021 1.00 41.04 C ATOM 789 CD LYS A 485 -6.052 -3.656 -8.485 1.00 34.53 C ATOM 790 CE LYS A 485 -5.052 -4.715 -8.030 1.00 62.12 C ATOM 791 NZ LYS A 485 -5.419 -6.070 -8.521 1.00 53.14 N ATOM 0 H LYS A 485 -1.993 0.321 -8.305 1.00 34.21 H new ATOM 0 HA LYS A 485 -4.635 0.036 -9.313 1.00 20.14 H new ATOM 0 HB2 LYS A 485 -3.997 -2.372 -9.357 1.00 72.03 H new ATOM 0 HB3 LYS A 485 -3.556 -2.290 -7.663 1.00 72.03 H new ATOM 0 HG2 LYS A 485 -5.780 -2.183 -6.938 1.00 41.04 H new ATOM 0 HG3 LYS A 485 -6.360 -1.525 -8.456 1.00 41.04 H new ATOM 0 HD2 LYS A 485 -7.041 -3.906 -8.100 1.00 34.53 H new ATOM 0 HD3 LYS A 485 -6.120 -3.670 -9.573 1.00 34.53 H new ATOM 0 HE2 LYS A 485 -4.057 -4.455 -8.392 1.00 62.12 H new ATOM 0 HE3 LYS A 485 -5.003 -4.724 -6.941 1.00 62.12 H new ATOM 0 HZ1 LYS A 485 -4.716 -6.761 -8.191 1.00 53.14 H new ATOM 0 HZ2 LYS A 485 -6.357 -6.329 -8.155 1.00 53.14 H new ATOM 0 HZ3 LYS A 485 -5.441 -6.068 -9.561 1.00 53.14 H new ATOM 805 N ASN A 486 -5.549 0.607 -6.970 1.00 40.34 N ATOM 806 CA ASN A 486 -5.971 1.297 -5.745 1.00 2.30 C ATOM 807 C ASN A 486 -7.293 0.739 -5.185 1.00 73.43 C ATOM 808 O ASN A 486 -8.116 0.192 -5.924 1.00 54.32 O ATOM 809 CB ASN A 486 -6.084 2.813 -5.998 1.00 12.24 C ATOM 810 CG ASN A 486 -6.780 3.178 -7.308 1.00 40.11 C ATOM 811 OD1 ASN A 486 -6.463 4.190 -7.921 1.00 65.23 O ATOM 812 ND2 ASN A 486 -7.735 2.382 -7.747 1.00 1.02 N ATOM 0 H ASN A 486 -6.318 0.334 -7.582 1.00 40.34 H new ATOM 0 HA ASN A 486 -5.206 1.117 -4.990 1.00 2.30 H new ATOM 0 HB2 ASN A 486 -6.628 3.269 -5.171 1.00 12.24 H new ATOM 0 HB3 ASN A 486 -5.084 3.246 -5.998 1.00 12.24 H new ATOM 0 HD21 ASN A 486 -8.226 2.604 -8.613 1.00 1.02 H new ATOM 0 HD22 ASN A 486 -7.983 1.544 -7.221 1.00 1.02 H new ATOM 819 N TRP A 487 -7.481 0.883 -3.873 1.00 10.34 N ATOM 820 CA TRP A 487 -8.703 0.431 -3.188 1.00 33.34 C ATOM 821 C TRP A 487 -9.285 1.550 -2.313 1.00 62.33 C ATOM 822 O TRP A 487 -8.550 2.401 -1.802 1.00 40.42 O ATOM 823 CB TRP A 487 -8.415 -0.786 -2.295 1.00 4.34 C ATOM 824 CG TRP A 487 -7.880 -1.984 -3.022 1.00 65.14 C ATOM 825 CD1 TRP A 487 -8.595 -3.051 -3.484 1.00 15.22 C ATOM 826 CD2 TRP A 487 -6.512 -2.240 -3.354 1.00 1.23 C ATOM 827 NE1 TRP A 487 -7.752 -3.955 -4.082 1.00 13.42 N ATOM 828 CE2 TRP A 487 -6.470 -3.479 -4.016 1.00 33.11 C ATOM 829 CE3 TRP A 487 -5.318 -1.540 -3.157 1.00 12.00 C ATOM 830 CZ2 TRP A 487 -5.282 -4.033 -4.481 1.00 5.02 C ATOM 831 CZ3 TRP A 487 -4.140 -2.092 -3.619 1.00 65.42 C ATOM 832 CH2 TRP A 487 -4.129 -3.327 -4.274 1.00 2.10 C ATOM 0 H TRP A 487 -6.796 1.314 -3.252 1.00 10.34 H new ATOM 0 HA TRP A 487 -9.422 0.156 -3.960 1.00 33.34 H new ATOM 0 HB2 TRP A 487 -7.699 -0.494 -1.527 1.00 4.34 H new ATOM 0 HB3 TRP A 487 -9.334 -1.069 -1.783 1.00 4.34 H new ATOM 0 HD1 TRP A 487 -9.665 -3.167 -3.393 1.00 15.22 H new ATOM 0 HE1 TRP A 487 -8.035 -4.838 -4.507 1.00 13.42 H new ATOM 0 HE3 TRP A 487 -5.317 -0.585 -2.653 1.00 12.00 H new ATOM 0 HZ2 TRP A 487 -5.270 -4.987 -4.988 1.00 5.02 H new ATOM 0 HZ3 TRP A 487 -3.211 -1.561 -3.472 1.00 65.42 H new ATOM 0 HH2 TRP A 487 -3.191 -3.732 -4.624 1.00 2.10 H new ATOM 843 N THR A 488 -10.602 1.558 -2.149 1.00 23.13 N ATOM 844 CA THR A 488 -11.264 2.508 -1.244 1.00 54.42 C ATOM 845 C THR A 488 -11.919 1.773 -0.069 1.00 52.41 C ATOM 846 O THR A 488 -12.807 0.942 -0.262 1.00 2.31 O ATOM 847 CB THR A 488 -12.336 3.351 -1.979 1.00 5.35 C ATOM 848 OG1 THR A 488 -11.730 4.090 -3.051 1.00 11.11 O ATOM 849 CG2 THR A 488 -13.027 4.317 -1.023 1.00 41.52 C ATOM 0 H THR A 488 -11.238 0.920 -2.628 1.00 23.13 H new ATOM 0 HA THR A 488 -10.492 3.180 -0.870 1.00 54.42 H new ATOM 0 HB THR A 488 -13.084 2.667 -2.381 1.00 5.35 H new ATOM 0 HG1 THR A 488 -12.414 4.619 -3.512 1.00 11.11 H new ATOM 0 HG21 THR A 488 -13.774 4.895 -1.567 1.00 41.52 H new ATOM 0 HG22 THR A 488 -13.513 3.755 -0.226 1.00 41.52 H new ATOM 0 HG23 THR A 488 -12.288 4.993 -0.592 1.00 41.52 H new ATOM 857 N VAL A 489 -11.485 2.089 1.148 1.00 63.11 N ATOM 858 CA VAL A 489 -11.987 1.417 2.354 1.00 1.03 C ATOM 859 C VAL A 489 -12.243 2.413 3.496 1.00 64.31 C ATOM 860 O VAL A 489 -11.947 3.602 3.387 1.00 41.22 O ATOM 861 CB VAL A 489 -10.998 0.323 2.851 1.00 44.03 C ATOM 862 CG1 VAL A 489 -10.858 -0.807 1.829 1.00 2.21 C ATOM 863 CG2 VAL A 489 -9.632 0.931 3.174 1.00 22.40 C ATOM 0 H VAL A 489 -10.785 2.808 1.331 1.00 63.11 H new ATOM 0 HA VAL A 489 -12.930 0.949 2.073 1.00 1.03 H new ATOM 0 HB VAL A 489 -11.409 -0.104 3.766 1.00 44.03 H new ATOM 0 HG11 VAL A 489 -10.160 -1.555 2.206 1.00 2.21 H new ATOM 0 HG12 VAL A 489 -11.831 -1.270 1.663 1.00 2.21 H new ATOM 0 HG13 VAL A 489 -10.483 -0.403 0.889 1.00 2.21 H new ATOM 0 HG21 VAL A 489 -8.958 0.148 3.519 1.00 22.40 H new ATOM 0 HG22 VAL A 489 -9.220 1.396 2.278 1.00 22.40 H new ATOM 0 HG23 VAL A 489 -9.744 1.683 3.955 1.00 22.40 H new ATOM 873 N SER A 490 -12.822 1.918 4.582 1.00 11.40 N ATOM 874 CA SER A 490 -13.039 2.723 5.790 1.00 64.23 C ATOM 875 C SER A 490 -12.382 2.057 7.002 1.00 40.40 C ATOM 876 O SER A 490 -12.463 0.838 7.167 1.00 73.23 O ATOM 877 CB SER A 490 -14.541 2.922 6.052 1.00 75.50 C ATOM 878 OG SER A 490 -15.218 1.680 6.212 1.00 53.02 O ATOM 0 H SER A 490 -13.154 0.956 4.657 1.00 11.40 H new ATOM 0 HA SER A 490 -12.582 3.700 5.631 1.00 64.23 H new ATOM 0 HB2 SER A 490 -14.677 3.528 6.948 1.00 75.50 H new ATOM 0 HB3 SER A 490 -14.985 3.474 5.223 1.00 75.50 H new ATOM 0 HG SER A 490 -16.170 1.845 6.379 1.00 53.02 H new ATOM 884 N LEU A 491 -11.734 2.849 7.850 1.00 22.24 N ATOM 885 CA LEU A 491 -11.070 2.312 9.044 1.00 30.54 C ATOM 886 C LEU A 491 -11.690 2.878 10.321 1.00 23.10 C ATOM 887 O LEU A 491 -11.648 4.083 10.559 1.00 44.31 O ATOM 888 CB LEU A 491 -9.569 2.644 9.015 1.00 33.53 C ATOM 889 CG LEU A 491 -8.751 1.930 7.928 1.00 44.44 C ATOM 890 CD1 LEU A 491 -7.304 2.418 7.935 1.00 12.04 C ATOM 891 CD2 LEU A 491 -8.802 0.416 8.120 1.00 11.03 C ATOM 0 H LEU A 491 -11.652 3.860 7.738 1.00 22.24 H new ATOM 0 HA LEU A 491 -11.204 1.230 9.040 1.00 30.54 H new ATOM 0 HB2 LEU A 491 -9.456 3.720 8.881 1.00 33.53 H new ATOM 0 HB3 LEU A 491 -9.142 2.397 9.987 1.00 33.53 H new ATOM 0 HG LEU A 491 -9.192 2.169 6.960 1.00 44.44 H new ATOM 0 HD11 LEU A 491 -6.742 1.900 7.158 1.00 12.04 H new ATOM 0 HD12 LEU A 491 -7.281 3.491 7.745 1.00 12.04 H new ATOM 0 HD13 LEU A 491 -6.855 2.211 8.907 1.00 12.04 H new ATOM 0 HD21 LEU A 491 -8.216 -0.070 7.340 1.00 11.03 H new ATOM 0 HD22 LEU A 491 -8.390 0.159 9.096 1.00 11.03 H new ATOM 0 HD23 LEU A 491 -9.836 0.076 8.062 1.00 11.03 H new ATOM 903 N GLY A 492 -12.235 1.997 11.152 1.00 44.22 N ATOM 904 CA GLY A 492 -12.823 2.416 12.416 1.00 73.24 C ATOM 905 C GLY A 492 -11.780 2.716 13.488 1.00 11.51 C ATOM 906 O GLY A 492 -10.575 2.742 13.207 1.00 63.25 O ATOM 0 H GLY A 492 -12.281 0.994 10.974 1.00 44.22 H new ATOM 0 HA2 GLY A 492 -13.432 3.305 12.250 1.00 73.24 H new ATOM 0 HA3 GLY A 492 -13.492 1.634 12.776 1.00 73.24 H new ATOM 910 N PRO A 493 -12.211 2.944 14.741 1.00 53.52 N ATOM 911 CA PRO A 493 -11.291 3.240 15.848 1.00 5.25 C ATOM 912 C PRO A 493 -10.301 2.089 16.110 1.00 20.44 C ATOM 913 O PRO A 493 -10.651 1.072 16.718 1.00 33.23 O ATOM 914 CB PRO A 493 -12.225 3.464 17.049 1.00 50.12 C ATOM 915 CG PRO A 493 -13.505 2.788 16.675 1.00 30.22 C ATOM 916 CD PRO A 493 -13.618 2.924 15.181 1.00 54.22 C ATOM 0 HA PRO A 493 -10.657 4.101 15.636 1.00 5.25 H new ATOM 0 HB2 PRO A 493 -11.805 3.038 17.960 1.00 50.12 H new ATOM 0 HB3 PRO A 493 -12.380 4.527 17.236 1.00 50.12 H new ATOM 0 HG2 PRO A 493 -13.495 1.739 16.973 1.00 30.22 H new ATOM 0 HG3 PRO A 493 -14.354 3.254 17.176 1.00 30.22 H new ATOM 0 HD2 PRO A 493 -14.167 2.091 14.741 1.00 54.22 H new ATOM 0 HD3 PRO A 493 -14.142 3.837 14.898 1.00 54.22 H new ATOM 924 N LYS A 494 -9.074 2.260 15.608 1.00 70.43 N ATOM 925 CA LYS A 494 -7.997 1.272 15.761 1.00 31.14 C ATOM 926 C LYS A 494 -8.297 -0.034 15.000 1.00 61.52 C ATOM 927 O LYS A 494 -8.009 -1.134 15.476 1.00 31.22 O ATOM 928 CB LYS A 494 -7.720 1.014 17.253 1.00 13.41 C ATOM 929 CG LYS A 494 -7.251 2.267 17.990 1.00 35.51 C ATOM 930 CD LYS A 494 -7.011 2.011 19.473 1.00 32.24 C ATOM 931 CE LYS A 494 -6.548 3.275 20.192 1.00 72.05 C ATOM 932 NZ LYS A 494 -6.280 3.026 21.629 1.00 3.01 N ATOM 0 H LYS A 494 -8.797 3.089 15.082 1.00 70.43 H new ATOM 0 HA LYS A 494 -7.094 1.686 15.312 1.00 31.14 H new ATOM 0 HB2 LYS A 494 -8.626 0.636 17.727 1.00 13.41 H new ATOM 0 HB3 LYS A 494 -6.962 0.236 17.349 1.00 13.41 H new ATOM 0 HG2 LYS A 494 -6.331 2.631 17.533 1.00 35.51 H new ATOM 0 HG3 LYS A 494 -7.997 3.054 17.876 1.00 35.51 H new ATOM 0 HD2 LYS A 494 -7.929 1.645 19.933 1.00 32.24 H new ATOM 0 HD3 LYS A 494 -6.261 1.229 19.591 1.00 32.24 H new ATOM 0 HE2 LYS A 494 -5.645 3.654 19.714 1.00 72.05 H new ATOM 0 HE3 LYS A 494 -7.309 4.049 20.093 1.00 72.05 H new ATOM 0 HZ1 LYS A 494 -5.968 3.909 22.082 1.00 3.01 H new ATOM 0 HZ2 LYS A 494 -7.149 2.688 22.091 1.00 3.01 H new ATOM 0 HZ3 LYS A 494 -5.535 2.306 21.724 1.00 3.01 H new ATOM 946 N GLU A 495 -8.853 0.107 13.795 1.00 52.41 N ATOM 947 CA GLU A 495 -9.174 -1.043 12.934 1.00 0.15 C ATOM 948 C GLU A 495 -8.094 -1.248 11.856 1.00 60.23 C ATOM 949 O GLU A 495 -7.443 -0.289 11.430 1.00 11.12 O ATOM 950 CB GLU A 495 -10.541 -0.819 12.268 1.00 23.11 C ATOM 951 CG GLU A 495 -11.018 -1.977 11.393 1.00 33.34 C ATOM 952 CD GLU A 495 -11.314 -3.247 12.182 1.00 32.23 C ATOM 953 OE1 GLU A 495 -10.373 -4.030 12.441 1.00 12.33 O ATOM 954 OE2 GLU A 495 -12.489 -3.476 12.534 1.00 32.33 O ATOM 0 H GLU A 495 -9.093 1.011 13.388 1.00 52.41 H new ATOM 0 HA GLU A 495 -9.208 -1.939 13.553 1.00 0.15 H new ATOM 0 HB2 GLU A 495 -11.284 -0.638 13.045 1.00 23.11 H new ATOM 0 HB3 GLU A 495 -10.490 0.083 11.658 1.00 23.11 H new ATOM 0 HG2 GLU A 495 -11.917 -1.672 10.858 1.00 33.34 H new ATOM 0 HG3 GLU A 495 -10.258 -2.193 10.642 1.00 33.34 H new ATOM 961 N GLU A 496 -7.911 -2.497 11.412 1.00 1.34 N ATOM 962 CA GLU A 496 -6.936 -2.812 10.356 1.00 41.23 C ATOM 963 C GLU A 496 -7.552 -3.715 9.274 1.00 51.21 C ATOM 964 O GLU A 496 -8.277 -4.664 9.579 1.00 31.44 O ATOM 965 CB GLU A 496 -5.695 -3.502 10.949 1.00 63.24 C ATOM 966 CG GLU A 496 -4.566 -3.694 9.937 1.00 35.34 C ATOM 967 CD GLU A 496 -3.392 -4.487 10.487 1.00 50.33 C ATOM 968 OE1 GLU A 496 -2.568 -3.906 11.224 1.00 64.13 O ATOM 969 OE2 GLU A 496 -3.281 -5.692 10.169 1.00 24.40 O ATOM 0 H GLU A 496 -8.423 -3.306 11.765 1.00 1.34 H new ATOM 0 HA GLU A 496 -6.641 -1.868 9.897 1.00 41.23 H new ATOM 0 HB2 GLU A 496 -5.325 -2.911 11.787 1.00 63.24 H new ATOM 0 HB3 GLU A 496 -5.985 -4.474 11.348 1.00 63.24 H new ATOM 0 HG2 GLU A 496 -4.959 -4.204 9.057 1.00 35.34 H new ATOM 0 HG3 GLU A 496 -4.213 -2.717 9.608 1.00 35.34 H new ATOM 976 N LYS A 497 -7.262 -3.410 8.008 1.00 55.00 N ATOM 977 CA LYS A 497 -7.713 -4.235 6.878 1.00 71.04 C ATOM 978 C LYS A 497 -6.503 -4.760 6.085 1.00 33.23 C ATOM 979 O LYS A 497 -5.480 -4.080 5.979 1.00 24.23 O ATOM 980 CB LYS A 497 -8.632 -3.426 5.943 1.00 12.23 C ATOM 981 CG LYS A 497 -9.724 -2.626 6.660 1.00 21.40 C ATOM 982 CD LYS A 497 -10.648 -3.505 7.502 1.00 51.44 C ATOM 983 CE LYS A 497 -11.466 -4.470 6.656 1.00 14.44 C ATOM 984 NZ LYS A 497 -12.256 -5.406 7.499 1.00 73.24 N ATOM 0 H LYS A 497 -6.714 -2.594 7.735 1.00 55.00 H new ATOM 0 HA LYS A 497 -8.275 -5.079 7.278 1.00 71.04 H new ATOM 0 HB2 LYS A 497 -8.020 -2.739 5.359 1.00 12.23 H new ATOM 0 HB3 LYS A 497 -9.104 -4.110 5.238 1.00 12.23 H new ATOM 0 HG2 LYS A 497 -9.258 -1.878 7.302 1.00 21.40 H new ATOM 0 HG3 LYS A 497 -10.317 -2.087 5.921 1.00 21.40 H new ATOM 0 HD2 LYS A 497 -10.052 -4.070 8.219 1.00 51.44 H new ATOM 0 HD3 LYS A 497 -11.322 -2.871 8.078 1.00 51.44 H new ATOM 0 HE2 LYS A 497 -12.139 -3.907 6.009 1.00 14.44 H new ATOM 0 HE3 LYS A 497 -10.801 -5.039 6.006 1.00 14.44 H new ATOM 0 HZ1 LYS A 497 -12.800 -6.048 6.888 1.00 73.24 H new ATOM 0 HZ2 LYS A 497 -11.612 -5.961 8.098 1.00 73.24 H new ATOM 0 HZ3 LYS A 497 -12.909 -4.864 8.101 1.00 73.24 H new ATOM 998 N VAL A 498 -6.613 -5.966 5.528 1.00 11.12 N ATOM 999 CA VAL A 498 -5.521 -6.552 4.736 1.00 4.03 C ATOM 1000 C VAL A 498 -5.920 -6.701 3.258 1.00 64.25 C ATOM 1001 O VAL A 498 -6.828 -7.462 2.921 1.00 40.14 O ATOM 1002 CB VAL A 498 -5.081 -7.929 5.300 1.00 52.21 C ATOM 1003 CG1 VAL A 498 -3.904 -8.497 4.504 1.00 31.11 C ATOM 1004 CG2 VAL A 498 -4.729 -7.815 6.784 1.00 61.43 C ATOM 0 H VAL A 498 -7.441 -6.557 5.607 1.00 11.12 H new ATOM 0 HA VAL A 498 -4.678 -5.864 4.805 1.00 4.03 H new ATOM 0 HB VAL A 498 -5.918 -8.620 5.199 1.00 52.21 H new ATOM 0 HG11 VAL A 498 -3.615 -9.462 4.920 1.00 31.11 H new ATOM 0 HG12 VAL A 498 -4.197 -8.624 3.462 1.00 31.11 H new ATOM 0 HG13 VAL A 498 -3.060 -7.810 4.562 1.00 31.11 H new ATOM 0 HG21 VAL A 498 -4.423 -8.791 7.161 1.00 61.43 H new ATOM 0 HG22 VAL A 498 -3.912 -7.104 6.911 1.00 61.43 H new ATOM 0 HG23 VAL A 498 -5.601 -7.468 7.339 1.00 61.43 H new ATOM 1014 N LEU A 499 -5.236 -5.965 2.382 1.00 71.02 N ATOM 1015 CA LEU A 499 -5.529 -5.981 0.940 1.00 2.24 C ATOM 1016 C LEU A 499 -4.438 -6.731 0.152 1.00 3.33 C ATOM 1017 O LEU A 499 -3.250 -6.476 0.330 1.00 2.32 O ATOM 1018 CB LEU A 499 -5.645 -4.540 0.419 1.00 42.33 C ATOM 1019 CG LEU A 499 -6.682 -3.664 1.145 1.00 12.34 C ATOM 1020 CD1 LEU A 499 -6.629 -2.226 0.635 1.00 30.14 C ATOM 1021 CD2 LEU A 499 -8.089 -4.245 0.987 1.00 63.42 C ATOM 0 H LEU A 499 -4.469 -5.345 2.644 1.00 71.02 H new ATOM 0 HA LEU A 499 -6.473 -6.505 0.793 1.00 2.24 H new ATOM 0 HB2 LEU A 499 -4.669 -4.062 0.499 1.00 42.33 H new ATOM 0 HB3 LEU A 499 -5.898 -4.573 -0.641 1.00 42.33 H new ATOM 0 HG LEU A 499 -6.436 -3.656 2.207 1.00 12.34 H new ATOM 0 HD11 LEU A 499 -7.370 -1.625 1.162 1.00 30.14 H new ATOM 0 HD12 LEU A 499 -5.636 -1.814 0.812 1.00 30.14 H new ATOM 0 HD13 LEU A 499 -6.843 -2.211 -0.434 1.00 30.14 H new ATOM 0 HD21 LEU A 499 -8.806 -3.610 1.508 1.00 63.42 H new ATOM 0 HD22 LEU A 499 -8.347 -4.291 -0.071 1.00 63.42 H new ATOM 0 HD23 LEU A 499 -8.118 -5.249 1.411 1.00 63.42 H new ATOM 1033 N THR A 500 -4.845 -7.655 -0.718 1.00 20.55 N ATOM 1034 CA THR A 500 -3.891 -8.400 -1.561 1.00 63.51 C ATOM 1035 C THR A 500 -4.057 -8.068 -3.045 1.00 21.42 C ATOM 1036 O THR A 500 -5.152 -7.739 -3.508 1.00 71.24 O ATOM 1037 CB THR A 500 -4.033 -9.935 -1.405 1.00 14.24 C ATOM 1038 OG1 THR A 500 -5.381 -10.346 -1.683 1.00 1.04 O ATOM 1039 CG2 THR A 500 -3.633 -10.397 -0.011 1.00 14.42 C ATOM 0 H THR A 500 -5.822 -7.910 -0.862 1.00 20.55 H new ATOM 0 HA THR A 500 -2.906 -8.088 -1.214 1.00 63.51 H new ATOM 0 HB THR A 500 -3.358 -10.399 -2.124 1.00 14.24 H new ATOM 0 HG1 THR A 500 -5.454 -11.318 -1.582 1.00 1.04 H new ATOM 0 HG21 THR A 500 -3.746 -11.479 0.060 1.00 14.42 H new ATOM 0 HG22 THR A 500 -2.594 -10.127 0.177 1.00 14.42 H new ATOM 0 HG23 THR A 500 -4.273 -9.916 0.729 1.00 14.42 H new ATOM 1047 N PHE A 501 -2.962 -8.166 -3.793 1.00 72.32 N ATOM 1048 CA PHE A 501 -2.997 -7.957 -5.241 1.00 1.14 C ATOM 1049 C PHE A 501 -2.019 -8.891 -5.965 1.00 31.14 C ATOM 1050 O PHE A 501 -0.969 -9.244 -5.427 1.00 4.12 O ATOM 1051 CB PHE A 501 -2.695 -6.491 -5.585 1.00 1.11 C ATOM 1052 CG PHE A 501 -1.371 -5.974 -5.067 1.00 11.22 C ATOM 1053 CD1 PHE A 501 -0.216 -6.081 -5.832 1.00 35.43 C ATOM 1054 CD2 PHE A 501 -1.287 -5.363 -3.823 1.00 22.42 C ATOM 1055 CE1 PHE A 501 0.989 -5.592 -5.368 1.00 12.44 C ATOM 1056 CE2 PHE A 501 -0.084 -4.870 -3.357 1.00 44.31 C ATOM 1057 CZ PHE A 501 1.054 -4.984 -4.129 1.00 2.04 C ATOM 0 H PHE A 501 -2.038 -8.389 -3.422 1.00 72.32 H new ATOM 0 HA PHE A 501 -4.003 -8.195 -5.585 1.00 1.14 H new ATOM 0 HB2 PHE A 501 -2.714 -6.376 -6.669 1.00 1.11 H new ATOM 0 HB3 PHE A 501 -3.494 -5.867 -5.184 1.00 1.11 H new ATOM 0 HD1 PHE A 501 -0.261 -6.553 -6.802 1.00 35.43 H new ATOM 0 HD2 PHE A 501 -2.173 -5.272 -3.212 1.00 22.42 H new ATOM 0 HE1 PHE A 501 1.879 -5.685 -5.972 1.00 12.44 H new ATOM 0 HE2 PHE A 501 -0.034 -4.395 -2.388 1.00 44.31 H new ATOM 0 HZ PHE A 501 1.995 -4.598 -3.765 1.00 2.04 H new ATOM 1067 N SER A 502 -2.375 -9.278 -7.188 1.00 12.43 N ATOM 1068 CA SER A 502 -1.558 -10.190 -7.999 1.00 60.21 C ATOM 1069 C SER A 502 -0.938 -9.456 -9.192 1.00 13.34 C ATOM 1070 O SER A 502 -1.641 -8.983 -10.088 1.00 32.15 O ATOM 1071 CB SER A 502 -2.410 -11.364 -8.500 1.00 50.42 C ATOM 1072 OG SER A 502 -3.504 -10.912 -9.286 1.00 43.53 O ATOM 0 H SER A 502 -3.233 -8.972 -7.647 1.00 12.43 H new ATOM 0 HA SER A 502 -0.754 -10.571 -7.370 1.00 60.21 H new ATOM 0 HB2 SER A 502 -1.791 -12.039 -9.090 1.00 50.42 H new ATOM 0 HB3 SER A 502 -2.782 -11.935 -7.649 1.00 50.42 H new ATOM 0 HG SER A 502 -3.258 -10.079 -9.741 1.00 43.53 H new ATOM 1078 N TRP A 503 0.385 -9.364 -9.202 1.00 70.43 N ATOM 1079 CA TRP A 503 1.109 -8.633 -10.245 1.00 32.25 C ATOM 1080 C TRP A 503 1.930 -9.586 -11.130 1.00 63.43 C ATOM 1081 O TRP A 503 2.575 -10.511 -10.635 1.00 64.25 O ATOM 1082 CB TRP A 503 2.019 -7.580 -9.595 1.00 71.51 C ATOM 1083 CG TRP A 503 2.890 -6.833 -10.566 1.00 22.30 C ATOM 1084 CD1 TRP A 503 2.488 -6.142 -11.675 1.00 62.10 C ATOM 1085 CD2 TRP A 503 4.314 -6.686 -10.498 1.00 20.31 C ATOM 1086 NE1 TRP A 503 3.574 -5.594 -12.309 1.00 33.23 N ATOM 1087 CE2 TRP A 503 4.706 -5.909 -11.603 1.00 14.10 C ATOM 1088 CE3 TRP A 503 5.295 -7.139 -9.611 1.00 50.20 C ATOM 1089 CZ2 TRP A 503 6.036 -5.575 -11.843 1.00 23.30 C ATOM 1090 CZ3 TRP A 503 6.614 -6.808 -9.851 1.00 74.31 C ATOM 1091 CH2 TRP A 503 6.973 -6.032 -10.959 1.00 65.41 C ATOM 0 H TRP A 503 0.987 -9.788 -8.496 1.00 70.43 H new ATOM 0 HA TRP A 503 0.383 -8.136 -10.888 1.00 32.25 H new ATOM 0 HB2 TRP A 503 1.399 -6.864 -9.055 1.00 71.51 H new ATOM 0 HB3 TRP A 503 2.654 -8.071 -8.858 1.00 71.51 H new ATOM 0 HD1 TRP A 503 1.464 -6.042 -12.004 1.00 62.10 H new ATOM 0 HE1 TRP A 503 3.544 -5.042 -13.166 1.00 33.23 H new ATOM 0 HE3 TRP A 503 5.026 -7.737 -8.753 1.00 50.20 H new ATOM 0 HZ2 TRP A 503 6.317 -4.976 -12.697 1.00 23.30 H new ATOM 0 HZ3 TRP A 503 7.381 -7.153 -9.173 1.00 74.31 H new ATOM 0 HH2 TRP A 503 8.013 -5.789 -11.119 1.00 65.41 H new ATOM 1102 N THR A 504 1.888 -9.358 -12.442 1.00 55.34 N ATOM 1103 CA THR A 504 2.655 -10.163 -13.400 1.00 44.04 C ATOM 1104 C THR A 504 3.670 -9.295 -14.163 1.00 53.44 C ATOM 1105 O THR A 504 3.299 -8.523 -15.050 1.00 70.32 O ATOM 1106 CB THR A 504 1.724 -10.879 -14.413 1.00 74.22 C ATOM 1107 OG1 THR A 504 0.838 -11.773 -13.718 1.00 10.31 O ATOM 1108 CG2 THR A 504 2.528 -11.667 -15.445 1.00 50.14 C ATOM 0 H THR A 504 1.329 -8.620 -12.870 1.00 55.34 H new ATOM 0 HA THR A 504 3.191 -10.918 -12.825 1.00 44.04 H new ATOM 0 HB THR A 504 1.147 -10.115 -14.934 1.00 74.22 H new ATOM 0 HG1 THR A 504 0.252 -12.220 -14.364 1.00 10.31 H new ATOM 0 HG21 THR A 504 1.846 -12.157 -16.140 1.00 50.14 H new ATOM 0 HG22 THR A 504 3.180 -10.988 -15.994 1.00 50.14 H new ATOM 0 HG23 THR A 504 3.132 -12.419 -14.938 1.00 50.14 H new ATOM 1116 N PRO A 505 4.964 -9.383 -13.807 1.00 62.00 N ATOM 1117 CA PRO A 505 6.028 -8.630 -14.487 1.00 44.00 C ATOM 1118 C PRO A 505 6.468 -9.285 -15.809 1.00 35.02 C ATOM 1119 O PRO A 505 7.247 -10.235 -15.815 1.00 14.00 O ATOM 1120 CB PRO A 505 7.164 -8.651 -13.460 1.00 43.24 C ATOM 1121 CG PRO A 505 6.980 -9.939 -12.723 1.00 14.41 C ATOM 1122 CD PRO A 505 5.493 -10.205 -12.696 1.00 50.32 C ATOM 0 HA PRO A 505 5.708 -7.629 -14.776 1.00 44.00 H new ATOM 0 HB2 PRO A 505 8.139 -8.608 -13.946 1.00 43.24 H new ATOM 0 HB3 PRO A 505 7.105 -7.796 -12.786 1.00 43.24 H new ATOM 0 HG2 PRO A 505 7.511 -10.751 -13.220 1.00 14.41 H new ATOM 0 HG3 PRO A 505 7.381 -9.869 -11.712 1.00 14.41 H new ATOM 0 HD2 PRO A 505 5.274 -11.263 -12.842 1.00 50.32 H new ATOM 0 HD3 PRO A 505 5.053 -9.917 -11.741 1.00 50.32 H new ATOM 1130 N THR A 506 5.961 -8.779 -16.930 1.00 34.32 N ATOM 1131 CA THR A 506 6.262 -9.361 -18.250 1.00 61.33 C ATOM 1132 C THR A 506 7.651 -8.955 -18.772 1.00 62.13 C ATOM 1133 O THR A 506 8.149 -9.532 -19.740 1.00 12.03 O ATOM 1134 CB THR A 506 5.190 -8.972 -19.295 1.00 14.13 C ATOM 1135 OG1 THR A 506 5.010 -7.550 -19.303 1.00 15.14 O ATOM 1136 CG2 THR A 506 3.858 -9.649 -18.992 1.00 44.32 C ATOM 0 H THR A 506 5.341 -7.970 -16.959 1.00 34.32 H new ATOM 0 HA THR A 506 6.255 -10.442 -18.108 1.00 61.33 H new ATOM 0 HB THR A 506 5.535 -9.306 -20.274 1.00 14.13 H new ATOM 0 HG1 THR A 506 4.331 -7.310 -19.968 1.00 15.14 H new ATOM 0 HG21 THR A 506 3.123 -9.358 -19.742 1.00 44.32 H new ATOM 0 HG22 THR A 506 3.987 -10.731 -19.011 1.00 44.32 H new ATOM 0 HG23 THR A 506 3.510 -9.343 -18.005 1.00 44.32 H new ATOM 1144 N GLN A 507 8.270 -7.963 -18.136 1.00 24.41 N ATOM 1145 CA GLN A 507 9.647 -7.559 -18.467 1.00 21.31 C ATOM 1146 C GLN A 507 10.560 -7.659 -17.232 1.00 5.15 C ATOM 1147 O GLN A 507 10.149 -7.334 -16.116 1.00 63.53 O ATOM 1148 CB GLN A 507 9.667 -6.125 -19.028 1.00 64.14 C ATOM 1149 CG GLN A 507 11.060 -5.624 -19.408 1.00 15.33 C ATOM 1150 CD GLN A 507 11.728 -6.485 -20.472 1.00 54.21 C ATOM 1151 OE1 GLN A 507 12.413 -7.453 -20.162 1.00 42.13 O ATOM 1152 NE2 GLN A 507 11.547 -6.139 -21.729 1.00 23.51 N ATOM 0 H GLN A 507 7.844 -7.419 -17.386 1.00 24.41 H new ATOM 0 HA GLN A 507 10.025 -8.240 -19.230 1.00 21.31 H new ATOM 0 HB2 GLN A 507 9.024 -6.081 -19.907 1.00 64.14 H new ATOM 0 HB3 GLN A 507 9.239 -5.450 -18.287 1.00 64.14 H new ATOM 0 HG2 GLN A 507 10.986 -4.599 -19.771 1.00 15.33 H new ATOM 0 HG3 GLN A 507 11.688 -5.602 -18.518 1.00 15.33 H new ATOM 0 HE21 GLN A 507 10.972 -5.328 -21.957 1.00 23.51 H new ATOM 0 HE22 GLN A 507 11.982 -6.682 -22.475 1.00 23.51 H new ATOM 1161 N GLU A 508 11.800 -8.100 -17.442 1.00 3.15 N ATOM 1162 CA GLU A 508 12.769 -8.264 -16.348 1.00 21.21 C ATOM 1163 C GLU A 508 13.397 -6.926 -15.927 1.00 34.14 C ATOM 1164 O GLU A 508 13.487 -5.985 -16.720 1.00 11.54 O ATOM 1165 CB GLU A 508 13.856 -9.285 -16.742 1.00 34.40 C ATOM 1166 CG GLU A 508 14.645 -8.950 -18.014 1.00 41.42 C ATOM 1167 CD GLU A 508 15.724 -7.894 -17.809 1.00 2.24 C ATOM 1168 OE1 GLU A 508 16.648 -8.130 -17.003 1.00 52.24 O ATOM 1169 OE2 GLU A 508 15.665 -6.834 -18.465 1.00 54.32 O ATOM 0 H GLU A 508 12.162 -8.352 -18.362 1.00 3.15 H new ATOM 0 HA GLU A 508 12.227 -8.646 -15.483 1.00 21.21 H new ATOM 0 HB2 GLU A 508 14.558 -9.380 -15.914 1.00 34.40 H new ATOM 0 HB3 GLU A 508 13.385 -10.259 -16.873 1.00 34.40 H new ATOM 0 HG2 GLU A 508 15.109 -9.861 -18.393 1.00 41.42 H new ATOM 0 HG3 GLU A 508 13.951 -8.603 -18.780 1.00 41.42 H new ATOM 1176 N GLY A 509 13.799 -6.836 -14.664 1.00 61.32 N ATOM 1177 CA GLY A 509 14.424 -5.620 -14.159 1.00 2.23 C ATOM 1178 C GLY A 509 14.077 -5.327 -12.706 1.00 25.54 C ATOM 1179 O GLY A 509 13.434 -6.137 -12.035 1.00 2.31 O ATOM 0 H GLY A 509 13.704 -7.584 -13.977 1.00 61.32 H new ATOM 0 HA2 GLY A 509 15.506 -5.708 -14.257 1.00 2.23 H new ATOM 0 HA3 GLY A 509 14.115 -4.777 -14.777 1.00 2.23 H new ATOM 1183 N MET A 510 14.501 -4.168 -12.218 1.00 34.25 N ATOM 1184 CA MET A 510 14.224 -3.761 -10.839 1.00 5.24 C ATOM 1185 C MET A 510 12.905 -2.966 -10.756 1.00 61.32 C ATOM 1186 O MET A 510 12.652 -2.067 -11.564 1.00 33.12 O ATOM 1187 CB MET A 510 15.396 -2.928 -10.292 1.00 51.53 C ATOM 1188 CG MET A 510 15.399 -2.790 -8.777 1.00 2.24 C ATOM 1189 SD MET A 510 13.972 -1.882 -8.152 1.00 24.35 S ATOM 1190 CE MET A 510 14.124 -2.190 -6.397 1.00 0.14 C ATOM 0 H MET A 510 15.040 -3.489 -12.756 1.00 34.25 H new ATOM 0 HA MET A 510 14.114 -4.656 -10.227 1.00 5.24 H new ATOM 0 HB2 MET A 510 16.333 -3.387 -10.607 1.00 51.53 H new ATOM 0 HB3 MET A 510 15.362 -1.934 -10.738 1.00 51.53 H new ATOM 0 HG2 MET A 510 15.417 -3.783 -8.327 1.00 2.24 H new ATOM 0 HG3 MET A 510 16.312 -2.282 -8.465 1.00 2.24 H new ATOM 0 HE1 MET A 510 13.173 -1.981 -5.907 1.00 0.14 H new ATOM 0 HE2 MET A 510 14.395 -3.233 -6.233 1.00 0.14 H new ATOM 0 HE3 MET A 510 14.897 -1.544 -5.980 1.00 0.14 H new ATOM 1200 N TYR A 511 12.064 -3.308 -9.780 1.00 44.42 N ATOM 1201 CA TYR A 511 10.761 -2.654 -9.603 1.00 30.11 C ATOM 1202 C TYR A 511 10.522 -2.244 -8.140 1.00 62.05 C ATOM 1203 O TYR A 511 10.517 -3.081 -7.237 1.00 42.13 O ATOM 1204 CB TYR A 511 9.630 -3.577 -10.084 1.00 73.24 C ATOM 1205 CG TYR A 511 9.646 -3.844 -11.579 1.00 42.21 C ATOM 1206 CD1 TYR A 511 10.377 -4.901 -12.107 1.00 64.24 C ATOM 1207 CD2 TYR A 511 8.929 -3.042 -12.458 1.00 71.03 C ATOM 1208 CE1 TYR A 511 10.392 -5.150 -13.465 1.00 13.41 C ATOM 1209 CE2 TYR A 511 8.939 -3.285 -13.819 1.00 0.13 C ATOM 1210 CZ TYR A 511 9.672 -4.342 -14.317 1.00 33.13 C ATOM 1211 OH TYR A 511 9.688 -4.587 -15.672 1.00 13.45 O ATOM 0 H TYR A 511 12.260 -4.038 -9.095 1.00 44.42 H new ATOM 0 HA TYR A 511 10.766 -1.746 -10.206 1.00 30.11 H new ATOM 0 HB2 TYR A 511 9.700 -4.527 -9.555 1.00 73.24 H new ATOM 0 HB3 TYR A 511 8.672 -3.132 -9.815 1.00 73.24 H new ATOM 0 HD1 TYR A 511 10.943 -5.539 -11.444 1.00 64.24 H new ATOM 0 HD2 TYR A 511 8.354 -2.214 -12.071 1.00 71.03 H new ATOM 0 HE1 TYR A 511 10.967 -5.976 -13.858 1.00 13.41 H new ATOM 0 HE2 TYR A 511 8.376 -2.651 -14.488 1.00 0.13 H new ATOM 0 HH TYR A 511 9.862 -5.538 -15.830 1.00 13.45 H new ATOM 1221 N ARG A 512 10.324 -0.949 -7.918 1.00 22.30 N ATOM 1222 CA ARG A 512 10.026 -0.416 -6.586 1.00 65.33 C ATOM 1223 C ARG A 512 8.508 -0.291 -6.367 1.00 74.11 C ATOM 1224 O ARG A 512 7.829 0.448 -7.085 1.00 12.23 O ATOM 1225 CB ARG A 512 10.697 0.955 -6.413 1.00 14.35 C ATOM 1226 CG ARG A 512 10.309 1.678 -5.124 1.00 34.15 C ATOM 1227 CD ARG A 512 10.891 3.087 -5.062 1.00 33.44 C ATOM 1228 NE ARG A 512 10.584 3.862 -6.267 1.00 74.41 N ATOM 1229 CZ ARG A 512 9.582 4.700 -6.378 1.00 53.01 C ATOM 1230 NH1 ARG A 512 8.743 4.857 -5.407 1.00 71.44 N ATOM 1231 NH2 ARG A 512 9.407 5.363 -7.473 1.00 64.11 N ATOM 0 H ARG A 512 10.364 -0.239 -8.650 1.00 22.30 H new ATOM 0 HA ARG A 512 10.420 -1.109 -5.843 1.00 65.33 H new ATOM 0 HB2 ARG A 512 11.779 0.824 -6.432 1.00 14.35 H new ATOM 0 HB3 ARG A 512 10.437 1.585 -7.263 1.00 14.35 H new ATOM 0 HG2 ARG A 512 9.223 1.731 -5.051 1.00 34.15 H new ATOM 0 HG3 ARG A 512 10.659 1.103 -4.266 1.00 34.15 H new ATOM 0 HD2 ARG A 512 10.495 3.604 -4.188 1.00 33.44 H new ATOM 0 HD3 ARG A 512 11.972 3.027 -4.935 1.00 33.44 H new ATOM 0 HE ARG A 512 11.193 3.741 -7.076 1.00 74.41 H new ATOM 0 HH11 ARG A 512 8.857 4.326 -4.544 1.00 71.44 H new ATOM 0 HH12 ARG A 512 7.967 5.512 -5.504 1.00 71.44 H new ATOM 0 HH21 ARG A 512 10.050 5.235 -8.255 1.00 64.11 H new ATOM 0 HH22 ARG A 512 8.626 6.014 -7.556 1.00 64.11 H new ATOM 1245 N ILE A 513 7.989 -1.016 -5.376 1.00 12.44 N ATOM 1246 CA ILE A 513 6.558 -0.986 -5.043 1.00 0.42 C ATOM 1247 C ILE A 513 6.291 -0.152 -3.774 1.00 63.11 C ATOM 1248 O ILE A 513 6.880 -0.395 -2.720 1.00 64.52 O ATOM 1249 CB ILE A 513 5.997 -2.419 -4.838 1.00 33.23 C ATOM 1250 CG1 ILE A 513 6.191 -3.261 -6.115 1.00 44.13 C ATOM 1251 CG2 ILE A 513 4.521 -2.375 -4.439 1.00 72.24 C ATOM 1252 CD1 ILE A 513 5.636 -4.668 -6.017 1.00 21.11 C ATOM 0 H ILE A 513 8.540 -1.637 -4.784 1.00 12.44 H new ATOM 0 HA ILE A 513 6.049 -0.520 -5.887 1.00 0.42 H new ATOM 0 HB ILE A 513 6.552 -2.890 -4.026 1.00 33.23 H new ATOM 0 HG12 ILE A 513 5.712 -2.750 -6.951 1.00 44.13 H new ATOM 0 HG13 ILE A 513 7.255 -3.317 -6.343 1.00 44.13 H new ATOM 0 HG21 ILE A 513 4.151 -3.391 -4.301 1.00 72.24 H new ATOM 0 HG22 ILE A 513 4.412 -1.820 -3.507 1.00 72.24 H new ATOM 0 HG23 ILE A 513 3.946 -1.883 -5.224 1.00 72.24 H new ATOM 0 HD11 ILE A 513 5.812 -5.195 -6.955 1.00 21.11 H new ATOM 0 HD12 ILE A 513 6.132 -5.199 -5.204 1.00 21.11 H new ATOM 0 HD13 ILE A 513 4.565 -4.624 -5.821 1.00 21.11 H new ATOM 1264 N ASN A 514 5.395 0.822 -3.884 1.00 52.11 N ATOM 1265 CA ASN A 514 5.037 1.692 -2.755 1.00 24.24 C ATOM 1266 C ASN A 514 3.524 1.702 -2.505 1.00 15.30 C ATOM 1267 O ASN A 514 2.728 1.676 -3.441 1.00 31.13 O ATOM 1268 CB ASN A 514 5.516 3.124 -3.014 1.00 61.22 C ATOM 1269 CG ASN A 514 7.019 3.265 -2.882 1.00 13.11 C ATOM 1270 OD1 ASN A 514 7.762 3.081 -3.836 1.00 43.51 O ATOM 1271 ND2 ASN A 514 7.478 3.589 -1.694 1.00 60.50 N ATOM 0 H ASN A 514 4.896 1.035 -4.748 1.00 52.11 H new ATOM 0 HA ASN A 514 5.530 1.292 -1.869 1.00 24.24 H new ATOM 0 HB2 ASN A 514 5.212 3.430 -4.015 1.00 61.22 H new ATOM 0 HB3 ASN A 514 5.028 3.800 -2.312 1.00 61.22 H new ATOM 0 HD21 ASN A 514 8.482 3.694 -1.546 1.00 60.50 H new ATOM 0 HD22 ASN A 514 6.830 3.735 -0.920 1.00 60.50 H new ATOM 1278 N ALA A 515 3.138 1.746 -1.233 1.00 51.14 N ATOM 1279 CA ALA A 515 1.727 1.864 -0.851 1.00 3.54 C ATOM 1280 C ALA A 515 1.487 3.147 -0.050 1.00 43.24 C ATOM 1281 O ALA A 515 2.242 3.466 0.872 1.00 64.50 O ATOM 1282 CB ALA A 515 1.279 0.650 -0.045 1.00 55.21 C ATOM 0 H ALA A 515 3.783 1.702 -0.444 1.00 51.14 H new ATOM 0 HA ALA A 515 1.136 1.909 -1.766 1.00 3.54 H new ATOM 0 HB1 ALA A 515 0.229 0.761 0.227 1.00 55.21 H new ATOM 0 HB2 ALA A 515 1.406 -0.252 -0.644 1.00 55.21 H new ATOM 0 HB3 ALA A 515 1.882 0.572 0.860 1.00 55.21 H new ATOM 1288 N THR A 516 0.437 3.877 -0.408 1.00 33.32 N ATOM 1289 CA THR A 516 0.107 5.151 0.243 1.00 53.32 C ATOM 1290 C THR A 516 -1.368 5.212 0.653 1.00 12.41 C ATOM 1291 O THR A 516 -2.245 4.747 -0.077 1.00 14.35 O ATOM 1292 CB THR A 516 0.404 6.348 -0.694 1.00 73.15 C ATOM 1293 OG1 THR A 516 -0.229 6.147 -1.967 1.00 11.22 O ATOM 1294 CG2 THR A 516 1.904 6.535 -0.899 1.00 22.33 C ATOM 0 H THR A 516 -0.209 3.610 -1.151 1.00 33.32 H new ATOM 0 HA THR A 516 0.731 5.214 1.135 1.00 53.32 H new ATOM 0 HB THR A 516 0.006 7.246 -0.221 1.00 73.15 H new ATOM 0 HG1 THR A 516 0.315 5.539 -2.510 1.00 11.22 H new ATOM 0 HG21 THR A 516 2.078 7.383 -1.561 1.00 22.33 H new ATOM 0 HG22 THR A 516 2.382 6.722 0.063 1.00 22.33 H new ATOM 0 HG23 THR A 516 2.325 5.634 -1.345 1.00 22.33 H new ATOM 1302 N VAL A 517 -1.641 5.785 1.827 1.00 64.24 N ATOM 1303 CA VAL A 517 -3.019 5.973 2.291 1.00 32.53 C ATOM 1304 C VAL A 517 -3.437 7.452 2.211 1.00 51.43 C ATOM 1305 O VAL A 517 -2.649 8.350 2.512 1.00 71.33 O ATOM 1306 CB VAL A 517 -3.210 5.444 3.736 1.00 22.24 C ATOM 1307 CG1 VAL A 517 -2.270 6.145 4.709 1.00 32.24 C ATOM 1308 CG2 VAL A 517 -4.665 5.583 4.182 1.00 31.24 C ATOM 0 H VAL A 517 -0.929 6.126 2.473 1.00 64.24 H new ATOM 0 HA VAL A 517 -3.661 5.394 1.627 1.00 32.53 H new ATOM 0 HB VAL A 517 -2.958 4.384 3.738 1.00 22.24 H new ATOM 0 HG11 VAL A 517 -2.428 5.753 5.714 1.00 32.24 H new ATOM 0 HG12 VAL A 517 -1.237 5.968 4.408 1.00 32.24 H new ATOM 0 HG13 VAL A 517 -2.472 7.216 4.702 1.00 32.24 H new ATOM 0 HG21 VAL A 517 -4.772 5.205 5.199 1.00 31.24 H new ATOM 0 HG22 VAL A 517 -4.956 6.633 4.153 1.00 31.24 H new ATOM 0 HG23 VAL A 517 -5.307 5.010 3.513 1.00 31.24 H new ATOM 1318 N ASP A 518 -4.689 7.677 1.805 1.00 60.32 N ATOM 1319 CA ASP A 518 -5.233 9.023 1.563 1.00 23.24 C ATOM 1320 C ASP A 518 -4.225 9.919 0.817 1.00 44.22 C ATOM 1321 O ASP A 518 -3.690 10.886 1.366 1.00 23.31 O ATOM 1322 CB ASP A 518 -5.699 9.692 2.870 1.00 45.43 C ATOM 1323 CG ASP A 518 -6.611 10.897 2.625 1.00 43.43 C ATOM 1324 OD1 ASP A 518 -6.891 11.221 1.447 1.00 25.11 O ATOM 1325 OD2 ASP A 518 -7.052 11.530 3.607 1.00 62.21 O ATOM 0 H ASP A 518 -5.361 6.929 1.633 1.00 60.32 H new ATOM 0 HA ASP A 518 -6.106 8.901 0.922 1.00 23.24 H new ATOM 0 HB2 ASP A 518 -6.228 8.959 3.480 1.00 45.43 H new ATOM 0 HB3 ASP A 518 -4.827 10.012 3.441 1.00 45.43 H new ATOM 1330 N GLU A 519 -3.941 9.562 -0.434 1.00 63.23 N ATOM 1331 CA GLU A 519 -3.104 10.388 -1.313 1.00 13.43 C ATOM 1332 C GLU A 519 -3.685 11.796 -1.472 1.00 4.43 C ATOM 1333 O GLU A 519 -2.951 12.772 -1.652 1.00 55.34 O ATOM 1334 CB GLU A 519 -2.954 9.715 -2.684 1.00 72.24 C ATOM 1335 CG GLU A 519 -1.878 8.638 -2.728 1.00 11.03 C ATOM 1336 CD GLU A 519 -0.471 9.219 -2.766 1.00 13.35 C ATOM 1337 OE1 GLU A 519 0.040 9.646 -1.712 1.00 74.03 O ATOM 1338 OE2 GLU A 519 0.119 9.272 -3.866 1.00 14.24 O ATOM 0 H GLU A 519 -4.279 8.702 -0.867 1.00 63.23 H new ATOM 0 HA GLU A 519 -2.120 10.482 -0.853 1.00 13.43 H new ATOM 0 HB2 GLU A 519 -3.909 9.272 -2.967 1.00 72.24 H new ATOM 0 HB3 GLU A 519 -2.723 10.477 -3.428 1.00 72.24 H new ATOM 0 HG2 GLU A 519 -1.978 7.994 -1.855 1.00 11.03 H new ATOM 0 HG3 GLU A 519 -2.032 8.011 -3.606 1.00 11.03 H new ATOM 1345 N GLU A 520 -5.008 11.885 -1.422 1.00 61.42 N ATOM 1346 CA GLU A 520 -5.707 13.166 -1.542 1.00 74.23 C ATOM 1347 C GLU A 520 -5.444 14.048 -0.310 1.00 13.10 C ATOM 1348 O GLU A 520 -5.509 15.278 -0.386 1.00 45.52 O ATOM 1349 CB GLU A 520 -7.221 12.932 -1.685 1.00 14.12 C ATOM 1350 CG GLU A 520 -7.602 11.735 -2.556 1.00 71.42 C ATOM 1351 CD GLU A 520 -6.962 11.766 -3.933 1.00 22.00 C ATOM 1352 OE1 GLU A 520 -7.376 12.595 -4.768 1.00 51.53 O ATOM 1353 OE2 GLU A 520 -6.047 10.951 -4.189 1.00 35.23 O ATOM 0 H GLU A 520 -5.625 11.082 -1.299 1.00 61.42 H new ATOM 0 HA GLU A 520 -5.330 13.675 -2.429 1.00 74.23 H new ATOM 0 HB2 GLU A 520 -7.649 12.793 -0.692 1.00 14.12 H new ATOM 0 HB3 GLU A 520 -7.676 13.829 -2.105 1.00 14.12 H new ATOM 0 HG2 GLU A 520 -7.309 10.817 -2.047 1.00 71.42 H new ATOM 0 HG3 GLU A 520 -8.686 11.706 -2.667 1.00 71.42 H new ATOM 1360 N ASN A 521 -5.140 13.396 0.815 1.00 33.42 N ATOM 1361 CA ASN A 521 -4.952 14.063 2.109 1.00 34.25 C ATOM 1362 C ASN A 521 -6.202 14.877 2.487 1.00 73.10 C ATOM 1363 O ASN A 521 -6.175 16.106 2.574 1.00 42.25 O ATOM 1364 CB ASN A 521 -3.689 14.941 2.108 1.00 62.14 C ATOM 1365 CG ASN A 521 -3.362 15.482 3.492 1.00 12.52 C ATOM 1366 OD1 ASN A 521 -3.774 16.577 3.858 1.00 62.00 O ATOM 1367 ND2 ASN A 521 -2.629 14.717 4.276 1.00 23.34 N ATOM 0 H ASN A 521 -5.016 12.384 0.856 1.00 33.42 H new ATOM 0 HA ASN A 521 -4.810 13.294 2.868 1.00 34.25 H new ATOM 0 HB2 ASN A 521 -2.845 14.359 1.739 1.00 62.14 H new ATOM 0 HB3 ASN A 521 -3.828 15.773 1.418 1.00 62.14 H new ATOM 0 HD21 ASN A 521 -2.390 15.031 5.216 1.00 23.34 H new ATOM 0 HD22 ASN A 521 -2.301 13.811 3.942 1.00 23.34 H new ATOM 1374 N THR A 522 -7.308 14.169 2.681 1.00 1.35 N ATOM 1375 CA THR A 522 -8.589 14.795 3.036 1.00 5.54 C ATOM 1376 C THR A 522 -8.819 14.806 4.550 1.00 52.33 C ATOM 1377 O THR A 522 -9.681 15.530 5.052 1.00 51.04 O ATOM 1378 CB THR A 522 -9.778 14.080 2.351 1.00 14.22 C ATOM 1379 OG1 THR A 522 -9.802 12.681 2.699 1.00 43.40 O ATOM 1380 CG2 THR A 522 -9.697 14.228 0.836 1.00 64.44 C ATOM 0 H THR A 522 -7.350 13.153 2.599 1.00 1.35 H new ATOM 0 HA THR A 522 -8.534 15.824 2.681 1.00 5.54 H new ATOM 0 HB THR A 522 -10.696 14.549 2.704 1.00 14.22 H new ATOM 0 HG1 THR A 522 -10.562 12.247 2.257 1.00 43.40 H new ATOM 0 HG21 THR A 522 -10.543 13.718 0.375 1.00 64.44 H new ATOM 0 HG22 THR A 522 -9.723 15.285 0.572 1.00 64.44 H new ATOM 0 HG23 THR A 522 -8.767 13.787 0.477 1.00 64.44 H new ATOM 1388 N VAL A 523 -8.050 14.005 5.277 1.00 12.42 N ATOM 1389 CA VAL A 523 -8.118 13.982 6.741 1.00 42.21 C ATOM 1390 C VAL A 523 -6.767 14.388 7.365 1.00 31.34 C ATOM 1391 O VAL A 523 -5.708 14.049 6.842 1.00 53.33 O ATOM 1392 CB VAL A 523 -8.551 12.587 7.265 1.00 52.44 C ATOM 1393 CG1 VAL A 523 -7.487 11.528 6.973 1.00 34.03 C ATOM 1394 CG2 VAL A 523 -8.878 12.644 8.757 1.00 23.21 C ATOM 0 H VAL A 523 -7.368 13.359 4.879 1.00 12.42 H new ATOM 0 HA VAL A 523 -8.872 14.709 7.042 1.00 42.21 H new ATOM 0 HB VAL A 523 -9.457 12.297 6.732 1.00 52.44 H new ATOM 0 HG11 VAL A 523 -7.821 10.562 7.353 1.00 34.03 H new ATOM 0 HG12 VAL A 523 -7.328 11.459 5.897 1.00 34.03 H new ATOM 0 HG13 VAL A 523 -6.553 11.806 7.461 1.00 34.03 H new ATOM 0 HG21 VAL A 523 -9.179 11.655 9.102 1.00 23.21 H new ATOM 0 HG22 VAL A 523 -7.997 12.969 9.310 1.00 23.21 H new ATOM 0 HG23 VAL A 523 -9.692 13.350 8.924 1.00 23.21 H new ATOM 1404 N VAL A 524 -6.811 15.129 8.475 1.00 33.14 N ATOM 1405 CA VAL A 524 -5.584 15.592 9.139 1.00 22.33 C ATOM 1406 C VAL A 524 -5.001 14.502 10.052 1.00 33.13 C ATOM 1407 O VAL A 524 -5.660 14.042 10.989 1.00 1.41 O ATOM 1408 CB VAL A 524 -5.843 16.874 9.969 1.00 60.21 C ATOM 1409 CG1 VAL A 524 -4.550 17.381 10.607 1.00 20.53 C ATOM 1410 CG2 VAL A 524 -6.481 17.960 9.102 1.00 72.42 C ATOM 0 H VAL A 524 -7.675 15.421 8.932 1.00 33.14 H new ATOM 0 HA VAL A 524 -4.863 15.820 8.354 1.00 22.33 H new ATOM 0 HB VAL A 524 -6.539 16.624 10.770 1.00 60.21 H new ATOM 0 HG11 VAL A 524 -4.758 18.282 11.184 1.00 20.53 H new ATOM 0 HG12 VAL A 524 -4.144 16.613 11.266 1.00 20.53 H new ATOM 0 HG13 VAL A 524 -3.825 17.610 9.826 1.00 20.53 H new ATOM 0 HG21 VAL A 524 -6.654 18.852 9.705 1.00 72.42 H new ATOM 0 HG22 VAL A 524 -5.814 18.205 8.276 1.00 72.42 H new ATOM 0 HG23 VAL A 524 -7.431 17.599 8.707 1.00 72.42 H new ATOM 1420 N GLU A 525 -3.759 14.108 9.774 1.00 21.23 N ATOM 1421 CA GLU A 525 -3.129 12.961 10.436 1.00 2.21 C ATOM 1422 C GLU A 525 -2.161 13.391 11.553 1.00 32.22 C ATOM 1423 O GLU A 525 -1.686 14.526 11.581 1.00 21.32 O ATOM 1424 CB GLU A 525 -2.362 12.107 9.401 1.00 62.02 C ATOM 1425 CG GLU A 525 -2.979 12.090 7.995 1.00 15.40 C ATOM 1426 CD GLU A 525 -2.382 13.147 7.062 1.00 4.34 C ATOM 1427 OE1 GLU A 525 -2.636 14.359 7.269 1.00 40.15 O ATOM 1428 OE2 GLU A 525 -1.649 12.773 6.123 1.00 12.32 O ATOM 0 H GLU A 525 -3.162 14.570 9.088 1.00 21.23 H new ATOM 0 HA GLU A 525 -3.929 12.376 10.891 1.00 2.21 H new ATOM 0 HB2 GLU A 525 -1.340 12.480 9.329 1.00 62.02 H new ATOM 0 HB3 GLU A 525 -2.303 11.083 9.769 1.00 62.02 H new ATOM 0 HG2 GLU A 525 -2.836 11.103 7.554 1.00 15.40 H new ATOM 0 HG3 GLU A 525 -4.054 12.251 8.075 1.00 15.40 H new ATOM 1435 N LEU A 526 -1.874 12.469 12.476 1.00 70.23 N ATOM 1436 CA LEU A 526 -0.880 12.702 13.536 1.00 14.01 C ATOM 1437 C LEU A 526 0.549 12.779 12.964 1.00 3.53 C ATOM 1438 O LEU A 526 1.399 13.510 13.477 1.00 52.32 O ATOM 1439 CB LEU A 526 -0.960 11.589 14.595 1.00 71.04 C ATOM 1440 CG LEU A 526 -2.269 11.540 15.399 1.00 32.42 C ATOM 1441 CD1 LEU A 526 -2.267 10.359 16.367 1.00 0.22 C ATOM 1442 CD2 LEU A 526 -2.488 12.855 16.147 1.00 1.43 C ATOM 0 H LEU A 526 -2.316 11.550 12.513 1.00 70.23 H new ATOM 0 HA LEU A 526 -1.110 13.661 14.001 1.00 14.01 H new ATOM 0 HB2 LEU A 526 -0.821 10.628 14.100 1.00 71.04 H new ATOM 0 HB3 LEU A 526 -0.130 11.712 15.291 1.00 71.04 H new ATOM 0 HG LEU A 526 -3.095 11.402 14.701 1.00 32.42 H new ATOM 0 HD11 LEU A 526 -3.203 10.344 16.925 1.00 0.22 H new ATOM 0 HD12 LEU A 526 -2.164 9.430 15.807 1.00 0.22 H new ATOM 0 HD13 LEU A 526 -1.432 10.459 17.061 1.00 0.22 H new ATOM 0 HD21 LEU A 526 -3.419 12.802 16.711 1.00 1.43 H new ATOM 0 HD22 LEU A 526 -1.658 13.026 16.833 1.00 1.43 H new ATOM 0 HD23 LEU A 526 -2.543 13.676 15.432 1.00 1.43 H new ATOM 1454 N ASN A 527 0.806 12.009 11.909 1.00 15.53 N ATOM 1455 CA ASN A 527 2.109 12.018 11.235 1.00 33.25 C ATOM 1456 C ASN A 527 1.943 11.798 9.725 1.00 21.42 C ATOM 1457 O ASN A 527 1.301 10.844 9.298 1.00 55.45 O ATOM 1458 CB ASN A 527 3.031 10.940 11.827 1.00 51.33 C ATOM 1459 CG ASN A 527 4.388 10.884 11.138 1.00 20.22 C ATOM 1460 OD1 ASN A 527 4.883 11.883 10.624 1.00 41.22 O ATOM 1461 ND2 ASN A 527 5.007 9.721 11.129 1.00 22.23 N ATOM 0 H ASN A 527 0.128 11.367 11.498 1.00 15.53 H new ATOM 0 HA ASN A 527 2.564 12.995 11.395 1.00 33.25 H new ATOM 0 HB2 ASN A 527 3.175 11.135 12.890 1.00 51.33 H new ATOM 0 HB3 ASN A 527 2.546 9.967 11.744 1.00 51.33 H new ATOM 0 HD21 ASN A 527 5.922 9.634 10.687 1.00 22.23 H new ATOM 0 HD22 ASN A 527 4.571 8.908 11.564 1.00 22.23 H new ATOM 1468 N GLU A 528 2.555 12.668 8.927 1.00 53.04 N ATOM 1469 CA GLU A 528 2.435 12.608 7.463 1.00 63.02 C ATOM 1470 C GLU A 528 3.423 11.596 6.856 1.00 14.10 C ATOM 1471 O GLU A 528 3.189 11.043 5.782 1.00 60.12 O ATOM 1472 CB GLU A 528 2.707 14.001 6.884 1.00 1.30 C ATOM 1473 CG GLU A 528 2.619 14.086 5.365 1.00 54.03 C ATOM 1474 CD GLU A 528 3.252 15.358 4.830 1.00 33.41 C ATOM 1475 OE1 GLU A 528 2.557 16.390 4.749 1.00 74.34 O ATOM 1476 OE2 GLU A 528 4.462 15.336 4.514 1.00 55.03 O ATOM 0 H GLU A 528 3.143 13.429 9.266 1.00 53.04 H new ATOM 0 HA GLU A 528 1.426 12.281 7.212 1.00 63.02 H new ATOM 0 HB2 GLU A 528 1.995 14.705 7.316 1.00 1.30 H new ATOM 0 HB3 GLU A 528 3.701 14.322 7.196 1.00 1.30 H new ATOM 0 HG2 GLU A 528 3.114 13.221 4.924 1.00 54.03 H new ATOM 0 HG3 GLU A 528 1.574 14.045 5.059 1.00 54.03 H new ATOM 1483 N ASN A 529 4.518 11.334 7.566 1.00 50.03 N ATOM 1484 CA ASN A 529 5.547 10.403 7.084 1.00 55.34 C ATOM 1485 C ASN A 529 5.223 8.952 7.480 1.00 71.32 C ATOM 1486 O ASN A 529 6.073 8.066 7.386 1.00 12.23 O ATOM 1487 CB ASN A 529 6.922 10.812 7.628 1.00 65.32 C ATOM 1488 CG ASN A 529 7.352 12.183 7.134 1.00 63.11 C ATOM 1489 OD1 ASN A 529 7.944 12.316 6.068 1.00 32.44 O ATOM 1490 ND2 ASN A 529 7.070 13.214 7.905 1.00 50.34 N ATOM 0 H ASN A 529 4.719 11.750 8.475 1.00 50.03 H new ATOM 0 HA ASN A 529 5.564 10.452 5.995 1.00 55.34 H new ATOM 0 HB2 ASN A 529 6.894 10.813 8.718 1.00 65.32 H new ATOM 0 HB3 ASN A 529 7.664 10.071 7.329 1.00 65.32 H new ATOM 0 HD21 ASN A 529 7.345 14.154 7.620 1.00 50.34 H new ATOM 0 HD22 ASN A 529 6.576 13.072 8.786 1.00 50.34 H new ATOM 1497 N ASN A 530 3.985 8.717 7.912 1.00 73.53 N ATOM 1498 CA ASN A 530 3.536 7.381 8.319 1.00 61.34 C ATOM 1499 C ASN A 530 2.587 6.772 7.266 1.00 72.12 C ATOM 1500 O ASN A 530 2.334 5.567 7.259 1.00 40.23 O ATOM 1501 CB ASN A 530 2.843 7.477 9.687 1.00 74.14 C ATOM 1502 CG ASN A 530 2.532 6.127 10.310 1.00 54.34 C ATOM 1503 OD1 ASN A 530 3.201 5.131 10.045 1.00 70.31 O ATOM 1504 ND2 ASN A 530 1.529 6.089 11.161 1.00 33.42 N ATOM 0 H ASN A 530 3.268 9.439 7.990 1.00 73.53 H new ATOM 0 HA ASN A 530 4.401 6.723 8.398 1.00 61.34 H new ATOM 0 HB2 ASN A 530 3.479 8.043 10.367 1.00 74.14 H new ATOM 0 HB3 ASN A 530 1.915 8.038 9.576 1.00 74.14 H new ATOM 0 HD21 ASN A 530 1.286 5.213 11.624 1.00 33.42 H new ATOM 0 HD22 ASN A 530 0.995 6.935 11.358 1.00 33.42 H new ATOM 1511 N ASN A 531 2.086 7.619 6.361 1.00 15.42 N ATOM 1512 CA ASN A 531 1.122 7.194 5.331 1.00 34.33 C ATOM 1513 C ASN A 531 1.772 6.348 4.221 1.00 70.21 C ATOM 1514 O ASN A 531 1.074 5.680 3.456 1.00 33.31 O ATOM 1515 CB ASN A 531 0.460 8.418 4.680 1.00 43.53 C ATOM 1516 CG ASN A 531 -0.199 9.349 5.680 1.00 63.41 C ATOM 1517 OD1 ASN A 531 0.266 9.508 6.800 1.00 63.23 O ATOM 1518 ND2 ASN A 531 -1.294 9.967 5.280 1.00 53.40 N ATOM 0 H ASN A 531 2.331 8.608 6.318 1.00 15.42 H new ATOM 0 HA ASN A 531 0.381 6.579 5.842 1.00 34.33 H new ATOM 0 HB2 ASN A 531 1.212 8.973 4.119 1.00 43.53 H new ATOM 0 HB3 ASN A 531 -0.288 8.079 3.963 1.00 43.53 H new ATOM 0 HD21 ASN A 531 -1.781 10.602 5.913 1.00 53.40 H new ATOM 0 HD22 ASN A 531 -1.653 9.810 4.338 1.00 53.40 H new ATOM 1525 N VAL A 532 3.100 6.393 4.120 1.00 40.23 N ATOM 1526 CA VAL A 532 3.815 5.768 2.996 1.00 22.01 C ATOM 1527 C VAL A 532 4.651 4.550 3.426 1.00 32.24 C ATOM 1528 O VAL A 532 5.393 4.603 4.409 1.00 12.31 O ATOM 1529 CB VAL A 532 4.753 6.792 2.307 1.00 72.34 C ATOM 1530 CG1 VAL A 532 5.433 6.178 1.081 1.00 15.00 C ATOM 1531 CG2 VAL A 532 3.991 8.061 1.933 1.00 3.24 C ATOM 0 H VAL A 532 3.706 6.854 4.799 1.00 40.23 H new ATOM 0 HA VAL A 532 3.047 5.428 2.302 1.00 22.01 H new ATOM 0 HB VAL A 532 5.533 7.064 3.018 1.00 72.34 H new ATOM 0 HG11 VAL A 532 6.085 6.918 0.618 1.00 15.00 H new ATOM 0 HG12 VAL A 532 6.024 5.315 1.387 1.00 15.00 H new ATOM 0 HG13 VAL A 532 4.675 5.863 0.364 1.00 15.00 H new ATOM 0 HG21 VAL A 532 4.670 8.764 1.451 1.00 3.24 H new ATOM 0 HG22 VAL A 532 3.181 7.811 1.247 1.00 3.24 H new ATOM 0 HG23 VAL A 532 3.577 8.515 2.833 1.00 3.24 H new ATOM 1541 N ALA A 533 4.533 3.458 2.668 1.00 41.41 N ATOM 1542 CA ALA A 533 5.370 2.266 2.861 1.00 10.35 C ATOM 1543 C ALA A 533 6.117 1.909 1.563 1.00 45.31 C ATOM 1544 O ALA A 533 5.549 1.982 0.471 1.00 12.33 O ATOM 1545 CB ALA A 533 4.520 1.087 3.323 1.00 52.23 C ATOM 0 H ALA A 533 3.860 3.372 1.907 1.00 41.41 H new ATOM 0 HA ALA A 533 6.107 2.488 3.632 1.00 10.35 H new ATOM 0 HB1 ALA A 533 5.156 0.212 3.461 1.00 52.23 H new ATOM 0 HB2 ALA A 533 4.035 1.336 4.267 1.00 52.23 H new ATOM 0 HB3 ALA A 533 3.761 0.869 2.572 1.00 52.23 H new ATOM 1551 N THR A 534 7.388 1.523 1.685 1.00 50.43 N ATOM 1552 CA THR A 534 8.227 1.219 0.512 1.00 43.33 C ATOM 1553 C THR A 534 8.736 -0.228 0.528 1.00 22.04 C ATOM 1554 O THR A 534 9.209 -0.720 1.553 1.00 54.12 O ATOM 1555 CB THR A 534 9.451 2.171 0.430 1.00 34.11 C ATOM 1556 OG1 THR A 534 9.013 3.537 0.387 1.00 40.42 O ATOM 1557 CG2 THR A 534 10.305 1.880 -0.803 1.00 23.12 C ATOM 0 H THR A 534 7.864 1.412 2.580 1.00 50.43 H new ATOM 0 HA THR A 534 7.589 1.362 -0.360 1.00 43.33 H new ATOM 0 HB THR A 534 10.058 2.003 1.320 1.00 34.11 H new ATOM 0 HG1 THR A 534 9.792 4.129 0.336 1.00 40.42 H new ATOM 0 HG21 THR A 534 11.153 2.565 -0.828 1.00 23.12 H new ATOM 0 HG22 THR A 534 10.669 0.853 -0.759 1.00 23.12 H new ATOM 0 HG23 THR A 534 9.703 2.014 -1.702 1.00 23.12 H new ATOM 1565 N PHE A 535 8.647 -0.902 -0.620 1.00 22.43 N ATOM 1566 CA PHE A 535 9.158 -2.272 -0.770 1.00 63.32 C ATOM 1567 C PHE A 535 9.843 -2.446 -2.138 1.00 21.41 C ATOM 1568 O PHE A 535 9.337 -1.986 -3.160 1.00 10.34 O ATOM 1569 CB PHE A 535 8.014 -3.285 -0.612 1.00 3.43 C ATOM 1570 CG PHE A 535 8.469 -4.725 -0.581 1.00 65.30 C ATOM 1571 CD1 PHE A 535 9.087 -5.246 0.548 1.00 20.02 C ATOM 1572 CD2 PHE A 535 8.279 -5.558 -1.678 1.00 41.12 C ATOM 1573 CE1 PHE A 535 9.503 -6.564 0.583 1.00 51.41 C ATOM 1574 CE2 PHE A 535 8.694 -6.877 -1.644 1.00 12.22 C ATOM 1575 CZ PHE A 535 9.307 -7.380 -0.513 1.00 3.44 C ATOM 0 H PHE A 535 8.224 -0.521 -1.466 1.00 22.43 H new ATOM 0 HA PHE A 535 9.897 -2.454 0.010 1.00 63.32 H new ATOM 0 HB2 PHE A 535 7.473 -3.066 0.308 1.00 3.43 H new ATOM 0 HB3 PHE A 535 7.311 -3.154 -1.434 1.00 3.43 H new ATOM 0 HD1 PHE A 535 9.245 -4.614 1.409 1.00 20.02 H new ATOM 0 HD2 PHE A 535 7.802 -5.171 -2.566 1.00 41.12 H new ATOM 0 HE1 PHE A 535 9.982 -6.955 1.468 1.00 51.41 H new ATOM 0 HE2 PHE A 535 8.539 -7.514 -2.502 1.00 12.22 H new ATOM 0 HZ PHE A 535 9.632 -8.410 -0.486 1.00 3.44 H new ATOM 1585 N ASP A 536 10.998 -3.105 -2.151 1.00 54.13 N ATOM 1586 CA ASP A 536 11.788 -3.274 -3.378 1.00 75.31 C ATOM 1587 C ASP A 536 11.695 -4.708 -3.937 1.00 22.02 C ATOM 1588 O ASP A 536 11.829 -5.687 -3.202 1.00 50.52 O ATOM 1589 CB ASP A 536 13.247 -2.889 -3.101 1.00 14.13 C ATOM 1590 CG ASP A 536 13.803 -3.568 -1.862 1.00 74.24 C ATOM 1591 OD1 ASP A 536 13.390 -3.196 -0.742 1.00 63.42 O ATOM 1592 OD2 ASP A 536 14.647 -4.478 -1.999 1.00 3.12 O ATOM 0 H ASP A 536 11.414 -3.534 -1.324 1.00 54.13 H new ATOM 0 HA ASP A 536 11.375 -2.615 -4.142 1.00 75.31 H new ATOM 0 HB2 ASP A 536 13.859 -3.155 -3.963 1.00 14.13 H new ATOM 0 HB3 ASP A 536 13.318 -1.808 -2.981 1.00 14.13 H new ATOM 1597 N VAL A 537 11.465 -4.818 -5.248 1.00 44.44 N ATOM 1598 CA VAL A 537 11.337 -6.121 -5.918 1.00 51.33 C ATOM 1599 C VAL A 537 12.326 -6.256 -7.093 1.00 24.24 C ATOM 1600 O VAL A 537 12.566 -5.301 -7.832 1.00 62.30 O ATOM 1601 CB VAL A 537 9.892 -6.336 -6.445 1.00 53.25 C ATOM 1602 CG1 VAL A 537 9.752 -7.690 -7.147 1.00 52.23 C ATOM 1603 CG2 VAL A 537 8.882 -6.213 -5.304 1.00 71.42 C ATOM 0 H VAL A 537 11.363 -4.018 -5.872 1.00 44.44 H new ATOM 0 HA VAL A 537 11.570 -6.882 -5.173 1.00 51.33 H new ATOM 0 HB VAL A 537 9.683 -5.558 -7.179 1.00 53.25 H new ATOM 0 HG11 VAL A 537 8.729 -7.810 -7.504 1.00 52.23 H new ATOM 0 HG12 VAL A 537 10.439 -7.735 -7.992 1.00 52.23 H new ATOM 0 HG13 VAL A 537 9.988 -8.490 -6.445 1.00 52.23 H new ATOM 0 HG21 VAL A 537 7.875 -6.366 -5.691 1.00 71.42 H new ATOM 0 HG22 VAL A 537 9.097 -6.965 -4.545 1.00 71.42 H new ATOM 0 HG23 VAL A 537 8.953 -5.220 -4.861 1.00 71.42 H new ATOM 1613 N SER A 538 12.894 -7.450 -7.257 1.00 20.34 N ATOM 1614 CA SER A 538 13.817 -7.739 -8.365 1.00 25.42 C ATOM 1615 C SER A 538 13.252 -8.849 -9.267 1.00 2.34 C ATOM 1616 O SER A 538 13.052 -9.981 -8.821 1.00 21.51 O ATOM 1617 CB SER A 538 15.189 -8.159 -7.821 1.00 5.41 C ATOM 1618 OG SER A 538 16.099 -8.448 -8.873 1.00 5.35 O ATOM 0 H SER A 538 12.732 -8.241 -6.634 1.00 20.34 H new ATOM 0 HA SER A 538 13.932 -6.831 -8.957 1.00 25.42 H new ATOM 0 HB2 SER A 538 15.594 -7.362 -7.197 1.00 5.41 H new ATOM 0 HB3 SER A 538 15.076 -9.037 -7.184 1.00 5.41 H new ATOM 0 HG SER A 538 16.964 -8.711 -8.494 1.00 5.35 H new ATOM 1624 N VAL A 539 12.994 -8.520 -10.532 1.00 35.40 N ATOM 1625 CA VAL A 539 12.411 -9.476 -11.483 1.00 31.54 C ATOM 1626 C VAL A 539 13.476 -10.068 -12.424 1.00 33.50 C ATOM 1627 O VAL A 539 14.168 -9.340 -13.138 1.00 23.44 O ATOM 1628 CB VAL A 539 11.298 -8.813 -12.330 1.00 61.43 C ATOM 1629 CG1 VAL A 539 10.698 -9.808 -13.326 1.00 35.52 C ATOM 1630 CG2 VAL A 539 10.218 -8.233 -11.419 1.00 2.13 C ATOM 0 H VAL A 539 13.179 -7.598 -10.926 1.00 35.40 H new ATOM 0 HA VAL A 539 11.982 -10.283 -10.889 1.00 31.54 H new ATOM 0 HB VAL A 539 11.741 -7.999 -12.904 1.00 61.43 H new ATOM 0 HG11 VAL A 539 9.919 -9.315 -13.908 1.00 35.52 H new ATOM 0 HG12 VAL A 539 11.479 -10.167 -13.996 1.00 35.52 H new ATOM 0 HG13 VAL A 539 10.269 -10.651 -12.784 1.00 35.52 H new ATOM 0 HG21 VAL A 539 9.440 -7.769 -12.026 1.00 2.13 H new ATOM 0 HG22 VAL A 539 9.782 -9.031 -10.818 1.00 2.13 H new ATOM 0 HG23 VAL A 539 10.660 -7.484 -10.762 1.00 2.13 H new ATOM 1640 N VAL A 540 13.582 -11.398 -12.425 1.00 74.21 N ATOM 1641 CA VAL A 540 14.573 -12.113 -13.247 1.00 73.13 C ATOM 1642 C VAL A 540 13.911 -12.979 -14.338 1.00 44.34 C ATOM 1643 O VAL A 540 12.702 -13.214 -14.313 1.00 72.22 O ATOM 1644 CB VAL A 540 15.479 -13.010 -12.361 1.00 11.11 C ATOM 1645 CG1 VAL A 540 16.314 -12.159 -11.405 1.00 75.25 C ATOM 1646 CG2 VAL A 540 14.639 -14.029 -11.586 1.00 32.21 C ATOM 0 H VAL A 540 12.991 -12.010 -11.863 1.00 74.21 H new ATOM 0 HA VAL A 540 15.178 -11.351 -13.738 1.00 73.13 H new ATOM 0 HB VAL A 540 16.160 -13.556 -13.014 1.00 11.11 H new ATOM 0 HG11 VAL A 540 16.941 -12.808 -10.794 1.00 75.25 H new ATOM 0 HG12 VAL A 540 16.945 -11.480 -11.979 1.00 75.25 H new ATOM 0 HG13 VAL A 540 15.652 -11.581 -10.760 1.00 75.25 H new ATOM 0 HG21 VAL A 540 15.293 -14.648 -10.971 1.00 32.21 H new ATOM 0 HG22 VAL A 540 13.929 -13.504 -10.946 1.00 32.21 H new ATOM 0 HG23 VAL A 540 14.096 -14.662 -12.288 1.00 32.21 H new ATOM 1656 N LEU A 541 14.715 -13.463 -15.286 1.00 54.31 N ATOM 1657 CA LEU A 541 14.215 -14.302 -16.392 1.00 34.13 C ATOM 1658 C LEU A 541 14.177 -15.791 -16.004 1.00 51.20 C ATOM 1659 O LEU A 541 13.954 -16.662 -16.851 1.00 61.33 O ATOM 1660 CB LEU A 541 15.098 -14.113 -17.638 1.00 54.53 C ATOM 1661 CG LEU A 541 15.076 -12.706 -18.256 1.00 60.24 C ATOM 1662 CD1 LEU A 541 16.063 -12.609 -19.416 1.00 41.03 C ATOM 1663 CD2 LEU A 541 13.665 -12.346 -18.719 1.00 41.54 C ATOM 0 H LEU A 541 15.720 -13.291 -15.315 1.00 54.31 H new ATOM 0 HA LEU A 541 13.196 -13.985 -16.612 1.00 34.13 H new ATOM 0 HB2 LEU A 541 16.127 -14.359 -17.374 1.00 54.53 H new ATOM 0 HB3 LEU A 541 14.784 -14.829 -18.397 1.00 54.53 H new ATOM 0 HG LEU A 541 15.380 -11.992 -17.490 1.00 60.24 H new ATOM 0 HD11 LEU A 541 16.031 -11.605 -19.838 1.00 41.03 H new ATOM 0 HD12 LEU A 541 17.070 -12.819 -19.055 1.00 41.03 H new ATOM 0 HD13 LEU A 541 15.794 -13.334 -20.184 1.00 41.03 H new ATOM 0 HD21 LEU A 541 13.669 -11.346 -19.154 1.00 41.54 H new ATOM 0 HD22 LEU A 541 13.333 -13.066 -19.467 1.00 41.54 H new ATOM 0 HD23 LEU A 541 12.986 -12.368 -17.867 1.00 41.54 H new ATOM 1675 N GLU A 542 14.379 -16.071 -14.718 1.00 50.41 N ATOM 1676 CA GLU A 542 14.445 -17.451 -14.210 1.00 71.12 C ATOM 1677 C GLU A 542 13.449 -17.692 -13.044 1.00 10.51 C ATOM 1678 O GLU A 542 13.797 -17.421 -11.870 1.00 37.41 O ATOM 1679 CB GLU A 542 15.899 -17.763 -13.792 1.00 4.01 C ATOM 1680 CG GLU A 542 16.544 -16.681 -12.927 1.00 0.34 C ATOM 1681 CD GLU A 542 18.041 -16.872 -12.744 1.00 54.11 C ATOM 1682 OE1 GLU A 542 18.802 -16.534 -13.676 1.00 42.01 O ATOM 1683 OE2 GLU A 542 18.467 -17.336 -11.663 1.00 71.54 O ATOM 0 H GLU A 542 14.501 -15.358 -13.999 1.00 50.41 H new ATOM 0 HA GLU A 542 14.145 -18.133 -15.006 1.00 71.12 H new ATOM 0 HB2 GLU A 542 15.915 -18.707 -13.247 1.00 4.01 H new ATOM 0 HB3 GLU A 542 16.502 -17.903 -14.689 1.00 4.01 H new ATOM 0 HG2 GLU A 542 16.362 -15.707 -13.380 1.00 0.34 H new ATOM 0 HG3 GLU A 542 16.063 -16.673 -11.949 1.00 0.34 H new TER 1690 GLU A 542