USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=24 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 514 ASN :FLIP amide:sc= -0.852! F(o=-1.8,f=0.34!) USER MOD Set 1.2: A 534 THR OG1 : rot -44:sc= 1.19 USER MOD Set 2.1: A 506 THR OG1 : rot 76:sc= 1.22 USER MOD Set 2.2: A 507 GLN : amide:sc= 1.01 K(o=2.2,f=-0.89) USER MOD Set 3.1: A 472 SER OG : rot -41:sc= 1.29 USER MOD Set 3.2: A 522 THR OG1 : rot -154:sc= 0.741 USER MOD Set 4.1: A 441 THR OG1 : rot 122:sc= 0.0999 USER MOD Set 4.2: A 530 ASN : amide:sc= -3.42! C(o=-3.3!,f=-3.7!) USER MOD Single : A 435 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.861 K(o=-0.86,f=-3.2!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -144:sc= 0.739 USER MOD Single : A 461 HIS : no HD1:sc= 0.632 K(o=0.63,f=-2.1!) USER MOD Single : A 463 LYS NZ :NH3+ 159:sc= 2.11 (180deg=0.802) USER MOD Single : A 464 ASN : amide:sc= 0.385 K(o=0.38,f=-9.3!) USER MOD Single : A 473 THR OG1 : rot 94:sc= 0.087 USER MOD Single : A 474 LYS NZ :NH3+ -148:sc= 1.29 (180deg=0.787) USER MOD Single : A 478 TYR OH : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= -0.221 K(o=-0.22,f=-1) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 151:sc= -0.181 USER MOD Single : A 485 LYS NZ :NH3+ 166:sc= -0.0155 (180deg=-0.182) USER MOD Single : A 486 ASN : amide:sc= 0 X(o=0,f=-0.017) 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+ -173:sc= 0 (180deg=-0.045) 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 34:sc= 0.313 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 510 MET CE :methyl -159:sc= -0.305 (180deg=-0.814) USER MOD Single : A 511 TYR OH : rot 37:sc= 0.391 USER MOD Single : A 516 THR OG1 : rot 70:sc=-0.00424 USER MOD Single : A 521 ASN : amide:sc= -0.368 K(o=-0.37,f=-3.5!) USER MOD Single : A 527 ASN : amide:sc= -2.99! C(o=-3!,f=-4.1!) USER MOD Single : A 529 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.22) USER MOD Single : A 531 ASN : amide:sc= 0.416 K(o=0.42,f=-2.9!) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 435 -10.969 16.256 20.998 1.00 14.24 N ATOM 2 CA MET A 435 -10.400 16.333 19.628 1.00 22.31 C ATOM 3 C MET A 435 -9.599 15.066 19.289 1.00 21.51 C ATOM 4 O MET A 435 -8.418 14.960 19.615 1.00 34.51 O ATOM 5 CB MET A 435 -9.504 17.570 19.489 1.00 30.53 C ATOM 6 CG MET A 435 -10.225 18.888 19.748 1.00 62.11 C ATOM 7 SD MET A 435 -9.173 20.322 19.445 1.00 74.34 S ATOM 8 CE MET A 435 -10.315 21.664 19.786 1.00 11.20 C ATOM 0 HA MET A 435 -11.230 16.413 18.926 1.00 22.31 H new ATOM 0 HB2 MET A 435 -8.669 17.481 20.184 1.00 30.53 H new ATOM 0 HB3 MET A 435 -9.082 17.590 18.484 1.00 30.53 H new ATOM 0 HG2 MET A 435 -11.107 18.947 19.110 1.00 62.11 H new ATOM 0 HG3 MET A 435 -10.575 18.910 20.780 1.00 62.11 H new ATOM 0 HE1 MET A 435 -9.809 22.618 19.641 1.00 11.20 H new ATOM 0 HE2 MET A 435 -11.166 21.598 19.108 1.00 11.20 H new ATOM 0 HE3 MET A 435 -10.665 21.591 20.816 1.00 11.20 H new ATOM 20 N GLU A 436 -10.254 14.102 18.645 1.00 24.54 N ATOM 21 CA GLU A 436 -9.598 12.852 18.245 1.00 12.23 C ATOM 22 C GLU A 436 -8.939 12.985 16.864 1.00 50.34 C ATOM 23 O GLU A 436 -9.582 13.381 15.889 1.00 1.30 O ATOM 24 CB GLU A 436 -10.610 11.690 18.232 1.00 60.02 C ATOM 25 CG GLU A 436 -10.874 11.058 19.599 1.00 32.44 C ATOM 26 CD GLU A 436 -11.367 12.046 20.646 1.00 73.13 C ATOM 27 OE1 GLU A 436 -12.556 12.425 20.600 1.00 41.12 O ATOM 28 OE2 GLU A 436 -10.572 12.436 21.528 1.00 30.24 O ATOM 0 H GLU A 436 -11.239 14.160 18.387 1.00 24.54 H new ATOM 0 HA GLU A 436 -8.819 12.639 18.978 1.00 12.23 H new ATOM 0 HB2 GLU A 436 -11.554 12.053 17.826 1.00 60.02 H new ATOM 0 HB3 GLU A 436 -10.247 10.918 17.554 1.00 60.02 H new ATOM 0 HG2 GLU A 436 -11.612 10.264 19.486 1.00 32.44 H new ATOM 0 HG3 GLU A 436 -9.956 10.591 19.957 1.00 32.44 H new ATOM 35 N PHE A 437 -7.657 12.646 16.785 1.00 61.21 N ATOM 36 CA PHE A 437 -6.911 12.694 15.521 1.00 70.21 C ATOM 37 C PHE A 437 -6.538 11.279 15.055 1.00 71.11 C ATOM 38 O PHE A 437 -6.078 10.460 15.848 1.00 11.10 O ATOM 39 CB PHE A 437 -5.642 13.546 15.675 1.00 14.05 C ATOM 40 CG PHE A 437 -5.908 15.018 15.860 1.00 63.04 C ATOM 41 CD1 PHE A 437 -6.010 15.858 14.759 1.00 24.31 C ATOM 42 CD2 PHE A 437 -6.049 15.563 17.127 1.00 33.05 C ATOM 43 CE1 PHE A 437 -6.247 17.208 14.919 1.00 53.23 C ATOM 44 CE2 PHE A 437 -6.289 16.915 17.291 1.00 42.31 C ATOM 45 CZ PHE A 437 -6.387 17.738 16.185 1.00 52.40 C ATOM 0 H PHE A 437 -7.105 12.332 17.583 1.00 61.21 H new ATOM 0 HA PHE A 437 -7.553 13.151 14.768 1.00 70.21 H new ATOM 0 HB2 PHE A 437 -5.073 13.180 16.530 1.00 14.05 H new ATOM 0 HB3 PHE A 437 -5.016 13.409 14.793 1.00 14.05 H new ATOM 0 HD1 PHE A 437 -5.902 15.450 13.765 1.00 24.31 H new ATOM 0 HD2 PHE A 437 -5.971 14.925 17.995 1.00 33.05 H new ATOM 0 HE1 PHE A 437 -6.323 17.849 14.053 1.00 53.23 H new ATOM 0 HE2 PHE A 437 -6.400 17.328 18.283 1.00 42.31 H new ATOM 0 HZ PHE A 437 -6.573 18.794 16.312 1.00 52.40 H new ATOM 55 N PRO A 438 -6.747 10.973 13.760 1.00 75.23 N ATOM 56 CA PRO A 438 -6.480 9.642 13.201 1.00 4.42 C ATOM 57 C PRO A 438 -5.002 9.413 12.847 1.00 31.50 C ATOM 58 O PRO A 438 -4.168 10.302 13.012 1.00 4.35 O ATOM 59 CB PRO A 438 -7.365 9.610 11.953 1.00 63.15 C ATOM 60 CG PRO A 438 -7.482 11.036 11.513 1.00 73.13 C ATOM 61 CD PRO A 438 -7.259 11.904 12.732 1.00 31.31 C ATOM 0 HA PRO A 438 -6.697 8.849 13.917 1.00 4.42 H new ATOM 0 HB2 PRO A 438 -6.921 8.993 11.172 1.00 63.15 H new ATOM 0 HB3 PRO A 438 -8.344 9.186 12.176 1.00 63.15 H new ATOM 0 HG2 PRO A 438 -6.746 11.261 10.741 1.00 73.13 H new ATOM 0 HG3 PRO A 438 -8.465 11.225 11.081 1.00 73.13 H new ATOM 0 HD2 PRO A 438 -6.544 12.701 12.527 1.00 31.31 H new ATOM 0 HD3 PRO A 438 -8.184 12.381 13.054 1.00 31.31 H new ATOM 69 N ASP A 439 -4.686 8.192 12.413 1.00 14.21 N ATOM 70 CA ASP A 439 -3.329 7.848 11.977 1.00 71.31 C ATOM 71 C ASP A 439 -3.375 6.654 11.003 1.00 40.45 C ATOM 72 O ASP A 439 -3.290 5.497 11.417 1.00 44.11 O ATOM 73 CB ASP A 439 -2.449 7.533 13.196 1.00 72.01 C ATOM 74 CG ASP A 439 -0.969 7.472 12.854 1.00 63.43 C ATOM 75 OD1 ASP A 439 -0.323 8.540 12.819 1.00 34.22 O ATOM 76 OD2 ASP A 439 -0.440 6.361 12.635 1.00 73.31 O ATOM 0 H ASP A 439 -5.352 7.422 12.353 1.00 14.21 H new ATOM 0 HA ASP A 439 -2.892 8.698 11.453 1.00 71.31 H new ATOM 0 HB2 ASP A 439 -2.610 8.293 13.960 1.00 72.01 H new ATOM 0 HB3 ASP A 439 -2.758 6.580 13.625 1.00 72.01 H new ATOM 81 N LEU A 440 -3.563 6.946 9.719 1.00 45.44 N ATOM 82 CA LEU A 440 -3.703 5.907 8.689 1.00 14.11 C ATOM 83 C LEU A 440 -2.346 5.495 8.100 1.00 24.32 C ATOM 84 O LEU A 440 -1.754 6.223 7.301 1.00 62.32 O ATOM 85 CB LEU A 440 -4.618 6.406 7.557 1.00 53.12 C ATOM 86 CG LEU A 440 -6.034 6.825 7.986 1.00 12.21 C ATOM 87 CD1 LEU A 440 -6.787 7.447 6.814 1.00 34.42 C ATOM 88 CD2 LEU A 440 -6.811 5.640 8.560 1.00 10.30 C ATOM 0 H LEU A 440 -3.623 7.899 9.360 1.00 45.44 H new ATOM 0 HA LEU A 440 -4.143 5.033 9.168 1.00 14.11 H new ATOM 0 HB2 LEU A 440 -4.137 7.256 7.073 1.00 53.12 H new ATOM 0 HB3 LEU A 440 -4.702 5.619 6.808 1.00 53.12 H new ATOM 0 HG LEU A 440 -5.939 7.574 8.772 1.00 12.21 H new ATOM 0 HD11 LEU A 440 -7.787 7.737 7.137 1.00 34.42 H new ATOM 0 HD12 LEU A 440 -6.249 8.328 6.462 1.00 34.42 H new ATOM 0 HD13 LEU A 440 -6.863 6.721 6.004 1.00 34.42 H new ATOM 0 HD21 LEU A 440 -7.808 5.967 8.854 1.00 10.30 H new ATOM 0 HD22 LEU A 440 -6.894 4.859 7.804 1.00 10.30 H new ATOM 0 HD23 LEU A 440 -6.286 5.248 9.431 1.00 10.30 H new ATOM 100 N THR A 441 -1.859 4.321 8.483 1.00 33.12 N ATOM 101 CA THR A 441 -0.591 3.808 7.946 1.00 73.20 C ATOM 102 C THR A 441 -0.802 2.566 7.081 1.00 63.34 C ATOM 103 O THR A 441 -1.760 1.810 7.270 1.00 74.14 O ATOM 104 CB THR A 441 0.422 3.471 9.064 1.00 32.31 C ATOM 105 OG1 THR A 441 1.642 2.958 8.498 1.00 73.25 O ATOM 106 CG2 THR A 441 -0.149 2.462 10.053 1.00 3.43 C ATOM 0 H THR A 441 -2.314 3.706 9.158 1.00 33.12 H new ATOM 0 HA THR A 441 -0.184 4.610 7.331 1.00 73.20 H new ATOM 0 HB THR A 441 0.632 4.395 9.603 1.00 32.31 H new ATOM 0 HG1 THR A 441 2.394 3.521 8.777 1.00 73.25 H new ATOM 0 HG21 THR A 441 0.591 2.250 10.824 1.00 3.43 H new ATOM 0 HG22 THR A 441 -1.047 2.873 10.515 1.00 3.43 H new ATOM 0 HG23 THR A 441 -0.401 1.540 9.528 1.00 3.43 H new ATOM 114 N VAL A 442 0.100 2.367 6.125 1.00 63.55 N ATOM 115 CA VAL A 442 0.040 1.217 5.219 1.00 22.33 C ATOM 116 C VAL A 442 1.351 0.410 5.259 1.00 34.14 C ATOM 117 O VAL A 442 2.433 0.970 5.456 1.00 23.01 O ATOM 118 CB VAL A 442 -0.241 1.671 3.761 1.00 20.02 C ATOM 119 CG1 VAL A 442 -1.578 2.406 3.666 1.00 42.11 C ATOM 120 CG2 VAL A 442 0.892 2.554 3.239 1.00 41.04 C ATOM 0 H VAL A 442 0.889 2.991 5.954 1.00 63.55 H new ATOM 0 HA VAL A 442 -0.778 0.581 5.558 1.00 22.33 H new ATOM 0 HB VAL A 442 -0.297 0.779 3.138 1.00 20.02 H new ATOM 0 HG11 VAL A 442 -1.752 2.714 2.635 1.00 42.11 H new ATOM 0 HG12 VAL A 442 -2.381 1.743 3.987 1.00 42.11 H new ATOM 0 HG13 VAL A 442 -1.556 3.286 4.308 1.00 42.11 H new ATOM 0 HG21 VAL A 442 0.673 2.860 2.216 1.00 41.04 H new ATOM 0 HG22 VAL A 442 0.985 3.438 3.870 1.00 41.04 H new ATOM 0 HG23 VAL A 442 1.827 1.995 3.258 1.00 41.04 H new ATOM 130 N GLU A 443 1.251 -0.904 5.064 1.00 63.13 N ATOM 131 CA GLU A 443 2.425 -1.789 5.067 1.00 32.33 C ATOM 132 C GLU A 443 2.397 -2.756 3.873 1.00 31.03 C ATOM 133 O GLU A 443 1.336 -3.250 3.493 1.00 1.01 O ATOM 134 CB GLU A 443 2.482 -2.590 6.378 1.00 13.25 C ATOM 135 CG GLU A 443 2.574 -1.727 7.634 1.00 73.05 C ATOM 136 CD GLU A 443 2.706 -2.553 8.902 1.00 54.11 C ATOM 137 OE1 GLU A 443 3.828 -3.023 9.194 1.00 51.42 O ATOM 138 OE2 GLU A 443 1.693 -2.754 9.604 1.00 11.24 O ATOM 0 H GLU A 443 0.367 -1.385 4.901 1.00 63.13 H new ATOM 0 HA GLU A 443 3.314 -1.164 4.983 1.00 32.33 H new ATOM 0 HB2 GLU A 443 1.594 -3.218 6.446 1.00 13.25 H new ATOM 0 HB3 GLU A 443 3.343 -3.258 6.346 1.00 13.25 H new ATOM 0 HG2 GLU A 443 3.431 -1.059 7.549 1.00 73.05 H new ATOM 0 HG3 GLU A 443 1.686 -1.099 7.705 1.00 73.05 H new ATOM 145 N ILE A 444 3.566 -3.029 3.290 1.00 65.51 N ATOM 146 CA ILE A 444 3.672 -3.949 2.145 1.00 75.43 C ATOM 147 C ILE A 444 4.413 -5.238 2.538 1.00 51.11 C ATOM 148 O ILE A 444 5.498 -5.188 3.116 1.00 10.20 O ATOM 149 CB ILE A 444 4.417 -3.287 0.957 1.00 54.53 C ATOM 150 CG1 ILE A 444 3.743 -1.962 0.562 1.00 71.35 C ATOM 151 CG2 ILE A 444 4.473 -4.240 -0.240 1.00 24.12 C ATOM 152 CD1 ILE A 444 4.448 -1.228 -0.560 1.00 4.45 C ATOM 0 H ILE A 444 4.455 -2.628 3.589 1.00 65.51 H new ATOM 0 HA ILE A 444 2.654 -4.193 1.840 1.00 75.43 H new ATOM 0 HB ILE A 444 5.438 -3.070 1.272 1.00 54.53 H new ATOM 0 HG12 ILE A 444 2.715 -2.164 0.262 1.00 71.35 H new ATOM 0 HG13 ILE A 444 3.698 -1.313 1.437 1.00 71.35 H new ATOM 0 HG21 ILE A 444 4.999 -3.758 -1.064 1.00 24.12 H new ATOM 0 HG22 ILE A 444 5.000 -5.151 0.044 1.00 24.12 H new ATOM 0 HG23 ILE A 444 3.460 -4.490 -0.554 1.00 24.12 H new ATOM 0 HD11 ILE A 444 3.914 -0.304 -0.782 1.00 4.45 H new ATOM 0 HD12 ILE A 444 5.468 -0.994 -0.257 1.00 4.45 H new ATOM 0 HD13 ILE A 444 4.469 -1.857 -1.450 1.00 4.45 H new ATOM 164 N LYS A 445 3.830 -6.391 2.221 1.00 43.11 N ATOM 165 CA LYS A 445 4.456 -7.684 2.532 1.00 23.13 C ATOM 166 C LYS A 445 4.416 -8.627 1.319 1.00 34.14 C ATOM 167 O LYS A 445 3.385 -8.761 0.662 1.00 23.41 O ATOM 168 CB LYS A 445 3.747 -8.336 3.731 1.00 33.14 C ATOM 169 CG LYS A 445 4.448 -9.584 4.267 1.00 75.04 C ATOM 170 CD LYS A 445 5.845 -9.258 4.795 1.00 44.42 C ATOM 171 CE LYS A 445 6.527 -10.479 5.401 1.00 33.24 C ATOM 172 NZ LYS A 445 7.855 -10.140 5.976 1.00 44.33 N ATOM 0 H LYS A 445 2.928 -6.462 1.750 1.00 43.11 H new ATOM 0 HA LYS A 445 5.501 -7.503 2.785 1.00 23.13 H new ATOM 0 HB2 LYS A 445 3.667 -7.604 4.534 1.00 33.14 H new ATOM 0 HB3 LYS A 445 2.731 -8.600 3.439 1.00 33.14 H new ATOM 0 HG2 LYS A 445 3.850 -10.024 5.065 1.00 75.04 H new ATOM 0 HG3 LYS A 445 4.522 -10.330 3.475 1.00 75.04 H new ATOM 0 HD2 LYS A 445 6.457 -8.867 3.982 1.00 44.42 H new ATOM 0 HD3 LYS A 445 5.774 -8.472 5.547 1.00 44.42 H new ATOM 0 HE2 LYS A 445 5.891 -10.902 6.179 1.00 33.24 H new ATOM 0 HE3 LYS A 445 6.647 -11.246 4.636 1.00 33.24 H new ATOM 0 HZ1 LYS A 445 8.288 -10.996 6.379 1.00 44.33 H new ATOM 0 HZ2 LYS A 445 8.470 -9.760 5.229 1.00 44.33 H new ATOM 0 HZ3 LYS A 445 7.738 -9.427 6.724 1.00 44.33 H new ATOM 186 N GLY A 446 5.543 -9.273 1.024 1.00 51.22 N ATOM 187 CA GLY A 446 5.596 -10.220 -0.088 1.00 4.40 C ATOM 188 C GLY A 446 7.019 -10.575 -0.519 1.00 65.33 C ATOM 189 O GLY A 446 7.985 -10.215 0.158 1.00 31.32 O ATOM 0 H GLY A 446 6.420 -9.160 1.532 1.00 51.22 H new ATOM 0 HA2 GLY A 446 5.073 -11.133 0.197 1.00 4.40 H new ATOM 0 HA3 GLY A 446 5.061 -9.799 -0.939 1.00 4.40 H new ATOM 193 N PRO A 447 7.177 -11.291 -1.650 1.00 64.03 N ATOM 194 CA PRO A 447 8.502 -11.689 -2.163 1.00 0.24 C ATOM 195 C PRO A 447 9.321 -10.502 -2.706 1.00 11.03 C ATOM 196 O PRO A 447 8.855 -9.743 -3.561 1.00 50.35 O ATOM 197 CB PRO A 447 8.163 -12.676 -3.289 1.00 52.05 C ATOM 198 CG PRO A 447 6.797 -12.280 -3.740 1.00 33.41 C ATOM 199 CD PRO A 447 6.080 -11.779 -2.513 1.00 1.42 C ATOM 0 HA PRO A 447 9.127 -12.112 -1.377 1.00 0.24 H new ATOM 0 HB2 PRO A 447 8.884 -12.610 -4.104 1.00 52.05 H new ATOM 0 HB3 PRO A 447 8.179 -13.706 -2.932 1.00 52.05 H new ATOM 0 HG2 PRO A 447 6.849 -11.505 -4.505 1.00 33.41 H new ATOM 0 HG3 PRO A 447 6.271 -13.127 -4.180 1.00 33.41 H new ATOM 0 HD2 PRO A 447 5.376 -10.983 -2.756 1.00 1.42 H new ATOM 0 HD3 PRO A 447 5.510 -12.572 -2.029 1.00 1.42 H new ATOM 207 N ASP A 448 10.548 -10.355 -2.211 1.00 21.12 N ATOM 208 CA ASP A 448 11.437 -9.265 -2.629 1.00 73.04 C ATOM 209 C ASP A 448 12.085 -9.540 -4.002 1.00 4.41 C ATOM 210 O ASP A 448 12.569 -8.622 -4.668 1.00 54.41 O ATOM 211 CB ASP A 448 12.508 -9.037 -1.559 1.00 11.04 C ATOM 212 CG ASP A 448 13.232 -10.318 -1.191 1.00 70.20 C ATOM 213 OD1 ASP A 448 12.686 -11.109 -0.387 1.00 52.41 O ATOM 214 OD2 ASP A 448 14.343 -10.550 -1.701 1.00 4.42 O ATOM 0 H ASP A 448 10.954 -10.980 -1.515 1.00 21.12 H new ATOM 0 HA ASP A 448 10.836 -8.362 -2.739 1.00 73.04 H new ATOM 0 HB2 ASP A 448 13.230 -8.305 -1.920 1.00 11.04 H new ATOM 0 HB3 ASP A 448 12.044 -8.615 -0.667 1.00 11.04 H new ATOM 219 N VAL A 449 12.107 -10.809 -4.408 1.00 51.44 N ATOM 220 CA VAL A 449 12.589 -11.203 -5.742 1.00 51.02 C ATOM 221 C VAL A 449 11.563 -12.117 -6.434 1.00 54.51 C ATOM 222 O VAL A 449 11.124 -13.115 -5.858 1.00 3.22 O ATOM 223 CB VAL A 449 13.956 -11.939 -5.668 1.00 42.44 C ATOM 224 CG1 VAL A 449 14.421 -12.375 -7.058 1.00 44.25 C ATOM 225 CG2 VAL A 449 15.011 -11.060 -4.998 1.00 23.22 C ATOM 0 H VAL A 449 11.795 -11.591 -3.831 1.00 51.44 H new ATOM 0 HA VAL A 449 12.720 -10.287 -6.319 1.00 51.02 H new ATOM 0 HB VAL A 449 13.821 -12.834 -5.061 1.00 42.44 H new ATOM 0 HG11 VAL A 449 15.380 -12.887 -6.977 1.00 44.25 H new ATOM 0 HG12 VAL A 449 13.684 -13.050 -7.493 1.00 44.25 H new ATOM 0 HG13 VAL A 449 14.531 -11.498 -7.696 1.00 44.25 H new ATOM 0 HG21 VAL A 449 15.959 -11.596 -4.958 1.00 23.22 H new ATOM 0 HG22 VAL A 449 15.138 -10.142 -5.572 1.00 23.22 H new ATOM 0 HG23 VAL A 449 14.690 -10.814 -3.986 1.00 23.22 H new ATOM 235 N VAL A 450 11.177 -11.773 -7.664 1.00 64.40 N ATOM 236 CA VAL A 450 10.173 -12.546 -8.407 1.00 21.00 C ATOM 237 C VAL A 450 10.672 -12.937 -9.807 1.00 40.21 C ATOM 238 O VAL A 450 11.655 -12.389 -10.313 1.00 10.02 O ATOM 239 CB VAL A 450 8.831 -11.775 -8.542 1.00 44.41 C ATOM 240 CG1 VAL A 450 8.253 -11.443 -7.168 1.00 12.24 C ATOM 241 CG2 VAL A 450 9.007 -10.507 -9.379 1.00 72.02 C ATOM 0 H VAL A 450 11.542 -10.965 -8.169 1.00 64.40 H new ATOM 0 HA VAL A 450 10.003 -13.453 -7.826 1.00 21.00 H new ATOM 0 HB VAL A 450 8.124 -12.423 -9.060 1.00 44.41 H new ATOM 0 HG11 VAL A 450 7.314 -10.903 -7.289 1.00 12.24 H new ATOM 0 HG12 VAL A 450 8.073 -12.366 -6.616 1.00 12.24 H new ATOM 0 HG13 VAL A 450 8.959 -10.823 -6.616 1.00 12.24 H new ATOM 0 HG21 VAL A 450 8.052 -9.987 -9.457 1.00 72.02 H new ATOM 0 HG22 VAL A 450 9.738 -9.854 -8.901 1.00 72.02 H new ATOM 0 HG23 VAL A 450 9.357 -10.775 -10.376 1.00 72.02 H new ATOM 251 N GLY A 451 9.993 -13.900 -10.425 1.00 52.03 N ATOM 252 CA GLY A 451 10.371 -14.356 -11.760 1.00 24.15 C ATOM 253 C GLY A 451 9.555 -13.704 -12.873 1.00 22.12 C ATOM 254 O GLY A 451 8.416 -13.285 -12.662 1.00 72.32 O ATOM 0 H GLY A 451 9.184 -14.377 -10.027 1.00 52.03 H new ATOM 0 HA2 GLY A 451 11.428 -14.146 -11.923 1.00 24.15 H new ATOM 0 HA3 GLY A 451 10.249 -15.438 -11.815 1.00 24.15 H new ATOM 258 N VAL A 452 10.143 -13.624 -14.062 1.00 43.44 N ATOM 259 CA VAL A 452 9.469 -13.052 -15.230 1.00 52.04 C ATOM 260 C VAL A 452 8.308 -13.949 -15.699 1.00 14.12 C ATOM 261 O VAL A 452 8.408 -15.178 -15.660 1.00 72.21 O ATOM 262 CB VAL A 452 10.471 -12.840 -16.394 1.00 31.11 C ATOM 263 CG1 VAL A 452 11.025 -14.175 -16.889 1.00 62.54 C ATOM 264 CG2 VAL A 452 9.831 -12.056 -17.535 1.00 70.43 C ATOM 0 H VAL A 452 11.092 -13.950 -14.246 1.00 43.44 H new ATOM 0 HA VAL A 452 9.062 -12.086 -14.932 1.00 52.04 H new ATOM 0 HB VAL A 452 11.305 -12.251 -16.013 1.00 31.11 H new ATOM 0 HG11 VAL A 452 11.725 -13.998 -17.705 1.00 62.54 H new ATOM 0 HG12 VAL A 452 11.540 -14.680 -16.072 1.00 62.54 H new ATOM 0 HG13 VAL A 452 10.205 -14.800 -17.243 1.00 62.54 H new ATOM 0 HG21 VAL A 452 10.557 -11.923 -18.337 1.00 70.43 H new ATOM 0 HG22 VAL A 452 8.968 -12.604 -17.914 1.00 70.43 H new ATOM 0 HG23 VAL A 452 9.510 -11.080 -17.171 1.00 70.43 H new ATOM 274 N ASN A 453 7.208 -13.326 -16.126 1.00 5.14 N ATOM 275 CA ASN A 453 6.013 -14.053 -16.586 1.00 22.15 C ATOM 276 C ASN A 453 5.429 -14.958 -15.477 1.00 44.21 C ATOM 277 O ASN A 453 4.691 -15.907 -15.753 1.00 51.32 O ATOM 278 CB ASN A 453 6.349 -14.878 -17.842 1.00 73.15 C ATOM 279 CG ASN A 453 6.855 -14.009 -18.982 1.00 3.04 C ATOM 280 OD1 ASN A 453 6.449 -12.862 -19.132 1.00 71.43 O ATOM 281 ND2 ASN A 453 7.755 -14.546 -19.784 1.00 13.52 N ATOM 0 H ASN A 453 7.116 -12.311 -16.165 1.00 5.14 H new ATOM 0 HA ASN A 453 5.249 -13.317 -16.837 1.00 22.15 H new ATOM 0 HB2 ASN A 453 7.104 -15.624 -17.593 1.00 73.15 H new ATOM 0 HB3 ASN A 453 5.461 -15.420 -18.167 1.00 73.15 H new ATOM 0 HD21 ASN A 453 8.136 -14.003 -20.559 1.00 13.52 H new ATOM 0 HD22 ASN A 453 8.070 -15.504 -19.629 1.00 13.52 H new ATOM 288 N LYS A 454 5.757 -14.644 -14.222 1.00 71.44 N ATOM 289 CA LYS A 454 5.255 -15.402 -13.066 1.00 54.35 C ATOM 290 C LYS A 454 4.197 -14.606 -12.288 1.00 22.31 C ATOM 291 O LYS A 454 4.053 -13.398 -12.469 1.00 63.13 O ATOM 292 CB LYS A 454 6.415 -15.775 -12.128 1.00 75.42 C ATOM 293 CG LYS A 454 7.452 -16.702 -12.757 1.00 0.15 C ATOM 294 CD LYS A 454 6.849 -18.036 -13.193 1.00 12.01 C ATOM 295 CE LYS A 454 6.208 -18.781 -12.028 1.00 21.55 C ATOM 296 NZ LYS A 454 5.711 -20.122 -12.430 1.00 13.43 N ATOM 0 H LYS A 454 6.371 -13.867 -13.976 1.00 71.44 H new ATOM 0 HA LYS A 454 4.788 -16.311 -13.446 1.00 54.35 H new ATOM 0 HB2 LYS A 454 6.911 -14.861 -11.800 1.00 75.42 H new ATOM 0 HB3 LYS A 454 6.008 -16.254 -11.237 1.00 75.42 H new ATOM 0 HG2 LYS A 454 7.901 -16.209 -13.620 1.00 0.15 H new ATOM 0 HG3 LYS A 454 8.254 -16.885 -12.042 1.00 0.15 H new ATOM 0 HD2 LYS A 454 6.101 -17.860 -13.966 1.00 12.01 H new ATOM 0 HD3 LYS A 454 7.627 -18.658 -13.637 1.00 12.01 H new ATOM 0 HE2 LYS A 454 6.935 -18.890 -11.224 1.00 21.55 H new ATOM 0 HE3 LYS A 454 5.381 -18.192 -11.632 1.00 21.55 H new ATOM 0 HZ1 LYS A 454 5.283 -20.594 -11.608 1.00 13.43 H new ATOM 0 HZ2 LYS A 454 4.998 -20.018 -13.180 1.00 13.43 H new ATOM 0 HZ3 LYS A 454 6.504 -20.694 -12.784 1.00 13.43 H new ATOM 310 N LEU A 455 3.459 -15.293 -11.421 1.00 43.23 N ATOM 311 CA LEU A 455 2.422 -14.653 -10.607 1.00 12.04 C ATOM 312 C LEU A 455 2.891 -14.458 -9.155 1.00 1.55 C ATOM 313 O LEU A 455 3.165 -15.428 -8.446 1.00 32.51 O ATOM 314 CB LEU A 455 1.139 -15.494 -10.635 1.00 35.44 C ATOM 315 CG LEU A 455 -0.097 -14.817 -10.025 1.00 55.30 C ATOM 316 CD1 LEU A 455 -0.448 -13.551 -10.805 1.00 74.33 C ATOM 317 CD2 LEU A 455 -1.280 -15.784 -9.984 1.00 33.14 C ATOM 0 H LEU A 455 3.558 -16.296 -11.261 1.00 43.23 H new ATOM 0 HA LEU A 455 2.220 -13.670 -11.031 1.00 12.04 H new ATOM 0 HB2 LEU A 455 0.917 -15.756 -11.670 1.00 35.44 H new ATOM 0 HB3 LEU A 455 1.323 -16.427 -10.102 1.00 35.44 H new ATOM 0 HG LEU A 455 0.135 -14.532 -8.999 1.00 55.30 H new ATOM 0 HD11 LEU A 455 -1.326 -13.082 -10.361 1.00 74.33 H new ATOM 0 HD12 LEU A 455 0.392 -12.857 -10.769 1.00 74.33 H new ATOM 0 HD13 LEU A 455 -0.660 -13.810 -11.842 1.00 74.33 H new ATOM 0 HD21 LEU A 455 -2.144 -15.283 -9.548 1.00 33.14 H new ATOM 0 HD22 LEU A 455 -1.521 -16.108 -10.997 1.00 33.14 H new ATOM 0 HD23 LEU A 455 -1.020 -16.652 -9.378 1.00 33.14 H new ATOM 329 N ALA A 456 2.981 -13.202 -8.717 1.00 41.11 N ATOM 330 CA ALA A 456 3.406 -12.884 -7.347 1.00 71.20 C ATOM 331 C ALA A 456 2.274 -12.223 -6.545 1.00 5.34 C ATOM 332 O ALA A 456 1.616 -11.302 -7.029 1.00 62.23 O ATOM 333 CB ALA A 456 4.630 -11.974 -7.377 1.00 65.32 C ATOM 0 H ALA A 456 2.766 -12.385 -9.289 1.00 41.11 H new ATOM 0 HA ALA A 456 3.664 -13.819 -6.850 1.00 71.20 H new ATOM 0 HB1 ALA A 456 4.937 -11.744 -6.357 1.00 65.32 H new ATOM 0 HB2 ALA A 456 5.445 -12.478 -7.897 1.00 65.32 H new ATOM 0 HB3 ALA A 456 4.383 -11.049 -7.899 1.00 65.32 H new ATOM 339 N GLU A 457 2.053 -12.693 -5.317 1.00 24.22 N ATOM 340 CA GLU A 457 1.004 -12.140 -4.448 1.00 34.13 C ATOM 341 C GLU A 457 1.595 -11.374 -3.256 1.00 10.12 C ATOM 342 O GLU A 457 2.514 -11.850 -2.586 1.00 11.14 O ATOM 343 CB GLU A 457 0.081 -13.260 -3.947 1.00 72.22 C ATOM 344 CG GLU A 457 -0.916 -13.740 -4.993 1.00 52.44 C ATOM 345 CD GLU A 457 -1.713 -14.948 -4.534 1.00 4.44 C ATOM 346 OE1 GLU A 457 -1.265 -16.090 -4.767 1.00 13.24 O ATOM 347 OE2 GLU A 457 -2.792 -14.758 -3.936 1.00 71.32 O ATOM 0 H GLU A 457 2.585 -13.456 -4.898 1.00 24.22 H new ATOM 0 HA GLU A 457 0.425 -11.434 -5.043 1.00 34.13 H new ATOM 0 HB2 GLU A 457 0.690 -14.104 -3.623 1.00 72.22 H new ATOM 0 HB3 GLU A 457 -0.465 -12.906 -3.072 1.00 72.22 H new ATOM 0 HG2 GLU A 457 -1.602 -12.928 -5.234 1.00 52.44 H new ATOM 0 HG3 GLU A 457 -0.382 -13.989 -5.910 1.00 52.44 H new ATOM 354 N TYR A 458 1.053 -10.187 -3.001 1.00 71.00 N ATOM 355 CA TYR A 458 1.493 -9.343 -1.882 1.00 15.31 C ATOM 356 C TYR A 458 0.318 -8.998 -0.952 1.00 21.11 C ATOM 357 O TYR A 458 -0.848 -9.124 -1.335 1.00 3.41 O ATOM 358 CB TYR A 458 2.120 -8.043 -2.415 1.00 65.10 C ATOM 359 CG TYR A 458 3.390 -8.241 -3.228 1.00 10.02 C ATOM 360 CD1 TYR A 458 3.343 -8.692 -4.544 1.00 13.54 C ATOM 361 CD2 TYR A 458 4.639 -7.971 -2.676 1.00 72.34 C ATOM 362 CE1 TYR A 458 4.499 -8.867 -5.283 1.00 42.31 C ATOM 363 CE2 TYR A 458 5.798 -8.143 -3.409 1.00 1.21 C ATOM 364 CZ TYR A 458 5.723 -8.594 -4.709 1.00 33.32 C ATOM 365 OH TYR A 458 6.876 -8.766 -5.441 1.00 32.41 O ATOM 0 H TYR A 458 0.301 -9.780 -3.557 1.00 71.00 H new ATOM 0 HA TYR A 458 2.235 -9.903 -1.313 1.00 15.31 H new ATOM 0 HB2 TYR A 458 1.385 -7.527 -3.033 1.00 65.10 H new ATOM 0 HB3 TYR A 458 2.342 -7.389 -1.571 1.00 65.10 H new ATOM 0 HD1 TYR A 458 2.387 -8.909 -4.996 1.00 13.54 H new ATOM 0 HD2 TYR A 458 4.704 -7.621 -1.656 1.00 72.34 H new ATOM 0 HE1 TYR A 458 4.443 -9.215 -6.304 1.00 42.31 H new ATOM 0 HE2 TYR A 458 6.758 -7.925 -2.965 1.00 1.21 H new ATOM 0 HH TYR A 458 7.589 -9.097 -4.856 1.00 32.41 H new ATOM 375 N GLU A 459 0.634 -8.541 0.261 1.00 63.11 N ATOM 376 CA GLU A 459 -0.383 -8.081 1.216 1.00 50.53 C ATOM 377 C GLU A 459 -0.152 -6.613 1.582 1.00 30.01 C ATOM 378 O GLU A 459 0.947 -6.228 1.991 1.00 72.24 O ATOM 379 CB GLU A 459 -0.355 -8.897 2.522 1.00 75.34 C ATOM 380 CG GLU A 459 -0.721 -10.373 2.388 1.00 42.32 C ATOM 381 CD GLU A 459 -0.977 -11.031 3.743 1.00 60.02 C ATOM 382 OE1 GLU A 459 -0.299 -10.666 4.734 1.00 35.01 O ATOM 383 OE2 GLU A 459 -1.874 -11.893 3.837 1.00 52.33 O ATOM 0 H GLU A 459 1.591 -8.478 0.609 1.00 63.11 H new ATOM 0 HA GLU A 459 -1.348 -8.211 0.726 1.00 50.53 H new ATOM 0 HB2 GLU A 459 0.644 -8.827 2.951 1.00 75.34 H new ATOM 0 HB3 GLU A 459 -1.040 -8.435 3.233 1.00 75.34 H new ATOM 0 HG2 GLU A 459 -1.611 -10.470 1.766 1.00 42.32 H new ATOM 0 HG3 GLU A 459 0.085 -10.900 1.877 1.00 42.32 H new ATOM 390 N VAL A 460 -1.189 -5.799 1.441 1.00 20.31 N ATOM 391 CA VAL A 460 -1.165 -4.426 1.931 1.00 23.24 C ATOM 392 C VAL A 460 -1.935 -4.336 3.253 1.00 23.50 C ATOM 393 O VAL A 460 -3.150 -4.531 3.290 1.00 25.12 O ATOM 394 CB VAL A 460 -1.787 -3.443 0.907 1.00 71.40 C ATOM 395 CG1 VAL A 460 -1.691 -2.001 1.406 1.00 14.51 C ATOM 396 CG2 VAL A 460 -1.120 -3.594 -0.461 1.00 33.42 C ATOM 0 H VAL A 460 -2.063 -6.067 0.989 1.00 20.31 H new ATOM 0 HA VAL A 460 -0.123 -4.144 2.083 1.00 23.24 H new ATOM 0 HB VAL A 460 -2.843 -3.690 0.798 1.00 71.40 H new ATOM 0 HG11 VAL A 460 -2.134 -1.331 0.670 1.00 14.51 H new ATOM 0 HG12 VAL A 460 -2.226 -1.907 2.351 1.00 14.51 H new ATOM 0 HG13 VAL A 460 -0.644 -1.736 1.554 1.00 14.51 H new ATOM 0 HG21 VAL A 460 -1.571 -2.895 -1.165 1.00 33.42 H new ATOM 0 HG22 VAL A 460 -0.055 -3.382 -0.372 1.00 33.42 H new ATOM 0 HG23 VAL A 460 -1.258 -4.613 -0.823 1.00 33.42 H new ATOM 406 N HIS A 461 -1.219 -4.060 4.336 1.00 31.33 N ATOM 407 CA HIS A 461 -1.831 -3.930 5.663 1.00 42.22 C ATOM 408 C HIS A 461 -2.112 -2.459 5.987 1.00 72.13 C ATOM 409 O HIS A 461 -1.186 -1.681 6.224 1.00 73.22 O ATOM 410 CB HIS A 461 -0.916 -4.550 6.733 1.00 33.22 C ATOM 411 CG HIS A 461 -0.918 -6.051 6.734 1.00 55.45 C ATOM 412 ND1 HIS A 461 -1.469 -6.806 7.751 1.00 12.04 N ATOM 413 CD2 HIS A 461 -0.429 -6.939 5.836 1.00 4.02 C ATOM 414 CE1 HIS A 461 -1.317 -8.088 7.479 1.00 21.53 C ATOM 415 NE2 HIS A 461 -0.691 -8.194 6.324 1.00 52.04 N ATOM 0 H HIS A 461 -0.209 -3.920 4.326 1.00 31.33 H new ATOM 0 HA HIS A 461 -2.780 -4.466 5.660 1.00 42.22 H new ATOM 0 HB2 HIS A 461 0.103 -4.197 6.575 1.00 33.22 H new ATOM 0 HB3 HIS A 461 -1.228 -4.195 7.715 1.00 33.22 H new ATOM 0 HD2 HIS A 461 0.073 -6.703 4.909 1.00 4.02 H new ATOM 0 HE1 HIS A 461 -1.649 -8.910 8.097 1.00 21.53 H new ATOM 0 HE2 HIS A 461 -0.441 -9.070 5.866 1.00 52.04 H new ATOM 424 N VAL A 462 -3.387 -2.078 5.971 1.00 12.33 N ATOM 425 CA VAL A 462 -3.780 -0.696 6.247 1.00 10.34 C ATOM 426 C VAL A 462 -4.477 -0.599 7.610 1.00 51.24 C ATOM 427 O VAL A 462 -5.489 -1.254 7.855 1.00 34.12 O ATOM 428 CB VAL A 462 -4.697 -0.138 5.121 1.00 43.21 C ATOM 429 CG1 VAL A 462 -4.024 -0.313 3.765 1.00 21.32 C ATOM 430 CG2 VAL A 462 -6.074 -0.805 5.118 1.00 22.54 C ATOM 0 H VAL A 462 -4.166 -2.705 5.770 1.00 12.33 H new ATOM 0 HA VAL A 462 -2.877 -0.087 6.275 1.00 10.34 H new ATOM 0 HB VAL A 462 -4.850 0.923 5.317 1.00 43.21 H new ATOM 0 HG11 VAL A 462 -4.673 0.080 2.983 1.00 21.32 H new ATOM 0 HG12 VAL A 462 -3.077 0.227 3.756 1.00 21.32 H new ATOM 0 HG13 VAL A 462 -3.839 -1.372 3.584 1.00 21.32 H new ATOM 0 HG21 VAL A 462 -6.680 -0.384 4.316 1.00 22.54 H new ATOM 0 HG22 VAL A 462 -5.958 -1.877 4.961 1.00 22.54 H new ATOM 0 HG23 VAL A 462 -6.566 -0.629 6.075 1.00 22.54 H new ATOM 440 N LYS A 463 -3.934 0.221 8.500 1.00 3.23 N ATOM 441 CA LYS A 463 -4.427 0.300 9.878 1.00 11.41 C ATOM 442 C LYS A 463 -4.489 1.742 10.390 1.00 42.43 C ATOM 443 O LYS A 463 -3.644 2.576 10.062 1.00 55.51 O ATOM 444 CB LYS A 463 -3.542 -0.548 10.801 1.00 44.40 C ATOM 445 CG LYS A 463 -2.049 -0.362 10.556 1.00 71.41 C ATOM 446 CD LYS A 463 -1.213 -0.769 11.766 1.00 51.21 C ATOM 447 CE LYS A 463 -1.254 -2.271 12.029 1.00 20.31 C ATOM 448 NZ LYS A 463 -0.684 -3.052 10.900 1.00 63.20 N ATOM 0 H LYS A 463 -3.152 0.843 8.297 1.00 3.23 H new ATOM 0 HA LYS A 463 -5.445 -0.091 9.883 1.00 11.41 H new ATOM 0 HB2 LYS A 463 -3.766 -0.295 11.837 1.00 44.40 H new ATOM 0 HB3 LYS A 463 -3.795 -1.600 10.667 1.00 44.40 H new ATOM 0 HG2 LYS A 463 -1.747 -0.954 9.692 1.00 71.41 H new ATOM 0 HG3 LYS A 463 -1.849 0.682 10.313 1.00 71.41 H new ATOM 0 HD2 LYS A 463 -0.180 -0.459 11.610 1.00 51.21 H new ATOM 0 HD3 LYS A 463 -1.575 -0.240 12.647 1.00 51.21 H new ATOM 0 HE2 LYS A 463 -0.699 -2.494 12.940 1.00 20.31 H new ATOM 0 HE3 LYS A 463 -2.285 -2.581 12.199 1.00 20.31 H new ATOM 0 HZ1 LYS A 463 -0.402 -3.994 11.237 1.00 63.20 H new ATOM 0 HZ2 LYS A 463 -1.399 -3.152 10.151 1.00 63.20 H new ATOM 0 HZ3 LYS A 463 0.148 -2.557 10.521 1.00 63.20 H new ATOM 462 N ASN A 464 -5.506 2.021 11.198 1.00 12.11 N ATOM 463 CA ASN A 464 -5.664 3.327 11.840 1.00 71.40 C ATOM 464 C ASN A 464 -5.169 3.256 13.295 1.00 62.41 C ATOM 465 O ASN A 464 -5.612 2.405 14.062 1.00 34.25 O ATOM 466 CB ASN A 464 -7.151 3.718 11.800 1.00 10.22 C ATOM 467 CG ASN A 464 -7.445 5.121 12.312 1.00 54.45 C ATOM 468 OD1 ASN A 464 -6.733 5.669 13.152 1.00 63.12 O ATOM 469 ND2 ASN A 464 -8.521 5.704 11.826 1.00 14.13 N ATOM 0 H ASN A 464 -6.243 1.354 11.428 1.00 12.11 H new ATOM 0 HA ASN A 464 -5.075 4.077 11.312 1.00 71.40 H new ATOM 0 HB2 ASN A 464 -7.508 3.636 10.773 1.00 10.22 H new ATOM 0 HB3 ASN A 464 -7.719 3.001 12.393 1.00 10.22 H new ATOM 0 HD21 ASN A 464 -8.784 6.636 12.145 1.00 14.13 H new ATOM 0 HD22 ASN A 464 -9.091 5.223 11.130 1.00 14.13 H new ATOM 476 N LEU A 465 -4.275 4.161 13.681 1.00 31.53 N ATOM 477 CA LEU A 465 -3.713 4.156 15.043 1.00 63.12 C ATOM 478 C LEU A 465 -4.176 5.372 15.860 1.00 33.50 C ATOM 479 O LEU A 465 -3.850 5.500 17.042 1.00 34.12 O ATOM 480 CB LEU A 465 -2.180 4.110 14.978 1.00 61.21 C ATOM 481 CG LEU A 465 -1.596 2.908 14.214 1.00 12.53 C ATOM 482 CD1 LEU A 465 -0.075 2.970 14.198 1.00 52.34 C ATOM 483 CD2 LEU A 465 -2.078 1.589 14.820 1.00 32.12 C ATOM 0 H LEU A 465 -3.921 4.906 13.081 1.00 31.53 H new ATOM 0 HA LEU A 465 -4.081 3.264 15.550 1.00 63.12 H new ATOM 0 HB2 LEU A 465 -1.824 5.027 14.509 1.00 61.21 H new ATOM 0 HB3 LEU A 465 -1.789 4.099 15.995 1.00 61.21 H new ATOM 0 HG LEU A 465 -1.951 2.956 13.185 1.00 12.53 H new ATOM 0 HD11 LEU A 465 0.318 2.112 13.653 1.00 52.34 H new ATOM 0 HD12 LEU A 465 0.247 3.889 13.708 1.00 52.34 H new ATOM 0 HD13 LEU A 465 0.301 2.954 15.221 1.00 52.34 H new ATOM 0 HD21 LEU A 465 -1.652 0.755 14.262 1.00 32.12 H new ATOM 0 HD22 LEU A 465 -1.761 1.530 15.861 1.00 32.12 H new ATOM 0 HD23 LEU A 465 -3.166 1.541 14.769 1.00 32.12 H new ATOM 495 N GLY A 466 -4.958 6.247 15.232 1.00 63.33 N ATOM 496 CA GLY A 466 -5.434 7.457 15.898 1.00 63.35 C ATOM 497 C GLY A 466 -6.655 7.232 16.788 1.00 44.20 C ATOM 498 O GLY A 466 -6.996 8.081 17.610 1.00 4.52 O ATOM 0 H GLY A 466 -5.274 6.142 14.268 1.00 63.33 H new ATOM 0 HA2 GLY A 466 -4.626 7.869 16.503 1.00 63.35 H new ATOM 0 HA3 GLY A 466 -5.679 8.204 15.143 1.00 63.35 H new ATOM 502 N GLY A 467 -7.326 6.093 16.612 1.00 73.03 N ATOM 503 CA GLY A 467 -8.472 5.754 17.462 1.00 50.45 C ATOM 504 C GLY A 467 -9.776 6.437 17.044 1.00 51.13 C ATOM 505 O GLY A 467 -10.707 6.554 17.840 1.00 43.34 O ATOM 0 H GLY A 467 -7.102 5.398 15.900 1.00 73.03 H new ATOM 0 HA2 GLY A 467 -8.617 4.674 17.446 1.00 50.45 H new ATOM 0 HA3 GLY A 467 -8.243 6.029 18.491 1.00 50.45 H new ATOM 509 N ILE A 468 -9.839 6.883 15.795 1.00 2.22 N ATOM 510 CA ILE A 468 -11.048 7.529 15.249 1.00 11.11 C ATOM 511 C ILE A 468 -11.336 7.059 13.815 1.00 74.55 C ATOM 512 O ILE A 468 -10.431 6.990 12.986 1.00 41.21 O ATOM 513 CB ILE A 468 -10.929 9.079 15.293 1.00 20.23 C ATOM 514 CG1 ILE A 468 -12.066 9.748 14.498 1.00 5.10 C ATOM 515 CG2 ILE A 468 -9.571 9.531 14.772 1.00 74.13 C ATOM 516 CD1 ILE A 468 -12.100 11.260 14.621 1.00 61.41 C ATOM 0 H ILE A 468 -9.068 6.813 15.131 1.00 2.22 H new ATOM 0 HA ILE A 468 -11.885 7.230 15.881 1.00 11.11 H new ATOM 0 HB ILE A 468 -11.019 9.391 16.334 1.00 20.23 H new ATOM 0 HG12 ILE A 468 -11.965 9.482 13.446 1.00 5.10 H new ATOM 0 HG13 ILE A 468 -13.020 9.345 14.839 1.00 5.10 H new ATOM 0 HG21 ILE A 468 -9.510 10.619 14.812 1.00 74.13 H new ATOM 0 HG22 ILE A 468 -8.783 9.100 15.389 1.00 74.13 H new ATOM 0 HG23 ILE A 468 -9.447 9.198 13.741 1.00 74.13 H new ATOM 0 HD11 ILE A 468 -12.928 11.654 14.033 1.00 61.41 H new ATOM 0 HD12 ILE A 468 -12.233 11.537 15.667 1.00 61.41 H new ATOM 0 HD13 ILE A 468 -11.163 11.676 14.252 1.00 61.41 H new ATOM 528 N GLY A 469 -12.601 6.744 13.530 1.00 52.41 N ATOM 529 CA GLY A 469 -12.984 6.210 12.224 1.00 1.15 C ATOM 530 C GLY A 469 -12.826 7.204 11.071 1.00 1.42 C ATOM 531 O GLY A 469 -13.225 8.368 11.179 1.00 15.23 O ATOM 0 H GLY A 469 -13.375 6.850 14.185 1.00 52.41 H new ATOM 0 HA2 GLY A 469 -12.381 5.327 12.013 1.00 1.15 H new ATOM 0 HA3 GLY A 469 -14.023 5.883 12.268 1.00 1.15 H new ATOM 535 N VAL A 470 -12.252 6.736 9.961 1.00 41.44 N ATOM 536 CA VAL A 470 -12.013 7.575 8.777 1.00 64.42 C ATOM 537 C VAL A 470 -12.541 6.911 7.486 1.00 32.22 C ATOM 538 O VAL A 470 -12.073 5.840 7.096 1.00 12.03 O ATOM 539 CB VAL A 470 -10.500 7.875 8.603 1.00 71.31 C ATOM 540 CG1 VAL A 470 -10.247 8.725 7.357 1.00 61.30 C ATOM 541 CG2 VAL A 470 -9.938 8.560 9.847 1.00 4.41 C ATOM 0 H VAL A 470 -11.940 5.771 9.854 1.00 41.44 H new ATOM 0 HA VAL A 470 -12.556 8.506 8.942 1.00 64.42 H new ATOM 0 HB VAL A 470 -9.983 6.925 8.472 1.00 71.31 H new ATOM 0 HG11 VAL A 470 -9.179 8.920 7.260 1.00 61.30 H new ATOM 0 HG12 VAL A 470 -10.600 8.191 6.475 1.00 61.30 H new ATOM 0 HG13 VAL A 470 -10.782 9.671 7.447 1.00 61.30 H new ATOM 0 HG21 VAL A 470 -8.876 8.761 9.703 1.00 4.41 H new ATOM 0 HG22 VAL A 470 -10.466 9.499 10.015 1.00 4.41 H new ATOM 0 HG23 VAL A 470 -10.070 7.910 10.712 1.00 4.41 H new ATOM 551 N PRO A 471 -13.536 7.535 6.814 1.00 23.05 N ATOM 552 CA PRO A 471 -14.049 7.063 5.510 1.00 41.20 C ATOM 553 C PRO A 471 -13.186 7.522 4.317 1.00 41.14 C ATOM 554 O PRO A 471 -13.350 7.051 3.194 1.00 21.31 O ATOM 555 CB PRO A 471 -15.441 7.700 5.453 1.00 65.32 C ATOM 556 CG PRO A 471 -15.289 8.987 6.195 1.00 22.13 C ATOM 557 CD PRO A 471 -14.275 8.729 7.287 1.00 65.21 C ATOM 0 HA PRO A 471 -14.047 5.976 5.435 1.00 41.20 H new ATOM 0 HB2 PRO A 471 -15.759 7.869 4.424 1.00 65.32 H new ATOM 0 HB3 PRO A 471 -16.191 7.059 5.917 1.00 65.32 H new ATOM 0 HG2 PRO A 471 -14.951 9.782 5.530 1.00 22.13 H new ATOM 0 HG3 PRO A 471 -16.242 9.308 6.617 1.00 22.13 H new ATOM 0 HD2 PRO A 471 -13.610 9.582 7.424 1.00 65.21 H new ATOM 0 HD3 PRO A 471 -14.759 8.545 8.246 1.00 65.21 H new ATOM 565 N SER A 472 -12.254 8.433 4.585 1.00 2.11 N ATOM 566 CA SER A 472 -11.426 9.070 3.544 1.00 43.52 C ATOM 567 C SER A 472 -10.248 8.181 3.103 1.00 71.24 C ATOM 568 O SER A 472 -9.348 8.637 2.395 1.00 35.33 O ATOM 569 CB SER A 472 -10.896 10.427 4.035 1.00 22.25 C ATOM 570 OG SER A 472 -10.299 11.162 2.974 1.00 54.02 O ATOM 0 H SER A 472 -12.045 8.756 5.530 1.00 2.11 H new ATOM 0 HA SER A 472 -12.069 9.218 2.677 1.00 43.52 H new ATOM 0 HB2 SER A 472 -11.714 11.005 4.466 1.00 22.25 H new ATOM 0 HB3 SER A 472 -10.165 10.269 4.828 1.00 22.25 H new ATOM 0 HG SER A 472 -9.770 10.556 2.414 1.00 54.02 H new ATOM 576 N THR A 473 -10.262 6.909 3.490 1.00 21.00 N ATOM 577 CA THR A 473 -9.072 6.061 3.378 1.00 31.02 C ATOM 578 C THR A 473 -8.982 5.382 2.001 1.00 4.15 C ATOM 579 O THR A 473 -9.535 4.306 1.767 1.00 31.42 O ATOM 580 CB THR A 473 -9.076 4.967 4.482 1.00 13.42 C ATOM 581 OG1 THR A 473 -9.162 5.575 5.781 1.00 74.30 O ATOM 582 CG2 THR A 473 -7.830 4.090 4.418 1.00 10.41 C ATOM 0 H THR A 473 -11.079 6.441 3.883 1.00 21.00 H new ATOM 0 HA THR A 473 -8.206 6.711 3.502 1.00 31.02 H new ATOM 0 HB THR A 473 -9.947 4.335 4.308 1.00 13.42 H new ATOM 0 HG1 THR A 473 -10.100 5.613 6.063 1.00 74.30 H new ATOM 0 HG21 THR A 473 -7.873 3.339 5.207 1.00 10.41 H new ATOM 0 HG22 THR A 473 -7.783 3.595 3.448 1.00 10.41 H new ATOM 0 HG23 THR A 473 -6.943 4.708 4.554 1.00 10.41 H new ATOM 590 N LYS A 474 -8.299 6.064 1.081 1.00 64.41 N ATOM 591 CA LYS A 474 -7.986 5.514 -0.243 1.00 21.43 C ATOM 592 C LYS A 474 -6.591 4.873 -0.237 1.00 60.21 C ATOM 593 O LYS A 474 -5.606 5.532 0.094 1.00 11.31 O ATOM 594 CB LYS A 474 -8.018 6.624 -1.307 1.00 30.42 C ATOM 595 CG LYS A 474 -9.311 7.430 -1.346 1.00 0.33 C ATOM 596 CD LYS A 474 -9.270 8.498 -2.439 1.00 34.31 C ATOM 597 CE LYS A 474 -10.504 9.395 -2.416 1.00 62.32 C ATOM 598 NZ LYS A 474 -10.488 10.401 -3.513 1.00 10.41 N ATOM 0 H LYS A 474 -7.947 7.010 1.229 1.00 64.41 H new ATOM 0 HA LYS A 474 -8.736 4.759 -0.481 1.00 21.43 H new ATOM 0 HB2 LYS A 474 -7.186 7.305 -1.127 1.00 30.42 H new ATOM 0 HB3 LYS A 474 -7.856 6.175 -2.287 1.00 30.42 H new ATOM 0 HG2 LYS A 474 -10.153 6.761 -1.521 1.00 0.33 H new ATOM 0 HG3 LYS A 474 -9.475 7.904 -0.378 1.00 0.33 H new ATOM 0 HD2 LYS A 474 -8.376 9.109 -2.314 1.00 34.31 H new ATOM 0 HD3 LYS A 474 -9.192 8.015 -3.413 1.00 34.31 H new ATOM 0 HE2 LYS A 474 -11.400 8.780 -2.502 1.00 62.32 H new ATOM 0 HE3 LYS A 474 -10.561 9.908 -1.456 1.00 62.32 H new ATOM 0 HZ1 LYS A 474 -10.965 11.269 -3.195 1.00 10.41 H new ATOM 0 HZ2 LYS A 474 -9.504 10.621 -3.768 1.00 10.41 H new ATOM 0 HZ3 LYS A 474 -10.984 10.017 -4.343 1.00 10.41 H new ATOM 612 N VAL A 475 -6.507 3.600 -0.612 1.00 52.45 N ATOM 613 CA VAL A 475 -5.225 2.879 -0.638 1.00 33.22 C ATOM 614 C VAL A 475 -4.785 2.590 -2.081 1.00 70.42 C ATOM 615 O VAL A 475 -5.485 1.909 -2.826 1.00 25.44 O ATOM 616 CB VAL A 475 -5.318 1.546 0.144 1.00 32.54 C ATOM 617 CG1 VAL A 475 -3.955 0.854 0.210 1.00 42.03 C ATOM 618 CG2 VAL A 475 -5.882 1.784 1.545 1.00 14.01 C ATOM 0 H VAL A 475 -7.308 3.040 -0.903 1.00 52.45 H new ATOM 0 HA VAL A 475 -4.485 3.520 -0.160 1.00 33.22 H new ATOM 0 HB VAL A 475 -6.001 0.884 -0.389 1.00 32.54 H new ATOM 0 HG11 VAL A 475 -4.048 -0.080 0.764 1.00 42.03 H new ATOM 0 HG12 VAL A 475 -3.605 0.643 -0.800 1.00 42.03 H new ATOM 0 HG13 VAL A 475 -3.240 1.505 0.713 1.00 42.03 H new ATOM 0 HG21 VAL A 475 -5.940 0.836 2.080 1.00 14.01 H new ATOM 0 HG22 VAL A 475 -5.230 2.468 2.088 1.00 14.01 H new ATOM 0 HG23 VAL A 475 -6.879 2.218 1.467 1.00 14.01 H new ATOM 628 N ARG A 476 -3.624 3.110 -2.474 1.00 64.21 N ATOM 629 CA ARG A 476 -3.134 2.958 -3.853 1.00 32.42 C ATOM 630 C ARG A 476 -1.753 2.282 -3.897 1.00 70.44 C ATOM 631 O ARG A 476 -0.933 2.471 -2.999 1.00 53.02 O ATOM 632 CB ARG A 476 -3.076 4.334 -4.533 1.00 73.04 C ATOM 633 CG ARG A 476 -4.435 5.026 -4.612 1.00 0.21 C ATOM 634 CD ARG A 476 -4.337 6.440 -5.175 1.00 2.01 C ATOM 635 NE ARG A 476 -5.653 7.078 -5.262 1.00 43.30 N ATOM 636 CZ ARG A 476 -5.896 8.321 -4.945 1.00 72.31 C ATOM 637 NH1 ARG A 476 -4.944 9.091 -4.529 1.00 10.20 N ATOM 638 NH2 ARG A 476 -7.094 8.797 -5.060 1.00 14.41 N ATOM 0 H ARG A 476 -3.002 3.640 -1.863 1.00 64.21 H new ATOM 0 HA ARG A 476 -3.829 2.313 -4.390 1.00 32.42 H new ATOM 0 HB2 ARG A 476 -2.382 4.973 -3.987 1.00 73.04 H new ATOM 0 HB3 ARG A 476 -2.676 4.217 -5.540 1.00 73.04 H new ATOM 0 HG2 ARG A 476 -5.105 4.435 -5.237 1.00 0.21 H new ATOM 0 HG3 ARG A 476 -4.878 5.064 -3.617 1.00 0.21 H new ATOM 0 HD2 ARG A 476 -3.682 7.040 -4.542 1.00 2.01 H new ATOM 0 HD3 ARG A 476 -3.882 6.407 -6.165 1.00 2.01 H new ATOM 0 HE ARG A 476 -6.434 6.512 -5.593 1.00 43.30 H new ATOM 0 HH11 ARG A 476 -3.994 8.729 -4.446 1.00 10.20 H new ATOM 0 HH12 ARG A 476 -5.143 10.061 -4.284 1.00 10.20 H new ATOM 0 HH21 ARG A 476 -7.849 8.201 -5.399 1.00 14.41 H new ATOM 0 HH22 ARG A 476 -7.283 9.768 -4.812 1.00 14.41 H new ATOM 652 N VAL A 477 -1.503 1.496 -4.951 1.00 53.34 N ATOM 653 CA VAL A 477 -0.216 0.813 -5.135 1.00 53.24 C ATOM 654 C VAL A 477 0.453 1.235 -6.451 1.00 51.02 C ATOM 655 O VAL A 477 -0.134 1.115 -7.531 1.00 75.13 O ATOM 656 CB VAL A 477 -0.384 -0.730 -5.130 1.00 74.14 C ATOM 657 CG1 VAL A 477 0.940 -1.433 -5.433 1.00 51.45 C ATOM 658 CG2 VAL A 477 -0.955 -1.206 -3.798 1.00 31.34 C ATOM 0 H VAL A 477 -2.179 1.316 -5.693 1.00 53.34 H new ATOM 0 HA VAL A 477 0.416 1.106 -4.296 1.00 53.24 H new ATOM 0 HB VAL A 477 -1.089 -0.991 -5.920 1.00 74.14 H new ATOM 0 HG11 VAL A 477 0.790 -2.513 -5.422 1.00 51.45 H new ATOM 0 HG12 VAL A 477 1.298 -1.126 -6.416 1.00 51.45 H new ATOM 0 HG13 VAL A 477 1.677 -1.162 -4.677 1.00 51.45 H new ATOM 0 HG21 VAL A 477 -1.065 -2.290 -3.816 1.00 31.34 H new ATOM 0 HG22 VAL A 477 -0.280 -0.923 -2.991 1.00 31.34 H new ATOM 0 HG23 VAL A 477 -1.929 -0.745 -3.634 1.00 31.34 H new ATOM 668 N TYR A 478 1.683 1.727 -6.347 1.00 35.32 N ATOM 669 CA TYR A 478 2.465 2.151 -7.511 1.00 2.51 C ATOM 670 C TYR A 478 3.660 1.213 -7.733 1.00 32.44 C ATOM 671 O TYR A 478 4.339 0.830 -6.785 1.00 21.24 O ATOM 672 CB TYR A 478 2.987 3.582 -7.308 1.00 3.44 C ATOM 673 CG TYR A 478 1.903 4.618 -7.059 1.00 21.44 C ATOM 674 CD1 TYR A 478 1.411 4.845 -5.778 1.00 43.10 C ATOM 675 CD2 TYR A 478 1.387 5.379 -8.102 1.00 22.14 C ATOM 676 CE1 TYR A 478 0.433 5.794 -5.545 1.00 21.24 C ATOM 677 CE2 TYR A 478 0.411 6.332 -7.876 1.00 33.43 C ATOM 678 CZ TYR A 478 -0.060 6.536 -6.597 1.00 55.45 C ATOM 679 OH TYR A 478 -1.027 7.490 -6.367 1.00 65.03 O ATOM 0 H TYR A 478 2.168 1.844 -5.457 1.00 35.32 H new ATOM 0 HA TYR A 478 1.813 2.117 -8.384 1.00 2.51 H new ATOM 0 HB2 TYR A 478 3.678 3.587 -6.465 1.00 3.44 H new ATOM 0 HB3 TYR A 478 3.557 3.876 -8.189 1.00 3.44 H new ATOM 0 HD1 TYR A 478 1.800 4.270 -4.951 1.00 43.10 H new ATOM 0 HD2 TYR A 478 1.755 5.223 -9.105 1.00 22.14 H new ATOM 0 HE1 TYR A 478 0.058 5.953 -4.545 1.00 21.24 H new ATOM 0 HE2 TYR A 478 0.020 6.914 -8.698 1.00 33.43 H new ATOM 0 HH TYR A 478 -1.266 7.924 -7.212 1.00 65.03 H new ATOM 689 N ILE A 479 3.911 0.851 -8.985 1.00 30.43 N ATOM 690 CA ILE A 479 5.065 0.020 -9.337 1.00 14.32 C ATOM 691 C ILE A 479 6.030 0.769 -10.264 1.00 65.34 C ATOM 692 O ILE A 479 5.716 1.027 -11.430 1.00 63.22 O ATOM 693 CB ILE A 479 4.636 -1.307 -10.017 1.00 14.33 C ATOM 694 CG1 ILE A 479 3.753 -2.129 -9.062 1.00 40.15 C ATOM 695 CG2 ILE A 479 5.866 -2.110 -10.461 1.00 62.25 C ATOM 696 CD1 ILE A 479 3.300 -3.457 -9.631 1.00 11.41 C ATOM 0 H ILE A 479 3.330 1.119 -9.780 1.00 30.43 H new ATOM 0 HA ILE A 479 5.572 -0.214 -8.401 1.00 14.32 H new ATOM 0 HB ILE A 479 4.053 -1.073 -10.908 1.00 14.33 H new ATOM 0 HG12 ILE A 479 4.304 -2.310 -8.139 1.00 40.15 H new ATOM 0 HG13 ILE A 479 2.875 -1.540 -8.798 1.00 40.15 H new ATOM 0 HG21 ILE A 479 5.544 -3.037 -10.935 1.00 62.25 H new ATOM 0 HG22 ILE A 479 6.447 -1.522 -11.171 1.00 62.25 H new ATOM 0 HG23 ILE A 479 6.482 -2.342 -9.592 1.00 62.25 H new ATOM 0 HD11 ILE A 479 2.683 -3.976 -8.897 1.00 11.41 H new ATOM 0 HD12 ILE A 479 2.720 -3.285 -10.538 1.00 11.41 H new ATOM 0 HD13 ILE A 479 4.171 -4.067 -9.868 1.00 11.41 H new ATOM 708 N ASN A 480 7.188 1.144 -9.724 1.00 22.20 N ATOM 709 CA ASN A 480 8.274 1.731 -10.517 1.00 22.41 C ATOM 710 C ASN A 480 7.826 3.039 -11.209 1.00 72.45 C ATOM 711 O ASN A 480 8.278 3.369 -12.308 1.00 3.25 O ATOM 712 CB ASN A 480 8.745 0.694 -11.549 1.00 44.41 C ATOM 713 CG ASN A 480 10.061 1.050 -12.211 1.00 31.33 C ATOM 714 OD1 ASN A 480 10.918 1.700 -11.622 1.00 11.42 O ATOM 715 ND2 ASN A 480 10.233 0.612 -13.440 1.00 4.32 N ATOM 0 H ASN A 480 7.402 1.052 -8.731 1.00 22.20 H new ATOM 0 HA ASN A 480 9.100 1.992 -9.856 1.00 22.41 H new ATOM 0 HB2 ASN A 480 8.845 -0.274 -11.059 1.00 44.41 H new ATOM 0 HB3 ASN A 480 7.979 0.585 -12.317 1.00 44.41 H new ATOM 0 HD21 ASN A 480 11.102 0.810 -13.935 1.00 4.32 H new ATOM 0 HD22 ASN A 480 9.497 0.074 -13.897 1.00 4.32 H new ATOM 722 N GLY A 481 6.956 3.793 -10.539 1.00 2.54 N ATOM 723 CA GLY A 481 6.465 5.058 -11.089 1.00 44.33 C ATOM 724 C GLY A 481 5.103 4.951 -11.778 1.00 14.12 C ATOM 725 O GLY A 481 4.475 5.969 -12.081 1.00 1.14 O ATOM 0 H GLY A 481 6.578 3.554 -9.622 1.00 2.54 H new ATOM 0 HA2 GLY A 481 6.397 5.790 -10.284 1.00 44.33 H new ATOM 0 HA3 GLY A 481 7.194 5.438 -11.805 1.00 44.33 H new ATOM 729 N THR A 482 4.643 3.727 -12.038 1.00 4.03 N ATOM 730 CA THR A 482 3.342 3.506 -12.701 1.00 32.44 C ATOM 731 C THR A 482 2.272 3.023 -11.709 1.00 1.24 C ATOM 732 O THR A 482 2.480 2.047 -10.993 1.00 3.01 O ATOM 733 CB THR A 482 3.461 2.460 -13.842 1.00 62.45 C ATOM 734 OG1 THR A 482 4.434 2.884 -14.808 1.00 14.32 O ATOM 735 CG2 THR A 482 2.119 2.243 -14.541 1.00 34.34 C ATOM 0 H THR A 482 5.145 2.871 -11.803 1.00 4.03 H new ATOM 0 HA THR A 482 3.042 4.469 -13.114 1.00 32.44 H new ATOM 0 HB THR A 482 3.776 1.518 -13.392 1.00 62.45 H new ATOM 0 HG1 THR A 482 4.500 2.215 -15.521 1.00 14.32 H new ATOM 0 HG21 THR A 482 2.237 1.505 -15.334 1.00 34.34 H new ATOM 0 HG22 THR A 482 1.386 1.885 -13.818 1.00 34.34 H new ATOM 0 HG23 THR A 482 1.775 3.185 -14.969 1.00 34.34 H new ATOM 743 N LEU A 483 1.123 3.704 -11.668 1.00 64.31 N ATOM 744 CA LEU A 483 -0.002 3.262 -10.831 1.00 53.53 C ATOM 745 C LEU A 483 -0.502 1.876 -11.273 1.00 64.53 C ATOM 746 O LEU A 483 -0.787 1.651 -12.451 1.00 65.34 O ATOM 747 CB LEU A 483 -1.152 4.280 -10.891 1.00 42.22 C ATOM 748 CG LEU A 483 -2.408 3.899 -10.084 1.00 2.11 C ATOM 749 CD1 LEU A 483 -2.077 3.732 -8.600 1.00 52.31 C ATOM 750 CD2 LEU A 483 -3.514 4.934 -10.283 1.00 73.53 C ATOM 0 H LEU A 483 0.946 4.557 -12.199 1.00 64.31 H new ATOM 0 HA LEU A 483 0.352 3.191 -9.802 1.00 53.53 H new ATOM 0 HB2 LEU A 483 -0.785 5.241 -10.529 1.00 42.22 H new ATOM 0 HB3 LEU A 483 -1.438 4.420 -11.933 1.00 42.22 H new ATOM 0 HG LEU A 483 -2.770 2.940 -10.456 1.00 2.11 H new ATOM 0 HD11 LEU A 483 -2.981 3.463 -8.054 1.00 52.31 H new ATOM 0 HD12 LEU A 483 -1.333 2.945 -8.480 1.00 52.31 H new ATOM 0 HD13 LEU A 483 -1.681 4.669 -8.208 1.00 52.31 H new ATOM 0 HD21 LEU A 483 -4.391 4.645 -9.704 1.00 73.53 H new ATOM 0 HD22 LEU A 483 -3.163 5.910 -9.948 1.00 73.53 H new ATOM 0 HD23 LEU A 483 -3.777 4.986 -11.339 1.00 73.53 H new ATOM 762 N TYR A 484 -0.603 0.950 -10.324 1.00 23.33 N ATOM 763 CA TYR A 484 -0.977 -0.435 -10.629 1.00 33.02 C ATOM 764 C TYR A 484 -2.423 -0.763 -10.216 1.00 22.24 C ATOM 765 O TYR A 484 -3.160 -1.408 -10.967 1.00 20.32 O ATOM 766 CB TYR A 484 -0.004 -1.389 -9.927 1.00 42.50 C ATOM 767 CG TYR A 484 -0.342 -2.854 -10.113 1.00 43.34 C ATOM 768 CD1 TYR A 484 -0.120 -3.487 -11.332 1.00 35.01 C ATOM 769 CD2 TYR A 484 -0.883 -3.601 -9.073 1.00 61.01 C ATOM 770 CE1 TYR A 484 -0.428 -4.820 -11.508 1.00 20.31 C ATOM 771 CE2 TYR A 484 -1.192 -4.938 -9.241 1.00 21.02 C ATOM 772 CZ TYR A 484 -0.960 -5.544 -10.461 1.00 45.30 C ATOM 773 OH TYR A 484 -1.263 -6.875 -10.640 1.00 14.35 O ATOM 0 H TYR A 484 -0.432 1.130 -9.335 1.00 23.33 H new ATOM 0 HA TYR A 484 -0.919 -0.561 -11.710 1.00 33.02 H new ATOM 0 HB2 TYR A 484 1.003 -1.208 -10.303 1.00 42.50 H new ATOM 0 HB3 TYR A 484 0.008 -1.161 -8.861 1.00 42.50 H new ATOM 0 HD1 TYR A 484 0.300 -2.926 -12.153 1.00 35.01 H new ATOM 0 HD2 TYR A 484 -1.065 -3.129 -8.119 1.00 61.01 H new ATOM 0 HE1 TYR A 484 -0.253 -5.295 -12.462 1.00 20.31 H new ATOM 0 HE2 TYR A 484 -1.612 -5.505 -8.424 1.00 21.02 H new ATOM 0 HH TYR A 484 -1.182 -7.347 -9.785 1.00 14.35 H new ATOM 783 N LYS A 485 -2.829 -0.324 -9.026 1.00 11.34 N ATOM 784 CA LYS A 485 -4.157 -0.661 -8.490 1.00 33.42 C ATOM 785 C LYS A 485 -4.545 0.286 -7.341 1.00 53.12 C ATOM 786 O LYS A 485 -3.678 0.915 -6.731 1.00 32.40 O ATOM 787 CB LYS A 485 -4.160 -2.121 -8.002 1.00 35.02 C ATOM 788 CG LYS A 485 -5.550 -2.716 -7.788 1.00 13.13 C ATOM 789 CD LYS A 485 -5.469 -4.176 -7.353 1.00 11.43 C ATOM 790 CE LYS A 485 -6.833 -4.857 -7.364 1.00 74.32 C ATOM 791 NZ LYS A 485 -7.373 -5.009 -8.745 1.00 34.52 N ATOM 0 H LYS A 485 -2.264 0.264 -8.413 1.00 11.34 H new ATOM 0 HA LYS A 485 -4.894 -0.543 -9.285 1.00 33.42 H new ATOM 0 HB2 LYS A 485 -3.624 -2.734 -8.727 1.00 35.02 H new ATOM 0 HB3 LYS A 485 -3.606 -2.178 -7.065 1.00 35.02 H new ATOM 0 HG2 LYS A 485 -6.082 -2.138 -7.032 1.00 13.13 H new ATOM 0 HG3 LYS A 485 -6.126 -2.641 -8.711 1.00 13.13 H new ATOM 0 HD2 LYS A 485 -4.791 -4.714 -8.016 1.00 11.43 H new ATOM 0 HD3 LYS A 485 -5.045 -4.232 -6.350 1.00 11.43 H new ATOM 0 HE2 LYS A 485 -6.751 -5.839 -6.897 1.00 74.32 H new ATOM 0 HE3 LYS A 485 -7.533 -4.276 -6.764 1.00 74.32 H new ATOM 0 HZ1 LYS A 485 -8.172 -5.675 -8.734 1.00 34.52 H new ATOM 0 HZ2 LYS A 485 -7.698 -4.085 -9.094 1.00 34.52 H new ATOM 0 HZ3 LYS A 485 -6.627 -5.373 -9.371 1.00 34.52 H new ATOM 805 N ASN A 486 -5.842 0.386 -7.048 1.00 23.12 N ATOM 806 CA ASN A 486 -6.317 1.242 -5.953 1.00 61.15 C ATOM 807 C ASN A 486 -7.544 0.637 -5.247 1.00 2.43 C ATOM 808 O ASN A 486 -8.263 -0.183 -5.820 1.00 61.23 O ATOM 809 CB ASN A 486 -6.654 2.642 -6.481 1.00 3.31 C ATOM 810 CG ASN A 486 -7.875 2.652 -7.382 1.00 30.14 C ATOM 811 OD1 ASN A 486 -8.991 2.894 -6.932 1.00 54.21 O ATOM 812 ND2 ASN A 486 -7.685 2.366 -8.653 1.00 41.35 N ATOM 0 H ASN A 486 -6.580 -0.110 -7.548 1.00 23.12 H new ATOM 0 HA ASN A 486 -5.513 1.315 -5.221 1.00 61.15 H new ATOM 0 HB2 ASN A 486 -6.824 3.312 -5.638 1.00 3.31 H new ATOM 0 HB3 ASN A 486 -5.799 3.033 -7.032 1.00 3.31 H new ATOM 0 HD21 ASN A 486 -8.478 2.341 -9.294 1.00 41.35 H new ATOM 0 HD22 ASN A 486 -6.745 2.169 -8.997 1.00 41.35 H new ATOM 819 N TRP A 487 -7.766 1.047 -4.002 1.00 55.12 N ATOM 820 CA TRP A 487 -8.921 0.601 -3.211 1.00 53.23 C ATOM 821 C TRP A 487 -9.547 1.779 -2.450 1.00 33.42 C ATOM 822 O TRP A 487 -8.847 2.715 -2.053 1.00 25.01 O ATOM 823 CB TRP A 487 -8.507 -0.469 -2.187 1.00 30.21 C ATOM 824 CG TRP A 487 -7.983 -1.741 -2.783 1.00 63.20 C ATOM 825 CD1 TRP A 487 -8.717 -2.797 -3.250 1.00 33.33 C ATOM 826 CD2 TRP A 487 -6.609 -2.101 -2.955 1.00 23.40 C ATOM 827 NE1 TRP A 487 -7.879 -3.785 -3.703 1.00 73.31 N ATOM 828 CE2 TRP A 487 -6.581 -3.382 -3.534 1.00 53.40 C ATOM 829 CE3 TRP A 487 -5.399 -1.460 -2.679 1.00 30.20 C ATOM 830 CZ2 TRP A 487 -5.391 -4.035 -3.836 1.00 24.02 C ATOM 831 CZ3 TRP A 487 -4.220 -2.110 -2.980 1.00 75.30 C ATOM 832 CH2 TRP A 487 -4.224 -3.386 -3.555 1.00 31.41 C ATOM 0 H TRP A 487 -7.154 1.697 -3.508 1.00 55.12 H new ATOM 0 HA TRP A 487 -9.646 0.181 -3.908 1.00 53.23 H new ATOM 0 HB2 TRP A 487 -7.743 -0.049 -1.533 1.00 30.21 H new ATOM 0 HB3 TRP A 487 -9.368 -0.705 -1.561 1.00 30.21 H new ATOM 0 HD1 TRP A 487 -9.796 -2.846 -3.261 1.00 33.33 H new ATOM 0 HE1 TRP A 487 -8.175 -4.676 -4.101 1.00 73.31 H new ATOM 0 HE3 TRP A 487 -5.387 -0.474 -2.238 1.00 30.20 H new ATOM 0 HZ2 TRP A 487 -5.390 -5.021 -4.277 1.00 24.02 H new ATOM 0 HZ3 TRP A 487 -3.278 -1.626 -2.768 1.00 75.30 H new ATOM 0 HH2 TRP A 487 -3.284 -3.867 -3.781 1.00 31.41 H new ATOM 843 N THR A 488 -10.858 1.728 -2.237 1.00 62.34 N ATOM 844 CA THR A 488 -11.537 2.719 -1.391 1.00 21.32 C ATOM 845 C THR A 488 -12.177 2.030 -0.179 1.00 51.31 C ATOM 846 O THR A 488 -13.067 1.188 -0.326 1.00 21.44 O ATOM 847 CB THR A 488 -12.631 3.492 -2.175 1.00 13.51 C ATOM 848 OG1 THR A 488 -12.063 4.096 -3.352 1.00 51.01 O ATOM 849 CG2 THR A 488 -13.274 4.575 -1.311 1.00 64.31 C ATOM 0 H THR A 488 -11.474 1.018 -2.633 1.00 62.34 H new ATOM 0 HA THR A 488 -10.784 3.433 -1.059 1.00 21.32 H new ATOM 0 HB THR A 488 -13.401 2.776 -2.463 1.00 13.51 H new ATOM 0 HG1 THR A 488 -12.761 4.580 -3.841 1.00 51.01 H new ATOM 0 HG21 THR A 488 -14.036 5.098 -1.890 1.00 64.31 H new ATOM 0 HG22 THR A 488 -13.734 4.117 -0.436 1.00 64.31 H new ATOM 0 HG23 THR A 488 -12.512 5.285 -0.990 1.00 64.31 H new ATOM 857 N VAL A 489 -11.729 2.397 1.020 1.00 62.11 N ATOM 858 CA VAL A 489 -12.176 1.743 2.261 1.00 21.32 C ATOM 859 C VAL A 489 -12.316 2.747 3.415 1.00 72.22 C ATOM 860 O VAL A 489 -12.000 3.931 3.274 1.00 1.11 O ATOM 861 CB VAL A 489 -11.199 0.615 2.701 1.00 60.51 C ATOM 862 CG1 VAL A 489 -11.167 -0.524 1.680 1.00 54.01 C ATOM 863 CG2 VAL A 489 -9.793 1.172 2.937 1.00 1.54 C ATOM 0 H VAL A 489 -11.053 3.147 1.165 1.00 62.11 H new ATOM 0 HA VAL A 489 -13.151 1.310 2.039 1.00 21.32 H new ATOM 0 HB VAL A 489 -11.567 0.208 3.642 1.00 60.51 H new ATOM 0 HG11 VAL A 489 -10.475 -1.296 2.017 1.00 54.01 H new ATOM 0 HG12 VAL A 489 -12.165 -0.950 1.579 1.00 54.01 H new ATOM 0 HG13 VAL A 489 -10.838 -0.138 0.715 1.00 54.01 H new ATOM 0 HG21 VAL A 489 -9.128 0.364 3.244 1.00 1.54 H new ATOM 0 HG22 VAL A 489 -9.419 1.619 2.016 1.00 1.54 H new ATOM 0 HG23 VAL A 489 -9.828 1.930 3.720 1.00 1.54 H new ATOM 873 N SER A 490 -12.823 2.270 4.549 1.00 55.20 N ATOM 874 CA SER A 490 -12.878 3.074 5.776 1.00 44.04 C ATOM 875 C SER A 490 -12.283 2.297 6.958 1.00 5.24 C ATOM 876 O SER A 490 -12.493 1.092 7.092 1.00 15.14 O ATOM 877 CB SER A 490 -14.322 3.493 6.097 1.00 4.44 C ATOM 878 OG SER A 490 -15.161 2.372 6.343 1.00 71.51 O ATOM 0 H SER A 490 -13.204 1.329 4.648 1.00 55.20 H new ATOM 0 HA SER A 490 -12.286 3.974 5.611 1.00 44.04 H new ATOM 0 HB2 SER A 490 -14.324 4.146 6.970 1.00 4.44 H new ATOM 0 HB3 SER A 490 -14.725 4.071 5.266 1.00 4.44 H new ATOM 0 HG SER A 490 -16.069 2.681 6.545 1.00 71.51 H new ATOM 884 N LEU A 491 -11.532 2.991 7.810 1.00 54.32 N ATOM 885 CA LEU A 491 -10.897 2.360 8.977 1.00 3.35 C ATOM 886 C LEU A 491 -11.416 2.949 10.294 1.00 43.30 C ATOM 887 O LEU A 491 -11.297 4.150 10.539 1.00 70.11 O ATOM 888 CB LEU A 491 -9.370 2.526 8.910 1.00 1.15 C ATOM 889 CG LEU A 491 -8.664 1.710 7.816 1.00 12.13 C ATOM 890 CD1 LEU A 491 -7.169 2.014 7.794 1.00 13.13 C ATOM 891 CD2 LEU A 491 -8.902 0.220 8.030 1.00 22.21 C ATOM 0 H LEU A 491 -11.345 3.990 7.719 1.00 54.32 H new ATOM 0 HA LEU A 491 -11.153 1.301 8.952 1.00 3.35 H new ATOM 0 HB2 LEU A 491 -9.143 3.581 8.756 1.00 1.15 H new ATOM 0 HB3 LEU A 491 -8.949 2.247 9.876 1.00 1.15 H new ATOM 0 HG LEU A 491 -9.083 1.995 6.851 1.00 12.13 H new ATOM 0 HD11 LEU A 491 -6.689 1.425 7.012 1.00 13.13 H new ATOM 0 HD12 LEU A 491 -7.016 3.075 7.595 1.00 13.13 H new ATOM 0 HD13 LEU A 491 -6.732 1.759 8.759 1.00 13.13 H new ATOM 0 HD21 LEU A 491 -8.396 -0.345 7.247 1.00 22.21 H new ATOM 0 HD22 LEU A 491 -8.509 -0.075 9.003 1.00 22.21 H new ATOM 0 HD23 LEU A 491 -9.972 0.013 7.993 1.00 22.21 H new ATOM 903 N GLY A 492 -11.979 2.091 11.141 1.00 11.12 N ATOM 904 CA GLY A 492 -12.467 2.522 12.444 1.00 55.31 C ATOM 905 C GLY A 492 -11.351 2.697 13.474 1.00 45.32 C ATOM 906 O GLY A 492 -10.166 2.616 13.139 1.00 71.12 O ATOM 0 H GLY A 492 -12.107 1.098 10.948 1.00 11.12 H new ATOM 0 HA2 GLY A 492 -13.001 3.466 12.332 1.00 55.31 H new ATOM 0 HA3 GLY A 492 -13.186 1.792 12.816 1.00 55.31 H new ATOM 910 N PRO A 493 -11.700 2.936 14.751 1.00 31.25 N ATOM 911 CA PRO A 493 -10.706 3.134 15.817 1.00 41.52 C ATOM 912 C PRO A 493 -9.799 1.909 16.025 1.00 12.23 C ATOM 913 O PRO A 493 -10.252 0.857 16.490 1.00 41.33 O ATOM 914 CB PRO A 493 -11.561 3.402 17.067 1.00 53.44 C ATOM 915 CG PRO A 493 -12.916 2.869 16.741 1.00 22.35 C ATOM 916 CD PRO A 493 -13.081 3.036 15.255 1.00 42.14 C ATOM 0 HA PRO A 493 -10.018 3.945 15.578 1.00 41.52 H new ATOM 0 HB2 PRO A 493 -11.143 2.905 17.943 1.00 53.44 H new ATOM 0 HB3 PRO A 493 -11.602 4.467 17.294 1.00 53.44 H new ATOM 0 HG2 PRO A 493 -13.002 1.821 17.028 1.00 22.35 H new ATOM 0 HG3 PRO A 493 -13.690 3.413 17.283 1.00 22.35 H new ATOM 0 HD2 PRO A 493 -13.722 2.263 14.831 1.00 42.14 H new ATOM 0 HD3 PRO A 493 -13.533 3.996 15.005 1.00 42.14 H new ATOM 924 N LYS A 494 -8.517 2.057 15.656 1.00 63.14 N ATOM 925 CA LYS A 494 -7.507 0.998 15.831 1.00 74.21 C ATOM 926 C LYS A 494 -7.789 -0.219 14.933 1.00 2.45 C ATOM 927 O LYS A 494 -7.364 -1.339 15.228 1.00 55.40 O ATOM 928 CB LYS A 494 -7.431 0.577 17.305 1.00 1.41 C ATOM 929 CG LYS A 494 -7.048 1.711 18.255 1.00 22.03 C ATOM 930 CD LYS A 494 -5.673 2.288 17.928 1.00 22.35 C ATOM 931 CE LYS A 494 -5.045 2.988 19.131 1.00 32.10 C ATOM 932 NZ LYS A 494 -5.923 4.036 19.712 1.00 73.11 N ATOM 0 H LYS A 494 -8.151 2.909 15.230 1.00 63.14 H new ATOM 0 HA LYS A 494 -6.543 1.406 15.527 1.00 74.21 H new ATOM 0 HB2 LYS A 494 -8.397 0.174 17.608 1.00 1.41 H new ATOM 0 HB3 LYS A 494 -6.704 -0.229 17.405 1.00 1.41 H new ATOM 0 HG2 LYS A 494 -7.796 2.501 18.197 1.00 22.03 H new ATOM 0 HG3 LYS A 494 -7.052 1.342 19.281 1.00 22.03 H new ATOM 0 HD2 LYS A 494 -5.015 1.487 17.590 1.00 22.35 H new ATOM 0 HD3 LYS A 494 -5.763 2.995 17.104 1.00 22.35 H new ATOM 0 HE2 LYS A 494 -4.815 2.247 19.897 1.00 32.10 H new ATOM 0 HE3 LYS A 494 -4.099 3.439 18.830 1.00 32.10 H new ATOM 0 HZ1 LYS A 494 -5.403 4.557 20.446 1.00 73.11 H new ATOM 0 HZ2 LYS A 494 -6.219 4.695 18.964 1.00 73.11 H new ATOM 0 HZ3 LYS A 494 -6.763 3.591 20.133 1.00 73.11 H new ATOM 946 N GLU A 495 -8.467 0.023 13.816 1.00 54.12 N ATOM 947 CA GLU A 495 -8.906 -1.047 12.914 1.00 51.13 C ATOM 948 C GLU A 495 -7.963 -1.210 11.708 1.00 44.52 C ATOM 949 O GLU A 495 -7.385 -0.233 11.224 1.00 73.30 O ATOM 950 CB GLU A 495 -10.330 -0.734 12.440 1.00 33.15 C ATOM 951 CG GLU A 495 -10.938 -1.776 11.510 1.00 73.11 C ATOM 952 CD GLU A 495 -12.440 -1.591 11.349 1.00 72.14 C ATOM 953 OE1 GLU A 495 -12.858 -0.668 10.622 1.00 73.31 O ATOM 954 OE2 GLU A 495 -13.206 -2.350 11.979 1.00 61.20 O ATOM 0 H GLU A 495 -8.729 0.959 13.508 1.00 54.12 H new ATOM 0 HA GLU A 495 -8.887 -1.991 13.459 1.00 51.13 H new ATOM 0 HB2 GLU A 495 -10.973 -0.628 13.313 1.00 33.15 H new ATOM 0 HB3 GLU A 495 -10.324 0.229 11.929 1.00 33.15 H new ATOM 0 HG2 GLU A 495 -10.458 -1.714 10.533 1.00 73.11 H new ATOM 0 HG3 GLU A 495 -10.736 -2.773 11.901 1.00 73.11 H new ATOM 961 N GLU A 496 -7.813 -2.451 11.231 1.00 4.24 N ATOM 962 CA GLU A 496 -6.976 -2.747 10.054 1.00 23.43 C ATOM 963 C GLU A 496 -7.731 -3.588 9.008 1.00 40.24 C ATOM 964 O GLU A 496 -8.550 -4.441 9.349 1.00 63.23 O ATOM 965 CB GLU A 496 -5.697 -3.500 10.462 1.00 3.00 C ATOM 966 CG GLU A 496 -4.858 -3.950 9.261 1.00 45.42 C ATOM 967 CD GLU A 496 -3.589 -4.686 9.646 1.00 41.41 C ATOM 968 OE1 GLU A 496 -3.683 -5.827 10.136 1.00 33.20 O ATOM 969 OE2 GLU A 496 -2.492 -4.132 9.453 1.00 14.31 O ATOM 0 H GLU A 496 -8.260 -3.271 11.641 1.00 4.24 H new ATOM 0 HA GLU A 496 -6.714 -1.786 9.612 1.00 23.43 H new ATOM 0 HB2 GLU A 496 -5.091 -2.857 11.101 1.00 3.00 H new ATOM 0 HB3 GLU A 496 -5.969 -4.373 11.055 1.00 3.00 H new ATOM 0 HG2 GLU A 496 -5.465 -4.597 8.627 1.00 45.42 H new ATOM 0 HG3 GLU A 496 -4.594 -3.076 8.665 1.00 45.42 H new ATOM 976 N LYS A 497 -7.438 -3.344 7.732 1.00 2.44 N ATOM 977 CA LYS A 497 -7.948 -4.175 6.634 1.00 54.12 C ATOM 978 C LYS A 497 -6.773 -4.758 5.834 1.00 74.13 C ATOM 979 O LYS A 497 -5.797 -4.059 5.551 1.00 11.05 O ATOM 980 CB LYS A 497 -8.851 -3.346 5.702 1.00 74.41 C ATOM 981 CG LYS A 497 -9.990 -2.620 6.416 1.00 63.20 C ATOM 982 CD LYS A 497 -10.986 -3.578 7.063 1.00 12.40 C ATOM 983 CE LYS A 497 -11.763 -4.383 6.028 1.00 52.12 C ATOM 984 NZ LYS A 497 -12.805 -5.231 6.662 1.00 10.44 N ATOM 0 H LYS A 497 -6.845 -2.572 7.428 1.00 2.44 H new ATOM 0 HA LYS A 497 -8.538 -4.988 7.058 1.00 54.12 H new ATOM 0 HB2 LYS A 497 -8.238 -2.611 5.180 1.00 74.41 H new ATOM 0 HB3 LYS A 497 -9.274 -4.005 4.944 1.00 74.41 H new ATOM 0 HG2 LYS A 497 -9.574 -1.964 7.181 1.00 63.20 H new ATOM 0 HG3 LYS A 497 -10.514 -1.985 5.702 1.00 63.20 H new ATOM 0 HD2 LYS A 497 -10.454 -4.260 7.727 1.00 12.40 H new ATOM 0 HD3 LYS A 497 -11.684 -3.012 7.680 1.00 12.40 H new ATOM 0 HE2 LYS A 497 -12.230 -3.704 5.315 1.00 52.12 H new ATOM 0 HE3 LYS A 497 -11.074 -5.013 5.465 1.00 52.12 H new ATOM 0 HZ1 LYS A 497 -13.313 -5.764 5.928 1.00 10.44 H new ATOM 0 HZ2 LYS A 497 -12.356 -5.896 7.324 1.00 10.44 H new ATOM 0 HZ3 LYS A 497 -13.476 -4.628 7.179 1.00 10.44 H new ATOM 998 N VAL A 498 -6.855 -6.034 5.472 1.00 72.12 N ATOM 999 CA VAL A 498 -5.791 -6.674 4.695 1.00 23.32 C ATOM 1000 C VAL A 498 -6.179 -6.768 3.213 1.00 10.22 C ATOM 1001 O VAL A 498 -7.090 -7.507 2.839 1.00 34.33 O ATOM 1002 CB VAL A 498 -5.467 -8.091 5.236 1.00 60.42 C ATOM 1003 CG1 VAL A 498 -4.318 -8.728 4.452 1.00 52.22 C ATOM 1004 CG2 VAL A 498 -5.145 -8.038 6.730 1.00 33.42 C ATOM 0 H VAL A 498 -7.640 -6.644 5.700 1.00 72.12 H new ATOM 0 HA VAL A 498 -4.901 -6.053 4.795 1.00 23.32 H new ATOM 0 HB VAL A 498 -6.350 -8.715 5.100 1.00 60.42 H new ATOM 0 HG11 VAL A 498 -4.111 -9.721 4.852 1.00 52.22 H new ATOM 0 HG12 VAL A 498 -4.596 -8.811 3.401 1.00 52.22 H new ATOM 0 HG13 VAL A 498 -3.427 -8.107 4.544 1.00 52.22 H new ATOM 0 HG21 VAL A 498 -4.921 -9.042 7.090 1.00 33.42 H new ATOM 0 HG22 VAL A 498 -4.282 -7.393 6.894 1.00 33.42 H new ATOM 0 HG23 VAL A 498 -6.003 -7.641 7.273 1.00 33.42 H new ATOM 1014 N LEU A 499 -5.474 -6.016 2.379 1.00 21.02 N ATOM 1015 CA LEU A 499 -5.744 -5.978 0.939 1.00 53.13 C ATOM 1016 C LEU A 499 -4.707 -6.805 0.171 1.00 24.42 C ATOM 1017 O LEU A 499 -3.548 -6.882 0.571 1.00 4.12 O ATOM 1018 CB LEU A 499 -5.725 -4.523 0.455 1.00 55.34 C ATOM 1019 CG LEU A 499 -6.670 -3.574 1.216 1.00 62.22 C ATOM 1020 CD1 LEU A 499 -6.471 -2.129 0.768 1.00 33.01 C ATOM 1021 CD2 LEU A 499 -8.127 -4.000 1.038 1.00 32.32 C ATOM 0 H LEU A 499 -4.703 -5.417 2.674 1.00 21.02 H new ATOM 0 HA LEU A 499 -6.727 -6.410 0.752 1.00 53.13 H new ATOM 0 HB2 LEU A 499 -4.707 -4.141 0.537 1.00 55.34 H new ATOM 0 HB3 LEU A 499 -5.989 -4.504 -0.602 1.00 55.34 H new ATOM 0 HG LEU A 499 -6.424 -3.635 2.276 1.00 62.22 H new ATOM 0 HD11 LEU A 499 -7.150 -1.480 1.321 1.00 33.01 H new ATOM 0 HD12 LEU A 499 -5.442 -1.826 0.962 1.00 33.01 H new ATOM 0 HD13 LEU A 499 -6.679 -2.047 -0.299 1.00 33.01 H new ATOM 0 HD21 LEU A 499 -8.776 -3.315 1.584 1.00 32.32 H new ATOM 0 HD22 LEU A 499 -8.386 -3.978 -0.021 1.00 32.32 H new ATOM 0 HD23 LEU A 499 -8.260 -5.011 1.423 1.00 32.32 H new ATOM 1033 N THR A 500 -5.120 -7.431 -0.925 1.00 11.53 N ATOM 1034 CA THR A 500 -4.210 -8.271 -1.720 1.00 63.43 C ATOM 1035 C THR A 500 -4.251 -7.933 -3.213 1.00 23.42 C ATOM 1036 O THR A 500 -5.239 -7.409 -3.728 1.00 30.02 O ATOM 1037 CB THR A 500 -4.524 -9.780 -1.566 1.00 53.02 C ATOM 1038 OG1 THR A 500 -5.928 -10.020 -1.736 1.00 44.41 O ATOM 1039 CG2 THR A 500 -4.065 -10.317 -0.214 1.00 21.03 C ATOM 0 H THR A 500 -6.072 -7.378 -1.288 1.00 11.53 H new ATOM 0 HA THR A 500 -3.216 -8.057 -1.327 1.00 63.43 H new ATOM 0 HB THR A 500 -3.972 -10.309 -2.343 1.00 53.02 H new ATOM 0 HG1 THR A 500 -6.110 -10.978 -1.638 1.00 44.41 H new ATOM 0 HG21 THR A 500 -4.303 -11.378 -0.144 1.00 21.03 H new ATOM 0 HG22 THR A 500 -2.988 -10.179 -0.114 1.00 21.03 H new ATOM 0 HG23 THR A 500 -4.575 -9.778 0.584 1.00 21.03 H new ATOM 1047 N PHE A 501 -3.156 -8.247 -3.897 1.00 30.44 N ATOM 1048 CA PHE A 501 -3.077 -8.123 -5.353 1.00 43.23 C ATOM 1049 C PHE A 501 -2.033 -9.098 -5.912 1.00 60.12 C ATOM 1050 O PHE A 501 -1.044 -9.415 -5.245 1.00 45.21 O ATOM 1051 CB PHE A 501 -2.745 -6.677 -5.770 1.00 24.32 C ATOM 1052 CG PHE A 501 -1.398 -6.175 -5.293 1.00 34.10 C ATOM 1053 CD1 PHE A 501 -1.252 -5.621 -4.029 1.00 5.11 C ATOM 1054 CD2 PHE A 501 -0.281 -6.247 -6.119 1.00 31.41 C ATOM 1055 CE1 PHE A 501 -0.025 -5.152 -3.599 1.00 24.34 C ATOM 1056 CE2 PHE A 501 0.947 -5.780 -5.690 1.00 54.22 C ATOM 1057 CZ PHE A 501 1.076 -5.232 -4.430 1.00 24.54 C ATOM 0 H PHE A 501 -2.300 -8.593 -3.463 1.00 30.44 H new ATOM 0 HA PHE A 501 -4.052 -8.375 -5.770 1.00 43.23 H new ATOM 0 HB2 PHE A 501 -2.778 -6.610 -6.857 1.00 24.32 H new ATOM 0 HB3 PHE A 501 -3.521 -6.015 -5.386 1.00 24.32 H new ATOM 0 HD1 PHE A 501 -2.108 -5.556 -3.373 1.00 5.11 H new ATOM 0 HD2 PHE A 501 -0.374 -6.673 -7.107 1.00 31.41 H new ATOM 0 HE1 PHE A 501 0.073 -4.723 -2.613 1.00 24.34 H new ATOM 0 HE2 PHE A 501 1.806 -5.844 -6.341 1.00 54.22 H new ATOM 0 HZ PHE A 501 2.035 -4.867 -4.094 1.00 24.54 H new ATOM 1067 N SER A 502 -2.262 -9.579 -7.128 1.00 41.34 N ATOM 1068 CA SER A 502 -1.338 -10.514 -7.778 1.00 21.34 C ATOM 1069 C SER A 502 -0.740 -9.900 -9.051 1.00 42.41 C ATOM 1070 O SER A 502 -1.451 -9.647 -10.027 1.00 3.40 O ATOM 1071 CB SER A 502 -2.062 -11.828 -8.109 1.00 30.30 C ATOM 1072 OG SER A 502 -3.231 -11.599 -8.886 1.00 44.31 O ATOM 0 H SER A 502 -3.080 -9.339 -7.689 1.00 41.34 H new ATOM 0 HA SER A 502 -0.521 -10.723 -7.087 1.00 21.34 H new ATOM 0 HB2 SER A 502 -1.387 -12.489 -8.652 1.00 30.30 H new ATOM 0 HB3 SER A 502 -2.333 -12.338 -7.185 1.00 30.30 H new ATOM 0 HG SER A 502 -3.081 -10.838 -9.486 1.00 44.31 H new ATOM 1078 N TRP A 503 0.571 -9.677 -9.037 1.00 55.24 N ATOM 1079 CA TRP A 503 1.267 -8.986 -10.133 1.00 64.41 C ATOM 1080 C TRP A 503 2.054 -9.965 -11.020 1.00 21.13 C ATOM 1081 O TRP A 503 2.719 -10.877 -10.523 1.00 13.43 O ATOM 1082 CB TRP A 503 2.208 -7.922 -9.543 1.00 20.22 C ATOM 1083 CG TRP A 503 2.998 -7.148 -10.566 1.00 21.03 C ATOM 1084 CD1 TRP A 503 2.517 -6.536 -11.688 1.00 73.51 C ATOM 1085 CD2 TRP A 503 4.407 -6.883 -10.541 1.00 12.32 C ATOM 1086 NE1 TRP A 503 3.540 -5.921 -12.367 1.00 15.30 N ATOM 1087 CE2 TRP A 503 4.710 -6.116 -11.681 1.00 30.34 C ATOM 1088 CE3 TRP A 503 5.442 -7.223 -9.664 1.00 3.44 C ATOM 1089 CZ2 TRP A 503 6.002 -5.682 -11.968 1.00 32.40 C ATOM 1090 CZ3 TRP A 503 6.724 -6.790 -9.948 1.00 1.11 C ATOM 1091 CH2 TRP A 503 6.994 -6.027 -11.092 1.00 34.23 C ATOM 0 H TRP A 503 1.183 -9.966 -8.274 1.00 55.24 H new ATOM 0 HA TRP A 503 0.520 -8.509 -10.767 1.00 64.41 H new ATOM 0 HB2 TRP A 503 1.618 -7.221 -8.952 1.00 20.22 H new ATOM 0 HB3 TRP A 503 2.903 -8.409 -8.859 1.00 20.22 H new ATOM 0 HD1 TRP A 503 1.482 -6.536 -11.997 1.00 73.51 H new ATOM 0 HE1 TRP A 503 3.444 -5.403 -13.240 1.00 15.30 H new ATOM 0 HE3 TRP A 503 5.244 -7.813 -8.781 1.00 3.44 H new ATOM 0 HZ2 TRP A 503 6.213 -5.095 -12.850 1.00 32.40 H new ATOM 0 HZ3 TRP A 503 7.531 -7.044 -9.277 1.00 1.11 H new ATOM 0 HH2 TRP A 503 8.006 -5.705 -11.286 1.00 34.23 H new ATOM 1102 N THR A 504 1.964 -9.775 -12.338 1.00 41.31 N ATOM 1103 CA THR A 504 2.717 -10.597 -13.299 1.00 52.42 C ATOM 1104 C THR A 504 3.706 -9.737 -14.109 1.00 31.15 C ATOM 1105 O THR A 504 3.316 -9.049 -15.059 1.00 3.23 O ATOM 1106 CB THR A 504 1.774 -11.346 -14.275 1.00 11.34 C ATOM 1107 OG1 THR A 504 0.882 -12.202 -13.542 1.00 42.24 O ATOM 1108 CG2 THR A 504 2.562 -12.185 -15.281 1.00 34.54 C ATOM 0 H THR A 504 1.378 -9.060 -12.768 1.00 41.31 H new ATOM 0 HA THR A 504 3.272 -11.332 -12.716 1.00 52.42 H new ATOM 0 HB THR A 504 1.203 -10.596 -14.822 1.00 11.34 H new ATOM 0 HG1 THR A 504 0.289 -12.669 -14.167 1.00 42.24 H new ATOM 0 HG21 THR A 504 1.870 -12.696 -15.950 1.00 34.54 H new ATOM 0 HG22 THR A 504 3.216 -11.536 -15.863 1.00 34.54 H new ATOM 0 HG23 THR A 504 3.163 -12.922 -14.748 1.00 34.54 H new ATOM 1116 N PRO A 505 5.003 -9.757 -13.738 1.00 34.32 N ATOM 1117 CA PRO A 505 6.040 -8.984 -14.433 1.00 64.11 C ATOM 1118 C PRO A 505 6.546 -9.670 -15.717 1.00 42.21 C ATOM 1119 O PRO A 505 7.362 -10.587 -15.663 1.00 21.21 O ATOM 1120 CB PRO A 505 7.154 -8.900 -13.384 1.00 52.05 C ATOM 1121 CG PRO A 505 7.025 -10.165 -12.600 1.00 1.04 C ATOM 1122 CD PRO A 505 5.556 -10.518 -12.596 1.00 20.31 C ATOM 0 HA PRO A 505 5.672 -8.017 -14.776 1.00 64.11 H new ATOM 0 HB2 PRO A 505 8.135 -8.821 -13.852 1.00 52.05 H new ATOM 0 HB3 PRO A 505 7.034 -8.024 -12.747 1.00 52.05 H new ATOM 0 HG2 PRO A 505 7.615 -10.963 -13.051 1.00 1.04 H new ATOM 0 HG3 PRO A 505 7.395 -10.031 -11.583 1.00 1.04 H new ATOM 0 HD2 PRO A 505 5.403 -11.590 -12.719 1.00 20.31 H new ATOM 0 HD3 PRO A 505 5.079 -10.233 -11.658 1.00 20.31 H new ATOM 1130 N THR A 506 6.047 -9.225 -16.868 1.00 51.11 N ATOM 1131 CA THR A 506 6.446 -9.796 -18.163 1.00 74.32 C ATOM 1132 C THR A 506 7.813 -9.273 -18.634 1.00 31.40 C ATOM 1133 O THR A 506 8.533 -9.965 -19.352 1.00 21.42 O ATOM 1134 CB THR A 506 5.387 -9.511 -19.252 1.00 62.15 C ATOM 1135 OG1 THR A 506 5.087 -8.106 -19.295 1.00 25.03 O ATOM 1136 CG2 THR A 506 4.110 -10.303 -18.987 1.00 62.43 C ATOM 0 H THR A 506 5.364 -8.470 -16.936 1.00 51.11 H new ATOM 0 HA THR A 506 6.526 -10.872 -18.009 1.00 74.32 H new ATOM 0 HB THR A 506 5.796 -9.822 -20.214 1.00 62.15 H new ATOM 0 HG1 THR A 506 5.819 -7.629 -19.739 1.00 25.03 H new ATOM 0 HG21 THR A 506 3.379 -10.086 -19.766 1.00 62.43 H new ATOM 0 HG22 THR A 506 4.336 -11.369 -18.988 1.00 62.43 H new ATOM 0 HG23 THR A 506 3.701 -10.020 -18.017 1.00 62.43 H new ATOM 1144 N GLN A 507 8.161 -8.047 -18.246 1.00 12.14 N ATOM 1145 CA GLN A 507 9.509 -7.512 -18.498 1.00 41.04 C ATOM 1146 C GLN A 507 10.376 -7.608 -17.236 1.00 54.23 C ATOM 1147 O GLN A 507 9.960 -7.197 -16.151 1.00 12.43 O ATOM 1148 CB GLN A 507 9.466 -6.050 -18.981 1.00 24.13 C ATOM 1149 CG GLN A 507 9.045 -5.873 -20.440 1.00 42.31 C ATOM 1150 CD GLN A 507 7.545 -5.962 -20.654 1.00 31.54 C ATOM 1151 OE1 GLN A 507 6.999 -7.029 -20.904 1.00 64.03 O ATOM 1152 NE2 GLN A 507 6.863 -4.836 -20.563 1.00 41.41 N ATOM 0 H GLN A 507 7.536 -7.405 -17.758 1.00 12.14 H new ATOM 0 HA GLN A 507 9.949 -8.120 -19.289 1.00 41.04 H new ATOM 0 HB2 GLN A 507 8.776 -5.492 -18.348 1.00 24.13 H new ATOM 0 HB3 GLN A 507 10.453 -5.607 -18.845 1.00 24.13 H new ATOM 0 HG2 GLN A 507 9.398 -4.905 -20.796 1.00 42.31 H new ATOM 0 HG3 GLN A 507 9.536 -6.634 -21.046 1.00 42.31 H new ATOM 0 HE21 GLN A 507 7.346 -3.963 -20.353 1.00 41.41 H new ATOM 0 HE22 GLN A 507 5.853 -4.839 -20.702 1.00 41.41 H new ATOM 1161 N GLU A 508 11.591 -8.128 -17.394 1.00 51.43 N ATOM 1162 CA GLU A 508 12.503 -8.346 -16.259 1.00 52.33 C ATOM 1163 C GLU A 508 13.352 -7.100 -15.952 1.00 32.43 C ATOM 1164 O GLU A 508 13.645 -6.295 -16.838 1.00 43.12 O ATOM 1165 CB GLU A 508 13.391 -9.585 -16.506 1.00 53.34 C ATOM 1166 CG GLU A 508 13.995 -9.695 -17.910 1.00 63.40 C ATOM 1167 CD GLU A 508 15.097 -8.688 -18.200 1.00 73.22 C ATOM 1168 OE1 GLU A 508 16.154 -8.749 -17.536 1.00 40.42 O ATOM 1169 OE2 GLU A 508 14.926 -7.853 -19.112 1.00 2.40 O ATOM 0 H GLU A 508 11.973 -8.409 -18.297 1.00 51.43 H new ATOM 0 HA GLU A 508 11.891 -8.534 -15.377 1.00 52.33 H new ATOM 0 HB2 GLU A 508 14.204 -9.579 -15.779 1.00 53.34 H new ATOM 0 HB3 GLU A 508 12.798 -10.479 -16.313 1.00 53.34 H new ATOM 0 HG2 GLU A 508 14.394 -10.701 -18.043 1.00 63.40 H new ATOM 0 HG3 GLU A 508 13.200 -9.568 -18.645 1.00 63.40 H new ATOM 1176 N GLY A 509 13.723 -6.936 -14.683 1.00 22.21 N ATOM 1177 CA GLY A 509 14.496 -5.772 -14.262 1.00 51.35 C ATOM 1178 C GLY A 509 14.215 -5.362 -12.819 1.00 44.44 C ATOM 1179 O GLY A 509 13.549 -6.085 -12.077 1.00 31.41 O ATOM 0 H GLY A 509 13.502 -7.591 -13.933 1.00 22.21 H new ATOM 0 HA2 GLY A 509 15.559 -5.989 -14.372 1.00 51.35 H new ATOM 0 HA3 GLY A 509 14.271 -4.935 -14.923 1.00 51.35 H new ATOM 1183 N MET A 510 14.724 -4.199 -12.415 1.00 22.44 N ATOM 1184 CA MET A 510 14.533 -3.705 -11.044 1.00 34.02 C ATOM 1185 C MET A 510 13.279 -2.814 -10.932 1.00 74.31 C ATOM 1186 O MET A 510 13.139 -1.825 -11.651 1.00 12.55 O ATOM 1187 CB MET A 510 15.775 -2.927 -10.589 1.00 65.35 C ATOM 1188 CG MET A 510 15.708 -2.466 -9.141 1.00 64.43 C ATOM 1189 SD MET A 510 15.460 -3.837 -7.998 1.00 73.10 S ATOM 1190 CE MET A 510 15.334 -2.964 -6.439 1.00 12.25 C ATOM 0 H MET A 510 15.271 -3.580 -13.013 1.00 22.44 H new ATOM 0 HA MET A 510 14.387 -4.568 -10.394 1.00 34.02 H new ATOM 0 HB2 MET A 510 16.656 -3.555 -10.721 1.00 65.35 H new ATOM 0 HB3 MET A 510 15.905 -2.057 -11.233 1.00 65.35 H new ATOM 0 HG2 MET A 510 16.630 -1.945 -8.885 1.00 64.43 H new ATOM 0 HG3 MET A 510 14.895 -1.749 -9.027 1.00 64.43 H new ATOM 0 HE1 MET A 510 15.551 -3.649 -5.620 1.00 12.25 H new ATOM 0 HE2 MET A 510 16.049 -2.142 -6.424 1.00 12.25 H new ATOM 0 HE3 MET A 510 14.325 -2.569 -6.324 1.00 12.25 H new ATOM 1200 N TYR A 511 12.374 -3.174 -10.018 1.00 2.43 N ATOM 1201 CA TYR A 511 11.126 -2.422 -9.802 1.00 13.34 C ATOM 1202 C TYR A 511 10.936 -2.071 -8.315 1.00 20.15 C ATOM 1203 O TYR A 511 11.420 -2.774 -7.433 1.00 11.41 O ATOM 1204 CB TYR A 511 9.916 -3.235 -10.291 1.00 15.02 C ATOM 1205 CG TYR A 511 9.887 -3.482 -11.791 1.00 43.13 C ATOM 1206 CD1 TYR A 511 10.639 -4.500 -12.367 1.00 63.55 C ATOM 1207 CD2 TYR A 511 9.099 -2.699 -12.631 1.00 55.40 C ATOM 1208 CE1 TYR A 511 10.609 -4.731 -13.729 1.00 71.12 C ATOM 1209 CE2 TYR A 511 9.064 -2.927 -13.995 1.00 24.34 C ATOM 1210 CZ TYR A 511 9.821 -3.943 -14.538 1.00 41.34 C ATOM 1211 OH TYR A 511 9.789 -4.176 -15.896 1.00 74.33 O ATOM 0 H TYR A 511 12.480 -3.986 -9.410 1.00 2.43 H new ATOM 0 HA TYR A 511 11.198 -1.497 -10.374 1.00 13.34 H new ATOM 0 HB2 TYR A 511 9.908 -4.196 -9.777 1.00 15.02 H new ATOM 0 HB3 TYR A 511 9.003 -2.713 -10.004 1.00 15.02 H new ATOM 0 HD1 TYR A 511 11.258 -5.122 -11.738 1.00 63.55 H new ATOM 0 HD2 TYR A 511 8.505 -1.901 -12.211 1.00 55.40 H new ATOM 0 HE1 TYR A 511 11.201 -5.526 -14.157 1.00 71.12 H new ATOM 0 HE2 TYR A 511 8.446 -2.311 -14.632 1.00 24.34 H new ATOM 0 HH TYR A 511 9.842 -5.140 -16.064 1.00 74.33 H new ATOM 1221 N ARG A 512 10.235 -0.974 -8.040 1.00 11.42 N ATOM 1222 CA ARG A 512 9.919 -0.584 -6.656 1.00 10.44 C ATOM 1223 C ARG A 512 8.405 -0.414 -6.447 1.00 52.22 C ATOM 1224 O ARG A 512 7.771 0.420 -7.092 1.00 50.55 O ATOM 1225 CB ARG A 512 10.658 0.711 -6.283 1.00 11.40 C ATOM 1226 CG ARG A 512 10.253 1.288 -4.928 1.00 24.42 C ATOM 1227 CD ARG A 512 11.201 2.394 -4.472 1.00 15.42 C ATOM 1228 NE ARG A 512 12.526 1.871 -4.145 1.00 10.13 N ATOM 1229 CZ ARG A 512 13.548 2.604 -3.798 1.00 32.35 C ATOM 1230 NH1 ARG A 512 13.457 3.895 -3.749 1.00 25.13 N ATOM 1231 NH2 ARG A 512 14.666 2.031 -3.504 1.00 1.21 N ATOM 0 H ARG A 512 9.873 -0.337 -8.750 1.00 11.42 H new ATOM 0 HA ARG A 512 10.256 -1.387 -6.001 1.00 10.44 H new ATOM 0 HB2 ARG A 512 11.731 0.517 -6.278 1.00 11.40 H new ATOM 0 HB3 ARG A 512 10.473 1.458 -7.055 1.00 11.40 H new ATOM 0 HG2 ARG A 512 9.239 1.682 -4.990 1.00 24.42 H new ATOM 0 HG3 ARG A 512 10.240 0.492 -4.184 1.00 24.42 H new ATOM 0 HD2 ARG A 512 11.290 3.144 -5.258 1.00 15.42 H new ATOM 0 HD3 ARG A 512 10.782 2.895 -3.599 1.00 15.42 H new ATOM 0 HE ARG A 512 12.661 0.861 -4.191 1.00 10.13 H new ATOM 0 HH11 ARG A 512 12.577 4.353 -3.984 1.00 25.13 H new ATOM 0 HH12 ARG A 512 14.266 4.453 -3.476 1.00 25.13 H new ATOM 0 HH21 ARG A 512 14.744 1.015 -3.544 1.00 1.21 H new ATOM 0 HH22 ARG A 512 15.472 2.594 -3.231 1.00 1.21 H new ATOM 1245 N ILE A 513 7.837 -1.202 -5.538 1.00 11.24 N ATOM 1246 CA ILE A 513 6.404 -1.127 -5.226 1.00 60.42 C ATOM 1247 C ILE A 513 6.145 -0.237 -3.997 1.00 54.15 C ATOM 1248 O ILE A 513 6.737 -0.434 -2.934 1.00 24.43 O ATOM 1249 CB ILE A 513 5.806 -2.538 -4.972 1.00 13.42 C ATOM 1250 CG1 ILE A 513 6.016 -3.437 -6.204 1.00 61.22 C ATOM 1251 CG2 ILE A 513 4.322 -2.444 -4.615 1.00 43.44 C ATOM 1252 CD1 ILE A 513 5.414 -4.824 -6.071 1.00 14.22 C ATOM 0 H ILE A 513 8.346 -1.904 -5.000 1.00 11.24 H new ATOM 0 HA ILE A 513 5.914 -0.685 -6.094 1.00 60.42 H new ATOM 0 HB ILE A 513 6.327 -2.985 -4.125 1.00 13.42 H new ATOM 0 HG12 ILE A 513 5.582 -2.947 -7.076 1.00 61.22 H new ATOM 0 HG13 ILE A 513 7.085 -3.534 -6.392 1.00 61.22 H new ATOM 0 HG21 ILE A 513 3.925 -3.444 -4.442 1.00 43.44 H new ATOM 0 HG22 ILE A 513 4.202 -1.845 -3.712 1.00 43.44 H new ATOM 0 HG23 ILE A 513 3.779 -1.976 -5.436 1.00 43.44 H new ATOM 0 HD11 ILE A 513 5.606 -5.393 -6.981 1.00 14.22 H new ATOM 0 HD12 ILE A 513 5.865 -5.336 -5.221 1.00 14.22 H new ATOM 0 HD13 ILE A 513 4.338 -4.740 -5.916 1.00 14.22 H new ATOM 1264 N ASN A 514 5.262 0.744 -4.153 1.00 24.54 N ATOM 1265 CA ASN A 514 4.903 1.658 -3.062 1.00 12.53 C ATOM 1266 C ASN A 514 3.393 1.642 -2.786 1.00 34.41 C ATOM 1267 O ASN A 514 2.583 1.494 -3.701 1.00 75.32 O ATOM 1268 CB ASN A 514 5.345 3.089 -3.394 1.00 73.42 C ATOM 1269 CG ASN A 514 6.847 3.272 -3.307 1.00 31.31 C ATOM 1270 OD1 ASN A 514 7.323 3.643 -2.137 1.00 31.15 O flip ATOM 1271 ND2 ASN A 514 7.574 3.087 -4.278 1.00 14.41 N flip ATOM 0 H ASN A 514 4.776 0.931 -5.030 1.00 24.54 H new ATOM 0 HA ASN A 514 5.421 1.314 -2.167 1.00 12.53 H new ATOM 0 HB2 ASN A 514 5.010 3.345 -4.399 1.00 73.42 H new ATOM 0 HB3 ASN A 514 4.858 3.783 -2.709 1.00 73.42 H new ATOM 0 HD21 ASN A 514 7.171 2.800 -5.170 1.00 14.41 H new ATOM 0 HD22 ASN A 514 8.582 3.220 -4.193 1.00 14.41 H new ATOM 1278 N ALA A 515 3.027 1.793 -1.517 1.00 30.11 N ATOM 1279 CA ALA A 515 1.621 1.908 -1.116 1.00 74.43 C ATOM 1280 C ALA A 515 1.396 3.205 -0.332 1.00 14.12 C ATOM 1281 O ALA A 515 2.182 3.547 0.555 1.00 64.13 O ATOM 1282 CB ALA A 515 1.195 0.704 -0.283 1.00 1.14 C ATOM 0 H ALA A 515 3.687 1.839 -0.741 1.00 30.11 H new ATOM 0 HA ALA A 515 1.009 1.933 -2.018 1.00 74.43 H new ATOM 0 HB1 ALA A 515 0.149 0.811 0.003 1.00 1.14 H new ATOM 0 HB2 ALA A 515 1.319 -0.206 -0.869 1.00 1.14 H new ATOM 0 HB3 ALA A 515 1.812 0.645 0.614 1.00 1.14 H new ATOM 1288 N THR A 516 0.333 3.930 -0.666 1.00 13.32 N ATOM 1289 CA THR A 516 0.040 5.217 -0.019 1.00 4.20 C ATOM 1290 C THR A 516 -1.450 5.363 0.319 1.00 71.40 C ATOM 1291 O THR A 516 -2.313 4.794 -0.356 1.00 62.02 O ATOM 1292 CB THR A 516 0.461 6.408 -0.913 1.00 12.31 C ATOM 1293 OG1 THR A 516 -0.171 6.311 -2.199 1.00 11.43 O ATOM 1294 CG2 THR A 516 1.976 6.461 -1.095 1.00 32.15 C ATOM 0 H THR A 516 -0.342 3.654 -1.379 1.00 13.32 H new ATOM 0 HA THR A 516 0.618 5.230 0.905 1.00 4.20 H new ATOM 0 HB THR A 516 0.141 7.323 -0.415 1.00 12.31 H new ATOM 0 HG1 THR A 516 -1.132 6.481 -2.105 1.00 11.43 H new ATOM 0 HG21 THR A 516 2.237 7.309 -1.728 1.00 32.15 H new ATOM 0 HG22 THR A 516 2.456 6.573 -0.123 1.00 32.15 H new ATOM 0 HG23 THR A 516 2.319 5.539 -1.565 1.00 32.15 H new ATOM 1302 N VAL A 517 -1.745 6.134 1.369 1.00 72.43 N ATOM 1303 CA VAL A 517 -3.133 6.388 1.787 1.00 64.24 C ATOM 1304 C VAL A 517 -3.411 7.896 1.958 1.00 4.54 C ATOM 1305 O VAL A 517 -2.506 8.673 2.275 1.00 31.51 O ATOM 1306 CB VAL A 517 -3.472 5.632 3.101 1.00 33.04 C ATOM 1307 CG1 VAL A 517 -2.548 6.057 4.235 1.00 64.31 C ATOM 1308 CG2 VAL A 517 -4.936 5.832 3.488 1.00 22.32 C ATOM 0 H VAL A 517 -1.043 6.595 1.948 1.00 72.43 H new ATOM 0 HA VAL A 517 -3.777 6.012 0.992 1.00 64.24 H new ATOM 0 HB VAL A 517 -3.314 4.569 2.921 1.00 33.04 H new ATOM 0 HG11 VAL A 517 -2.810 5.511 5.141 1.00 64.31 H new ATOM 0 HG12 VAL A 517 -1.515 5.838 3.964 1.00 64.31 H new ATOM 0 HG13 VAL A 517 -2.657 7.127 4.412 1.00 64.31 H new ATOM 0 HG21 VAL A 517 -5.145 5.292 4.411 1.00 22.32 H new ATOM 0 HG22 VAL A 517 -5.131 6.894 3.637 1.00 22.32 H new ATOM 0 HG23 VAL A 517 -5.578 5.453 2.693 1.00 22.32 H new ATOM 1318 N ASP A 518 -4.670 8.293 1.714 1.00 22.23 N ATOM 1319 CA ASP A 518 -5.110 9.700 1.780 1.00 40.22 C ATOM 1320 C ASP A 518 -4.151 10.635 1.015 1.00 1.14 C ATOM 1321 O ASP A 518 -3.804 11.723 1.475 1.00 65.42 O ATOM 1322 CB ASP A 518 -5.296 10.165 3.237 1.00 4.33 C ATOM 1323 CG ASP A 518 -6.142 11.435 3.330 1.00 0.15 C ATOM 1324 OD1 ASP A 518 -7.342 11.377 2.981 1.00 3.34 O ATOM 1325 OD2 ASP A 518 -5.619 12.495 3.735 1.00 25.22 O ATOM 0 H ASP A 518 -5.417 7.645 1.464 1.00 22.23 H new ATOM 0 HA ASP A 518 -6.081 9.755 1.288 1.00 40.22 H new ATOM 0 HB2 ASP A 518 -5.770 9.371 3.813 1.00 4.33 H new ATOM 0 HB3 ASP A 518 -4.320 10.346 3.687 1.00 4.33 H new ATOM 1330 N GLU A 519 -3.742 10.195 -0.174 1.00 65.25 N ATOM 1331 CA GLU A 519 -2.928 11.012 -1.087 1.00 24.31 C ATOM 1332 C GLU A 519 -3.552 12.395 -1.317 1.00 5.34 C ATOM 1333 O GLU A 519 -2.851 13.381 -1.540 1.00 10.10 O ATOM 1334 CB GLU A 519 -2.752 10.283 -2.425 1.00 5.24 C ATOM 1335 CG GLU A 519 -1.854 9.058 -2.341 1.00 44.21 C ATOM 1336 CD GLU A 519 -0.391 9.418 -2.121 1.00 13.23 C ATOM 1337 OE1 GLU A 519 -0.031 9.819 -0.992 1.00 23.34 O ATOM 1338 OE2 GLU A 519 0.398 9.306 -3.081 1.00 30.14 O ATOM 0 H GLU A 519 -3.962 9.267 -0.535 1.00 65.25 H new ATOM 0 HA GLU A 519 -1.953 11.161 -0.624 1.00 24.31 H new ATOM 0 HB2 GLU A 519 -3.731 9.980 -2.795 1.00 5.24 H new ATOM 0 HB3 GLU A 519 -2.337 10.978 -3.155 1.00 5.24 H new ATOM 0 HG2 GLU A 519 -2.193 8.419 -1.526 1.00 44.21 H new ATOM 0 HG3 GLU A 519 -1.948 8.480 -3.260 1.00 44.21 H new ATOM 1345 N GLU A 520 -4.877 12.448 -1.259 1.00 41.45 N ATOM 1346 CA GLU A 520 -5.625 13.684 -1.503 1.00 32.32 C ATOM 1347 C GLU A 520 -5.340 14.719 -0.399 1.00 75.10 C ATOM 1348 O GLU A 520 -5.503 15.924 -0.610 1.00 33.53 O ATOM 1349 CB GLU A 520 -7.145 13.398 -1.556 1.00 44.02 C ATOM 1350 CG GLU A 520 -7.533 11.971 -1.969 1.00 52.31 C ATOM 1351 CD GLU A 520 -7.115 11.586 -3.388 1.00 25.04 C ATOM 1352 OE1 GLU A 520 -5.903 11.488 -3.664 1.00 53.20 O ATOM 1353 OE2 GLU A 520 -8.006 11.338 -4.225 1.00 52.20 O ATOM 0 H GLU A 520 -5.464 11.643 -1.043 1.00 41.45 H new ATOM 0 HA GLU A 520 -5.301 14.087 -2.463 1.00 32.32 H new ATOM 0 HB2 GLU A 520 -7.570 13.602 -0.573 1.00 44.02 H new ATOM 0 HB3 GLU A 520 -7.605 14.098 -2.254 1.00 44.02 H new ATOM 0 HG2 GLU A 520 -7.083 11.268 -1.268 1.00 52.31 H new ATOM 0 HG3 GLU A 520 -8.614 11.862 -1.880 1.00 52.31 H new ATOM 1360 N ASN A 521 -4.922 14.230 0.777 1.00 12.12 N ATOM 1361 CA ASN A 521 -4.631 15.073 1.940 1.00 24.40 C ATOM 1362 C ASN A 521 -5.897 15.805 2.396 1.00 11.44 C ATOM 1363 O ASN A 521 -6.138 16.958 2.025 1.00 75.33 O ATOM 1364 CB ASN A 521 -3.497 16.073 1.649 1.00 52.44 C ATOM 1365 CG ASN A 521 -2.996 16.777 2.903 1.00 32.44 C ATOM 1366 OD1 ASN A 521 -3.725 16.945 3.876 1.00 24.10 O ATOM 1367 ND2 ASN A 521 -1.752 17.203 2.894 1.00 14.03 N ATOM 0 H ASN A 521 -4.776 13.235 0.947 1.00 12.12 H new ATOM 0 HA ASN A 521 -4.291 14.423 2.746 1.00 24.40 H new ATOM 0 HB2 ASN A 521 -2.667 15.547 1.177 1.00 52.44 H new ATOM 0 HB3 ASN A 521 -3.850 16.818 0.936 1.00 52.44 H new ATOM 0 HD21 ASN A 521 -1.372 17.686 3.708 1.00 14.03 H new ATOM 0 HD22 ASN A 521 -1.167 17.051 2.073 1.00 14.03 H new ATOM 1374 N THR A 522 -6.724 15.113 3.166 1.00 12.03 N ATOM 1375 CA THR A 522 -7.998 15.665 3.640 1.00 72.14 C ATOM 1376 C THR A 522 -7.964 15.953 5.143 1.00 3.43 C ATOM 1377 O THR A 522 -8.677 16.833 5.634 1.00 3.53 O ATOM 1378 CB THR A 522 -9.172 14.696 3.359 1.00 31.41 C ATOM 1379 OG1 THR A 522 -9.013 13.493 4.128 1.00 64.34 O ATOM 1380 CG2 THR A 522 -9.254 14.348 1.876 1.00 72.41 C ATOM 0 H THR A 522 -6.539 14.161 3.481 1.00 12.03 H new ATOM 0 HA THR A 522 -8.149 16.596 3.094 1.00 72.14 H new ATOM 0 HB THR A 522 -10.097 15.195 3.649 1.00 31.41 H new ATOM 0 HG1 THR A 522 -9.473 12.754 3.678 1.00 64.34 H new ATOM 0 HG21 THR A 522 -10.088 13.666 1.708 1.00 72.41 H new ATOM 0 HG22 THR A 522 -9.407 15.258 1.297 1.00 72.41 H new ATOM 0 HG23 THR A 522 -8.326 13.871 1.562 1.00 72.41 H new ATOM 1388 N VAL A 523 -7.129 15.216 5.874 1.00 22.01 N ATOM 1389 CA VAL A 523 -7.090 15.328 7.339 1.00 41.11 C ATOM 1390 C VAL A 523 -5.657 15.393 7.899 1.00 20.42 C ATOM 1391 O VAL A 523 -4.744 14.735 7.399 1.00 5.14 O ATOM 1392 CB VAL A 523 -7.850 14.145 7.999 1.00 22.23 C ATOM 1393 CG1 VAL A 523 -7.218 12.804 7.622 1.00 34.55 C ATOM 1394 CG2 VAL A 523 -7.914 14.311 9.519 1.00 62.11 C ATOM 0 H VAL A 523 -6.474 14.539 5.484 1.00 22.01 H new ATOM 0 HA VAL A 523 -7.581 16.270 7.585 1.00 41.11 H new ATOM 0 HB VAL A 523 -8.871 14.153 7.617 1.00 22.23 H new ATOM 0 HG11 VAL A 523 -7.771 11.994 8.098 1.00 34.55 H new ATOM 0 HG12 VAL A 523 -7.250 12.678 6.540 1.00 34.55 H new ATOM 0 HG13 VAL A 523 -6.182 12.783 7.959 1.00 34.55 H new ATOM 0 HG21 VAL A 523 -8.451 13.469 9.955 1.00 62.11 H new ATOM 0 HG22 VAL A 523 -6.903 14.345 9.924 1.00 62.11 H new ATOM 0 HG23 VAL A 523 -8.433 15.238 9.762 1.00 62.11 H new ATOM 1404 N VAL A 524 -5.465 16.220 8.927 1.00 72.10 N ATOM 1405 CA VAL A 524 -4.198 16.270 9.663 1.00 65.12 C ATOM 1406 C VAL A 524 -4.170 15.183 10.752 1.00 74.44 C ATOM 1407 O VAL A 524 -4.951 15.221 11.706 1.00 72.42 O ATOM 1408 CB VAL A 524 -3.975 17.661 10.314 1.00 54.12 C ATOM 1409 CG1 VAL A 524 -2.696 17.680 11.153 1.00 71.15 C ATOM 1410 CG2 VAL A 524 -3.946 18.758 9.249 1.00 0.33 C ATOM 0 H VAL A 524 -6.173 16.868 9.271 1.00 72.10 H new ATOM 0 HA VAL A 524 -3.395 16.092 8.948 1.00 65.12 H new ATOM 0 HB VAL A 524 -4.813 17.857 10.983 1.00 54.12 H new ATOM 0 HG11 VAL A 524 -2.566 18.667 11.596 1.00 71.15 H new ATOM 0 HG12 VAL A 524 -2.769 16.934 11.944 1.00 71.15 H new ATOM 0 HG13 VAL A 524 -1.840 17.453 10.517 1.00 71.15 H new ATOM 0 HG21 VAL A 524 -3.789 19.725 9.727 1.00 0.33 H new ATOM 0 HG22 VAL A 524 -3.134 18.563 8.548 1.00 0.33 H new ATOM 0 HG23 VAL A 524 -4.894 18.769 8.712 1.00 0.33 H new ATOM 1420 N GLU A 525 -3.271 14.216 10.601 1.00 34.44 N ATOM 1421 CA GLU A 525 -3.219 13.062 11.507 1.00 32.54 C ATOM 1422 C GLU A 525 -2.096 13.178 12.548 1.00 55.21 C ATOM 1423 O GLU A 525 -1.312 14.133 12.539 1.00 21.02 O ATOM 1424 CB GLU A 525 -3.046 11.774 10.693 1.00 5.45 C ATOM 1425 CG GLU A 525 -4.156 11.540 9.675 1.00 0.25 C ATOM 1426 CD GLU A 525 -4.222 10.097 9.212 1.00 4.14 C ATOM 1427 OE1 GLU A 525 -3.304 9.656 8.492 1.00 74.35 O ATOM 1428 OE2 GLU A 525 -5.183 9.396 9.587 1.00 14.41 O ATOM 0 H GLU A 525 -2.567 14.204 9.863 1.00 34.44 H new ATOM 0 HA GLU A 525 -4.161 13.037 12.055 1.00 32.54 H new ATOM 0 HB2 GLU A 525 -2.089 11.809 10.172 1.00 5.45 H new ATOM 0 HB3 GLU A 525 -3.006 10.925 11.376 1.00 5.45 H new ATOM 0 HG2 GLU A 525 -5.113 11.822 10.114 1.00 0.25 H new ATOM 0 HG3 GLU A 525 -3.997 12.188 8.813 1.00 0.25 H new ATOM 1435 N LEU A 526 -2.031 12.191 13.451 1.00 71.15 N ATOM 1436 CA LEU A 526 -0.991 12.147 14.489 1.00 22.03 C ATOM 1437 C LEU A 526 0.407 12.088 13.862 1.00 5.15 C ATOM 1438 O LEU A 526 1.346 12.724 14.342 1.00 34.41 O ATOM 1439 CB LEU A 526 -1.198 10.927 15.404 1.00 32.32 C ATOM 1440 CG LEU A 526 -2.530 10.888 16.172 1.00 4.31 C ATOM 1441 CD1 LEU A 526 -2.650 9.598 16.983 1.00 63.41 C ATOM 1442 CD2 LEU A 526 -2.662 12.106 17.083 1.00 71.10 C ATOM 0 H LEU A 526 -2.687 11.411 13.484 1.00 71.15 H new ATOM 0 HA LEU A 526 -1.070 13.059 15.081 1.00 22.03 H new ATOM 0 HB2 LEU A 526 -1.123 10.024 14.798 1.00 32.32 H new ATOM 0 HB3 LEU A 526 -0.382 10.895 16.126 1.00 32.32 H new ATOM 0 HG LEU A 526 -3.342 10.912 15.445 1.00 4.31 H new ATOM 0 HD11 LEU A 526 -3.600 9.592 17.518 1.00 63.41 H new ATOM 0 HD12 LEU A 526 -2.606 8.741 16.311 1.00 63.41 H new ATOM 0 HD13 LEU A 526 -1.830 9.541 17.699 1.00 63.41 H new ATOM 0 HD21 LEU A 526 -3.611 12.060 17.617 1.00 71.10 H new ATOM 0 HD22 LEU A 526 -1.842 12.114 17.801 1.00 71.10 H new ATOM 0 HD23 LEU A 526 -2.628 13.015 16.482 1.00 71.10 H new ATOM 1454 N ASN A 527 0.529 11.321 12.785 1.00 21.44 N ATOM 1455 CA ASN A 527 1.757 11.268 11.997 1.00 41.01 C ATOM 1456 C ASN A 527 1.426 11.174 10.500 1.00 64.15 C ATOM 1457 O ASN A 527 1.243 10.089 9.952 1.00 44.12 O ATOM 1458 CB ASN A 527 2.632 10.088 12.452 1.00 1.44 C ATOM 1459 CG ASN A 527 3.887 9.920 11.617 1.00 44.20 C ATOM 1460 OD1 ASN A 527 4.362 10.855 10.981 1.00 41.51 O ATOM 1461 ND2 ASN A 527 4.453 8.733 11.638 1.00 40.15 N ATOM 0 H ASN A 527 -0.217 10.720 12.433 1.00 21.44 H new ATOM 0 HA ASN A 527 2.322 12.186 12.158 1.00 41.01 H new ATOM 0 HB2 ASN A 527 2.914 10.233 13.495 1.00 1.44 H new ATOM 0 HB3 ASN A 527 2.046 9.170 12.405 1.00 1.44 H new ATOM 0 HD21 ASN A 527 5.313 8.569 11.115 1.00 40.15 H new ATOM 0 HD22 ASN A 527 4.032 7.977 12.177 1.00 40.15 H new ATOM 1468 N GLU A 528 1.368 12.329 9.840 1.00 64.40 N ATOM 1469 CA GLU A 528 0.960 12.405 8.426 1.00 33.12 C ATOM 1470 C GLU A 528 2.131 12.116 7.465 1.00 12.22 C ATOM 1471 O GLU A 528 2.055 12.396 6.266 1.00 32.20 O ATOM 1472 CB GLU A 528 0.302 13.772 8.100 1.00 24.12 C ATOM 1473 CG GLU A 528 0.512 14.872 9.144 1.00 20.55 C ATOM 1474 CD GLU A 528 1.969 15.256 9.336 1.00 25.15 C ATOM 1475 OE1 GLU A 528 2.520 15.971 8.476 1.00 21.32 O ATOM 1476 OE2 GLU A 528 2.569 14.851 10.353 1.00 23.35 O ATOM 0 H GLU A 528 1.598 13.231 10.257 1.00 64.40 H new ATOM 0 HA GLU A 528 0.215 11.624 8.272 1.00 33.12 H new ATOM 0 HB2 GLU A 528 0.691 14.124 7.144 1.00 24.12 H new ATOM 0 HB3 GLU A 528 -0.769 13.618 7.971 1.00 24.12 H new ATOM 0 HG2 GLU A 528 -0.052 15.756 8.847 1.00 20.55 H new ATOM 0 HG3 GLU A 528 0.104 14.539 10.098 1.00 20.55 H new ATOM 1483 N ASN A 529 3.212 11.554 7.998 1.00 71.34 N ATOM 1484 CA ASN A 529 4.287 10.989 7.170 1.00 12.33 C ATOM 1485 C ASN A 529 4.200 9.451 7.186 1.00 22.00 C ATOM 1486 O ASN A 529 4.932 8.753 6.481 1.00 53.42 O ATOM 1487 CB ASN A 529 5.656 11.456 7.686 1.00 23.21 C ATOM 1488 CG ASN A 529 6.805 11.024 6.792 1.00 13.24 C ATOM 1489 OD1 ASN A 529 7.432 9.991 7.009 1.00 0.53 O ATOM 1490 ND2 ASN A 529 7.089 11.806 5.775 1.00 72.11 N ATOM 0 H ASN A 529 3.372 11.475 9.002 1.00 71.34 H new ATOM 0 HA ASN A 529 4.170 11.338 6.144 1.00 12.33 H new ATOM 0 HB2 ASN A 529 5.656 12.543 7.769 1.00 23.21 H new ATOM 0 HB3 ASN A 529 5.815 11.060 8.689 1.00 23.21 H new ATOM 0 HD21 ASN A 529 7.849 11.561 5.140 1.00 72.11 H new ATOM 0 HD22 ASN A 529 6.550 12.658 5.621 1.00 72.11 H new ATOM 1497 N ASN A 530 3.256 8.941 7.971 1.00 51.03 N ATOM 1498 CA ASN A 530 3.099 7.499 8.196 1.00 54.32 C ATOM 1499 C ASN A 530 2.216 6.854 7.109 1.00 52.04 C ATOM 1500 O ASN A 530 1.999 5.641 7.100 1.00 73.23 O ATOM 1501 CB ASN A 530 2.474 7.295 9.584 1.00 3.33 C ATOM 1502 CG ASN A 530 2.587 5.880 10.104 1.00 20.33 C ATOM 1503 OD1 ASN A 530 3.510 5.149 9.766 1.00 20.02 O ATOM 1504 ND2 ASN A 530 1.656 5.486 10.947 1.00 74.40 N ATOM 0 H ASN A 530 2.575 9.512 8.472 1.00 51.03 H new ATOM 0 HA ASN A 530 4.075 7.017 8.145 1.00 54.32 H new ATOM 0 HB2 ASN A 530 2.955 7.971 10.291 1.00 3.33 H new ATOM 0 HB3 ASN A 530 1.421 7.573 9.542 1.00 3.33 H new ATOM 0 HD21 ASN A 530 1.689 4.546 11.341 1.00 74.40 H new ATOM 0 HD22 ASN A 530 0.901 6.121 11.207 1.00 74.40 H new ATOM 1511 N ASN A 531 1.739 7.677 6.177 1.00 12.02 N ATOM 1512 CA ASN A 531 0.793 7.230 5.144 1.00 41.32 C ATOM 1513 C ASN A 531 1.490 6.574 3.937 1.00 60.22 C ATOM 1514 O ASN A 531 0.823 6.046 3.046 1.00 23.30 O ATOM 1515 CB ASN A 531 -0.036 8.421 4.658 1.00 13.20 C ATOM 1516 CG ASN A 531 -0.539 9.278 5.802 1.00 71.40 C ATOM 1517 OD1 ASN A 531 0.106 10.244 6.188 1.00 62.54 O ATOM 1518 ND2 ASN A 531 -1.665 8.913 6.371 1.00 73.44 N ATOM 0 H ASN A 531 1.991 8.663 6.112 1.00 12.02 H new ATOM 0 HA ASN A 531 0.155 6.474 5.603 1.00 41.32 H new ATOM 0 HB2 ASN A 531 0.569 9.032 3.988 1.00 13.20 H new ATOM 0 HB3 ASN A 531 -0.885 8.058 4.079 1.00 13.20 H new ATOM 0 HD21 ASN A 531 -2.030 9.441 7.164 1.00 73.44 H new ATOM 0 HD22 ASN A 531 -2.174 8.102 6.020 1.00 73.44 H new ATOM 1525 N VAL A 532 2.823 6.615 3.900 1.00 54.42 N ATOM 1526 CA VAL A 532 3.586 6.089 2.756 1.00 12.40 C ATOM 1527 C VAL A 532 4.406 4.840 3.128 1.00 23.12 C ATOM 1528 O VAL A 532 5.021 4.780 4.196 1.00 62.24 O ATOM 1529 CB VAL A 532 4.546 7.165 2.182 1.00 24.30 C ATOM 1530 CG1 VAL A 532 5.320 6.632 0.973 1.00 34.42 C ATOM 1531 CG2 VAL A 532 3.779 8.437 1.814 1.00 75.41 C ATOM 0 H VAL A 532 3.400 7.005 4.645 1.00 54.42 H new ATOM 0 HA VAL A 532 2.850 5.811 2.002 1.00 12.40 H new ATOM 0 HB VAL A 532 5.269 7.412 2.959 1.00 24.30 H new ATOM 0 HG11 VAL A 532 5.984 7.409 0.594 1.00 34.42 H new ATOM 0 HG12 VAL A 532 5.910 5.765 1.272 1.00 34.42 H new ATOM 0 HG13 VAL A 532 4.618 6.341 0.191 1.00 34.42 H new ATOM 0 HG21 VAL A 532 4.472 9.177 1.414 1.00 75.41 H new ATOM 0 HG22 VAL A 532 3.025 8.203 1.063 1.00 75.41 H new ATOM 0 HG23 VAL A 532 3.293 8.839 2.703 1.00 75.41 H new ATOM 1541 N ALA A 533 4.412 3.851 2.233 1.00 35.05 N ATOM 1542 CA ALA A 533 5.215 2.630 2.402 1.00 63.20 C ATOM 1543 C ALA A 533 6.037 2.326 1.138 1.00 13.03 C ATOM 1544 O ALA A 533 5.567 2.535 0.015 1.00 3.43 O ATOM 1545 CB ALA A 533 4.315 1.447 2.742 1.00 2.33 C ATOM 0 H ALA A 533 3.864 3.869 1.373 1.00 35.05 H new ATOM 0 HA ALA A 533 5.909 2.796 3.226 1.00 63.20 H new ATOM 0 HB1 ALA A 533 4.923 0.551 2.864 1.00 2.33 H new ATOM 0 HB2 ALA A 533 3.780 1.652 3.669 1.00 2.33 H new ATOM 0 HB3 ALA A 533 3.598 1.292 1.936 1.00 2.33 H new ATOM 1551 N THR A 534 7.260 1.829 1.323 1.00 61.24 N ATOM 1552 CA THR A 534 8.165 1.528 0.200 1.00 73.34 C ATOM 1553 C THR A 534 8.686 0.084 0.264 1.00 2.40 C ATOM 1554 O THR A 534 9.095 -0.391 1.327 1.00 33.05 O ATOM 1555 CB THR A 534 9.380 2.495 0.182 1.00 10.33 C ATOM 1556 OG1 THR A 534 8.933 3.851 0.028 1.00 62.14 O ATOM 1557 CG2 THR A 534 10.351 2.156 -0.946 1.00 14.13 C ATOM 0 H THR A 534 7.653 1.624 2.241 1.00 61.24 H new ATOM 0 HA THR A 534 7.581 1.658 -0.711 1.00 73.34 H new ATOM 0 HB THR A 534 9.901 2.382 1.133 1.00 10.33 H new ATOM 0 HG1 THR A 534 8.245 3.892 -0.669 1.00 62.14 H new ATOM 0 HG21 THR A 534 11.188 2.854 -0.927 1.00 14.13 H new ATOM 0 HG22 THR A 534 10.722 1.140 -0.813 1.00 14.13 H new ATOM 0 HG23 THR A 534 9.837 2.232 -1.904 1.00 14.13 H new ATOM 1565 N PHE A 535 8.654 -0.615 -0.874 1.00 13.05 N ATOM 1566 CA PHE A 535 9.174 -1.985 -0.969 1.00 44.12 C ATOM 1567 C PHE A 535 9.857 -2.226 -2.331 1.00 32.24 C ATOM 1568 O PHE A 535 9.288 -1.932 -3.383 1.00 30.42 O ATOM 1569 CB PHE A 535 8.032 -2.990 -0.760 1.00 71.03 C ATOM 1570 CG PHE A 535 8.478 -4.430 -0.705 1.00 74.34 C ATOM 1571 CD1 PHE A 535 9.174 -4.911 0.395 1.00 50.51 C ATOM 1572 CD2 PHE A 535 8.201 -5.302 -1.748 1.00 1.13 C ATOM 1573 CE1 PHE A 535 9.585 -6.229 0.452 1.00 41.10 C ATOM 1574 CE2 PHE A 535 8.610 -6.621 -1.693 1.00 1.15 C ATOM 1575 CZ PHE A 535 9.301 -7.085 -0.592 1.00 61.33 C ATOM 0 H PHE A 535 8.272 -0.254 -1.748 1.00 13.05 H new ATOM 0 HA PHE A 535 9.923 -2.125 -0.189 1.00 44.12 H new ATOM 0 HB2 PHE A 535 7.514 -2.746 0.167 1.00 71.03 H new ATOM 0 HB3 PHE A 535 7.310 -2.876 -1.568 1.00 71.03 H new ATOM 0 HD1 PHE A 535 9.397 -4.247 1.217 1.00 50.51 H new ATOM 0 HD2 PHE A 535 7.660 -4.946 -2.612 1.00 1.13 H new ATOM 0 HE1 PHE A 535 10.128 -6.589 1.313 1.00 41.10 H new ATOM 0 HE2 PHE A 535 8.389 -7.289 -2.512 1.00 1.15 H new ATOM 0 HZ PHE A 535 9.619 -8.116 -0.548 1.00 61.33 H new ATOM 1585 N ASP A 536 11.078 -2.755 -2.307 1.00 44.34 N ATOM 1586 CA ASP A 536 11.838 -3.023 -3.533 1.00 41.22 C ATOM 1587 C ASP A 536 11.638 -4.467 -4.028 1.00 21.40 C ATOM 1588 O ASP A 536 11.699 -5.418 -3.246 1.00 74.11 O ATOM 1589 CB ASP A 536 13.329 -2.758 -3.289 1.00 12.33 C ATOM 1590 CG ASP A 536 13.632 -1.288 -3.048 1.00 13.02 C ATOM 1591 OD1 ASP A 536 13.527 -0.827 -1.892 1.00 55.42 O ATOM 1592 OD2 ASP A 536 13.990 -0.585 -4.020 1.00 62.50 O ATOM 0 H ASP A 536 11.567 -3.009 -1.449 1.00 44.34 H new ATOM 0 HA ASP A 536 11.465 -2.353 -4.308 1.00 41.22 H new ATOM 0 HB2 ASP A 536 13.661 -3.339 -2.429 1.00 12.33 H new ATOM 0 HB3 ASP A 536 13.901 -3.106 -4.149 1.00 12.33 H new ATOM 1597 N VAL A 537 11.410 -4.625 -5.334 1.00 1.32 N ATOM 1598 CA VAL A 537 11.222 -5.949 -5.946 1.00 12.00 C ATOM 1599 C VAL A 537 12.141 -6.140 -7.168 1.00 10.34 C ATOM 1600 O VAL A 537 12.165 -5.312 -8.081 1.00 44.04 O ATOM 1601 CB VAL A 537 9.750 -6.165 -6.389 1.00 41.53 C ATOM 1602 CG1 VAL A 537 9.567 -7.543 -7.024 1.00 31.42 C ATOM 1603 CG2 VAL A 537 8.793 -5.981 -5.212 1.00 30.22 C ATOM 0 H VAL A 537 11.350 -3.850 -5.994 1.00 1.32 H new ATOM 0 HA VAL A 537 11.480 -6.683 -5.183 1.00 12.00 H new ATOM 0 HB VAL A 537 9.513 -5.412 -7.140 1.00 41.53 H new ATOM 0 HG11 VAL A 537 8.527 -7.669 -7.326 1.00 31.42 H new ATOM 0 HG12 VAL A 537 10.212 -7.629 -7.899 1.00 31.42 H new ATOM 0 HG13 VAL A 537 9.831 -8.315 -6.301 1.00 31.42 H new ATOM 0 HG21 VAL A 537 7.768 -6.138 -5.548 1.00 30.22 H new ATOM 0 HG22 VAL A 537 9.033 -6.703 -4.432 1.00 30.22 H new ATOM 0 HG23 VAL A 537 8.894 -4.971 -4.815 1.00 30.22 H new ATOM 1613 N SER A 538 12.886 -7.242 -7.187 1.00 61.22 N ATOM 1614 CA SER A 538 13.775 -7.560 -8.316 1.00 72.53 C ATOM 1615 C SER A 538 13.170 -8.656 -9.203 1.00 44.12 C ATOM 1616 O SER A 538 12.893 -9.763 -8.737 1.00 34.52 O ATOM 1617 CB SER A 538 15.153 -8.008 -7.807 1.00 51.33 C ATOM 1618 OG SER A 538 16.018 -8.341 -8.883 1.00 63.53 O ATOM 0 H SER A 538 12.896 -7.933 -6.437 1.00 61.22 H new ATOM 0 HA SER A 538 13.891 -6.655 -8.912 1.00 72.53 H new ATOM 0 HB2 SER A 538 15.600 -7.211 -7.212 1.00 51.33 H new ATOM 0 HB3 SER A 538 15.038 -8.870 -7.150 1.00 51.33 H new ATOM 0 HG SER A 538 16.888 -8.621 -8.529 1.00 63.53 H new ATOM 1624 N VAL A 539 12.959 -8.343 -10.482 1.00 10.34 N ATOM 1625 CA VAL A 539 12.394 -9.308 -11.434 1.00 62.51 C ATOM 1626 C VAL A 539 13.493 -9.961 -12.286 1.00 72.24 C ATOM 1627 O VAL A 539 14.211 -9.282 -13.020 1.00 11.30 O ATOM 1628 CB VAL A 539 11.360 -8.636 -12.373 1.00 42.30 C ATOM 1629 CG1 VAL A 539 10.732 -9.665 -13.315 1.00 62.03 C ATOM 1630 CG2 VAL A 539 10.286 -7.908 -11.564 1.00 31.43 C ATOM 0 H VAL A 539 13.170 -7.430 -10.885 1.00 10.34 H new ATOM 0 HA VAL A 539 11.895 -10.076 -10.843 1.00 62.51 H new ATOM 0 HB VAL A 539 11.882 -7.898 -12.981 1.00 42.30 H new ATOM 0 HG11 VAL A 539 10.010 -9.171 -13.964 1.00 62.03 H new ATOM 0 HG12 VAL A 539 11.511 -10.125 -13.923 1.00 62.03 H new ATOM 0 HG13 VAL A 539 10.227 -10.434 -12.730 1.00 62.03 H new ATOM 0 HG21 VAL A 539 9.571 -7.444 -12.243 1.00 31.43 H new ATOM 0 HG22 VAL A 539 9.767 -8.621 -10.923 1.00 31.43 H new ATOM 0 HG23 VAL A 539 10.753 -7.139 -10.948 1.00 31.43 H new ATOM 1640 N VAL A 540 13.601 -11.284 -12.199 1.00 0.14 N ATOM 1641 CA VAL A 540 14.635 -12.036 -12.925 1.00 71.23 C ATOM 1642 C VAL A 540 14.028 -13.059 -13.905 1.00 4.32 C ATOM 1643 O VAL A 540 12.837 -13.364 -13.851 1.00 74.44 O ATOM 1644 CB VAL A 540 15.580 -12.773 -11.940 1.00 62.45 C ATOM 1645 CG1 VAL A 540 16.312 -11.775 -11.041 1.00 44.13 C ATOM 1646 CG2 VAL A 540 14.805 -13.792 -11.102 1.00 14.11 C ATOM 0 H VAL A 540 12.984 -11.865 -11.631 1.00 0.14 H new ATOM 0 HA VAL A 540 15.204 -11.305 -13.499 1.00 71.23 H new ATOM 0 HB VAL A 540 16.325 -13.313 -12.525 1.00 62.45 H new ATOM 0 HG11 VAL A 540 16.969 -12.314 -10.358 1.00 44.13 H new ATOM 0 HG12 VAL A 540 16.905 -11.098 -11.656 1.00 44.13 H new ATOM 0 HG13 VAL A 540 15.585 -11.201 -10.467 1.00 44.13 H new ATOM 0 HG21 VAL A 540 15.488 -14.296 -10.419 1.00 14.11 H new ATOM 0 HG22 VAL A 540 14.032 -13.280 -10.529 1.00 14.11 H new ATOM 0 HG23 VAL A 540 14.342 -14.527 -11.760 1.00 14.11 H new ATOM 1656 N LEU A 541 14.867 -13.605 -14.784 1.00 22.14 N ATOM 1657 CA LEU A 541 14.436 -14.608 -15.777 1.00 41.31 C ATOM 1658 C LEU A 541 14.332 -16.020 -15.171 1.00 40.11 C ATOM 1659 O LEU A 541 14.446 -17.017 -15.887 1.00 25.41 O ATOM 1660 CB LEU A 541 15.430 -14.631 -16.943 1.00 74.30 C ATOM 1661 CG LEU A 541 15.467 -13.363 -17.817 1.00 34.03 C ATOM 1662 CD1 LEU A 541 16.602 -13.442 -18.837 1.00 0.43 C ATOM 1663 CD2 LEU A 541 14.125 -13.154 -18.523 1.00 34.24 C ATOM 0 H LEU A 541 15.859 -13.372 -14.834 1.00 22.14 H new ATOM 0 HA LEU A 541 13.443 -14.321 -16.124 1.00 41.31 H new ATOM 0 HB2 LEU A 541 16.429 -14.802 -16.541 1.00 74.30 H new ATOM 0 HB3 LEU A 541 15.193 -15.482 -17.581 1.00 74.30 H new ATOM 0 HG LEU A 541 15.650 -12.508 -17.167 1.00 34.03 H new ATOM 0 HD11 LEU A 541 16.610 -12.536 -19.444 1.00 0.43 H new ATOM 0 HD12 LEU A 541 17.554 -13.537 -18.315 1.00 0.43 H new ATOM 0 HD13 LEU A 541 16.453 -14.309 -19.481 1.00 0.43 H new ATOM 0 HD21 LEU A 541 14.172 -12.253 -19.135 1.00 34.24 H new ATOM 0 HD22 LEU A 541 13.910 -14.013 -19.158 1.00 34.24 H new ATOM 0 HD23 LEU A 541 13.336 -13.046 -17.779 1.00 34.24 H new ATOM 1675 N GLU A 542 14.102 -16.086 -13.859 1.00 31.44 N ATOM 1676 CA GLU A 542 14.025 -17.360 -13.111 1.00 53.15 C ATOM 1677 C GLU A 542 15.398 -18.066 -13.031 1.00 14.23 C ATOM 1678 O GLU A 542 16.064 -17.962 -11.975 1.00 37.13 O ATOM 1679 CB GLU A 542 12.957 -18.305 -13.703 1.00 63.13 C ATOM 1680 CG GLU A 542 11.526 -17.778 -13.591 1.00 64.43 C ATOM 1681 CD GLU A 542 10.483 -18.800 -14.027 1.00 33.23 C ATOM 1682 OE1 GLU A 542 10.129 -19.684 -13.211 1.00 61.14 O ATOM 1683 OE2 GLU A 542 10.009 -18.728 -15.183 1.00 24.21 O ATOM 0 H GLU A 542 13.962 -15.261 -13.276 1.00 31.44 H new ATOM 0 HA GLU A 542 13.723 -17.108 -12.094 1.00 53.15 H new ATOM 0 HB2 GLU A 542 13.186 -18.482 -14.754 1.00 63.13 H new ATOM 0 HB3 GLU A 542 13.019 -19.268 -13.197 1.00 63.13 H new ATOM 0 HG2 GLU A 542 11.332 -17.485 -12.559 1.00 64.43 H new ATOM 0 HG3 GLU A 542 11.426 -16.881 -14.201 1.00 64.43 H new TER 1690 GLU A 542