USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1139 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 593 THR OG1 : rot 180:sc= -0.381 USER MOD Set 1.2: A 599 MET CE :methyl -161:sc= -0.184 (180deg=-0.863) USER MOD Set 2.1: A 585 GLN : amide:sc= -0.297 K(o=0.083,f=-0.49) USER MOD Set 2.2: A 586 HIS : no HE2:sc= 0.38 K(o=0.083,f=-3) USER MOD Set 3.1: A 580 LYS NZ :NH3+ -169:sc=-0.00897 (180deg=-0.185) USER MOD Set 3.2: A 582 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 559 LYS NZ :NH3+ -175:sc= 1.12 (180deg=0) USER MOD Set 4.2: A 637 ASN : amide:sc= 0.741 K(o=1.9,f=-5.2!) USER MOD Single : A 534 ASN : amide:sc= 0.59 K(o=0.59,f=-5.4!) USER MOD Single : A 535 CYS SG : rot -26:sc= 0.168 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 541 SER OG : rot -41:sc= 0.0167 USER MOD Single : A 542 MET CE :methyl -158:sc= -0.101 (180deg=-0.938) USER MOD Single : A 547 ASN : amide:sc= -0.126 X(o=-0.13,f=0) USER MOD Single : A 551 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 554 THR OG1 : rot 106:sc= 1.28 USER MOD Single : A 556 MET CE :methyl -151:sc= -0.7 (180deg=-1.14) USER MOD Single : A 558 THR OG1 : rot 180:sc= 0 USER MOD Single : A 561 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 566 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 570 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 THR OG1 : rot -52:sc= 1.19 USER MOD Single : A 579 LYS NZ :NH3+ 172:sc= 2.03 (180deg=1.95) USER MOD Single : A 581 MET CE :methyl -167:sc= -1.42 (180deg=-1.83!) USER MOD Single : A 590 SER OG : rot 180:sc=-0.00179 USER MOD Single : A 594 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0198) USER MOD Single : A 596 ASN : amide:sc= -0.239 K(o=-0.24,f=-1.9!) USER MOD Single : A 597 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 600 LYS NZ :NH3+ 173:sc= 0.831 (180deg=0.64) USER MOD Single : A 602 SER OG : rot 37:sc= 0.541 USER MOD Single : A 605 SER OG : rot 110:sc= 1.28 USER MOD Single : A 606 TYR OH : rot 180:sc= 0 USER MOD Single : A 611 CYS SG : rot -32:sc= -0.0974 USER MOD Single : A 614 THR OG1 : rot 96:sc= 0.652 USER MOD Single : A 619 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 SER OG : rot 180:sc= 0 USER MOD Single : A 626 THR OG1 : rot 180:sc= 0 USER MOD Single : A 627 TYR OH : rot 180:sc= 0.612 USER MOD Single : A 628 CYS SG : rot -160:sc= -0.485 USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 632 SER OG : rot -160:sc= 0 USER MOD Single : A 634 SER OG : rot 180:sc= 0.0235 USER MOD Single : A 639 ASN : amide:sc= 0.881 K(o=0.88,f=0) USER MOD Single : A 645 TYR OH : rot 180:sc= 0 USER MOD Single : A 647 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 648 MET CE :methyl -172:sc= -0.0372 (180deg=-0.167) USER MOD Single : A 654 THR OG1 : rot 180:sc= 0 USER MOD Single : A 665 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 668 SER OG : rot 180:sc= -0.442 USER MOD Single : A 672 HIS : no HD1:sc=-0.000714 X(o=-0.00071,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 534 6.381 14.027 5.201 1.00 3.46 N ATOM 2 CA ASN A 534 6.432 13.635 3.797 1.00 3.15 C ATOM 3 C ASN A 534 6.315 12.098 3.732 1.00 2.35 C ATOM 4 O ASN A 534 6.725 11.396 4.666 1.00 2.65 O ATOM 5 CB ASN A 534 7.775 14.150 3.240 1.00 4.49 C ATOM 6 CG ASN A 534 8.121 13.675 1.838 1.00 5.59 C ATOM 7 OD1 ASN A 534 8.453 12.517 1.631 1.00 5.93 O ATOM 8 ND2 ASN A 534 8.090 14.545 0.860 1.00 6.78 N ATOM 0 HA ASN A 534 5.622 14.055 3.201 1.00 3.15 H new ATOM 0 HB2 ASN A 534 7.757 15.240 3.243 1.00 4.49 H new ATOM 0 HB3 ASN A 534 8.572 13.843 3.917 1.00 4.49 H new ATOM 0 HD21 ASN A 534 8.344 14.259 -0.085 1.00 6.78 H new ATOM 0 HD22 ASN A 534 7.811 15.509 1.044 1.00 6.78 H new ATOM 15 N CYS A 535 5.788 11.558 2.632 1.00 2.11 N ATOM 16 CA CYS A 535 5.520 10.128 2.472 1.00 2.04 C ATOM 17 C CYS A 535 6.764 9.217 2.622 1.00 1.62 C ATOM 18 O CYS A 535 6.601 8.023 2.885 1.00 1.49 O ATOM 19 CB CYS A 535 4.791 9.941 1.132 1.00 3.10 C ATOM 20 SG CYS A 535 4.144 8.254 0.993 1.00 4.39 S ATOM 0 H CYS A 535 5.531 12.111 1.814 1.00 2.11 H new ATOM 0 HA CYS A 535 4.887 9.797 3.295 1.00 2.04 H new ATOM 0 HB2 CYS A 535 3.974 10.658 1.052 1.00 3.10 H new ATOM 0 HB3 CYS A 535 5.475 10.144 0.308 1.00 3.10 H new ATOM 0 HG CYS A 535 4.862 7.452 1.722 1.00 4.39 H new ATOM 26 N ARG A 536 8.000 9.742 2.556 1.00 1.58 N ATOM 27 CA ARG A 536 9.246 8.976 2.790 1.00 1.35 C ATOM 28 C ARG A 536 9.347 8.308 4.172 1.00 1.27 C ATOM 29 O ARG A 536 9.999 7.270 4.277 1.00 1.42 O ATOM 30 CB ARG A 536 10.475 9.852 2.471 1.00 1.64 C ATOM 31 CG ARG A 536 10.732 10.994 3.469 1.00 1.86 C ATOM 32 CD ARG A 536 11.847 11.914 2.951 1.00 2.36 C ATOM 33 NE ARG A 536 12.010 13.113 3.796 1.00 2.95 N ATOM 34 CZ ARG A 536 13.012 13.413 4.600 1.00 3.32 C ATOM 35 NH1 ARG A 536 13.985 12.595 4.880 1.00 3.47 N ATOM 36 NH2 ARG A 536 13.028 14.584 5.154 1.00 4.34 N ATOM 0 H ARG A 536 8.168 10.724 2.336 1.00 1.58 H new ATOM 0 HA ARG A 536 9.219 8.133 2.099 1.00 1.35 H new ATOM 0 HB2 ARG A 536 11.358 9.214 2.435 1.00 1.64 H new ATOM 0 HB3 ARG A 536 10.350 10.279 1.476 1.00 1.64 H new ATOM 0 HG2 ARG A 536 9.818 11.568 3.618 1.00 1.86 H new ATOM 0 HG3 ARG A 536 11.012 10.582 4.439 1.00 1.86 H new ATOM 0 HD2 ARG A 536 12.787 11.363 2.919 1.00 2.36 H new ATOM 0 HD3 ARG A 536 11.621 12.218 1.929 1.00 2.36 H new ATOM 0 HE ARG A 536 11.253 13.795 3.753 1.00 2.95 H new ATOM 0 HH11 ARG A 536 14.001 11.662 4.469 1.00 3.47 H new ATOM 0 HH12 ARG A 536 14.732 12.887 5.510 1.00 3.47 H new ATOM 0 HH21 ARG A 536 12.278 15.248 4.964 1.00 4.34 H new ATOM 0 HH22 ARG A 536 13.791 14.842 5.780 1.00 4.34 H new ATOM 50 N LYS A 537 8.665 8.824 5.208 1.00 1.34 N ATOM 51 CA LYS A 537 8.522 8.172 6.523 1.00 1.36 C ATOM 52 C LYS A 537 7.441 7.079 6.559 1.00 1.21 C ATOM 53 O LYS A 537 7.580 6.112 7.309 1.00 1.24 O ATOM 54 CB LYS A 537 8.269 9.289 7.542 1.00 1.63 C ATOM 55 CG LYS A 537 7.998 8.792 8.970 1.00 1.86 C ATOM 56 CD LYS A 537 8.117 9.980 9.925 1.00 2.64 C ATOM 57 CE LYS A 537 7.631 9.649 11.344 1.00 3.09 C ATOM 58 NZ LYS A 537 6.173 9.862 11.501 1.00 4.03 N ATOM 0 H LYS A 537 8.188 9.724 5.155 1.00 1.34 H new ATOM 0 HA LYS A 537 9.435 7.627 6.764 1.00 1.36 H new ATOM 0 HB2 LYS A 537 9.134 9.952 7.559 1.00 1.63 H new ATOM 0 HB3 LYS A 537 7.418 9.883 7.209 1.00 1.63 H new ATOM 0 HG2 LYS A 537 7.003 8.351 9.036 1.00 1.86 H new ATOM 0 HG3 LYS A 537 8.711 8.014 9.242 1.00 1.86 H new ATOM 0 HD2 LYS A 537 9.157 10.304 9.968 1.00 2.64 H new ATOM 0 HD3 LYS A 537 7.538 10.816 9.533 1.00 2.64 H new ATOM 0 HE2 LYS A 537 7.872 8.611 11.576 1.00 3.09 H new ATOM 0 HE3 LYS A 537 8.166 10.269 12.063 1.00 3.09 H new ATOM 0 HZ1 LYS A 537 5.890 9.626 12.474 1.00 4.03 H new ATOM 0 HZ2 LYS A 537 5.945 10.858 11.306 1.00 4.03 H new ATOM 0 HZ3 LYS A 537 5.659 9.252 10.834 1.00 4.03 H new ATOM 72 N LEU A 538 6.391 7.211 5.741 1.00 1.16 N ATOM 73 CA LEU A 538 5.232 6.305 5.715 1.00 1.13 C ATOM 74 C LEU A 538 5.493 5.076 4.823 1.00 1.03 C ATOM 75 O LEU A 538 5.334 3.944 5.269 1.00 1.10 O ATOM 76 CB LEU A 538 3.979 7.097 5.267 1.00 1.22 C ATOM 77 CG LEU A 538 2.619 6.620 5.827 1.00 1.38 C ATOM 78 CD1 LEU A 538 2.410 5.107 5.807 1.00 2.85 C ATOM 79 CD2 LEU A 538 2.415 7.095 7.266 1.00 1.64 C ATOM 0 H LEU A 538 6.320 7.968 5.061 1.00 1.16 H new ATOM 0 HA LEU A 538 5.057 5.916 6.718 1.00 1.13 H new ATOM 0 HB2 LEU A 538 4.117 8.140 5.551 1.00 1.22 H new ATOM 0 HB3 LEU A 538 3.928 7.067 4.179 1.00 1.22 H new ATOM 0 HG LEU A 538 1.890 7.064 5.150 1.00 1.38 H new ATOM 0 HD11 LEU A 538 1.429 4.870 6.219 1.00 2.85 H new ATOM 0 HD12 LEU A 538 2.470 4.745 4.781 1.00 2.85 H new ATOM 0 HD13 LEU A 538 3.182 4.625 6.407 1.00 2.85 H new ATOM 0 HD21 LEU A 538 1.450 6.744 7.632 1.00 1.64 H new ATOM 0 HD22 LEU A 538 3.209 6.696 7.897 1.00 1.64 H new ATOM 0 HD23 LEU A 538 2.440 8.184 7.297 1.00 1.64 H new ATOM 91 N VAL A 539 5.967 5.286 3.587 1.00 0.98 N ATOM 92 CA VAL A 539 6.300 4.210 2.627 1.00 0.97 C ATOM 93 C VAL A 539 7.375 3.267 3.196 1.00 1.05 C ATOM 94 O VAL A 539 7.294 2.053 3.042 1.00 1.21 O ATOM 95 CB VAL A 539 6.643 4.824 1.249 1.00 0.88 C ATOM 96 CG1 VAL A 539 8.138 5.036 1.011 1.00 0.85 C ATOM 97 CG2 VAL A 539 6.051 3.960 0.137 1.00 0.96 C ATOM 0 H VAL A 539 6.134 6.221 3.215 1.00 0.98 H new ATOM 0 HA VAL A 539 5.431 3.571 2.467 1.00 0.97 H new ATOM 0 HB VAL A 539 6.198 5.819 1.240 1.00 0.88 H new ATOM 0 HG11 VAL A 539 8.291 5.469 0.023 1.00 0.85 H new ATOM 0 HG12 VAL A 539 8.535 5.711 1.769 1.00 0.85 H new ATOM 0 HG13 VAL A 539 8.655 4.079 1.071 1.00 0.85 H new ATOM 0 HG21 VAL A 539 6.295 4.396 -0.832 1.00 0.96 H new ATOM 0 HG22 VAL A 539 6.467 2.954 0.197 1.00 0.96 H new ATOM 0 HG23 VAL A 539 4.968 3.912 0.251 1.00 0.96 H new ATOM 107 N ALA A 540 8.303 3.818 3.986 1.00 1.03 N ATOM 108 CA ALA A 540 9.324 3.111 4.762 1.00 1.13 C ATOM 109 C ALA A 540 8.784 2.120 5.820 1.00 1.38 C ATOM 110 O ALA A 540 9.561 1.308 6.338 1.00 1.53 O ATOM 111 CB ALA A 540 10.166 4.201 5.434 1.00 1.18 C ATOM 0 H ALA A 540 8.364 4.829 4.107 1.00 1.03 H new ATOM 0 HA ALA A 540 9.894 2.477 4.083 1.00 1.13 H new ATOM 0 HB1 ALA A 540 10.951 3.738 6.032 1.00 1.18 H new ATOM 0 HB2 ALA A 540 10.618 4.834 4.670 1.00 1.18 H new ATOM 0 HB3 ALA A 540 9.529 4.807 6.078 1.00 1.18 H new ATOM 117 N SER A 541 7.487 2.179 6.143 1.00 1.49 N ATOM 118 CA SER A 541 6.830 1.384 7.192 1.00 1.76 C ATOM 119 C SER A 541 6.190 0.097 6.661 1.00 1.90 C ATOM 120 O SER A 541 5.694 -0.732 7.426 1.00 2.18 O ATOM 121 CB SER A 541 5.793 2.236 7.917 1.00 1.83 C ATOM 122 OG SER A 541 5.561 1.741 9.224 1.00 2.73 O ATOM 0 H SER A 541 6.840 2.805 5.664 1.00 1.49 H new ATOM 0 HA SER A 541 7.608 1.074 7.890 1.00 1.76 H new ATOM 0 HB2 SER A 541 6.137 3.269 7.970 1.00 1.83 H new ATOM 0 HB3 SER A 541 4.860 2.239 7.353 1.00 1.83 H new ATOM 0 HG SER A 541 5.522 0.762 9.201 1.00 2.73 H new ATOM 128 N MET A 542 6.216 -0.091 5.338 1.00 1.78 N ATOM 129 CA MET A 542 5.992 -1.363 4.699 1.00 1.81 C ATOM 130 C MET A 542 7.314 -2.160 4.749 1.00 1.78 C ATOM 131 O MET A 542 8.363 -1.603 4.412 1.00 1.83 O ATOM 132 CB MET A 542 5.531 -1.091 3.261 1.00 1.80 C ATOM 133 CG MET A 542 5.132 -2.401 2.599 1.00 2.38 C ATOM 134 SD MET A 542 4.711 -2.336 0.842 1.00 2.81 S ATOM 135 CE MET A 542 3.897 -3.952 0.675 1.00 2.30 C ATOM 0 H MET A 542 6.399 0.665 4.678 1.00 1.78 H new ATOM 0 HA MET A 542 5.223 -1.952 5.198 1.00 1.81 H new ATOM 0 HB2 MET A 542 4.687 -0.401 3.263 1.00 1.80 H new ATOM 0 HB3 MET A 542 6.332 -0.615 2.695 1.00 1.80 H new ATOM 0 HG2 MET A 542 5.952 -3.108 2.725 1.00 2.38 H new ATOM 0 HG3 MET A 542 4.276 -2.806 3.138 1.00 2.38 H new ATOM 0 HE1 MET A 542 3.918 -4.264 -0.369 1.00 2.30 H new ATOM 0 HE2 MET A 542 4.422 -4.688 1.284 1.00 2.30 H new ATOM 0 HE3 MET A 542 2.863 -3.875 1.010 1.00 2.30 H new ATOM 145 N PRO A 543 7.304 -3.460 5.090 1.00 1.75 N ATOM 146 CA PRO A 543 8.520 -4.261 5.284 1.00 1.74 C ATOM 147 C PRO A 543 9.382 -4.393 4.018 1.00 1.68 C ATOM 148 O PRO A 543 10.606 -4.514 4.113 1.00 1.74 O ATOM 149 CB PRO A 543 8.019 -5.621 5.771 1.00 1.91 C ATOM 150 CG PRO A 543 6.630 -5.709 5.140 1.00 2.12 C ATOM 151 CD PRO A 543 6.134 -4.280 5.330 1.00 1.86 C ATOM 0 HA PRO A 543 9.187 -3.779 5.999 1.00 1.74 H new ATOM 0 HB2 PRO A 543 8.666 -6.433 5.441 1.00 1.91 H new ATOM 0 HB3 PRO A 543 7.974 -5.671 6.859 1.00 1.91 H new ATOM 0 HG2 PRO A 543 6.672 -5.995 4.089 1.00 2.12 H new ATOM 0 HG3 PRO A 543 5.994 -6.437 5.643 1.00 2.12 H new ATOM 0 HD2 PRO A 543 5.331 -4.042 4.632 1.00 1.86 H new ATOM 0 HD3 PRO A 543 5.740 -4.126 6.334 1.00 1.86 H new ATOM 159 N LEU A 544 8.775 -4.277 2.829 1.00 1.65 N ATOM 160 CA LEU A 544 9.480 -4.214 1.542 1.00 1.63 C ATOM 161 C LEU A 544 10.427 -2.997 1.427 1.00 1.52 C ATOM 162 O LEU A 544 11.339 -2.997 0.601 1.00 1.60 O ATOM 163 CB LEU A 544 8.457 -4.179 0.388 1.00 1.78 C ATOM 164 CG LEU A 544 7.378 -5.272 0.327 1.00 1.46 C ATOM 165 CD1 LEU A 544 6.589 -5.129 -0.979 1.00 1.53 C ATOM 166 CD2 LEU A 544 7.934 -6.689 0.352 1.00 3.06 C ATOM 0 H LEU A 544 7.761 -4.223 2.733 1.00 1.65 H new ATOM 0 HA LEU A 544 10.099 -5.109 1.479 1.00 1.63 H new ATOM 0 HB2 LEU A 544 7.950 -3.215 0.425 1.00 1.78 H new ATOM 0 HB3 LEU A 544 9.014 -4.211 -0.549 1.00 1.78 H new ATOM 0 HG LEU A 544 6.762 -5.131 1.215 1.00 1.46 H new ATOM 0 HD11 LEU A 544 5.822 -5.902 -1.027 1.00 1.53 H new ATOM 0 HD12 LEU A 544 6.117 -4.147 -1.013 1.00 1.53 H new ATOM 0 HD13 LEU A 544 7.266 -5.236 -1.827 1.00 1.53 H new ATOM 0 HD21 LEU A 544 7.112 -7.403 0.306 1.00 3.06 H new ATOM 0 HD22 LEU A 544 8.592 -6.837 -0.505 1.00 3.06 H new ATOM 0 HD23 LEU A 544 8.497 -6.843 1.273 1.00 3.06 H new ATOM 178 N PHE A 545 10.246 -1.973 2.266 1.00 1.42 N ATOM 179 CA PHE A 545 11.040 -0.742 2.333 1.00 1.34 C ATOM 180 C PHE A 545 11.796 -0.605 3.675 1.00 1.38 C ATOM 181 O PHE A 545 12.403 0.433 3.945 1.00 1.39 O ATOM 182 CB PHE A 545 10.122 0.471 2.132 1.00 1.38 C ATOM 183 CG PHE A 545 9.329 0.593 0.840 1.00 1.33 C ATOM 184 CD1 PHE A 545 8.213 -0.232 0.600 1.00 2.12 C ATOM 185 CD2 PHE A 545 9.587 1.665 -0.033 1.00 2.31 C ATOM 186 CE1 PHE A 545 7.314 0.072 -0.437 1.00 2.17 C ATOM 187 CE2 PHE A 545 8.691 1.974 -1.069 1.00 2.26 C ATOM 188 CZ PHE A 545 7.532 1.201 -1.242 1.00 1.33 C ATOM 0 H PHE A 545 9.497 -1.981 2.958 1.00 1.42 H new ATOM 0 HA PHE A 545 11.787 -0.787 1.540 1.00 1.34 H new ATOM 0 HB2 PHE A 545 9.410 0.484 2.957 1.00 1.38 H new ATOM 0 HB3 PHE A 545 10.736 1.367 2.226 1.00 1.38 H new ATOM 0 HD1 PHE A 545 8.047 -1.103 1.216 1.00 2.12 H new ATOM 0 HD2 PHE A 545 10.482 2.256 0.095 1.00 2.31 H new ATOM 0 HE1 PHE A 545 6.458 -0.562 -0.614 1.00 2.17 H new ATOM 0 HE2 PHE A 545 8.893 2.804 -1.730 1.00 2.26 H new ATOM 0 HZ PHE A 545 6.808 1.475 -1.995 1.00 1.33 H new ATOM 198 N ALA A 546 11.779 -1.631 4.535 1.00 1.48 N ATOM 199 CA ALA A 546 12.412 -1.611 5.860 1.00 1.65 C ATOM 200 C ALA A 546 13.923 -1.381 5.777 1.00 1.57 C ATOM 201 O ALA A 546 14.542 -0.747 6.627 1.00 1.71 O ATOM 202 CB ALA A 546 12.214 -2.988 6.480 1.00 1.79 C ATOM 0 H ALA A 546 11.316 -2.515 4.325 1.00 1.48 H new ATOM 0 HA ALA A 546 11.963 -0.803 6.438 1.00 1.65 H new ATOM 0 HB1 ALA A 546 12.673 -3.011 7.469 1.00 1.79 H new ATOM 0 HB2 ALA A 546 11.148 -3.197 6.570 1.00 1.79 H new ATOM 0 HB3 ALA A 546 12.680 -3.743 5.846 1.00 1.79 H new ATOM 208 N ASN A 547 14.501 -1.939 4.721 1.00 1.40 N ATOM 209 CA ASN A 547 15.916 -2.145 4.493 1.00 1.33 C ATOM 210 C ASN A 547 16.402 -1.331 3.276 1.00 1.12 C ATOM 211 O ASN A 547 17.513 -1.520 2.782 1.00 1.16 O ATOM 212 CB ASN A 547 16.064 -3.671 4.375 1.00 1.60 C ATOM 213 CG ASN A 547 16.131 -4.329 5.733 1.00 2.18 C ATOM 214 OD1 ASN A 547 17.134 -4.249 6.430 1.00 2.96 O ATOM 215 ND2 ASN A 547 15.073 -4.966 6.158 1.00 2.50 N ATOM 0 H ASN A 547 13.942 -2.286 3.941 1.00 1.40 H new ATOM 0 HA ASN A 547 16.557 -1.780 5.295 1.00 1.33 H new ATOM 0 HB2 ASN A 547 15.222 -4.077 3.814 1.00 1.60 H new ATOM 0 HB3 ASN A 547 16.966 -3.907 3.811 1.00 1.60 H new ATOM 0 HD21 ASN A 547 15.077 -5.403 7.080 1.00 2.50 H new ATOM 0 HD22 ASN A 547 14.243 -5.026 5.568 1.00 2.50 H new ATOM 222 N ALA A 548 15.559 -0.414 2.794 1.00 1.05 N ATOM 223 CA ALA A 548 15.779 0.386 1.590 1.00 0.97 C ATOM 224 C ALA A 548 16.831 1.509 1.735 1.00 0.93 C ATOM 225 O ALA A 548 17.082 2.028 2.829 1.00 0.97 O ATOM 226 CB ALA A 548 14.426 0.957 1.152 1.00 1.05 C ATOM 0 H ALA A 548 14.672 -0.202 3.250 1.00 1.05 H new ATOM 0 HA ALA A 548 16.202 -0.275 0.834 1.00 0.97 H new ATOM 0 HB1 ALA A 548 14.559 1.560 0.254 1.00 1.05 H new ATOM 0 HB2 ALA A 548 13.737 0.139 0.941 1.00 1.05 H new ATOM 0 HB3 ALA A 548 14.018 1.579 1.949 1.00 1.05 H new ATOM 232 N ASP A 549 17.397 1.930 0.598 1.00 0.91 N ATOM 233 CA ASP A 549 18.125 3.199 0.455 1.00 0.91 C ATOM 234 C ASP A 549 17.123 4.375 0.458 1.00 0.86 C ATOM 235 O ASP A 549 16.173 4.354 -0.331 1.00 0.81 O ATOM 236 CB ASP A 549 18.942 3.163 -0.850 1.00 0.94 C ATOM 237 CG ASP A 549 19.802 4.414 -1.067 1.00 1.10 C ATOM 238 OD1 ASP A 549 19.233 5.497 -1.327 1.00 2.13 O ATOM 239 OD2 ASP A 549 21.052 4.318 -0.992 1.00 1.68 O ATOM 0 H ASP A 549 17.362 1.389 -0.266 1.00 0.91 H new ATOM 0 HA ASP A 549 18.810 3.339 1.291 1.00 0.91 H new ATOM 0 HB2 ASP A 549 19.588 2.285 -0.841 1.00 0.94 H new ATOM 0 HB3 ASP A 549 18.261 3.049 -1.693 1.00 0.94 H new ATOM 244 N PRO A 550 17.294 5.409 1.304 1.00 0.95 N ATOM 245 CA PRO A 550 16.284 6.455 1.515 1.00 1.00 C ATOM 246 C PRO A 550 15.991 7.310 0.266 1.00 0.98 C ATOM 247 O PRO A 550 14.953 7.970 0.181 1.00 1.08 O ATOM 248 CB PRO A 550 16.840 7.312 2.658 1.00 1.17 C ATOM 249 CG PRO A 550 18.350 7.139 2.518 1.00 1.19 C ATOM 250 CD PRO A 550 18.470 5.674 2.119 1.00 1.08 C ATOM 0 HA PRO A 550 15.319 6.004 1.748 1.00 1.00 H new ATOM 0 HB2 PRO A 550 16.543 8.356 2.560 1.00 1.17 H new ATOM 0 HB3 PRO A 550 16.483 6.969 3.629 1.00 1.17 H new ATOM 0 HG2 PRO A 550 18.767 7.803 1.761 1.00 1.19 H new ATOM 0 HG3 PRO A 550 18.872 7.351 3.451 1.00 1.19 H new ATOM 0 HD2 PRO A 550 19.387 5.491 1.560 1.00 1.08 H new ATOM 0 HD3 PRO A 550 18.497 5.027 2.996 1.00 1.08 H new ATOM 258 N ASN A 551 16.871 7.280 -0.734 1.00 0.91 N ATOM 259 CA ASN A 551 16.719 8.034 -1.976 1.00 0.90 C ATOM 260 C ASN A 551 16.013 7.207 -3.055 1.00 0.81 C ATOM 261 O ASN A 551 15.204 7.754 -3.799 1.00 0.88 O ATOM 262 CB ASN A 551 18.084 8.557 -2.429 1.00 1.05 C ATOM 263 CG ASN A 551 18.791 9.368 -1.358 1.00 1.34 C ATOM 264 OD1 ASN A 551 19.862 9.021 -0.878 1.00 1.48 O ATOM 265 ND2 ASN A 551 18.207 10.461 -0.933 1.00 3.04 N ATOM 0 H ASN A 551 17.724 6.721 -0.702 1.00 0.91 H new ATOM 0 HA ASN A 551 16.074 8.894 -1.795 1.00 0.90 H new ATOM 0 HB2 ASN A 551 18.714 7.714 -2.715 1.00 1.05 H new ATOM 0 HB3 ASN A 551 17.954 9.174 -3.318 1.00 1.05 H new ATOM 0 HD21 ASN A 551 18.645 11.022 -0.202 1.00 3.04 H new ATOM 0 HD22 ASN A 551 17.314 10.751 -1.333 1.00 3.04 H new ATOM 272 N PHE A 552 16.223 5.885 -3.074 1.00 0.77 N ATOM 273 CA PHE A 552 15.397 4.952 -3.854 1.00 0.77 C ATOM 274 C PHE A 552 13.922 5.047 -3.431 1.00 0.76 C ATOM 275 O PHE A 552 13.045 5.191 -4.284 1.00 0.79 O ATOM 276 CB PHE A 552 15.950 3.524 -3.694 1.00 0.83 C ATOM 277 CG PHE A 552 14.979 2.403 -4.018 1.00 0.88 C ATOM 278 CD1 PHE A 552 14.699 2.050 -5.351 1.00 2.28 C ATOM 279 CD2 PHE A 552 14.336 1.715 -2.971 1.00 1.48 C ATOM 280 CE1 PHE A 552 13.785 1.019 -5.632 1.00 2.35 C ATOM 281 CE2 PHE A 552 13.420 0.687 -3.249 1.00 1.52 C ATOM 282 CZ PHE A 552 13.145 0.338 -4.582 1.00 1.08 C ATOM 0 H PHE A 552 16.970 5.431 -2.549 1.00 0.77 H new ATOM 0 HA PHE A 552 15.442 5.220 -4.910 1.00 0.77 H new ATOM 0 HB2 PHE A 552 16.825 3.419 -4.335 1.00 0.83 H new ATOM 0 HB3 PHE A 552 16.291 3.399 -2.666 1.00 0.83 H new ATOM 0 HD1 PHE A 552 15.187 2.572 -6.160 1.00 2.28 H new ATOM 0 HD2 PHE A 552 14.549 1.980 -1.946 1.00 1.48 H new ATOM 0 HE1 PHE A 552 13.574 0.750 -6.656 1.00 2.35 H new ATOM 0 HE2 PHE A 552 12.928 0.166 -2.440 1.00 1.52 H new ATOM 0 HZ PHE A 552 12.442 -0.453 -4.800 1.00 1.08 H new ATOM 292 N VAL A 553 13.637 5.055 -2.119 1.00 0.77 N ATOM 293 CA VAL A 553 12.235 5.136 -1.641 1.00 0.86 C ATOM 294 C VAL A 553 11.572 6.475 -1.964 1.00 0.91 C ATOM 295 O VAL A 553 10.388 6.534 -2.277 1.00 1.06 O ATOM 296 CB VAL A 553 12.057 4.810 -0.149 1.00 0.95 C ATOM 297 CG1 VAL A 553 12.866 3.577 0.213 1.00 1.50 C ATOM 298 CG2 VAL A 553 12.462 5.871 0.867 1.00 1.28 C ATOM 0 H VAL A 553 14.337 5.008 -1.379 1.00 0.77 H new ATOM 0 HA VAL A 553 11.726 4.353 -2.203 1.00 0.86 H new ATOM 0 HB VAL A 553 10.976 4.696 -0.072 1.00 0.95 H new ATOM 0 HG11 VAL A 553 12.734 3.353 1.272 1.00 1.50 H new ATOM 0 HG12 VAL A 553 12.525 2.730 -0.382 1.00 1.50 H new ATOM 0 HG13 VAL A 553 13.921 3.761 0.010 1.00 1.50 H new ATOM 0 HG21 VAL A 553 12.279 5.498 1.875 1.00 1.28 H new ATOM 0 HG22 VAL A 553 13.521 6.100 0.751 1.00 1.28 H new ATOM 0 HG23 VAL A 553 11.875 6.775 0.703 1.00 1.28 H new ATOM 308 N THR A 554 12.357 7.549 -1.927 1.00 0.83 N ATOM 309 CA THR A 554 11.935 8.925 -2.222 1.00 0.90 C ATOM 310 C THR A 554 11.749 9.162 -3.719 1.00 0.89 C ATOM 311 O THR A 554 10.817 9.863 -4.126 1.00 0.97 O ATOM 312 CB THR A 554 12.958 9.925 -1.670 1.00 0.97 C ATOM 313 OG1 THR A 554 13.041 9.817 -0.263 1.00 1.02 O ATOM 314 CG2 THR A 554 12.568 11.363 -1.999 1.00 1.09 C ATOM 0 H THR A 554 13.345 7.487 -1.681 1.00 0.83 H new ATOM 0 HA THR A 554 10.971 9.075 -1.736 1.00 0.90 H new ATOM 0 HB THR A 554 13.915 9.688 -2.135 1.00 0.97 H new ATOM 0 HG1 THR A 554 13.874 9.362 -0.018 1.00 1.02 H new ATOM 0 HG21 THR A 554 13.315 12.045 -1.593 1.00 1.09 H new ATOM 0 HG22 THR A 554 12.514 11.487 -3.081 1.00 1.09 H new ATOM 0 HG23 THR A 554 11.596 11.586 -1.559 1.00 1.09 H new ATOM 322 N ALA A 555 12.575 8.546 -4.569 1.00 0.82 N ATOM 323 CA ALA A 555 12.425 8.665 -6.015 1.00 0.85 C ATOM 324 C ALA A 555 11.090 8.067 -6.496 1.00 0.81 C ATOM 325 O ALA A 555 10.594 8.405 -7.567 1.00 0.90 O ATOM 326 CB ALA A 555 13.623 7.993 -6.699 1.00 0.85 C ATOM 0 H ALA A 555 13.356 7.959 -4.276 1.00 0.82 H new ATOM 0 HA ALA A 555 12.406 9.721 -6.286 1.00 0.85 H new ATOM 0 HB1 ALA A 555 13.519 8.077 -7.781 1.00 0.85 H new ATOM 0 HB2 ALA A 555 14.544 8.483 -6.384 1.00 0.85 H new ATOM 0 HB3 ALA A 555 13.658 6.940 -6.419 1.00 0.85 H new ATOM 332 N MET A 556 10.478 7.207 -5.676 1.00 0.72 N ATOM 333 CA MET A 556 9.196 6.553 -5.945 1.00 0.75 C ATOM 334 C MET A 556 7.964 7.450 -5.727 1.00 0.77 C ATOM 335 O MET A 556 6.865 7.088 -6.144 1.00 0.83 O ATOM 336 CB MET A 556 9.141 5.317 -5.044 1.00 0.84 C ATOM 337 CG MET A 556 8.304 4.190 -5.644 1.00 0.98 C ATOM 338 SD MET A 556 8.350 2.653 -4.688 1.00 1.09 S ATOM 339 CE MET A 556 10.129 2.450 -4.353 1.00 0.81 C ATOM 0 H MET A 556 10.876 6.939 -4.776 1.00 0.72 H new ATOM 0 HA MET A 556 9.150 6.296 -7.003 1.00 0.75 H new ATOM 0 HB2 MET A 556 10.154 4.957 -4.865 1.00 0.84 H new ATOM 0 HB3 MET A 556 8.727 5.596 -4.075 1.00 0.84 H new ATOM 0 HG2 MET A 556 7.270 4.524 -5.727 1.00 0.98 H new ATOM 0 HG3 MET A 556 8.656 3.988 -6.656 1.00 0.98 H new ATOM 0 HE1 MET A 556 10.363 1.390 -4.258 1.00 0.81 H new ATOM 0 HE2 MET A 556 10.705 2.877 -5.174 1.00 0.81 H new ATOM 0 HE3 MET A 556 10.385 2.962 -3.426 1.00 0.81 H new ATOM 349 N LEU A 557 8.122 8.613 -5.085 1.00 0.87 N ATOM 350 CA LEU A 557 7.016 9.466 -4.625 1.00 0.92 C ATOM 351 C LEU A 557 6.551 10.522 -5.650 1.00 1.04 C ATOM 352 O LEU A 557 5.436 11.033 -5.540 1.00 1.14 O ATOM 353 CB LEU A 557 7.440 10.129 -3.298 1.00 0.98 C ATOM 354 CG LEU A 557 7.948 9.153 -2.218 1.00 0.94 C ATOM 355 CD1 LEU A 557 8.329 9.905 -0.946 1.00 1.03 C ATOM 356 CD2 LEU A 557 6.916 8.080 -1.870 1.00 0.93 C ATOM 0 H LEU A 557 9.041 8.997 -4.865 1.00 0.87 H new ATOM 0 HA LEU A 557 6.145 8.825 -4.485 1.00 0.92 H new ATOM 0 HB2 LEU A 557 8.224 10.857 -3.507 1.00 0.98 H new ATOM 0 HB3 LEU A 557 6.590 10.682 -2.897 1.00 0.98 H new ATOM 0 HG LEU A 557 8.825 8.660 -2.637 1.00 0.94 H new ATOM 0 HD11 LEU A 557 8.685 9.197 -0.197 1.00 1.03 H new ATOM 0 HD12 LEU A 557 9.118 10.623 -1.170 1.00 1.03 H new ATOM 0 HD13 LEU A 557 7.457 10.433 -0.560 1.00 1.03 H new ATOM 0 HD21 LEU A 557 7.323 7.418 -1.105 1.00 0.93 H new ATOM 0 HD22 LEU A 557 6.010 8.555 -1.494 1.00 0.93 H new ATOM 0 HD23 LEU A 557 6.679 7.500 -2.762 1.00 0.93 H new ATOM 368 N THR A 558 7.371 10.851 -6.652 1.00 1.08 N ATOM 369 CA THR A 558 7.189 12.016 -7.550 1.00 1.20 C ATOM 370 C THR A 558 5.839 12.077 -8.296 1.00 1.18 C ATOM 371 O THR A 558 5.309 13.176 -8.491 1.00 1.29 O ATOM 372 CB THR A 558 8.387 12.134 -8.514 1.00 1.33 C ATOM 373 OG1 THR A 558 8.267 13.247 -9.374 1.00 2.43 O ATOM 374 CG2 THR A 558 8.582 10.908 -9.406 1.00 3.08 C ATOM 0 H THR A 558 8.204 10.306 -6.874 1.00 1.08 H new ATOM 0 HA THR A 558 7.156 12.888 -6.896 1.00 1.20 H new ATOM 0 HB THR A 558 9.245 12.239 -7.850 1.00 1.33 H new ATOM 0 HG1 THR A 558 9.046 13.287 -9.967 1.00 2.43 H new ATOM 0 HG21 THR A 558 9.443 11.064 -10.056 1.00 3.08 H new ATOM 0 HG22 THR A 558 8.752 10.029 -8.784 1.00 3.08 H new ATOM 0 HG23 THR A 558 7.691 10.755 -10.014 1.00 3.08 H new ATOM 382 N LYS A 559 5.210 10.940 -8.639 1.00 1.15 N ATOM 383 CA LYS A 559 3.849 10.874 -9.227 1.00 1.16 C ATOM 384 C LYS A 559 2.806 10.168 -8.349 1.00 1.13 C ATOM 385 O LYS A 559 1.673 9.978 -8.795 1.00 1.25 O ATOM 386 CB LYS A 559 3.899 10.269 -10.645 1.00 1.39 C ATOM 387 CG LYS A 559 4.387 8.807 -10.673 1.00 1.67 C ATOM 388 CD LYS A 559 3.534 7.876 -11.545 1.00 2.18 C ATOM 389 CE LYS A 559 2.243 7.472 -10.819 1.00 2.38 C ATOM 390 NZ LYS A 559 1.472 6.458 -11.573 1.00 3.09 N ATOM 0 H LYS A 559 5.636 10.021 -8.516 1.00 1.15 H new ATOM 0 HA LYS A 559 3.504 11.906 -9.289 1.00 1.16 H new ATOM 0 HB2 LYS A 559 2.905 10.320 -11.089 1.00 1.39 H new ATOM 0 HB3 LYS A 559 4.557 10.875 -11.267 1.00 1.39 H new ATOM 0 HG2 LYS A 559 5.415 8.786 -11.036 1.00 1.67 H new ATOM 0 HG3 LYS A 559 4.401 8.421 -9.654 1.00 1.67 H new ATOM 0 HD2 LYS A 559 3.287 8.375 -12.482 1.00 2.18 H new ATOM 0 HD3 LYS A 559 4.107 6.984 -11.799 1.00 2.18 H new ATOM 0 HE2 LYS A 559 2.490 7.079 -9.833 1.00 2.38 H new ATOM 0 HE3 LYS A 559 1.624 8.355 -10.664 1.00 2.38 H new ATOM 0 HZ1 LYS A 559 0.569 6.278 -11.089 1.00 3.09 H new ATOM 0 HZ2 LYS A 559 1.285 6.808 -12.534 1.00 3.09 H new ATOM 0 HZ3 LYS A 559 2.019 5.575 -11.626 1.00 3.09 H new ATOM 404 N LEU A 560 3.176 9.760 -7.134 1.00 1.14 N ATOM 405 CA LEU A 560 2.344 8.951 -6.239 1.00 1.15 C ATOM 406 C LEU A 560 1.186 9.794 -5.675 1.00 0.94 C ATOM 407 O LEU A 560 1.322 11.011 -5.506 1.00 1.12 O ATOM 408 CB LEU A 560 3.262 8.172 -5.256 1.00 1.80 C ATOM 409 CG LEU A 560 3.195 8.287 -3.715 1.00 0.92 C ATOM 410 CD1 LEU A 560 3.227 9.700 -3.134 1.00 2.42 C ATOM 411 CD2 LEU A 560 2.013 7.536 -3.115 1.00 1.45 C ATOM 0 H LEU A 560 4.086 9.989 -6.734 1.00 1.14 H new ATOM 0 HA LEU A 560 1.805 8.156 -6.754 1.00 1.15 H new ATOM 0 HB2 LEU A 560 3.122 7.116 -5.486 1.00 1.80 H new ATOM 0 HB3 LEU A 560 4.285 8.426 -5.533 1.00 1.80 H new ATOM 0 HG LEU A 560 4.133 7.816 -3.422 1.00 0.92 H new ATOM 0 HD11 LEU A 560 3.174 9.648 -2.047 1.00 2.42 H new ATOM 0 HD12 LEU A 560 4.153 10.194 -3.429 1.00 2.42 H new ATOM 0 HD13 LEU A 560 2.377 10.268 -3.512 1.00 2.42 H new ATOM 0 HD21 LEU A 560 2.019 7.654 -2.031 1.00 1.45 H new ATOM 0 HD22 LEU A 560 1.084 7.938 -3.518 1.00 1.45 H new ATOM 0 HD23 LEU A 560 2.089 6.478 -3.366 1.00 1.45 H new ATOM 423 N LYS A 561 0.023 9.171 -5.455 1.00 0.81 N ATOM 424 CA LYS A 561 -1.255 9.872 -5.233 1.00 0.81 C ATOM 425 C LYS A 561 -1.918 9.531 -3.897 1.00 0.76 C ATOM 426 O LYS A 561 -1.893 8.387 -3.453 1.00 0.77 O ATOM 427 CB LYS A 561 -2.201 9.572 -6.410 1.00 1.03 C ATOM 428 CG LYS A 561 -3.329 10.605 -6.578 1.00 1.32 C ATOM 429 CD LYS A 561 -3.022 11.733 -7.578 1.00 1.94 C ATOM 430 CE LYS A 561 -1.681 12.436 -7.328 1.00 2.04 C ATOM 431 NZ LYS A 561 -1.539 13.637 -8.178 1.00 2.72 N ATOM 0 H LYS A 561 -0.063 8.155 -5.425 1.00 0.81 H new ATOM 0 HA LYS A 561 -1.039 10.939 -5.183 1.00 0.81 H new ATOM 0 HB2 LYS A 561 -1.619 9.530 -7.331 1.00 1.03 H new ATOM 0 HB3 LYS A 561 -2.642 8.586 -6.267 1.00 1.03 H new ATOM 0 HG2 LYS A 561 -4.232 10.087 -6.901 1.00 1.32 H new ATOM 0 HG3 LYS A 561 -3.545 11.048 -5.606 1.00 1.32 H new ATOM 0 HD2 LYS A 561 -3.023 11.321 -8.587 1.00 1.94 H new ATOM 0 HD3 LYS A 561 -3.822 12.472 -7.535 1.00 1.94 H new ATOM 0 HE2 LYS A 561 -1.607 12.720 -6.278 1.00 2.04 H new ATOM 0 HE3 LYS A 561 -0.862 11.745 -7.530 1.00 2.04 H new ATOM 0 HZ1 LYS A 561 -0.623 14.091 -7.987 1.00 2.72 H new ATOM 0 HZ2 LYS A 561 -1.586 13.361 -9.180 1.00 2.72 H new ATOM 0 HZ3 LYS A 561 -2.307 14.305 -7.966 1.00 2.72 H new ATOM 445 N PHE A 562 -2.543 10.525 -3.274 1.00 0.99 N ATOM 446 CA PHE A 562 -3.358 10.379 -2.066 1.00 0.97 C ATOM 447 C PHE A 562 -4.862 10.246 -2.386 1.00 0.95 C ATOM 448 O PHE A 562 -5.325 10.766 -3.403 1.00 1.00 O ATOM 449 CB PHE A 562 -2.997 11.508 -1.084 1.00 1.10 C ATOM 450 CG PHE A 562 -4.091 12.509 -0.778 1.00 0.96 C ATOM 451 CD1 PHE A 562 -4.289 13.634 -1.598 1.00 1.77 C ATOM 452 CD2 PHE A 562 -4.892 12.326 0.362 1.00 2.45 C ATOM 453 CE1 PHE A 562 -5.278 14.580 -1.269 1.00 1.78 C ATOM 454 CE2 PHE A 562 -5.869 13.276 0.699 1.00 2.59 C ATOM 455 CZ PHE A 562 -6.066 14.403 -0.119 1.00 1.29 C ATOM 0 H PHE A 562 -2.496 11.489 -3.605 1.00 0.99 H new ATOM 0 HA PHE A 562 -3.127 9.437 -1.569 1.00 0.97 H new ATOM 0 HB2 PHE A 562 -2.676 11.055 -0.146 1.00 1.10 H new ATOM 0 HB3 PHE A 562 -2.141 12.050 -1.486 1.00 1.10 H new ATOM 0 HD1 PHE A 562 -3.682 13.772 -2.481 1.00 1.77 H new ATOM 0 HD2 PHE A 562 -4.755 11.452 0.981 1.00 2.45 H new ATOM 0 HE1 PHE A 562 -5.431 15.442 -1.901 1.00 1.78 H new ATOM 0 HE2 PHE A 562 -6.469 13.141 1.587 1.00 2.59 H new ATOM 0 HZ PHE A 562 -6.822 15.131 0.136 1.00 1.29 H new ATOM 465 N GLU A 563 -5.639 9.561 -1.534 1.00 0.93 N ATOM 466 CA GLU A 563 -7.113 9.469 -1.682 1.00 0.90 C ATOM 467 C GLU A 563 -7.838 9.422 -0.317 1.00 0.88 C ATOM 468 O GLU A 563 -7.255 9.021 0.685 1.00 0.93 O ATOM 469 CB GLU A 563 -7.477 8.282 -2.609 1.00 0.84 C ATOM 470 CG GLU A 563 -8.996 8.093 -2.786 1.00 1.66 C ATOM 471 CD GLU A 563 -9.443 7.353 -4.057 1.00 1.88 C ATOM 472 OE1 GLU A 563 -8.673 6.574 -4.671 1.00 2.32 O ATOM 473 OE2 GLU A 563 -10.635 7.506 -4.429 1.00 3.06 O ATOM 0 H GLU A 563 -5.274 9.056 -0.726 1.00 0.93 H new ATOM 0 HA GLU A 563 -7.472 10.381 -2.159 1.00 0.90 H new ATOM 0 HB2 GLU A 563 -7.021 8.440 -3.586 1.00 0.84 H new ATOM 0 HB3 GLU A 563 -7.049 7.366 -2.201 1.00 0.84 H new ATOM 0 HG2 GLU A 563 -9.377 7.550 -1.921 1.00 1.66 H new ATOM 0 HG3 GLU A 563 -9.467 9.076 -2.778 1.00 1.66 H new ATOM 480 N VAL A 564 -9.107 9.845 -0.250 1.00 0.88 N ATOM 481 CA VAL A 564 -9.907 9.949 0.991 1.00 0.88 C ATOM 482 C VAL A 564 -11.204 9.140 0.920 1.00 0.93 C ATOM 483 O VAL A 564 -11.845 9.045 -0.131 1.00 0.98 O ATOM 484 CB VAL A 564 -10.233 11.421 1.316 1.00 0.88 C ATOM 485 CG1 VAL A 564 -10.899 11.624 2.676 1.00 0.96 C ATOM 486 CG2 VAL A 564 -8.970 12.281 1.341 1.00 0.87 C ATOM 0 H VAL A 564 -9.626 10.134 -1.079 1.00 0.88 H new ATOM 0 HA VAL A 564 -9.294 9.529 1.788 1.00 0.88 H new ATOM 0 HB VAL A 564 -10.920 11.716 0.522 1.00 0.88 H new ATOM 0 HG11 VAL A 564 -11.096 12.685 2.830 1.00 0.96 H new ATOM 0 HG12 VAL A 564 -11.839 11.072 2.707 1.00 0.96 H new ATOM 0 HG13 VAL A 564 -10.238 11.260 3.463 1.00 0.96 H new ATOM 0 HG21 VAL A 564 -9.236 13.312 1.573 1.00 0.87 H new ATOM 0 HG22 VAL A 564 -8.287 11.903 2.102 1.00 0.87 H new ATOM 0 HG23 VAL A 564 -8.484 12.242 0.366 1.00 0.87 H new ATOM 496 N PHE A 565 -11.634 8.619 2.069 1.00 0.96 N ATOM 497 CA PHE A 565 -12.941 7.993 2.293 1.00 1.05 C ATOM 498 C PHE A 565 -13.591 8.513 3.588 1.00 1.14 C ATOM 499 O PHE A 565 -12.902 9.010 4.478 1.00 1.07 O ATOM 500 CB PHE A 565 -12.771 6.472 2.282 1.00 1.02 C ATOM 501 CG PHE A 565 -12.300 5.928 0.942 1.00 0.93 C ATOM 502 CD1 PHE A 565 -10.923 5.823 0.654 1.00 2.18 C ATOM 503 CD2 PHE A 565 -13.247 5.515 -0.015 1.00 1.92 C ATOM 504 CE1 PHE A 565 -10.504 5.271 -0.570 1.00 2.07 C ATOM 505 CE2 PHE A 565 -12.824 4.960 -1.236 1.00 2.00 C ATOM 506 CZ PHE A 565 -11.451 4.819 -1.502 1.00 0.85 C ATOM 0 H PHE A 565 -11.055 8.621 2.909 1.00 0.96 H new ATOM 0 HA PHE A 565 -13.626 8.263 1.489 1.00 1.05 H new ATOM 0 HB2 PHE A 565 -12.055 6.188 3.053 1.00 1.02 H new ATOM 0 HB3 PHE A 565 -13.721 6.005 2.542 1.00 1.02 H new ATOM 0 HD1 PHE A 565 -10.192 6.166 1.372 1.00 2.18 H new ATOM 0 HD2 PHE A 565 -14.302 5.625 0.189 1.00 1.92 H new ATOM 0 HE1 PHE A 565 -9.450 5.195 -0.793 1.00 2.07 H new ATOM 0 HE2 PHE A 565 -13.552 4.643 -1.968 1.00 2.00 H new ATOM 0 HZ PHE A 565 -11.124 4.362 -2.425 1.00 0.85 H new ATOM 516 N GLN A 566 -14.919 8.448 3.682 1.00 1.34 N ATOM 517 CA GLN A 566 -15.733 9.079 4.738 1.00 1.37 C ATOM 518 C GLN A 566 -16.710 8.077 5.400 1.00 1.12 C ATOM 519 O GLN A 566 -16.897 6.979 4.865 1.00 1.08 O ATOM 520 CB GLN A 566 -16.410 10.314 4.116 1.00 1.67 C ATOM 521 CG GLN A 566 -15.493 11.532 4.314 1.00 2.79 C ATOM 522 CD GLN A 566 -15.724 12.618 3.281 1.00 2.05 C ATOM 523 OE1 GLN A 566 -16.451 13.578 3.490 1.00 3.25 O ATOM 524 NE2 GLN A 566 -15.108 12.527 2.129 1.00 1.14 N ATOM 0 H GLN A 566 -15.484 7.938 3.004 1.00 1.34 H new ATOM 0 HA GLN A 566 -15.109 9.407 5.570 1.00 1.37 H new ATOM 0 HB2 GLN A 566 -16.595 10.149 3.055 1.00 1.67 H new ATOM 0 HB3 GLN A 566 -17.378 10.490 4.585 1.00 1.67 H new ATOM 0 HG2 GLN A 566 -15.655 11.944 5.310 1.00 2.79 H new ATOM 0 HG3 GLN A 566 -14.453 11.209 4.268 1.00 2.79 H new ATOM 0 HE21 GLN A 566 -14.498 11.732 1.938 1.00 1.14 H new ATOM 0 HE22 GLN A 566 -15.239 13.251 1.422 1.00 1.14 H new ATOM 533 N PRO A 567 -17.310 8.400 6.570 1.00 1.14 N ATOM 534 CA PRO A 567 -17.971 7.413 7.431 1.00 1.16 C ATOM 535 C PRO A 567 -19.082 6.614 6.723 1.00 1.17 C ATOM 536 O PRO A 567 -20.135 7.161 6.380 1.00 1.39 O ATOM 537 CB PRO A 567 -18.512 8.184 8.646 1.00 1.21 C ATOM 538 CG PRO A 567 -17.811 9.542 8.629 1.00 1.21 C ATOM 539 CD PRO A 567 -17.276 9.710 7.212 1.00 1.24 C ATOM 0 HA PRO A 567 -17.249 6.652 7.728 1.00 1.16 H new ATOM 0 HB2 PRO A 567 -19.594 8.302 8.583 1.00 1.21 H new ATOM 0 HB3 PRO A 567 -18.303 7.649 9.572 1.00 1.21 H new ATOM 0 HG2 PRO A 567 -18.504 10.344 8.884 1.00 1.21 H new ATOM 0 HG3 PRO A 567 -17.003 9.575 9.360 1.00 1.21 H new ATOM 0 HD2 PRO A 567 -17.882 10.425 6.656 1.00 1.24 H new ATOM 0 HD3 PRO A 567 -16.259 10.101 7.230 1.00 1.24 H new ATOM 547 N GLY A 568 -18.853 5.311 6.529 1.00 1.02 N ATOM 548 CA GLY A 568 -19.782 4.365 5.899 1.00 1.09 C ATOM 549 C GLY A 568 -19.412 3.965 4.468 1.00 1.14 C ATOM 550 O GLY A 568 -20.068 3.089 3.902 1.00 1.35 O ATOM 0 H GLY A 568 -17.981 4.868 6.818 1.00 1.02 H new ATOM 0 HA2 GLY A 568 -19.834 3.465 6.512 1.00 1.09 H new ATOM 0 HA3 GLY A 568 -20.779 4.805 5.893 1.00 1.09 H new ATOM 554 N ASP A 569 -18.377 4.564 3.865 1.00 1.04 N ATOM 555 CA ASP A 569 -18.011 4.315 2.471 1.00 1.09 C ATOM 556 C ASP A 569 -16.954 3.203 2.329 1.00 1.03 C ATOM 557 O ASP A 569 -15.916 3.206 2.998 1.00 0.98 O ATOM 558 CB ASP A 569 -17.616 5.630 1.774 1.00 1.17 C ATOM 559 CG ASP A 569 -17.909 5.662 0.266 1.00 1.34 C ATOM 560 OD1 ASP A 569 -18.341 4.639 -0.325 1.00 1.36 O ATOM 561 OD2 ASP A 569 -17.754 6.753 -0.334 1.00 2.39 O ATOM 0 H ASP A 569 -17.770 5.236 4.334 1.00 1.04 H new ATOM 0 HA ASP A 569 -18.890 3.931 1.953 1.00 1.09 H new ATOM 0 HB2 ASP A 569 -18.146 6.454 2.252 1.00 1.17 H new ATOM 0 HB3 ASP A 569 -16.551 5.803 1.929 1.00 1.17 H new ATOM 566 N TYR A 570 -17.235 2.236 1.456 1.00 1.08 N ATOM 567 CA TYR A 570 -16.393 1.064 1.183 1.00 1.04 C ATOM 568 C TYR A 570 -15.180 1.421 0.319 1.00 0.92 C ATOM 569 O TYR A 570 -15.324 2.084 -0.712 1.00 1.08 O ATOM 570 CB TYR A 570 -17.224 -0.048 0.535 1.00 1.21 C ATOM 571 CG TYR A 570 -18.046 -0.844 1.529 1.00 1.31 C ATOM 572 CD1 TYR A 570 -19.169 -0.270 2.158 1.00 2.64 C ATOM 573 CD2 TYR A 570 -17.662 -2.159 1.853 1.00 1.70 C ATOM 574 CE1 TYR A 570 -19.901 -1.006 3.107 1.00 2.73 C ATOM 575 CE2 TYR A 570 -18.403 -2.903 2.786 1.00 1.83 C ATOM 576 CZ TYR A 570 -19.519 -2.326 3.424 1.00 1.64 C ATOM 577 OH TYR A 570 -20.220 -3.041 4.339 1.00 1.84 O ATOM 0 H TYR A 570 -18.088 2.245 0.896 1.00 1.08 H new ATOM 0 HA TYR A 570 -16.008 0.701 2.136 1.00 1.04 H new ATOM 0 HB2 TYR A 570 -17.891 0.392 -0.206 1.00 1.21 H new ATOM 0 HB3 TYR A 570 -16.557 -0.725 0.001 1.00 1.21 H new ATOM 0 HD1 TYR A 570 -19.468 0.738 1.911 1.00 2.64 H new ATOM 0 HD2 TYR A 570 -16.794 -2.597 1.382 1.00 1.70 H new ATOM 0 HE1 TYR A 570 -20.756 -0.560 3.593 1.00 2.73 H new ATOM 0 HE2 TYR A 570 -18.117 -3.919 3.015 1.00 1.83 H new ATOM 0 HH TYR A 570 -19.820 -3.931 4.435 1.00 1.84 H new ATOM 587 N ILE A 571 -13.985 0.974 0.719 1.00 0.75 N ATOM 588 CA ILE A 571 -12.734 1.533 0.190 1.00 0.73 C ATOM 589 C ILE A 571 -12.081 0.701 -0.937 1.00 0.79 C ATOM 590 O ILE A 571 -11.456 1.273 -1.831 1.00 0.89 O ATOM 591 CB ILE A 571 -11.760 1.832 1.348 1.00 0.72 C ATOM 592 CG1 ILE A 571 -11.324 0.554 2.075 1.00 0.73 C ATOM 593 CG2 ILE A 571 -12.362 2.778 2.401 1.00 0.77 C ATOM 594 CD1 ILE A 571 -9.999 0.727 2.780 1.00 0.93 C ATOM 0 H ILE A 571 -13.856 0.230 1.405 1.00 0.75 H new ATOM 0 HA ILE A 571 -12.995 2.469 -0.303 1.00 0.73 H new ATOM 0 HB ILE A 571 -10.903 2.310 0.875 1.00 0.72 H new ATOM 0 HG12 ILE A 571 -12.087 0.272 2.801 1.00 0.73 H new ATOM 0 HG13 ILE A 571 -11.249 -0.263 1.358 1.00 0.73 H new ATOM 0 HG21 ILE A 571 -11.633 2.953 3.192 1.00 0.77 H new ATOM 0 HG22 ILE A 571 -12.623 3.726 1.931 1.00 0.77 H new ATOM 0 HG23 ILE A 571 -13.258 2.326 2.827 1.00 0.77 H new ATOM 0 HD11 ILE A 571 -9.729 -0.203 3.281 1.00 0.93 H new ATOM 0 HD12 ILE A 571 -9.230 0.983 2.051 1.00 0.93 H new ATOM 0 HD13 ILE A 571 -10.081 1.526 3.517 1.00 0.93 H new ATOM 606 N ILE A 572 -12.233 -0.630 -0.930 1.00 0.78 N ATOM 607 CA ILE A 572 -11.446 -1.619 -1.694 1.00 0.81 C ATOM 608 C ILE A 572 -12.314 -2.483 -2.628 1.00 1.04 C ATOM 609 O ILE A 572 -13.481 -2.740 -2.321 1.00 1.50 O ATOM 610 CB ILE A 572 -10.652 -2.461 -0.657 1.00 1.08 C ATOM 611 CG1 ILE A 572 -9.377 -1.676 -0.289 1.00 1.33 C ATOM 612 CG2 ILE A 572 -10.296 -3.880 -1.121 1.00 1.31 C ATOM 613 CD1 ILE A 572 -8.566 -2.219 0.895 1.00 1.42 C ATOM 0 H ILE A 572 -12.950 -1.076 -0.358 1.00 0.78 H new ATOM 0 HA ILE A 572 -10.760 -1.111 -2.372 1.00 0.81 H new ATOM 0 HB ILE A 572 -11.300 -2.610 0.207 1.00 1.08 H new ATOM 0 HG12 ILE A 572 -8.728 -1.647 -1.164 1.00 1.33 H new ATOM 0 HG13 ILE A 572 -9.660 -0.647 -0.067 1.00 1.33 H new ATOM 0 HG21 ILE A 572 -9.743 -4.392 -0.334 1.00 1.31 H new ATOM 0 HG22 ILE A 572 -11.210 -4.431 -1.340 1.00 1.31 H new ATOM 0 HG23 ILE A 572 -9.681 -3.826 -2.019 1.00 1.31 H new ATOM 0 HD11 ILE A 572 -7.694 -1.586 1.059 1.00 1.42 H new ATOM 0 HD12 ILE A 572 -9.187 -2.221 1.791 1.00 1.42 H new ATOM 0 HD13 ILE A 572 -8.240 -3.236 0.677 1.00 1.42 H new ATOM 625 N ARG A 573 -11.729 -2.956 -3.743 1.00 1.12 N ATOM 626 CA ARG A 573 -12.342 -3.868 -4.734 1.00 1.50 C ATOM 627 C ARG A 573 -11.276 -4.721 -5.458 1.00 1.25 C ATOM 628 O ARG A 573 -10.091 -4.388 -5.423 1.00 1.57 O ATOM 629 CB ARG A 573 -13.153 -2.995 -5.720 1.00 2.24 C ATOM 630 CG ARG A 573 -14.154 -3.762 -6.599 1.00 3.30 C ATOM 631 CD ARG A 573 -14.926 -2.825 -7.539 1.00 4.35 C ATOM 632 NE ARG A 573 -15.919 -2.002 -6.821 1.00 4.98 N ATOM 633 CZ ARG A 573 -15.983 -0.687 -6.743 1.00 6.23 C ATOM 634 NH1 ARG A 573 -15.111 0.113 -7.276 1.00 7.21 N ATOM 635 NH2 ARG A 573 -16.951 -0.101 -6.104 1.00 7.15 N ATOM 0 H ARG A 573 -10.773 -2.703 -3.992 1.00 1.12 H new ATOM 0 HA ARG A 573 -13.000 -4.582 -4.239 1.00 1.50 H new ATOM 0 HB2 ARG A 573 -13.697 -2.241 -5.151 1.00 2.24 H new ATOM 0 HB3 ARG A 573 -12.456 -2.464 -6.369 1.00 2.24 H new ATOM 0 HG2 ARG A 573 -13.622 -4.509 -7.188 1.00 3.30 H new ATOM 0 HG3 ARG A 573 -14.858 -4.299 -5.963 1.00 3.30 H new ATOM 0 HD2 ARG A 573 -14.222 -2.172 -8.056 1.00 4.35 H new ATOM 0 HD3 ARG A 573 -15.432 -3.416 -8.302 1.00 4.35 H new ATOM 0 HE ARG A 573 -16.647 -2.514 -6.323 1.00 4.98 H new ATOM 0 HH11 ARG A 573 -14.318 -0.268 -7.792 1.00 7.21 H new ATOM 0 HH12 ARG A 573 -15.219 1.123 -7.179 1.00 7.21 H new ATOM 0 HH21 ARG A 573 -17.676 -0.659 -5.653 1.00 7.15 H new ATOM 0 HH22 ARG A 573 -16.986 0.917 -6.053 1.00 7.15 H new ATOM 649 N GLU A 574 -11.679 -5.801 -6.131 1.00 1.68 N ATOM 650 CA GLU A 574 -10.876 -6.550 -7.125 1.00 1.63 C ATOM 651 C GLU A 574 -10.692 -5.752 -8.436 1.00 2.45 C ATOM 652 O GLU A 574 -11.473 -4.853 -8.769 1.00 3.60 O ATOM 653 CB GLU A 574 -11.514 -7.936 -7.382 1.00 2.94 C ATOM 654 CG GLU A 574 -10.557 -9.130 -7.228 1.00 3.08 C ATOM 655 CD GLU A 574 -9.529 -9.196 -8.354 1.00 3.84 C ATOM 656 OE1 GLU A 574 -8.524 -8.455 -8.271 1.00 4.17 O ATOM 657 OE2 GLU A 574 -9.754 -9.915 -9.356 1.00 4.95 O ATOM 0 H GLU A 574 -12.608 -6.201 -6.000 1.00 1.68 H new ATOM 0 HA GLU A 574 -9.877 -6.701 -6.715 1.00 1.63 H new ATOM 0 HB2 GLU A 574 -12.349 -8.068 -6.694 1.00 2.94 H new ATOM 0 HB3 GLU A 574 -11.927 -7.948 -8.391 1.00 2.94 H new ATOM 0 HG2 GLU A 574 -10.040 -9.058 -6.271 1.00 3.08 H new ATOM 0 HG3 GLU A 574 -11.133 -10.055 -7.210 1.00 3.08 H new ATOM 664 N GLY A 575 -9.641 -6.079 -9.186 1.00 2.52 N ATOM 665 CA GLY A 575 -9.293 -5.492 -10.490 1.00 3.97 C ATOM 666 C GLY A 575 -8.291 -6.318 -11.311 1.00 3.49 C ATOM 667 O GLY A 575 -7.930 -5.925 -12.423 1.00 4.75 O ATOM 0 H GLY A 575 -8.975 -6.793 -8.892 1.00 2.52 H new ATOM 0 HA2 GLY A 575 -10.205 -5.366 -11.073 1.00 3.97 H new ATOM 0 HA3 GLY A 575 -8.878 -4.497 -10.328 1.00 3.97 H new ATOM 671 N THR A 576 -7.892 -7.490 -10.806 1.00 1.92 N ATOM 672 CA THR A 576 -6.907 -8.435 -11.350 1.00 1.83 C ATOM 673 C THR A 576 -5.459 -7.945 -11.314 1.00 1.64 C ATOM 674 O THR A 576 -5.159 -6.874 -10.785 1.00 2.13 O ATOM 675 CB THR A 576 -7.332 -9.043 -12.700 1.00 2.82 C ATOM 676 OG1 THR A 576 -7.157 -8.132 -13.755 1.00 2.50 O ATOM 677 CG2 THR A 576 -8.795 -9.468 -12.682 1.00 4.25 C ATOM 0 H THR A 576 -8.284 -7.833 -9.929 1.00 1.92 H new ATOM 0 HA THR A 576 -6.908 -9.266 -10.645 1.00 1.83 H new ATOM 0 HB THR A 576 -6.695 -9.913 -12.856 1.00 2.82 H new ATOM 0 HG1 THR A 576 -7.602 -7.287 -13.535 1.00 2.50 H new ATOM 0 HG21 THR A 576 -9.062 -9.893 -13.650 1.00 4.25 H new ATOM 0 HG22 THR A 576 -8.947 -10.215 -11.903 1.00 4.25 H new ATOM 0 HG23 THR A 576 -9.423 -8.601 -12.480 1.00 4.25 H new ATOM 685 N ILE A 577 -4.529 -8.782 -11.787 1.00 1.65 N ATOM 686 CA ILE A 577 -3.090 -8.519 -11.641 1.00 1.75 C ATOM 687 C ILE A 577 -2.705 -7.171 -12.265 1.00 1.63 C ATOM 688 O ILE A 577 -3.183 -6.778 -13.335 1.00 1.64 O ATOM 689 CB ILE A 577 -2.231 -9.699 -12.156 1.00 2.19 C ATOM 690 CG1 ILE A 577 -2.296 -10.885 -11.158 1.00 2.78 C ATOM 691 CG2 ILE A 577 -0.758 -9.295 -12.376 1.00 2.47 C ATOM 692 CD1 ILE A 577 -3.296 -11.962 -11.586 1.00 2.95 C ATOM 0 H ILE A 577 -4.747 -9.650 -12.276 1.00 1.65 H new ATOM 0 HA ILE A 577 -2.870 -8.439 -10.576 1.00 1.75 H new ATOM 0 HB ILE A 577 -2.644 -9.999 -13.119 1.00 2.19 H new ATOM 0 HG12 ILE A 577 -1.306 -11.331 -11.065 1.00 2.78 H new ATOM 0 HG13 ILE A 577 -2.571 -10.510 -10.172 1.00 2.78 H new ATOM 0 HG21 ILE A 577 -0.195 -10.155 -12.737 1.00 2.47 H new ATOM 0 HG22 ILE A 577 -0.707 -8.493 -13.112 1.00 2.47 H new ATOM 0 HG23 ILE A 577 -0.330 -8.951 -11.434 1.00 2.47 H new ATOM 0 HD11 ILE A 577 -3.300 -12.767 -10.851 1.00 2.95 H new ATOM 0 HD12 ILE A 577 -4.293 -11.527 -11.653 1.00 2.95 H new ATOM 0 HD13 ILE A 577 -3.008 -12.360 -12.559 1.00 2.95 H new ATOM 704 N GLY A 578 -1.841 -6.449 -11.550 1.00 1.86 N ATOM 705 CA GLY A 578 -1.407 -5.110 -11.913 1.00 2.08 C ATOM 706 C GLY A 578 -2.237 -4.014 -11.230 1.00 1.82 C ATOM 707 O GLY A 578 -1.863 -2.840 -11.289 1.00 1.95 O ATOM 0 H GLY A 578 -1.418 -6.790 -10.687 1.00 1.86 H new ATOM 0 HA2 GLY A 578 -0.358 -4.987 -11.644 1.00 2.08 H new ATOM 0 HA3 GLY A 578 -1.475 -4.991 -12.994 1.00 2.08 H new ATOM 711 N LYS A 579 -3.300 -4.380 -10.496 1.00 1.76 N ATOM 712 CA LYS A 579 -3.956 -3.497 -9.525 1.00 1.54 C ATOM 713 C LYS A 579 -2.962 -2.996 -8.464 1.00 1.25 C ATOM 714 O LYS A 579 -2.108 -3.749 -7.993 1.00 1.34 O ATOM 715 CB LYS A 579 -5.169 -4.216 -8.911 1.00 1.72 C ATOM 716 CG LYS A 579 -5.914 -3.347 -7.882 1.00 2.25 C ATOM 717 CD LYS A 579 -7.264 -3.951 -7.476 1.00 2.34 C ATOM 718 CE LYS A 579 -7.140 -5.245 -6.658 1.00 3.58 C ATOM 719 NZ LYS A 579 -7.374 -5.000 -5.216 1.00 4.61 N ATOM 0 H LYS A 579 -3.729 -5.303 -10.562 1.00 1.76 H new ATOM 0 HA LYS A 579 -4.321 -2.607 -10.037 1.00 1.54 H new ATOM 0 HB2 LYS A 579 -5.858 -4.502 -9.706 1.00 1.72 H new ATOM 0 HB3 LYS A 579 -4.836 -5.136 -8.431 1.00 1.72 H new ATOM 0 HG2 LYS A 579 -5.292 -3.225 -6.995 1.00 2.25 H new ATOM 0 HG3 LYS A 579 -6.074 -2.352 -8.298 1.00 2.25 H new ATOM 0 HD2 LYS A 579 -7.821 -3.216 -6.895 1.00 2.34 H new ATOM 0 HD3 LYS A 579 -7.846 -4.154 -8.375 1.00 2.34 H new ATOM 0 HE2 LYS A 579 -7.858 -5.979 -7.025 1.00 3.58 H new ATOM 0 HE3 LYS A 579 -6.147 -5.672 -6.799 1.00 3.58 H new ATOM 0 HZ1 LYS A 579 -7.417 -5.909 -4.712 1.00 4.61 H new ATOM 0 HZ2 LYS A 579 -6.596 -4.427 -4.831 1.00 4.61 H new ATOM 0 HZ3 LYS A 579 -8.273 -4.492 -5.092 1.00 4.61 H new ATOM 733 N LYS A 580 -3.083 -1.717 -8.100 1.00 1.13 N ATOM 734 CA LYS A 580 -2.154 -0.988 -7.225 1.00 0.96 C ATOM 735 C LYS A 580 -2.465 -1.128 -5.727 1.00 0.99 C ATOM 736 O LYS A 580 -3.558 -1.533 -5.321 1.00 1.31 O ATOM 737 CB LYS A 580 -2.066 0.480 -7.674 1.00 1.09 C ATOM 738 CG LYS A 580 -3.370 1.271 -7.505 1.00 1.68 C ATOM 739 CD LYS A 580 -3.120 2.750 -7.832 1.00 2.52 C ATOM 740 CE LYS A 580 -4.396 3.598 -7.764 1.00 3.41 C ATOM 741 NZ LYS A 580 -5.424 3.124 -8.721 1.00 3.49 N ATOM 0 H LYS A 580 -3.859 -1.136 -8.417 1.00 1.13 H new ATOM 0 HA LYS A 580 -1.174 -1.452 -7.336 1.00 0.96 H new ATOM 0 HB2 LYS A 580 -1.278 0.975 -7.106 1.00 1.09 H new ATOM 0 HB3 LYS A 580 -1.770 0.510 -8.723 1.00 1.09 H new ATOM 0 HG2 LYS A 580 -4.140 0.868 -8.163 1.00 1.68 H new ATOM 0 HG3 LYS A 580 -3.738 1.171 -6.484 1.00 1.68 H new ATOM 0 HD2 LYS A 580 -2.385 3.152 -7.135 1.00 2.52 H new ATOM 0 HD3 LYS A 580 -2.690 2.829 -8.830 1.00 2.52 H new ATOM 0 HE2 LYS A 580 -4.800 3.567 -6.752 1.00 3.41 H new ATOM 0 HE3 LYS A 580 -4.153 4.639 -7.978 1.00 3.41 H new ATOM 0 HZ1 LYS A 580 -6.191 3.824 -8.781 1.00 3.49 H new ATOM 0 HZ2 LYS A 580 -4.994 3.000 -9.660 1.00 3.49 H new ATOM 0 HZ3 LYS A 580 -5.810 2.215 -8.394 1.00 3.49 H new ATOM 755 N MET A 581 -1.466 -0.778 -4.922 1.00 0.84 N ATOM 756 CA MET A 581 -1.389 -0.997 -3.474 1.00 0.92 C ATOM 757 C MET A 581 -1.798 0.270 -2.701 1.00 0.77 C ATOM 758 O MET A 581 -1.594 1.380 -3.197 1.00 0.74 O ATOM 759 CB MET A 581 0.040 -1.492 -3.180 1.00 1.25 C ATOM 760 CG MET A 581 0.395 -1.655 -1.703 1.00 1.59 C ATOM 761 SD MET A 581 1.004 -0.134 -0.928 1.00 1.74 S ATOM 762 CE MET A 581 1.200 -0.751 0.756 1.00 1.22 C ATOM 0 H MET A 581 -0.637 -0.305 -5.281 1.00 0.84 H new ATOM 0 HA MET A 581 -2.096 -1.753 -3.132 1.00 0.92 H new ATOM 0 HB2 MET A 581 0.181 -2.452 -3.677 1.00 1.25 H new ATOM 0 HB3 MET A 581 0.746 -0.794 -3.629 1.00 1.25 H new ATOM 0 HG2 MET A 581 -0.486 -2.000 -1.162 1.00 1.59 H new ATOM 0 HG3 MET A 581 1.154 -2.432 -1.604 1.00 1.59 H new ATOM 0 HE1 MET A 581 1.346 0.088 1.436 1.00 1.22 H new ATOM 0 HE2 MET A 581 0.307 -1.303 1.047 1.00 1.22 H new ATOM 0 HE3 MET A 581 2.066 -1.411 0.803 1.00 1.22 H new ATOM 772 N TYR A 582 -2.391 0.111 -1.509 1.00 0.79 N ATOM 773 CA TYR A 582 -2.943 1.208 -0.701 1.00 0.75 C ATOM 774 C TYR A 582 -2.441 1.187 0.754 1.00 0.79 C ATOM 775 O TYR A 582 -2.198 0.129 1.336 1.00 0.87 O ATOM 776 CB TYR A 582 -4.481 1.168 -0.727 1.00 0.76 C ATOM 777 CG TYR A 582 -5.125 1.572 -2.042 1.00 1.02 C ATOM 778 CD1 TYR A 582 -5.164 0.674 -3.127 1.00 1.65 C ATOM 779 CD2 TYR A 582 -5.710 2.847 -2.169 1.00 2.60 C ATOM 780 CE1 TYR A 582 -5.770 1.053 -4.340 1.00 1.82 C ATOM 781 CE2 TYR A 582 -6.336 3.222 -3.374 1.00 3.16 C ATOM 782 CZ TYR A 582 -6.365 2.326 -4.463 1.00 2.21 C ATOM 783 OH TYR A 582 -6.975 2.695 -5.620 1.00 2.86 O ATOM 0 H TYR A 582 -2.503 -0.803 -1.071 1.00 0.79 H new ATOM 0 HA TYR A 582 -2.591 2.137 -1.149 1.00 0.75 H new ATOM 0 HB2 TYR A 582 -4.805 0.157 -0.480 1.00 0.76 H new ATOM 0 HB3 TYR A 582 -4.857 1.824 0.058 1.00 0.76 H new ATOM 0 HD1 TYR A 582 -4.727 -0.309 -3.028 1.00 1.65 H new ATOM 0 HD2 TYR A 582 -5.679 3.539 -1.340 1.00 2.60 H new ATOM 0 HE1 TYR A 582 -5.779 0.369 -5.176 1.00 1.82 H new ATOM 0 HE2 TYR A 582 -6.794 4.196 -3.464 1.00 3.16 H new ATOM 0 HH TYR A 582 -7.331 3.604 -5.527 1.00 2.86 H new ATOM 793 N PHE A 583 -2.333 2.361 1.383 1.00 0.75 N ATOM 794 CA PHE A 583 -1.904 2.472 2.785 1.00 0.77 C ATOM 795 C PHE A 583 -2.558 3.640 3.544 1.00 0.76 C ATOM 796 O PHE A 583 -2.976 4.634 2.946 1.00 0.79 O ATOM 797 CB PHE A 583 -0.368 2.445 2.854 1.00 0.83 C ATOM 798 CG PHE A 583 0.396 3.498 2.070 1.00 0.99 C ATOM 799 CD1 PHE A 583 0.790 3.231 0.746 1.00 2.22 C ATOM 800 CD2 PHE A 583 0.811 4.693 2.689 1.00 2.07 C ATOM 801 CE1 PHE A 583 1.627 4.124 0.057 1.00 2.51 C ATOM 802 CE2 PHE A 583 1.655 5.586 2.002 1.00 2.33 C ATOM 803 CZ PHE A 583 2.073 5.295 0.691 1.00 1.87 C ATOM 0 H PHE A 583 -2.538 3.257 0.941 1.00 0.75 H new ATOM 0 HA PHE A 583 -2.273 1.602 3.328 1.00 0.77 H new ATOM 0 HB2 PHE A 583 -0.078 2.532 3.901 1.00 0.83 H new ATOM 0 HB3 PHE A 583 -0.035 1.465 2.511 1.00 0.83 H new ATOM 0 HD1 PHE A 583 0.446 2.332 0.256 1.00 2.22 H new ATOM 0 HD2 PHE A 583 0.482 4.924 3.691 1.00 2.07 H new ATOM 0 HE1 PHE A 583 1.927 3.911 -0.958 1.00 2.51 H new ATOM 0 HE2 PHE A 583 1.982 6.496 2.483 1.00 2.33 H new ATOM 0 HZ PHE A 583 2.736 5.971 0.172 1.00 1.87 H new ATOM 813 N ILE A 584 -2.706 3.483 4.867 1.00 0.79 N ATOM 814 CA ILE A 584 -3.500 4.364 5.742 1.00 0.85 C ATOM 815 C ILE A 584 -2.616 5.445 6.363 1.00 1.02 C ATOM 816 O ILE A 584 -1.733 5.128 7.159 1.00 1.13 O ATOM 817 CB ILE A 584 -4.234 3.560 6.850 1.00 0.87 C ATOM 818 CG1 ILE A 584 -4.911 2.291 6.284 1.00 0.80 C ATOM 819 CG2 ILE A 584 -5.300 4.476 7.497 1.00 0.89 C ATOM 820 CD1 ILE A 584 -5.688 1.478 7.317 1.00 0.83 C ATOM 0 H ILE A 584 -2.264 2.717 5.375 1.00 0.79 H new ATOM 0 HA ILE A 584 -4.258 4.844 5.123 1.00 0.85 H new ATOM 0 HB ILE A 584 -3.502 3.237 7.590 1.00 0.87 H new ATOM 0 HG12 ILE A 584 -5.590 2.583 5.483 1.00 0.80 H new ATOM 0 HG13 ILE A 584 -4.147 1.654 5.838 1.00 0.80 H new ATOM 0 HG21 ILE A 584 -5.826 3.927 8.278 1.00 0.89 H new ATOM 0 HG22 ILE A 584 -4.814 5.349 7.932 1.00 0.89 H new ATOM 0 HG23 ILE A 584 -6.012 4.798 6.737 1.00 0.89 H new ATOM 0 HD11 ILE A 584 -6.131 0.606 6.836 1.00 0.83 H new ATOM 0 HD12 ILE A 584 -5.012 1.152 8.107 1.00 0.83 H new ATOM 0 HD13 ILE A 584 -6.477 2.095 7.747 1.00 0.83 H new ATOM 832 N GLN A 585 -2.877 6.721 6.057 1.00 1.13 N ATOM 833 CA GLN A 585 -2.073 7.827 6.586 1.00 1.32 C ATOM 834 C GLN A 585 -2.666 8.395 7.880 1.00 1.38 C ATOM 835 O GLN A 585 -1.965 8.468 8.885 1.00 1.61 O ATOM 836 CB GLN A 585 -1.861 8.890 5.496 1.00 1.41 C ATOM 837 CG GLN A 585 -0.532 9.637 5.689 1.00 2.02 C ATOM 838 CD GLN A 585 -0.507 10.568 6.894 1.00 2.98 C ATOM 839 OE1 GLN A 585 0.091 10.282 7.923 1.00 4.75 O ATOM 840 NE2 GLN A 585 -1.163 11.696 6.801 1.00 2.33 N ATOM 0 H GLN A 585 -3.639 7.013 5.445 1.00 1.13 H new ATOM 0 HA GLN A 585 -1.090 7.448 6.864 1.00 1.32 H new ATOM 0 HB2 GLN A 585 -1.873 8.414 4.515 1.00 1.41 H new ATOM 0 HB3 GLN A 585 -2.686 9.602 5.515 1.00 1.41 H new ATOM 0 HG2 GLN A 585 0.271 8.907 5.792 1.00 2.02 H new ATOM 0 HG3 GLN A 585 -0.321 10.218 4.791 1.00 2.02 H new ATOM 0 HE21 GLN A 585 -1.659 11.928 5.941 1.00 2.33 H new ATOM 0 HE22 GLN A 585 -1.178 12.344 7.589 1.00 2.33 H new ATOM 849 N HIS A 586 -3.953 8.747 7.880 1.00 1.20 N ATOM 850 CA HIS A 586 -4.688 9.227 9.062 1.00 1.18 C ATOM 851 C HIS A 586 -6.169 8.815 8.997 1.00 1.03 C ATOM 852 O HIS A 586 -6.908 9.310 8.149 1.00 1.00 O ATOM 853 CB HIS A 586 -4.590 10.770 9.146 1.00 1.23 C ATOM 854 CG HIS A 586 -3.481 11.336 10.006 1.00 1.96 C ATOM 855 ND1 HIS A 586 -2.127 11.124 9.875 1.00 3.61 N ATOM 856 CD2 HIS A 586 -3.639 12.251 11.015 1.00 2.33 C ATOM 857 CE1 HIS A 586 -1.485 11.884 10.775 1.00 4.35 C ATOM 858 NE2 HIS A 586 -2.369 12.582 11.511 1.00 3.47 N ATOM 0 H HIS A 586 -4.531 8.707 7.040 1.00 1.20 H new ATOM 0 HA HIS A 586 -4.240 8.776 9.947 1.00 1.18 H new ATOM 0 HB2 HIS A 586 -4.468 11.158 8.135 1.00 1.23 H new ATOM 0 HB3 HIS A 586 -5.540 11.151 9.522 1.00 1.23 H new ATOM 0 HD1 HIS A 586 -1.686 10.494 9.205 1.00 3.61 H new ATOM 0 HD2 HIS A 586 -4.579 12.649 11.367 1.00 2.33 H new ATOM 0 HE1 HIS A 586 -0.412 11.929 10.892 1.00 4.35 H new ATOM 866 N GLY A 587 -6.623 7.942 9.902 1.00 1.01 N ATOM 867 CA GLY A 587 -8.032 7.631 10.131 1.00 0.97 C ATOM 868 C GLY A 587 -8.217 6.188 10.593 1.00 0.88 C ATOM 869 O GLY A 587 -7.245 5.527 10.968 1.00 0.97 O ATOM 0 H GLY A 587 -5.997 7.417 10.513 1.00 1.01 H new ATOM 0 HA2 GLY A 587 -8.438 8.309 10.881 1.00 0.97 H new ATOM 0 HA3 GLY A 587 -8.596 7.796 9.213 1.00 0.97 H new ATOM 873 N VAL A 588 -9.460 5.703 10.574 1.00 0.80 N ATOM 874 CA VAL A 588 -9.841 4.384 11.095 1.00 0.81 C ATOM 875 C VAL A 588 -10.818 3.704 10.127 1.00 0.79 C ATOM 876 O VAL A 588 -11.681 4.352 9.528 1.00 0.81 O ATOM 877 CB VAL A 588 -10.457 4.482 12.513 1.00 0.85 C ATOM 878 CG1 VAL A 588 -10.549 3.104 13.170 1.00 0.86 C ATOM 879 CG2 VAL A 588 -9.665 5.388 13.467 1.00 0.88 C ATOM 0 H VAL A 588 -10.247 6.225 10.189 1.00 0.80 H new ATOM 0 HA VAL A 588 -8.938 3.780 11.177 1.00 0.81 H new ATOM 0 HB VAL A 588 -11.445 4.915 12.356 1.00 0.85 H new ATOM 0 HG11 VAL A 588 -10.985 3.203 14.164 1.00 0.86 H new ATOM 0 HG12 VAL A 588 -11.176 2.452 12.562 1.00 0.86 H new ATOM 0 HG13 VAL A 588 -9.551 2.673 13.253 1.00 0.86 H new ATOM 0 HG21 VAL A 588 -10.155 5.408 14.440 1.00 0.88 H new ATOM 0 HG22 VAL A 588 -8.652 5.001 13.579 1.00 0.88 H new ATOM 0 HG23 VAL A 588 -9.625 6.398 13.060 1.00 0.88 H new ATOM 889 N VAL A 589 -10.692 2.389 9.963 1.00 0.77 N ATOM 890 CA VAL A 589 -11.550 1.561 9.100 1.00 0.75 C ATOM 891 C VAL A 589 -12.156 0.377 9.863 1.00 0.83 C ATOM 892 O VAL A 589 -11.535 -0.195 10.758 1.00 0.94 O ATOM 893 CB VAL A 589 -10.805 1.104 7.828 1.00 0.74 C ATOM 894 CG1 VAL A 589 -10.298 2.288 6.992 1.00 0.72 C ATOM 895 CG2 VAL A 589 -9.612 0.206 8.148 1.00 0.82 C ATOM 0 H VAL A 589 -9.970 1.848 10.439 1.00 0.77 H new ATOM 0 HA VAL A 589 -12.381 2.188 8.778 1.00 0.75 H new ATOM 0 HB VAL A 589 -11.542 0.542 7.254 1.00 0.74 H new ATOM 0 HG11 VAL A 589 -9.781 1.914 6.108 1.00 0.72 H new ATOM 0 HG12 VAL A 589 -11.143 2.905 6.685 1.00 0.72 H new ATOM 0 HG13 VAL A 589 -9.610 2.887 7.589 1.00 0.72 H new ATOM 0 HG21 VAL A 589 -9.120 -0.090 7.221 1.00 0.82 H new ATOM 0 HG22 VAL A 589 -8.906 0.749 8.776 1.00 0.82 H new ATOM 0 HG23 VAL A 589 -9.957 -0.683 8.675 1.00 0.82 H new ATOM 905 N SER A 590 -13.367 -0.005 9.468 1.00 0.86 N ATOM 906 CA SER A 590 -14.141 -1.148 9.976 1.00 1.17 C ATOM 907 C SER A 590 -14.252 -2.174 8.859 1.00 1.37 C ATOM 908 O SER A 590 -14.547 -1.865 7.705 1.00 1.19 O ATOM 909 CB SER A 590 -15.553 -0.729 10.380 1.00 1.32 C ATOM 910 OG SER A 590 -15.494 0.265 11.375 1.00 1.35 O ATOM 0 H SER A 590 -13.870 0.502 8.740 1.00 0.86 H new ATOM 0 HA SER A 590 -13.635 -1.553 10.852 1.00 1.17 H new ATOM 0 HB2 SER A 590 -16.092 -0.353 9.511 1.00 1.32 H new ATOM 0 HB3 SER A 590 -16.106 -1.593 10.749 1.00 1.32 H new ATOM 0 HG SER A 590 -16.403 0.530 11.627 1.00 1.35 H new ATOM 916 N VAL A 591 -13.888 -3.394 9.196 1.00 1.72 N ATOM 917 CA VAL A 591 -13.090 -4.239 8.330 1.00 1.46 C ATOM 918 C VAL A 591 -13.549 -5.680 8.500 1.00 1.23 C ATOM 919 O VAL A 591 -13.972 -6.071 9.590 1.00 1.33 O ATOM 920 CB VAL A 591 -11.630 -4.001 8.759 1.00 1.67 C ATOM 921 CG1 VAL A 591 -11.440 -4.189 10.249 1.00 2.96 C ATOM 922 CG2 VAL A 591 -10.630 -4.992 8.282 1.00 1.55 C ATOM 0 H VAL A 591 -14.139 -3.830 10.083 1.00 1.72 H new ATOM 0 HA VAL A 591 -13.193 -4.014 7.268 1.00 1.46 H new ATOM 0 HB VAL A 591 -11.472 -3.002 8.352 1.00 1.67 H new ATOM 0 HG11 VAL A 591 -10.396 -4.012 10.508 1.00 2.96 H new ATOM 0 HG12 VAL A 591 -12.073 -3.484 10.788 1.00 2.96 H new ATOM 0 HG13 VAL A 591 -11.714 -5.207 10.525 1.00 2.96 H new ATOM 0 HG21 VAL A 591 -9.641 -4.717 8.649 1.00 1.55 H new ATOM 0 HG22 VAL A 591 -10.893 -5.982 8.655 1.00 1.55 H new ATOM 0 HG23 VAL A 591 -10.622 -5.005 7.192 1.00 1.55 H new ATOM 932 N LEU A 592 -13.407 -6.494 7.462 1.00 1.06 N ATOM 933 CA LEU A 592 -13.528 -7.938 7.595 1.00 1.15 C ATOM 934 C LEU A 592 -12.211 -8.574 7.174 1.00 1.24 C ATOM 935 O LEU A 592 -11.663 -8.233 6.119 1.00 1.21 O ATOM 936 CB LEU A 592 -14.648 -8.494 6.686 1.00 1.33 C ATOM 937 CG LEU A 592 -16.131 -8.307 7.060 1.00 1.64 C ATOM 938 CD1 LEU A 592 -16.505 -9.247 8.200 1.00 2.17 C ATOM 939 CD2 LEU A 592 -16.556 -6.887 7.426 1.00 1.83 C ATOM 0 H LEU A 592 -13.207 -6.175 6.514 1.00 1.06 H new ATOM 0 HA LEU A 592 -13.771 -8.171 8.632 1.00 1.15 H new ATOM 0 HB2 LEU A 592 -14.508 -8.053 5.699 1.00 1.33 H new ATOM 0 HB3 LEU A 592 -14.476 -9.565 6.584 1.00 1.33 H new ATOM 0 HG LEU A 592 -16.671 -8.543 6.143 1.00 1.64 H new ATOM 0 HD11 LEU A 592 -17.555 -9.107 8.457 1.00 2.17 H new ATOM 0 HD12 LEU A 592 -16.342 -10.279 7.889 1.00 2.17 H new ATOM 0 HD13 LEU A 592 -15.886 -9.028 9.070 1.00 2.17 H new ATOM 0 HD21 LEU A 592 -17.618 -6.877 7.670 1.00 1.83 H new ATOM 0 HD22 LEU A 592 -15.982 -6.546 8.288 1.00 1.83 H new ATOM 0 HD23 LEU A 592 -16.372 -6.223 6.582 1.00 1.83 H new ATOM 951 N THR A 593 -11.742 -9.559 7.933 1.00 1.53 N ATOM 952 CA THR A 593 -10.830 -10.580 7.382 1.00 1.78 C ATOM 953 C THR A 593 -11.556 -11.829 6.858 1.00 1.96 C ATOM 954 O THR A 593 -12.374 -12.455 7.545 1.00 2.04 O ATOM 955 CB THR A 593 -9.668 -10.903 8.330 1.00 1.98 C ATOM 956 OG1 THR A 593 -10.057 -10.997 9.682 1.00 1.99 O ATOM 957 CG2 THR A 593 -8.650 -9.772 8.249 1.00 2.07 C ATOM 0 H THR A 593 -11.969 -9.680 8.920 1.00 1.53 H new ATOM 0 HA THR A 593 -10.378 -10.130 6.498 1.00 1.78 H new ATOM 0 HB THR A 593 -9.270 -11.868 8.017 1.00 1.98 H new ATOM 0 HG1 THR A 593 -9.274 -11.206 10.234 1.00 1.99 H new ATOM 0 HG21 THR A 593 -7.816 -9.985 8.917 1.00 2.07 H new ATOM 0 HG22 THR A 593 -8.283 -9.686 7.226 1.00 2.07 H new ATOM 0 HG23 THR A 593 -9.122 -8.835 8.545 1.00 2.07 H new ATOM 965 N LYS A 594 -11.245 -12.212 5.609 1.00 2.14 N ATOM 966 CA LYS A 594 -11.646 -13.496 5.006 1.00 2.35 C ATOM 967 C LYS A 594 -11.138 -14.675 5.841 1.00 2.75 C ATOM 968 O LYS A 594 -10.111 -14.565 6.506 1.00 3.47 O ATOM 969 CB LYS A 594 -11.252 -13.585 3.519 1.00 2.48 C ATOM 970 CG LYS A 594 -9.783 -13.907 3.199 1.00 2.80 C ATOM 971 CD LYS A 594 -8.801 -12.780 3.548 1.00 2.84 C ATOM 972 CE LYS A 594 -7.347 -13.123 3.203 1.00 3.35 C ATOM 973 NZ LYS A 594 -7.121 -13.251 1.747 1.00 3.96 N ATOM 0 H LYS A 594 -10.698 -11.628 4.977 1.00 2.14 H new ATOM 0 HA LYS A 594 -12.735 -13.551 5.020 1.00 2.35 H new ATOM 0 HB2 LYS A 594 -11.875 -14.347 3.050 1.00 2.48 H new ATOM 0 HB3 LYS A 594 -11.500 -12.635 3.046 1.00 2.48 H new ATOM 0 HG2 LYS A 594 -9.494 -14.807 3.742 1.00 2.80 H new ATOM 0 HG3 LYS A 594 -9.696 -14.134 2.136 1.00 2.80 H new ATOM 0 HD2 LYS A 594 -9.091 -11.875 3.015 1.00 2.84 H new ATOM 0 HD3 LYS A 594 -8.873 -12.559 4.613 1.00 2.84 H new ATOM 0 HE2 LYS A 594 -6.691 -12.349 3.602 1.00 3.35 H new ATOM 0 HE3 LYS A 594 -7.072 -14.057 3.693 1.00 3.35 H new ATOM 0 HZ1 LYS A 594 -6.108 -13.399 1.565 1.00 3.96 H new ATOM 0 HZ2 LYS A 594 -7.661 -14.062 1.382 1.00 3.96 H new ATOM 0 HZ3 LYS A 594 -7.435 -12.382 1.269 1.00 3.96 H new ATOM 987 N GLY A 595 -11.911 -15.757 5.890 1.00 3.02 N ATOM 988 CA GLY A 595 -11.766 -16.817 6.897 1.00 3.32 C ATOM 989 C GLY A 595 -12.316 -16.469 8.279 1.00 3.18 C ATOM 990 O GLY A 595 -12.567 -17.365 9.091 1.00 3.43 O ATOM 0 H GLY A 595 -12.666 -15.929 5.226 1.00 3.02 H new ATOM 0 HA2 GLY A 595 -12.271 -17.713 6.536 1.00 3.32 H new ATOM 0 HA3 GLY A 595 -10.709 -17.064 6.994 1.00 3.32 H new ATOM 994 N ASN A 596 -12.432 -15.178 8.589 1.00 2.83 N ATOM 995 CA ASN A 596 -12.241 -14.692 9.942 1.00 2.69 C ATOM 996 C ASN A 596 -13.318 -13.651 10.310 1.00 2.46 C ATOM 997 O ASN A 596 -14.515 -13.879 10.107 1.00 2.65 O ATOM 998 CB ASN A 596 -10.819 -14.124 10.047 1.00 2.57 C ATOM 999 CG ASN A 596 -9.636 -14.997 9.676 1.00 2.88 C ATOM 1000 OD1 ASN A 596 -9.698 -16.219 9.640 1.00 3.25 O ATOM 1001 ND2 ASN A 596 -8.486 -14.386 9.548 1.00 2.86 N ATOM 0 H ASN A 596 -12.659 -14.451 7.911 1.00 2.83 H new ATOM 0 HA ASN A 596 -12.352 -15.505 10.659 1.00 2.69 H new ATOM 0 HB2 ASN A 596 -10.776 -13.233 9.421 1.00 2.57 H new ATOM 0 HB3 ASN A 596 -10.673 -13.797 11.077 1.00 2.57 H new ATOM 0 HD21 ASN A 596 -7.632 -14.928 9.417 1.00 2.86 H new ATOM 0 HD22 ASN A 596 -8.443 -13.367 9.579 1.00 2.86 H new ATOM 1008 N LYS A 597 -12.891 -12.574 10.985 1.00 2.20 N ATOM 1009 CA LYS A 597 -13.704 -11.732 11.855 1.00 2.02 C ATOM 1010 C LYS A 597 -14.084 -10.398 11.245 1.00 1.76 C ATOM 1011 O LYS A 597 -13.478 -9.921 10.290 1.00 1.78 O ATOM 1012 CB LYS A 597 -13.087 -11.537 13.266 1.00 2.10 C ATOM 1013 CG LYS A 597 -11.700 -12.133 13.562 1.00 2.88 C ATOM 1014 CD LYS A 597 -11.642 -13.599 14.039 1.00 2.61 C ATOM 1015 CE LYS A 597 -12.570 -14.553 13.301 1.00 3.16 C ATOM 1016 NZ LYS A 597 -12.475 -15.939 13.814 1.00 4.17 N ATOM 0 H LYS A 597 -11.923 -12.257 10.932 1.00 2.20 H new ATOM 0 HA LYS A 597 -14.630 -12.295 11.973 1.00 2.02 H new ATOM 0 HB2 LYS A 597 -13.032 -10.465 13.456 1.00 2.10 H new ATOM 0 HB3 LYS A 597 -13.786 -11.954 13.991 1.00 2.10 H new ATOM 0 HG2 LYS A 597 -11.098 -12.050 12.657 1.00 2.88 H new ATOM 0 HG3 LYS A 597 -11.222 -11.513 14.321 1.00 2.88 H new ATOM 0 HD2 LYS A 597 -10.618 -13.959 13.935 1.00 2.61 H new ATOM 0 HD3 LYS A 597 -11.884 -13.629 15.101 1.00 2.61 H new ATOM 0 HE2 LYS A 597 -13.598 -14.203 13.396 1.00 3.16 H new ATOM 0 HE3 LYS A 597 -12.327 -14.544 12.239 1.00 3.16 H new ATOM 0 HZ1 LYS A 597 -13.125 -16.552 13.281 1.00 4.17 H new ATOM 0 HZ2 LYS A 597 -11.501 -16.285 13.700 1.00 4.17 H new ATOM 0 HZ3 LYS A 597 -12.733 -15.955 14.821 1.00 4.17 H new ATOM 1030 N GLU A 598 -15.030 -9.761 11.922 1.00 1.78 N ATOM 1031 CA GLU A 598 -15.308 -8.336 11.780 1.00 1.81 C ATOM 1032 C GLU A 598 -14.558 -7.526 12.848 1.00 1.86 C ATOM 1033 O GLU A 598 -14.677 -7.758 14.055 1.00 2.07 O ATOM 1034 CB GLU A 598 -16.815 -8.044 11.705 1.00 2.35 C ATOM 1035 CG GLU A 598 -17.608 -8.485 12.939 1.00 2.88 C ATOM 1036 CD GLU A 598 -19.122 -8.349 12.737 1.00 3.45 C ATOM 1037 OE1 GLU A 598 -19.562 -7.363 12.086 1.00 3.42 O ATOM 1038 OE2 GLU A 598 -19.873 -9.216 13.250 1.00 4.56 O ATOM 0 H GLU A 598 -15.637 -10.227 12.597 1.00 1.78 H new ATOM 0 HA GLU A 598 -14.918 -8.001 10.819 1.00 1.81 H new ATOM 0 HB2 GLU A 598 -16.958 -6.973 11.560 1.00 2.35 H new ATOM 0 HB3 GLU A 598 -17.226 -8.542 10.827 1.00 2.35 H new ATOM 0 HG2 GLU A 598 -17.366 -9.522 13.172 1.00 2.88 H new ATOM 0 HG3 GLU A 598 -17.303 -7.886 13.797 1.00 2.88 H new ATOM 1045 N MET A 599 -13.734 -6.601 12.371 1.00 1.76 N ATOM 1046 CA MET A 599 -12.711 -5.858 13.106 1.00 1.81 C ATOM 1047 C MET A 599 -12.803 -4.346 12.898 1.00 1.91 C ATOM 1048 O MET A 599 -13.654 -3.831 12.160 1.00 2.36 O ATOM 1049 CB MET A 599 -11.320 -6.456 12.832 1.00 1.79 C ATOM 1050 CG MET A 599 -11.130 -7.796 13.546 1.00 2.20 C ATOM 1051 SD MET A 599 -9.482 -8.512 13.323 1.00 2.29 S ATOM 1052 CE MET A 599 -9.431 -8.551 11.513 1.00 2.10 C ATOM 0 H MET A 599 -13.763 -6.329 11.388 1.00 1.76 H new ATOM 0 HA MET A 599 -12.900 -5.978 14.173 1.00 1.81 H new ATOM 0 HB2 MET A 599 -11.188 -6.593 11.759 1.00 1.79 H new ATOM 0 HB3 MET A 599 -10.552 -5.756 13.161 1.00 1.79 H new ATOM 0 HG2 MET A 599 -11.316 -7.660 14.611 1.00 2.20 H new ATOM 0 HG3 MET A 599 -11.876 -8.502 13.180 1.00 2.20 H new ATOM 0 HE1 MET A 599 -8.663 -9.252 11.186 1.00 2.10 H new ATOM 0 HE2 MET A 599 -10.400 -8.869 11.128 1.00 2.10 H new ATOM 0 HE3 MET A 599 -9.200 -7.556 11.134 1.00 2.10 H new ATOM 1062 N LYS A 600 -11.910 -3.633 13.582 1.00 1.63 N ATOM 1063 CA LYS A 600 -11.342 -2.355 13.243 1.00 1.48 C ATOM 1064 C LYS A 600 -9.834 -2.424 12.942 1.00 1.55 C ATOM 1065 O LYS A 600 -9.148 -3.385 13.309 1.00 1.87 O ATOM 1066 CB LYS A 600 -11.646 -1.464 14.467 1.00 1.55 C ATOM 1067 CG LYS A 600 -11.848 -0.003 14.116 1.00 0.93 C ATOM 1068 CD LYS A 600 -13.222 0.230 13.475 1.00 1.24 C ATOM 1069 CE LYS A 600 -14.388 0.301 14.470 1.00 2.13 C ATOM 1070 NZ LYS A 600 -14.388 1.549 15.264 1.00 3.11 N ATOM 0 H LYS A 600 -11.540 -3.979 14.467 1.00 1.63 H new ATOM 0 HA LYS A 600 -11.771 -1.961 12.322 1.00 1.48 H new ATOM 0 HB2 LYS A 600 -12.541 -1.837 14.965 1.00 1.55 H new ATOM 0 HB3 LYS A 600 -10.826 -1.548 15.180 1.00 1.55 H new ATOM 0 HG2 LYS A 600 -11.756 0.606 15.015 1.00 0.93 H new ATOM 0 HG3 LYS A 600 -11.065 0.320 13.431 1.00 0.93 H new ATOM 0 HD2 LYS A 600 -13.190 1.159 12.906 1.00 1.24 H new ATOM 0 HD3 LYS A 600 -13.417 -0.572 12.764 1.00 1.24 H new ATOM 0 HE2 LYS A 600 -15.329 0.222 13.926 1.00 2.13 H new ATOM 0 HE3 LYS A 600 -14.337 -0.554 15.145 1.00 2.13 H new ATOM 0 HZ1 LYS A 600 -15.258 1.599 15.832 1.00 3.11 H new ATOM 0 HZ2 LYS A 600 -13.561 1.559 15.895 1.00 3.11 H new ATOM 0 HZ3 LYS A 600 -14.345 2.368 14.624 1.00 3.11 H new ATOM 1084 N LEU A 601 -9.337 -1.407 12.244 1.00 1.37 N ATOM 1085 CA LEU A 601 -7.970 -1.219 11.748 1.00 1.44 C ATOM 1086 C LEU A 601 -7.710 0.303 11.609 1.00 1.27 C ATOM 1087 O LEU A 601 -8.647 1.059 11.364 1.00 1.16 O ATOM 1088 CB LEU A 601 -7.893 -2.016 10.425 1.00 1.79 C ATOM 1089 CG LEU A 601 -6.799 -1.622 9.425 1.00 1.48 C ATOM 1090 CD1 LEU A 601 -5.424 -1.951 9.971 1.00 1.88 C ATOM 1091 CD2 LEU A 601 -6.969 -2.394 8.119 1.00 1.81 C ATOM 0 H LEU A 601 -9.932 -0.620 11.986 1.00 1.37 H new ATOM 0 HA LEU A 601 -7.188 -1.589 12.412 1.00 1.44 H new ATOM 0 HB2 LEU A 601 -7.758 -3.069 10.674 1.00 1.79 H new ATOM 0 HB3 LEU A 601 -8.856 -1.928 9.922 1.00 1.79 H new ATOM 0 HG LEU A 601 -6.889 -0.549 9.253 1.00 1.48 H new ATOM 0 HD11 LEU A 601 -4.665 -1.662 9.244 1.00 1.88 H new ATOM 0 HD12 LEU A 601 -5.262 -1.406 10.901 1.00 1.88 H new ATOM 0 HD13 LEU A 601 -5.355 -3.022 10.162 1.00 1.88 H new ATOM 0 HD21 LEU A 601 -6.185 -2.103 7.420 1.00 1.81 H new ATOM 0 HD22 LEU A 601 -6.900 -3.464 8.317 1.00 1.81 H new ATOM 0 HD23 LEU A 601 -7.943 -2.167 7.686 1.00 1.81 H new ATOM 1103 N SER A 602 -6.471 0.780 11.774 1.00 1.30 N ATOM 1104 CA SER A 602 -6.153 2.224 11.867 1.00 1.25 C ATOM 1105 C SER A 602 -4.793 2.602 11.256 1.00 1.35 C ATOM 1106 O SER A 602 -4.090 1.770 10.676 1.00 1.48 O ATOM 1107 CB SER A 602 -6.271 2.676 13.331 1.00 1.39 C ATOM 1108 OG SER A 602 -6.218 4.085 13.471 1.00 2.52 O ATOM 0 H SER A 602 -5.651 0.178 11.848 1.00 1.30 H new ATOM 0 HA SER A 602 -6.883 2.760 11.260 1.00 1.25 H new ATOM 0 HB2 SER A 602 -7.209 2.308 13.747 1.00 1.39 H new ATOM 0 HB3 SER A 602 -5.466 2.226 13.913 1.00 1.39 H new ATOM 0 HG SER A 602 -6.681 4.506 12.717 1.00 2.52 H new ATOM 1114 N ASP A 603 -4.460 3.892 11.325 1.00 1.36 N ATOM 1115 CA ASP A 603 -3.371 4.554 10.600 1.00 1.40 C ATOM 1116 C ASP A 603 -1.968 3.966 10.813 1.00 1.40 C ATOM 1117 O ASP A 603 -1.651 3.414 11.870 1.00 1.53 O ATOM 1118 CB ASP A 603 -3.390 6.065 10.857 1.00 1.45 C ATOM 1119 CG ASP A 603 -2.828 6.504 12.214 1.00 1.46 C ATOM 1120 OD1 ASP A 603 -1.590 6.636 12.350 1.00 1.78 O ATOM 1121 OD2 ASP A 603 -3.639 6.796 13.124 1.00 2.05 O ATOM 0 H ASP A 603 -4.972 4.541 11.922 1.00 1.36 H new ATOM 0 HA ASP A 603 -3.579 4.355 9.549 1.00 1.40 H new ATOM 0 HB2 ASP A 603 -2.821 6.558 10.069 1.00 1.45 H new ATOM 0 HB3 ASP A 603 -4.418 6.418 10.776 1.00 1.45 H new ATOM 1126 N GLY A 604 -1.122 4.105 9.785 1.00 1.25 N ATOM 1127 CA GLY A 604 0.214 3.508 9.726 1.00 1.23 C ATOM 1128 C GLY A 604 0.245 2.050 9.244 1.00 1.15 C ATOM 1129 O GLY A 604 1.278 1.387 9.365 1.00 1.42 O ATOM 0 H GLY A 604 -1.354 4.648 8.953 1.00 1.25 H new ATOM 0 HA2 GLY A 604 0.837 4.109 9.063 1.00 1.23 H new ATOM 0 HA3 GLY A 604 0.664 3.558 10.718 1.00 1.23 H new ATOM 1133 N SER A 605 -0.887 1.561 8.734 1.00 1.01 N ATOM 1134 CA SER A 605 -1.140 0.196 8.246 1.00 1.01 C ATOM 1135 C SER A 605 -1.363 0.162 6.724 1.00 0.94 C ATOM 1136 O SER A 605 -1.523 1.216 6.107 1.00 0.90 O ATOM 1137 CB SER A 605 -2.375 -0.354 8.955 1.00 1.04 C ATOM 1138 OG SER A 605 -2.275 -0.206 10.360 1.00 1.05 O ATOM 0 H SER A 605 -1.715 2.150 8.643 1.00 1.01 H new ATOM 0 HA SER A 605 -0.264 -0.415 8.462 1.00 1.01 H new ATOM 0 HB2 SER A 605 -3.264 0.165 8.596 1.00 1.04 H new ATOM 0 HB3 SER A 605 -2.499 -1.408 8.707 1.00 1.04 H new ATOM 0 HG SER A 605 -2.910 0.476 10.663 1.00 1.05 H new ATOM 1144 N TYR A 606 -1.413 -1.021 6.099 1.00 0.94 N ATOM 1145 CA TYR A 606 -1.531 -1.138 4.633 1.00 0.91 C ATOM 1146 C TYR A 606 -2.282 -2.382 4.114 1.00 0.97 C ATOM 1147 O TYR A 606 -2.293 -3.428 4.769 1.00 1.16 O ATOM 1148 CB TYR A 606 -0.137 -1.038 4.014 1.00 1.01 C ATOM 1149 CG TYR A 606 0.763 -2.237 4.242 1.00 1.28 C ATOM 1150 CD1 TYR A 606 1.578 -2.292 5.388 1.00 2.25 C ATOM 1151 CD2 TYR A 606 0.772 -3.299 3.316 1.00 2.46 C ATOM 1152 CE1 TYR A 606 2.396 -3.416 5.615 1.00 2.88 C ATOM 1153 CE2 TYR A 606 1.596 -4.419 3.537 1.00 2.99 C ATOM 1154 CZ TYR A 606 2.406 -4.483 4.691 1.00 2.79 C ATOM 1155 OH TYR A 606 3.211 -5.554 4.906 1.00 3.62 O ATOM 0 H TYR A 606 -1.374 -1.917 6.585 1.00 0.94 H new ATOM 0 HA TYR A 606 -2.164 -0.309 4.317 1.00 0.91 H new ATOM 0 HB2 TYR A 606 -0.245 -0.885 2.940 1.00 1.01 H new ATOM 0 HB3 TYR A 606 0.357 -0.153 4.414 1.00 1.01 H new ATOM 0 HD1 TYR A 606 1.576 -1.473 6.093 1.00 2.25 H new ATOM 0 HD2 TYR A 606 0.147 -3.254 2.437 1.00 2.46 H new ATOM 0 HE1 TYR A 606 3.017 -3.462 6.498 1.00 2.88 H new ATOM 0 HE2 TYR A 606 1.608 -5.229 2.823 1.00 2.99 H new ATOM 0 HH TYR A 606 3.098 -6.200 4.178 1.00 3.62 H new ATOM 1165 N PHE A 607 -2.913 -2.241 2.939 1.00 0.87 N ATOM 1166 CA PHE A 607 -3.947 -3.137 2.380 1.00 0.91 C ATOM 1167 C PHE A 607 -4.217 -2.932 0.863 1.00 1.38 C ATOM 1168 O PHE A 607 -3.534 -2.167 0.182 1.00 1.75 O ATOM 1169 CB PHE A 607 -5.234 -2.983 3.220 1.00 1.29 C ATOM 1170 CG PHE A 607 -5.844 -1.600 3.422 1.00 0.87 C ATOM 1171 CD1 PHE A 607 -5.422 -0.450 2.716 1.00 1.71 C ATOM 1172 CD2 PHE A 607 -6.894 -1.484 4.352 1.00 2.01 C ATOM 1173 CE1 PHE A 607 -6.020 0.797 2.965 1.00 1.83 C ATOM 1174 CE2 PHE A 607 -7.503 -0.241 4.583 1.00 1.93 C ATOM 1175 CZ PHE A 607 -7.063 0.899 3.900 1.00 0.94 C ATOM 0 H PHE A 607 -2.708 -1.459 2.317 1.00 0.87 H new ATOM 0 HA PHE A 607 -3.572 -4.158 2.446 1.00 0.91 H new ATOM 0 HB2 PHE A 607 -5.998 -3.612 2.763 1.00 1.29 H new ATOM 0 HB3 PHE A 607 -5.029 -3.396 4.208 1.00 1.29 H new ATOM 0 HD1 PHE A 607 -4.635 -0.530 1.981 1.00 1.71 H new ATOM 0 HD2 PHE A 607 -7.233 -2.356 4.891 1.00 2.01 H new ATOM 0 HE1 PHE A 607 -5.678 1.676 2.438 1.00 1.83 H new ATOM 0 HE2 PHE A 607 -8.315 -0.164 5.291 1.00 1.93 H new ATOM 0 HZ PHE A 607 -7.525 1.856 4.092 1.00 0.94 H new ATOM 1185 N GLY A 608 -5.209 -3.637 0.304 1.00 1.72 N ATOM 1186 CA GLY A 608 -5.711 -3.466 -1.068 1.00 2.57 C ATOM 1187 C GLY A 608 -5.158 -4.512 -2.031 1.00 3.10 C ATOM 1188 O GLY A 608 -5.899 -5.376 -2.504 1.00 4.13 O ATOM 0 H GLY A 608 -5.703 -4.370 0.813 1.00 1.72 H new ATOM 0 HA2 GLY A 608 -6.800 -3.523 -1.062 1.00 2.57 H new ATOM 0 HA3 GLY A 608 -5.446 -2.471 -1.426 1.00 2.57 H new ATOM 1192 N GLU A 609 -3.850 -4.473 -2.270 1.00 3.24 N ATOM 1193 CA GLU A 609 -3.100 -5.495 -3.006 1.00 3.78 C ATOM 1194 C GLU A 609 -1.647 -5.542 -2.529 1.00 3.24 C ATOM 1195 O GLU A 609 -1.061 -4.512 -2.197 1.00 4.35 O ATOM 1196 CB GLU A 609 -3.116 -5.236 -4.531 1.00 5.41 C ATOM 1197 CG GLU A 609 -4.022 -6.199 -5.313 1.00 6.28 C ATOM 1198 CD GLU A 609 -3.562 -7.666 -5.327 1.00 6.44 C ATOM 1199 OE1 GLU A 609 -2.682 -8.051 -4.517 1.00 6.29 O ATOM 1200 OE2 GLU A 609 -4.140 -8.447 -6.115 1.00 7.35 O ATOM 0 H GLU A 609 -3.261 -3.705 -1.948 1.00 3.24 H new ATOM 0 HA GLU A 609 -3.589 -6.449 -2.809 1.00 3.78 H new ATOM 0 HB2 GLU A 609 -3.446 -4.213 -4.713 1.00 5.41 H new ATOM 0 HB3 GLU A 609 -2.099 -5.316 -4.915 1.00 5.41 H new ATOM 0 HG2 GLU A 609 -5.025 -6.154 -4.889 1.00 6.28 H new ATOM 0 HG3 GLU A 609 -4.095 -5.848 -6.342 1.00 6.28 H new ATOM 1207 N ILE A 610 -1.047 -6.732 -2.592 1.00 2.43 N ATOM 1208 CA ILE A 610 0.403 -6.890 -2.663 1.00 2.47 C ATOM 1209 C ILE A 610 0.698 -7.858 -3.807 1.00 2.04 C ATOM 1210 O ILE A 610 0.632 -9.077 -3.657 1.00 2.84 O ATOM 1211 CB ILE A 610 1.084 -7.320 -1.338 1.00 3.35 C ATOM 1212 CG1 ILE A 610 0.868 -6.339 -0.160 1.00 4.72 C ATOM 1213 CG2 ILE A 610 2.599 -7.402 -1.639 1.00 3.91 C ATOM 1214 CD1 ILE A 610 -0.418 -6.582 0.643 1.00 5.70 C ATOM 0 H ILE A 610 -1.557 -7.615 -2.595 1.00 2.43 H new ATOM 0 HA ILE A 610 0.843 -5.911 -2.851 1.00 2.47 H new ATOM 0 HB ILE A 610 0.643 -8.265 -1.021 1.00 3.35 H new ATOM 0 HG12 ILE A 610 1.721 -6.408 0.515 1.00 4.72 H new ATOM 0 HG13 ILE A 610 0.851 -5.321 -0.550 1.00 4.72 H new ATOM 0 HG21 ILE A 610 3.133 -7.702 -0.738 1.00 3.91 H new ATOM 0 HG22 ILE A 610 2.774 -8.135 -2.426 1.00 3.91 H new ATOM 0 HG23 ILE A 610 2.958 -6.426 -1.966 1.00 3.91 H new ATOM 0 HD11 ILE A 610 -0.488 -5.850 1.448 1.00 5.70 H new ATOM 0 HD12 ILE A 610 -1.282 -6.483 -0.014 1.00 5.70 H new ATOM 0 HD13 ILE A 610 -0.398 -7.586 1.067 1.00 5.70 H new ATOM 1226 N CYS A 611 1.078 -7.291 -4.946 1.00 2.26 N ATOM 1227 CA CYS A 611 1.402 -7.982 -6.200 1.00 2.71 C ATOM 1228 C CYS A 611 2.890 -7.792 -6.603 1.00 2.05 C ATOM 1229 O CYS A 611 3.340 -8.243 -7.657 1.00 2.77 O ATOM 1230 CB CYS A 611 0.426 -7.371 -7.205 1.00 4.29 C ATOM 1231 SG CYS A 611 0.499 -8.170 -8.832 1.00 6.04 S ATOM 0 H CYS A 611 1.176 -6.279 -5.030 1.00 2.26 H new ATOM 0 HA CYS A 611 1.294 -9.065 -6.132 1.00 2.71 H new ATOM 0 HB2 CYS A 611 -0.588 -7.448 -6.813 1.00 4.29 H new ATOM 0 HB3 CYS A 611 0.644 -6.309 -7.317 1.00 4.29 H new ATOM 0 HG CYS A 611 1.713 -8.575 -9.062 1.00 6.04 H new ATOM 1237 N LEU A 612 3.654 -7.073 -5.771 1.00 1.59 N ATOM 1238 CA LEU A 612 4.950 -6.456 -6.085 1.00 1.37 C ATOM 1239 C LEU A 612 6.045 -7.487 -6.421 1.00 1.64 C ATOM 1240 O LEU A 612 6.803 -7.284 -7.370 1.00 1.99 O ATOM 1241 CB LEU A 612 5.296 -5.565 -4.869 1.00 1.65 C ATOM 1242 CG LEU A 612 6.294 -4.409 -5.054 1.00 1.46 C ATOM 1243 CD1 LEU A 612 7.718 -4.837 -5.373 1.00 2.51 C ATOM 1244 CD2 LEU A 612 5.855 -3.416 -6.124 1.00 1.03 C ATOM 0 H LEU A 612 3.369 -6.896 -4.808 1.00 1.59 H new ATOM 0 HA LEU A 612 4.889 -5.859 -6.995 1.00 1.37 H new ATOM 0 HB2 LEU A 612 4.364 -5.139 -4.497 1.00 1.65 H new ATOM 0 HB3 LEU A 612 5.686 -6.214 -4.085 1.00 1.65 H new ATOM 0 HG LEU A 612 6.294 -3.936 -4.072 1.00 1.46 H new ATOM 0 HD11 LEU A 612 8.347 -3.954 -5.485 1.00 2.51 H new ATOM 0 HD12 LEU A 612 8.102 -5.455 -4.562 1.00 2.51 H new ATOM 0 HD13 LEU A 612 7.727 -5.409 -6.301 1.00 2.51 H new ATOM 0 HD21 LEU A 612 6.597 -2.623 -6.211 1.00 1.03 H new ATOM 0 HD22 LEU A 612 5.760 -3.930 -7.080 1.00 1.03 H new ATOM 0 HD23 LEU A 612 4.893 -2.984 -5.847 1.00 1.03 H new ATOM 1256 N LEU A 613 6.090 -8.604 -5.682 1.00 1.74 N ATOM 1257 CA LEU A 613 6.932 -9.785 -5.962 1.00 2.14 C ATOM 1258 C LEU A 613 6.117 -11.096 -5.890 1.00 2.22 C ATOM 1259 O LEU A 613 6.666 -12.165 -5.617 1.00 2.95 O ATOM 1260 CB LEU A 613 8.175 -9.863 -5.046 1.00 2.55 C ATOM 1261 CG LEU A 613 8.873 -8.535 -4.703 1.00 2.94 C ATOM 1262 CD1 LEU A 613 8.313 -7.987 -3.388 1.00 3.49 C ATOM 1263 CD2 LEU A 613 10.377 -8.713 -4.513 1.00 3.90 C ATOM 0 H LEU A 613 5.523 -8.718 -4.842 1.00 1.74 H new ATOM 0 HA LEU A 613 7.293 -9.663 -6.983 1.00 2.14 H new ATOM 0 HB2 LEU A 613 7.879 -10.341 -4.112 1.00 2.55 H new ATOM 0 HB3 LEU A 613 8.906 -10.517 -5.521 1.00 2.55 H new ATOM 0 HG LEU A 613 8.691 -7.855 -5.535 1.00 2.94 H new ATOM 0 HD11 LEU A 613 8.808 -7.046 -3.146 1.00 3.49 H new ATOM 0 HD12 LEU A 613 7.241 -7.817 -3.492 1.00 3.49 H new ATOM 0 HD13 LEU A 613 8.491 -8.707 -2.589 1.00 3.49 H new ATOM 0 HD21 LEU A 613 10.830 -7.751 -4.272 1.00 3.90 H new ATOM 0 HD22 LEU A 613 10.560 -9.414 -3.699 1.00 3.90 H new ATOM 0 HD23 LEU A 613 10.816 -9.101 -5.432 1.00 3.90 H new ATOM 1275 N THR A 614 4.794 -10.972 -5.984 1.00 1.73 N ATOM 1276 CA THR A 614 3.813 -11.823 -5.283 1.00 2.18 C ATOM 1277 C THR A 614 2.528 -12.071 -6.092 1.00 2.39 C ATOM 1278 O THR A 614 2.244 -11.370 -7.070 1.00 2.28 O ATOM 1279 CB THR A 614 3.409 -11.136 -3.964 1.00 2.57 C ATOM 1280 OG1 THR A 614 3.119 -9.785 -4.230 1.00 3.70 O ATOM 1281 CG2 THR A 614 4.479 -11.103 -2.876 1.00 3.79 C ATOM 0 H THR A 614 4.355 -10.258 -6.565 1.00 1.73 H new ATOM 0 HA THR A 614 4.297 -12.786 -5.121 1.00 2.18 H new ATOM 0 HB THR A 614 2.571 -11.729 -3.597 1.00 2.57 H new ATOM 0 HG1 THR A 614 2.153 -9.676 -4.355 1.00 3.70 H new ATOM 0 HG21 THR A 614 4.086 -10.597 -1.994 1.00 3.79 H new ATOM 0 HG22 THR A 614 4.762 -12.122 -2.613 1.00 3.79 H new ATOM 0 HG23 THR A 614 5.354 -10.566 -3.242 1.00 3.79 H new ATOM 1289 N ARG A 615 1.706 -13.042 -5.655 1.00 3.10 N ATOM 1290 CA ARG A 615 0.370 -13.342 -6.217 1.00 3.58 C ATOM 1291 C ARG A 615 -0.698 -12.308 -5.828 1.00 3.50 C ATOM 1292 O ARG A 615 -0.645 -11.711 -4.750 1.00 4.53 O ATOM 1293 CB ARG A 615 -0.073 -14.781 -5.873 1.00 5.43 C ATOM 1294 CG ARG A 615 0.795 -15.817 -6.609 1.00 5.66 C ATOM 1295 CD ARG A 615 0.245 -17.250 -6.599 1.00 7.33 C ATOM 1296 NE ARG A 615 0.383 -17.915 -5.292 1.00 9.08 N ATOM 1297 CZ ARG A 615 0.473 -19.215 -5.067 1.00 10.69 C ATOM 1298 NH1 ARG A 615 0.348 -20.102 -6.009 1.00 11.07 N ATOM 1299 NH2 ARG A 615 0.685 -19.667 -3.869 1.00 12.23 N ATOM 0 H ARG A 615 1.956 -13.658 -4.881 1.00 3.10 H new ATOM 0 HA ARG A 615 0.470 -13.271 -7.300 1.00 3.58 H new ATOM 0 HB2 ARG A 615 -0.001 -14.940 -4.797 1.00 5.43 H new ATOM 0 HB3 ARG A 615 -1.119 -14.918 -6.146 1.00 5.43 H new ATOM 0 HG2 ARG A 615 0.916 -15.498 -7.644 1.00 5.66 H new ATOM 0 HG3 ARG A 615 1.788 -15.822 -6.159 1.00 5.66 H new ATOM 0 HD2 ARG A 615 -0.808 -17.230 -6.880 1.00 7.33 H new ATOM 0 HD3 ARG A 615 0.766 -17.837 -7.355 1.00 7.33 H new ATOM 0 HE ARG A 615 0.412 -17.308 -4.473 1.00 9.08 H new ATOM 0 HH11 ARG A 615 0.173 -19.805 -6.969 1.00 11.07 H new ATOM 0 HH12 ARG A 615 0.425 -21.095 -5.788 1.00 11.07 H new ATOM 0 HH21 ARG A 615 0.784 -19.017 -3.089 1.00 12.23 H new ATOM 0 HH22 ARG A 615 0.753 -20.672 -3.708 1.00 12.23 H new ATOM 1313 N GLY A 616 -1.658 -12.108 -6.730 1.00 3.02 N ATOM 1314 CA GLY A 616 -2.661 -11.040 -6.736 1.00 3.50 C ATOM 1315 C GLY A 616 -4.113 -11.532 -6.623 1.00 2.47 C ATOM 1316 O GLY A 616 -4.429 -12.406 -5.806 1.00 2.94 O ATOM 0 H GLY A 616 -1.764 -12.730 -7.532 1.00 3.02 H new ATOM 0 HA2 GLY A 616 -2.455 -10.360 -5.909 1.00 3.50 H new ATOM 0 HA3 GLY A 616 -2.556 -10.464 -7.656 1.00 3.50 H new ATOM 1320 N ARG A 617 -4.990 -10.954 -7.462 1.00 2.37 N ATOM 1321 CA ARG A 617 -6.466 -11.113 -7.477 1.00 1.66 C ATOM 1322 C ARG A 617 -7.152 -10.736 -6.150 1.00 2.16 C ATOM 1323 O ARG A 617 -8.240 -11.237 -5.851 1.00 3.31 O ATOM 1324 CB ARG A 617 -6.885 -12.516 -7.990 1.00 1.74 C ATOM 1325 CG ARG A 617 -6.455 -12.860 -9.426 1.00 2.06 C ATOM 1326 CD ARG A 617 -7.106 -11.943 -10.473 1.00 2.04 C ATOM 1327 NE ARG A 617 -7.890 -12.680 -11.480 1.00 2.53 N ATOM 1328 CZ ARG A 617 -9.188 -12.925 -11.447 1.00 2.58 C ATOM 1329 NH1 ARG A 617 -10.001 -12.426 -10.561 1.00 2.82 N ATOM 1330 NH2 ARG A 617 -9.742 -13.682 -12.342 1.00 3.46 N ATOM 0 H ARG A 617 -4.673 -10.322 -8.197 1.00 2.37 H new ATOM 0 HA ARG A 617 -6.836 -10.380 -8.194 1.00 1.66 H new ATOM 0 HB2 ARG A 617 -6.470 -13.267 -7.317 1.00 1.74 H new ATOM 0 HB3 ARG A 617 -7.970 -12.596 -7.927 1.00 1.74 H new ATOM 0 HG2 ARG A 617 -5.371 -12.783 -9.505 1.00 2.06 H new ATOM 0 HG3 ARG A 617 -6.718 -13.896 -9.642 1.00 2.06 H new ATOM 0 HD2 ARG A 617 -7.755 -11.228 -9.968 1.00 2.04 H new ATOM 0 HD3 ARG A 617 -6.329 -11.367 -10.976 1.00 2.04 H new ATOM 0 HE ARG A 617 -7.378 -13.038 -12.286 1.00 2.53 H new ATOM 0 HH11 ARG A 617 -9.645 -11.804 -9.835 1.00 2.82 H new ATOM 0 HH12 ARG A 617 -10.994 -12.657 -10.593 1.00 2.82 H new ATOM 0 HH21 ARG A 617 -9.175 -14.096 -13.082 1.00 3.46 H new ATOM 0 HH22 ARG A 617 -10.745 -13.864 -12.306 1.00 3.46 H new ATOM 1344 N ARG A 618 -6.522 -9.881 -5.335 1.00 1.88 N ATOM 1345 CA ARG A 618 -6.942 -9.615 -3.950 1.00 2.15 C ATOM 1346 C ARG A 618 -8.132 -8.657 -3.871 1.00 2.54 C ATOM 1347 O ARG A 618 -8.110 -7.572 -4.455 1.00 3.10 O ATOM 1348 CB ARG A 618 -5.743 -9.109 -3.129 1.00 2.21 C ATOM 1349 CG ARG A 618 -5.982 -9.201 -1.614 1.00 3.28 C ATOM 1350 CD ARG A 618 -4.914 -8.461 -0.806 1.00 3.98 C ATOM 1351 NE ARG A 618 -3.617 -9.165 -0.808 1.00 4.26 N ATOM 1352 CZ ARG A 618 -2.945 -9.595 0.245 1.00 5.24 C ATOM 1353 NH1 ARG A 618 -3.456 -9.623 1.441 1.00 6.01 N ATOM 1354 NH2 ARG A 618 -1.721 -10.020 0.106 1.00 6.09 N ATOM 0 H ARG A 618 -5.699 -9.349 -5.619 1.00 1.88 H new ATOM 0 HA ARG A 618 -7.290 -10.554 -3.518 1.00 2.15 H new ATOM 0 HB2 ARG A 618 -4.858 -9.690 -3.389 1.00 2.21 H new ATOM 0 HB3 ARG A 618 -5.535 -8.073 -3.398 1.00 2.21 H new ATOM 0 HG2 ARG A 618 -6.963 -8.787 -1.378 1.00 3.28 H new ATOM 0 HG3 ARG A 618 -5.998 -10.249 -1.315 1.00 3.28 H new ATOM 0 HD2 ARG A 618 -4.781 -7.460 -1.216 1.00 3.98 H new ATOM 0 HD3 ARG A 618 -5.258 -8.342 0.221 1.00 3.98 H new ATOM 0 HE ARG A 618 -3.194 -9.338 -1.720 1.00 4.26 H new ATOM 0 HH11 ARG A 618 -4.413 -9.305 1.594 1.00 6.01 H new ATOM 0 HH12 ARG A 618 -2.900 -9.963 2.225 1.00 6.01 H new ATOM 0 HH21 ARG A 618 -1.283 -10.020 -0.815 1.00 6.09 H new ATOM 0 HH22 ARG A 618 -1.201 -10.352 0.918 1.00 6.09 H new ATOM 1368 N THR A 619 -9.136 -9.031 -3.081 1.00 2.59 N ATOM 1369 CA THR A 619 -10.218 -8.144 -2.624 1.00 2.88 C ATOM 1370 C THR A 619 -10.551 -8.413 -1.153 1.00 2.24 C ATOM 1371 O THR A 619 -10.327 -9.522 -0.648 1.00 2.24 O ATOM 1372 CB THR A 619 -11.447 -8.240 -3.544 1.00 4.02 C ATOM 1373 OG1 THR A 619 -12.416 -7.276 -3.203 1.00 5.38 O ATOM 1374 CG2 THR A 619 -12.136 -9.603 -3.551 1.00 3.81 C ATOM 0 H THR A 619 -9.227 -9.984 -2.728 1.00 2.59 H new ATOM 0 HA THR A 619 -9.873 -7.112 -2.687 1.00 2.88 H new ATOM 0 HB THR A 619 -11.041 -8.066 -4.541 1.00 4.02 H new ATOM 0 HG1 THR A 619 -13.185 -7.358 -3.805 1.00 5.38 H new ATOM 0 HG21 THR A 619 -12.990 -9.575 -4.227 1.00 3.81 H new ATOM 0 HG22 THR A 619 -11.432 -10.365 -3.886 1.00 3.81 H new ATOM 0 HG23 THR A 619 -12.478 -9.843 -2.544 1.00 3.81 H new ATOM 1382 N ALA A 620 -11.070 -7.399 -0.459 1.00 2.10 N ATOM 1383 CA ALA A 620 -11.445 -7.446 0.951 1.00 1.74 C ATOM 1384 C ALA A 620 -12.672 -6.560 1.232 1.00 1.74 C ATOM 1385 O ALA A 620 -12.843 -5.491 0.638 1.00 2.23 O ATOM 1386 CB ALA A 620 -10.243 -7.020 1.805 1.00 2.02 C ATOM 0 H ALA A 620 -11.247 -6.488 -0.882 1.00 2.10 H new ATOM 0 HA ALA A 620 -11.725 -8.466 1.213 1.00 1.74 H new ATOM 0 HB1 ALA A 620 -10.516 -7.053 2.860 1.00 2.02 H new ATOM 0 HB2 ALA A 620 -9.410 -7.699 1.625 1.00 2.02 H new ATOM 0 HB3 ALA A 620 -9.948 -6.005 1.538 1.00 2.02 H new ATOM 1392 N SER A 621 -13.517 -6.994 2.166 1.00 1.66 N ATOM 1393 CA SER A 621 -14.730 -6.280 2.580 1.00 1.71 C ATOM 1394 C SER A 621 -14.382 -5.294 3.707 1.00 1.57 C ATOM 1395 O SER A 621 -14.173 -5.694 4.854 1.00 1.59 O ATOM 1396 CB SER A 621 -15.844 -7.266 2.986 1.00 1.83 C ATOM 1397 OG SER A 621 -15.864 -8.440 2.177 1.00 2.03 O ATOM 0 H SER A 621 -13.377 -7.870 2.669 1.00 1.66 H new ATOM 0 HA SER A 621 -15.120 -5.708 1.738 1.00 1.71 H new ATOM 0 HB2 SER A 621 -15.708 -7.551 4.029 1.00 1.83 H new ATOM 0 HB3 SER A 621 -16.810 -6.765 2.916 1.00 1.83 H new ATOM 0 HG SER A 621 -16.586 -9.031 2.476 1.00 2.03 H new ATOM 1403 N VAL A 622 -14.214 -4.007 3.383 1.00 1.41 N ATOM 1404 CA VAL A 622 -13.818 -2.981 4.368 1.00 1.26 C ATOM 1405 C VAL A 622 -14.326 -1.578 4.001 1.00 1.14 C ATOM 1406 O VAL A 622 -14.271 -1.162 2.839 1.00 1.08 O ATOM 1407 CB VAL A 622 -12.291 -3.045 4.626 1.00 1.23 C ATOM 1408 CG1 VAL A 622 -11.442 -3.057 3.355 1.00 1.24 C ATOM 1409 CG2 VAL A 622 -11.758 -1.942 5.546 1.00 1.08 C ATOM 0 H VAL A 622 -14.346 -3.644 2.439 1.00 1.41 H new ATOM 0 HA VAL A 622 -14.312 -3.207 5.313 1.00 1.26 H new ATOM 0 HB VAL A 622 -12.187 -4.005 5.132 1.00 1.23 H new ATOM 0 HG11 VAL A 622 -10.386 -3.103 3.623 1.00 1.24 H new ATOM 0 HG12 VAL A 622 -11.701 -3.927 2.752 1.00 1.24 H new ATOM 0 HG13 VAL A 622 -11.632 -2.149 2.782 1.00 1.24 H new ATOM 0 HG21 VAL A 622 -10.682 -2.062 5.673 1.00 1.08 H new ATOM 0 HG22 VAL A 622 -11.965 -0.968 5.103 1.00 1.08 H new ATOM 0 HG23 VAL A 622 -12.247 -2.010 6.518 1.00 1.08 H new ATOM 1419 N ARG A 623 -14.800 -0.833 5.012 1.00 1.12 N ATOM 1420 CA ARG A 623 -15.312 0.545 4.913 1.00 1.03 C ATOM 1421 C ARG A 623 -14.663 1.484 5.927 1.00 0.89 C ATOM 1422 O ARG A 623 -14.126 1.042 6.941 1.00 0.87 O ATOM 1423 CB ARG A 623 -16.855 0.575 4.998 1.00 1.22 C ATOM 1424 CG ARG A 623 -17.498 0.318 6.376 1.00 1.37 C ATOM 1425 CD ARG A 623 -17.714 -1.166 6.696 1.00 1.02 C ATOM 1426 NE ARG A 623 -18.348 -1.355 8.017 1.00 2.26 N ATOM 1427 CZ ARG A 623 -18.345 -2.464 8.739 1.00 3.24 C ATOM 1428 NH1 ARG A 623 -17.762 -3.561 8.362 1.00 3.43 N ATOM 1429 NH2 ARG A 623 -18.940 -2.534 9.890 1.00 4.68 N ATOM 0 H ARG A 623 -14.839 -1.191 5.966 1.00 1.12 H new ATOM 0 HA ARG A 623 -15.030 0.921 3.930 1.00 1.03 H new ATOM 0 HB2 ARG A 623 -17.192 1.550 4.646 1.00 1.22 H new ATOM 0 HB3 ARG A 623 -17.245 -0.167 4.301 1.00 1.22 H new ATOM 0 HG2 ARG A 623 -16.866 0.757 7.148 1.00 1.37 H new ATOM 0 HG3 ARG A 623 -18.458 0.832 6.419 1.00 1.37 H new ATOM 0 HD2 ARG A 623 -18.339 -1.617 5.925 1.00 1.02 H new ATOM 0 HD3 ARG A 623 -16.756 -1.686 6.675 1.00 1.02 H new ATOM 0 HE ARG A 623 -18.836 -0.551 8.412 1.00 2.26 H new ATOM 0 HH11 ARG A 623 -17.274 -3.598 7.467 1.00 3.43 H new ATOM 0 HH12 ARG A 623 -17.792 -4.386 8.961 1.00 3.43 H new ATOM 0 HH21 ARG A 623 -19.428 -1.719 10.262 1.00 4.68 H new ATOM 0 HH22 ARG A 623 -18.920 -3.404 10.423 1.00 4.68 H new ATOM 1443 N ALA A 624 -14.721 2.788 5.684 1.00 0.87 N ATOM 1444 CA ALA A 624 -14.249 3.770 6.659 1.00 0.86 C ATOM 1445 C ALA A 624 -15.226 3.909 7.853 1.00 0.89 C ATOM 1446 O ALA A 624 -16.440 4.035 7.668 1.00 0.96 O ATOM 1447 CB ALA A 624 -13.961 5.083 5.928 1.00 0.98 C ATOM 0 H ALA A 624 -15.089 3.192 4.823 1.00 0.87 H new ATOM 0 HA ALA A 624 -13.317 3.434 7.114 1.00 0.86 H new ATOM 0 HB1 ALA A 624 -13.608 5.827 6.642 1.00 0.98 H new ATOM 0 HB2 ALA A 624 -13.197 4.917 5.169 1.00 0.98 H new ATOM 0 HB3 ALA A 624 -14.873 5.442 5.452 1.00 0.98 H new ATOM 1453 N ASP A 625 -14.708 3.900 9.089 1.00 0.94 N ATOM 1454 CA ASP A 625 -15.502 4.122 10.322 1.00 1.02 C ATOM 1455 C ASP A 625 -15.865 5.603 10.529 1.00 1.10 C ATOM 1456 O ASP A 625 -16.762 5.968 11.291 1.00 1.18 O ATOM 1457 CB ASP A 625 -14.658 3.697 11.532 1.00 1.10 C ATOM 1458 CG ASP A 625 -15.486 3.527 12.813 1.00 1.56 C ATOM 1459 OD1 ASP A 625 -16.609 2.978 12.780 1.00 2.22 O ATOM 1460 OD2 ASP A 625 -14.990 3.924 13.895 1.00 2.46 O ATOM 0 H ASP A 625 -13.718 3.738 9.271 1.00 0.94 H new ATOM 0 HA ASP A 625 -16.420 3.543 10.223 1.00 1.02 H new ATOM 0 HB2 ASP A 625 -14.155 2.757 11.304 1.00 1.10 H new ATOM 0 HB3 ASP A 625 -13.881 4.441 11.705 1.00 1.10 H new ATOM 1465 N THR A 626 -15.062 6.439 9.886 1.00 1.08 N ATOM 1466 CA THR A 626 -14.803 7.863 10.143 1.00 1.10 C ATOM 1467 C THR A 626 -14.239 8.484 8.845 1.00 1.07 C ATOM 1468 O THR A 626 -14.032 7.754 7.874 1.00 1.03 O ATOM 1469 CB THR A 626 -13.829 7.967 11.338 1.00 1.14 C ATOM 1470 OG1 THR A 626 -13.525 9.302 11.674 1.00 1.30 O ATOM 1471 CG2 THR A 626 -12.518 7.209 11.122 1.00 1.13 C ATOM 0 H THR A 626 -14.517 6.111 9.089 1.00 1.08 H new ATOM 0 HA THR A 626 -15.705 8.413 10.409 1.00 1.10 H new ATOM 0 HB THR A 626 -14.368 7.499 12.162 1.00 1.14 H new ATOM 0 HG1 THR A 626 -12.908 9.315 12.435 1.00 1.30 H new ATOM 0 HG21 THR A 626 -11.882 7.325 12.000 1.00 1.13 H new ATOM 0 HG22 THR A 626 -12.731 6.152 10.965 1.00 1.13 H new ATOM 0 HG23 THR A 626 -12.006 7.610 10.247 1.00 1.13 H new ATOM 1479 N TYR A 627 -13.956 9.788 8.768 1.00 1.13 N ATOM 1480 CA TYR A 627 -13.088 10.309 7.697 1.00 1.22 C ATOM 1481 C TYR A 627 -11.684 9.686 7.837 1.00 1.32 C ATOM 1482 O TYR A 627 -11.054 9.750 8.899 1.00 1.66 O ATOM 1483 CB TYR A 627 -13.110 11.850 7.664 1.00 1.35 C ATOM 1484 CG TYR A 627 -11.921 12.539 6.995 1.00 1.82 C ATOM 1485 CD1 TYR A 627 -10.704 12.640 7.698 1.00 3.55 C ATOM 1486 CD2 TYR A 627 -12.017 13.106 5.704 1.00 1.74 C ATOM 1487 CE1 TYR A 627 -9.568 13.210 7.099 1.00 4.07 C ATOM 1488 CE2 TYR A 627 -10.888 13.729 5.120 1.00 2.24 C ATOM 1489 CZ TYR A 627 -9.652 13.747 5.800 1.00 3.04 C ATOM 1490 OH TYR A 627 -8.533 14.257 5.214 1.00 3.73 O ATOM 0 H TYR A 627 -14.305 10.493 9.418 1.00 1.13 H new ATOM 0 HA TYR A 627 -13.465 10.011 6.719 1.00 1.22 H new ATOM 0 HB2 TYR A 627 -14.019 12.166 7.152 1.00 1.35 H new ATOM 0 HB3 TYR A 627 -13.180 12.211 8.690 1.00 1.35 H new ATOM 0 HD1 TYR A 627 -10.644 12.274 8.712 1.00 3.55 H new ATOM 0 HD2 TYR A 627 -12.951 13.064 5.163 1.00 1.74 H new ATOM 0 HE1 TYR A 627 -8.631 13.236 7.635 1.00 4.07 H new ATOM 0 HE2 TYR A 627 -10.973 14.193 4.149 1.00 2.24 H new ATOM 0 HH TYR A 627 -8.755 14.588 4.319 1.00 3.73 H new ATOM 1500 N CYS A 628 -11.216 9.046 6.762 1.00 1.10 N ATOM 1501 CA CYS A 628 -9.940 8.345 6.687 1.00 1.03 C ATOM 1502 C CYS A 628 -9.203 8.707 5.395 1.00 0.99 C ATOM 1503 O CYS A 628 -9.724 8.548 4.286 1.00 1.03 O ATOM 1504 CB CYS A 628 -10.176 6.830 6.810 1.00 0.99 C ATOM 1505 SG CYS A 628 -8.617 5.966 7.128 1.00 2.79 S ATOM 0 H CYS A 628 -11.740 9.003 5.888 1.00 1.10 H new ATOM 0 HA CYS A 628 -9.304 8.656 7.515 1.00 1.03 H new ATOM 0 HB2 CYS A 628 -10.880 6.631 7.618 1.00 0.99 H new ATOM 0 HB3 CYS A 628 -10.628 6.451 5.893 1.00 0.99 H new ATOM 0 HG CYS A 628 -8.745 4.710 6.816 1.00 2.79 H new ATOM 1511 N ARG A 629 -7.968 9.185 5.550 1.00 0.96 N ATOM 1512 CA ARG A 629 -7.080 9.610 4.474 1.00 0.90 C ATOM 1513 C ARG A 629 -6.017 8.543 4.204 1.00 0.88 C ATOM 1514 O ARG A 629 -5.262 8.126 5.089 1.00 0.91 O ATOM 1515 CB ARG A 629 -6.541 11.003 4.822 1.00 0.87 C ATOM 1516 CG ARG A 629 -5.548 11.514 3.794 1.00 1.89 C ATOM 1517 CD ARG A 629 -5.273 13.007 3.993 1.00 1.97 C ATOM 1518 NE ARG A 629 -4.433 13.292 5.175 1.00 2.67 N ATOM 1519 CZ ARG A 629 -4.806 13.751 6.357 1.00 3.44 C ATOM 1520 NH1 ARG A 629 -6.036 14.036 6.659 1.00 4.00 N ATOM 1521 NH2 ARG A 629 -3.956 13.940 7.322 1.00 4.36 N ATOM 0 H ARG A 629 -7.543 9.290 6.471 1.00 0.96 H new ATOM 0 HA ARG A 629 -7.607 9.707 3.525 1.00 0.90 H new ATOM 0 HB2 ARG A 629 -7.373 11.703 4.898 1.00 0.87 H new ATOM 0 HB3 ARG A 629 -6.062 10.970 5.801 1.00 0.87 H new ATOM 0 HG2 ARG A 629 -4.616 10.955 3.874 1.00 1.89 H new ATOM 0 HG3 ARG A 629 -5.937 11.343 2.790 1.00 1.89 H new ATOM 0 HD2 ARG A 629 -4.782 13.401 3.103 1.00 1.97 H new ATOM 0 HD3 ARG A 629 -6.222 13.534 4.094 1.00 1.97 H new ATOM 0 HE ARG A 629 -3.435 13.111 5.064 1.00 2.67 H new ATOM 0 HH11 ARG A 629 -6.774 13.908 5.966 1.00 4.00 H new ATOM 0 HH12 ARG A 629 -6.265 14.387 7.589 1.00 4.00 H new ATOM 0 HH21 ARG A 629 -2.968 13.733 7.179 1.00 4.36 H new ATOM 0 HH22 ARG A 629 -4.277 14.296 8.222 1.00 4.36 H new ATOM 1535 N LEU A 630 -5.995 8.108 2.950 1.00 0.85 N ATOM 1536 CA LEU A 630 -5.201 7.011 2.404 1.00 0.81 C ATOM 1537 C LEU A 630 -4.206 7.524 1.342 1.00 0.82 C ATOM 1538 O LEU A 630 -4.184 8.698 0.958 1.00 1.08 O ATOM 1539 CB LEU A 630 -6.128 5.921 1.795 1.00 0.74 C ATOM 1540 CG LEU A 630 -7.258 5.326 2.665 1.00 0.73 C ATOM 1541 CD1 LEU A 630 -7.915 4.139 1.943 1.00 0.68 C ATOM 1542 CD2 LEU A 630 -6.743 4.803 4.002 1.00 0.83 C ATOM 0 H LEU A 630 -6.575 8.545 2.234 1.00 0.85 H new ATOM 0 HA LEU A 630 -4.629 6.569 3.220 1.00 0.81 H new ATOM 0 HB2 LEU A 630 -6.588 6.343 0.901 1.00 0.74 H new ATOM 0 HB3 LEU A 630 -5.495 5.096 1.469 1.00 0.74 H new ATOM 0 HG LEU A 630 -7.968 6.135 2.838 1.00 0.73 H new ATOM 0 HD11 LEU A 630 -8.709 3.729 2.566 1.00 0.68 H new ATOM 0 HD12 LEU A 630 -8.335 4.477 0.995 1.00 0.68 H new ATOM 0 HD13 LEU A 630 -7.167 3.369 1.754 1.00 0.68 H new ATOM 0 HD21 LEU A 630 -7.574 4.395 4.577 1.00 0.83 H new ATOM 0 HD22 LEU A 630 -6.004 4.021 3.827 1.00 0.83 H new ATOM 0 HD23 LEU A 630 -6.282 5.619 4.559 1.00 0.83 H new ATOM 1554 N TYR A 631 -3.385 6.608 0.852 1.00 0.67 N ATOM 1555 CA TYR A 631 -2.425 6.769 -0.241 1.00 0.68 C ATOM 1556 C TYR A 631 -2.509 5.571 -1.190 1.00 0.71 C ATOM 1557 O TYR A 631 -2.886 4.484 -0.740 1.00 0.87 O ATOM 1558 CB TYR A 631 -1.023 6.839 0.369 1.00 0.94 C ATOM 1559 CG TYR A 631 -0.418 8.216 0.511 1.00 1.91 C ATOM 1560 CD1 TYR A 631 -0.110 8.947 -0.646 1.00 3.08 C ATOM 1561 CD2 TYR A 631 -0.089 8.724 1.781 1.00 3.31 C ATOM 1562 CE1 TYR A 631 0.498 10.217 -0.541 1.00 4.57 C ATOM 1563 CE2 TYR A 631 0.523 9.988 1.891 1.00 4.75 C ATOM 1564 CZ TYR A 631 0.814 10.739 0.735 1.00 5.17 C ATOM 1565 OH TYR A 631 1.406 11.953 0.882 1.00 6.80 O ATOM 0 H TYR A 631 -3.367 5.662 1.232 1.00 0.67 H new ATOM 0 HA TYR A 631 -2.645 7.676 -0.804 1.00 0.68 H new ATOM 0 HB2 TYR A 631 -1.057 6.378 1.356 1.00 0.94 H new ATOM 0 HB3 TYR A 631 -0.354 6.234 -0.243 1.00 0.94 H new ATOM 0 HD1 TYR A 631 -0.338 8.538 -1.619 1.00 3.08 H new ATOM 0 HD2 TYR A 631 -0.305 8.147 2.668 1.00 3.31 H new ATOM 0 HE1 TYR A 631 0.721 10.787 -1.431 1.00 4.57 H new ATOM 0 HE2 TYR A 631 0.770 10.383 2.865 1.00 4.75 H new ATOM 0 HH TYR A 631 1.542 12.137 1.835 1.00 6.80 H new ATOM 1575 N SER A 632 -2.116 5.737 -2.461 1.00 0.69 N ATOM 1576 CA SER A 632 -1.968 4.617 -3.395 1.00 0.82 C ATOM 1577 C SER A 632 -0.744 4.692 -4.316 1.00 0.78 C ATOM 1578 O SER A 632 -0.343 5.770 -4.765 1.00 0.91 O ATOM 1579 CB SER A 632 -3.261 4.406 -4.191 1.00 1.10 C ATOM 1580 OG SER A 632 -3.424 5.374 -5.212 1.00 1.62 O ATOM 0 H SER A 632 -1.894 6.646 -2.866 1.00 0.69 H new ATOM 0 HA SER A 632 -1.779 3.744 -2.771 1.00 0.82 H new ATOM 0 HB2 SER A 632 -3.254 3.410 -4.634 1.00 1.10 H new ATOM 0 HB3 SER A 632 -4.114 4.448 -3.513 1.00 1.10 H new ATOM 0 HG SER A 632 -4.366 5.413 -5.479 1.00 1.62 H new ATOM 1586 N LEU A 633 -0.140 3.527 -4.597 1.00 0.74 N ATOM 1587 CA LEU A 633 1.127 3.394 -5.332 1.00 0.76 C ATOM 1588 C LEU A 633 1.146 2.119 -6.204 1.00 0.82 C ATOM 1589 O LEU A 633 0.854 1.016 -5.738 1.00 0.84 O ATOM 1590 CB LEU A 633 2.278 3.441 -4.300 1.00 0.74 C ATOM 1591 CG LEU A 633 3.644 3.917 -4.837 1.00 0.92 C ATOM 1592 CD1 LEU A 633 4.547 4.314 -3.665 1.00 1.09 C ATOM 1593 CD2 LEU A 633 4.385 2.845 -5.634 1.00 1.53 C ATOM 0 H LEU A 633 -0.529 2.628 -4.312 1.00 0.74 H new ATOM 0 HA LEU A 633 1.250 4.217 -6.036 1.00 0.76 H new ATOM 0 HB2 LEU A 633 1.981 4.099 -3.483 1.00 0.74 H new ATOM 0 HB3 LEU A 633 2.403 2.444 -3.878 1.00 0.74 H new ATOM 0 HG LEU A 633 3.432 4.757 -5.498 1.00 0.92 H new ATOM 0 HD11 LEU A 633 5.511 4.650 -4.046 1.00 1.09 H new ATOM 0 HD12 LEU A 633 4.078 5.121 -3.102 1.00 1.09 H new ATOM 0 HD13 LEU A 633 4.695 3.454 -3.012 1.00 1.09 H new ATOM 0 HD21 LEU A 633 5.337 3.244 -5.983 1.00 1.53 H new ATOM 0 HD22 LEU A 633 4.566 1.979 -4.998 1.00 1.53 H new ATOM 0 HD23 LEU A 633 3.781 2.546 -6.491 1.00 1.53 H new ATOM 1605 N SER A 634 1.472 2.283 -7.488 1.00 0.94 N ATOM 1606 CA SER A 634 1.527 1.230 -8.512 1.00 0.99 C ATOM 1607 C SER A 634 2.800 0.378 -8.483 1.00 0.99 C ATOM 1608 O SER A 634 3.918 0.890 -8.366 1.00 0.97 O ATOM 1609 CB SER A 634 1.382 1.898 -9.876 1.00 1.03 C ATOM 1610 OG SER A 634 1.603 1.003 -10.944 1.00 2.29 O ATOM 0 H SER A 634 1.718 3.199 -7.864 1.00 0.94 H new ATOM 0 HA SER A 634 0.714 0.534 -8.304 1.00 0.99 H new ATOM 0 HB2 SER A 634 0.382 2.323 -9.964 1.00 1.03 H new ATOM 0 HB3 SER A 634 2.088 2.726 -9.948 1.00 1.03 H new ATOM 0 HG SER A 634 1.497 1.477 -11.795 1.00 2.29 H new ATOM 1616 N VAL A 635 2.651 -0.933 -8.702 1.00 1.07 N ATOM 1617 CA VAL A 635 3.798 -1.848 -8.826 1.00 1.15 C ATOM 1618 C VAL A 635 4.593 -1.601 -10.103 1.00 1.13 C ATOM 1619 O VAL A 635 5.782 -1.906 -10.118 1.00 1.30 O ATOM 1620 CB VAL A 635 3.427 -3.340 -8.700 1.00 1.29 C ATOM 1621 CG1 VAL A 635 2.340 -3.600 -7.661 1.00 1.50 C ATOM 1622 CG2 VAL A 635 3.041 -4.047 -9.995 1.00 1.87 C ATOM 0 H VAL A 635 1.744 -1.389 -8.798 1.00 1.07 H new ATOM 0 HA VAL A 635 4.432 -1.614 -7.971 1.00 1.15 H new ATOM 0 HB VAL A 635 4.372 -3.774 -8.374 1.00 1.29 H new ATOM 0 HG11 VAL A 635 2.124 -4.668 -7.620 1.00 1.50 H new ATOM 0 HG12 VAL A 635 2.683 -3.261 -6.683 1.00 1.50 H new ATOM 0 HG13 VAL A 635 1.436 -3.057 -7.937 1.00 1.50 H new ATOM 0 HG21 VAL A 635 2.801 -5.089 -9.783 1.00 1.87 H new ATOM 0 HG22 VAL A 635 2.172 -3.556 -10.432 1.00 1.87 H new ATOM 0 HG23 VAL A 635 3.874 -4.002 -10.696 1.00 1.87 H new ATOM 1632 N ASP A 636 3.992 -1.029 -11.155 1.00 1.02 N ATOM 1633 CA ASP A 636 4.745 -0.635 -12.347 1.00 1.09 C ATOM 1634 C ASP A 636 5.782 0.423 -11.980 1.00 1.04 C ATOM 1635 O ASP A 636 6.953 0.277 -12.328 1.00 1.28 O ATOM 1636 CB ASP A 636 3.830 -0.072 -13.444 1.00 1.17 C ATOM 1637 CG ASP A 636 3.012 -1.120 -14.191 1.00 1.64 C ATOM 1638 OD1 ASP A 636 3.492 -2.257 -14.406 1.00 2.49 O ATOM 1639 OD2 ASP A 636 1.892 -0.790 -14.643 1.00 2.09 O ATOM 0 H ASP A 636 2.993 -0.831 -11.202 1.00 1.02 H new ATOM 0 HA ASP A 636 5.233 -1.530 -12.732 1.00 1.09 H new ATOM 0 HB2 ASP A 636 3.148 0.649 -12.994 1.00 1.17 H new ATOM 0 HB3 ASP A 636 4.441 0.473 -14.164 1.00 1.17 H new ATOM 1644 N ASN A 637 5.374 1.444 -11.221 1.00 0.87 N ATOM 1645 CA ASN A 637 6.229 2.570 -10.865 1.00 0.81 C ATOM 1646 C ASN A 637 7.290 2.216 -9.800 1.00 0.75 C ATOM 1647 O ASN A 637 8.308 2.899 -9.739 1.00 0.89 O ATOM 1648 CB ASN A 637 5.342 3.771 -10.484 1.00 0.93 C ATOM 1649 CG ASN A 637 4.462 4.237 -11.637 1.00 1.42 C ATOM 1650 OD1 ASN A 637 3.242 4.234 -11.558 1.00 2.40 O ATOM 1651 ND2 ASN A 637 5.037 4.683 -12.727 1.00 1.27 N ATOM 0 H ASN A 637 4.432 1.509 -10.835 1.00 0.87 H new ATOM 0 HA ASN A 637 6.825 2.849 -11.734 1.00 0.81 H new ATOM 0 HB2 ASN A 637 4.712 3.499 -9.638 1.00 0.93 H new ATOM 0 HB3 ASN A 637 5.975 4.596 -10.158 1.00 0.93 H new ATOM 0 HD21 ASN A 637 4.467 5.024 -13.501 1.00 1.27 H new ATOM 0 HD22 ASN A 637 6.054 4.689 -12.801 1.00 1.27 H new ATOM 1658 N PHE A 638 7.112 1.129 -9.029 1.00 0.77 N ATOM 1659 CA PHE A 638 8.145 0.463 -8.217 1.00 0.84 C ATOM 1660 C PHE A 638 9.136 -0.332 -9.085 1.00 0.89 C ATOM 1661 O PHE A 638 10.353 -0.168 -8.985 1.00 0.93 O ATOM 1662 CB PHE A 638 7.485 -0.465 -7.196 1.00 1.02 C ATOM 1663 CG PHE A 638 8.416 -0.953 -6.087 1.00 1.21 C ATOM 1664 CD1 PHE A 638 9.517 -1.792 -6.362 1.00 2.43 C ATOM 1665 CD2 PHE A 638 8.145 -0.603 -4.752 1.00 1.60 C ATOM 1666 CE1 PHE A 638 10.372 -2.213 -5.327 1.00 2.66 C ATOM 1667 CE2 PHE A 638 8.993 -1.031 -3.714 1.00 1.73 C ATOM 1668 CZ PHE A 638 10.114 -1.822 -4.003 1.00 1.74 C ATOM 0 H PHE A 638 6.204 0.671 -8.952 1.00 0.77 H new ATOM 0 HA PHE A 638 8.710 1.239 -7.700 1.00 0.84 H new ATOM 0 HB2 PHE A 638 6.642 0.056 -6.742 1.00 1.02 H new ATOM 0 HB3 PHE A 638 7.080 -1.331 -7.720 1.00 1.02 H new ATOM 0 HD1 PHE A 638 9.705 -2.114 -7.376 1.00 2.43 H new ATOM 0 HD2 PHE A 638 7.279 -0.001 -4.522 1.00 1.60 H new ATOM 0 HE1 PHE A 638 11.225 -2.836 -5.550 1.00 2.66 H new ATOM 0 HE2 PHE A 638 8.780 -0.750 -2.693 1.00 1.73 H new ATOM 0 HZ PHE A 638 10.778 -2.130 -3.209 1.00 1.74 H new ATOM 1678 N ASN A 639 8.627 -1.213 -9.952 1.00 0.95 N ATOM 1679 CA ASN A 639 9.458 -2.049 -10.821 1.00 1.04 C ATOM 1680 C ASN A 639 10.257 -1.197 -11.837 1.00 1.08 C ATOM 1681 O ASN A 639 11.315 -1.628 -12.301 1.00 1.16 O ATOM 1682 CB ASN A 639 8.561 -3.103 -11.497 1.00 1.12 C ATOM 1683 CG ASN A 639 8.229 -4.305 -10.620 1.00 1.41 C ATOM 1684 OD1 ASN A 639 9.064 -5.179 -10.419 1.00 1.93 O ATOM 1685 ND2 ASN A 639 7.029 -4.424 -10.094 1.00 1.40 N ATOM 0 H ASN A 639 7.626 -1.366 -10.070 1.00 0.95 H new ATOM 0 HA ASN A 639 10.210 -2.567 -10.226 1.00 1.04 H new ATOM 0 HB2 ASN A 639 7.631 -2.626 -11.806 1.00 1.12 H new ATOM 0 HB3 ASN A 639 9.055 -3.455 -12.403 1.00 1.12 H new ATOM 0 HD21 ASN A 639 6.800 -5.239 -9.524 1.00 1.40 H new ATOM 0 HD22 ASN A 639 6.327 -3.702 -10.256 1.00 1.40 H new ATOM 1692 N GLU A 640 9.793 0.022 -12.138 1.00 1.07 N ATOM 1693 CA GLU A 640 10.495 1.051 -12.913 1.00 1.11 C ATOM 1694 C GLU A 640 11.724 1.619 -12.185 1.00 1.13 C ATOM 1695 O GLU A 640 12.824 1.604 -12.734 1.00 1.34 O ATOM 1696 CB GLU A 640 9.535 2.226 -13.194 1.00 1.05 C ATOM 1697 CG GLU A 640 8.616 2.095 -14.423 1.00 1.85 C ATOM 1698 CD GLU A 640 9.312 2.176 -15.790 1.00 2.41 C ATOM 1699 OE1 GLU A 640 10.385 1.555 -15.976 1.00 3.17 O ATOM 1700 OE2 GLU A 640 8.759 2.815 -16.724 1.00 3.26 O ATOM 0 H GLU A 640 8.871 0.333 -11.832 1.00 1.07 H new ATOM 0 HA GLU A 640 10.832 0.570 -13.831 1.00 1.11 H new ATOM 0 HB2 GLU A 640 8.907 2.369 -12.314 1.00 1.05 H new ATOM 0 HB3 GLU A 640 10.131 3.131 -13.311 1.00 1.05 H new ATOM 0 HG2 GLU A 640 8.090 1.142 -14.360 1.00 1.85 H new ATOM 0 HG3 GLU A 640 7.861 2.880 -14.374 1.00 1.85 H new ATOM 1707 N VAL A 641 11.545 2.130 -10.963 1.00 0.99 N ATOM 1708 CA VAL A 641 12.591 2.823 -10.180 1.00 1.03 C ATOM 1709 C VAL A 641 13.701 1.877 -9.713 1.00 1.10 C ATOM 1710 O VAL A 641 14.853 2.289 -9.585 1.00 1.20 O ATOM 1711 CB VAL A 641 11.944 3.602 -9.017 1.00 0.95 C ATOM 1712 CG1 VAL A 641 11.076 2.732 -8.120 1.00 0.96 C ATOM 1713 CG2 VAL A 641 12.924 4.347 -8.107 1.00 0.98 C ATOM 0 H VAL A 641 10.652 2.076 -10.474 1.00 0.99 H new ATOM 0 HA VAL A 641 13.087 3.540 -10.834 1.00 1.03 H new ATOM 0 HB VAL A 641 11.337 4.334 -9.550 1.00 0.95 H new ATOM 0 HG11 VAL A 641 10.651 3.342 -7.322 1.00 0.96 H new ATOM 0 HG12 VAL A 641 10.271 2.292 -8.709 1.00 0.96 H new ATOM 0 HG13 VAL A 641 11.683 1.938 -7.685 1.00 0.96 H new ATOM 0 HG21 VAL A 641 12.371 4.863 -7.322 1.00 0.98 H new ATOM 0 HG22 VAL A 641 13.615 3.635 -7.657 1.00 0.98 H new ATOM 0 HG23 VAL A 641 13.484 5.075 -8.694 1.00 0.98 H new ATOM 1723 N LEU A 642 13.395 0.585 -9.552 1.00 1.10 N ATOM 1724 CA LEU A 642 14.407 -0.453 -9.291 1.00 1.19 C ATOM 1725 C LEU A 642 15.489 -0.545 -10.395 1.00 1.34 C ATOM 1726 O LEU A 642 16.584 -1.050 -10.145 1.00 1.55 O ATOM 1727 CB LEU A 642 13.727 -1.825 -9.073 1.00 1.13 C ATOM 1728 CG LEU A 642 14.090 -2.514 -7.741 1.00 1.61 C ATOM 1729 CD1 LEU A 642 13.490 -3.920 -7.672 1.00 1.82 C ATOM 1730 CD2 LEU A 642 15.588 -2.700 -7.521 1.00 2.74 C ATOM 0 H LEU A 642 12.441 0.226 -9.598 1.00 1.10 H new ATOM 0 HA LEU A 642 14.928 -0.159 -8.380 1.00 1.19 H new ATOM 0 HB2 LEU A 642 12.646 -1.692 -9.116 1.00 1.13 H new ATOM 0 HB3 LEU A 642 13.999 -2.486 -9.896 1.00 1.13 H new ATOM 0 HG LEU A 642 13.690 -1.843 -6.980 1.00 1.61 H new ATOM 0 HD11 LEU A 642 13.760 -4.385 -6.724 1.00 1.82 H new ATOM 0 HD12 LEU A 642 12.405 -3.857 -7.749 1.00 1.82 H new ATOM 0 HD13 LEU A 642 13.877 -4.522 -8.494 1.00 1.82 H new ATOM 0 HD21 LEU A 642 15.757 -3.191 -6.563 1.00 2.74 H new ATOM 0 HD22 LEU A 642 16.000 -3.315 -8.321 1.00 2.74 H new ATOM 0 HD23 LEU A 642 16.079 -1.727 -7.522 1.00 2.74 H new ATOM 1742 N GLU A 643 15.231 -0.049 -11.610 1.00 1.32 N ATOM 1743 CA GLU A 643 16.206 -0.012 -12.703 1.00 1.47 C ATOM 1744 C GLU A 643 17.311 1.047 -12.499 1.00 1.43 C ATOM 1745 O GLU A 643 18.301 1.046 -13.230 1.00 1.63 O ATOM 1746 CB GLU A 643 15.456 0.247 -14.017 1.00 1.60 C ATOM 1747 CG GLU A 643 14.268 -0.703 -14.278 1.00 1.90 C ATOM 1748 CD GLU A 643 14.608 -1.998 -15.030 1.00 2.40 C ATOM 1749 OE1 GLU A 643 15.348 -1.962 -16.048 1.00 2.86 O ATOM 1750 OE2 GLU A 643 14.051 -3.059 -14.651 1.00 3.40 O ATOM 0 H GLU A 643 14.325 0.344 -11.864 1.00 1.32 H new ATOM 0 HA GLU A 643 16.715 -0.975 -12.729 1.00 1.47 H new ATOM 0 HB2 GLU A 643 15.089 1.273 -14.014 1.00 1.60 H new ATOM 0 HB3 GLU A 643 16.160 0.162 -14.845 1.00 1.60 H new ATOM 0 HG2 GLU A 643 13.820 -0.967 -13.320 1.00 1.90 H new ATOM 0 HG3 GLU A 643 13.511 -0.162 -14.846 1.00 1.90 H new ATOM 1757 N GLU A 644 17.194 1.963 -11.529 1.00 1.26 N ATOM 1758 CA GLU A 644 18.223 2.963 -11.206 1.00 1.31 C ATOM 1759 C GLU A 644 19.201 2.519 -10.100 1.00 1.30 C ATOM 1760 O GLU A 644 20.258 3.131 -9.905 1.00 1.34 O ATOM 1761 CB GLU A 644 17.483 4.219 -10.782 1.00 1.32 C ATOM 1762 CG GLU A 644 16.655 4.796 -11.935 1.00 1.40 C ATOM 1763 CD GLU A 644 17.469 5.734 -12.828 1.00 1.72 C ATOM 1764 OE1 GLU A 644 18.132 5.259 -13.780 1.00 3.15 O ATOM 1765 OE2 GLU A 644 17.474 6.968 -12.585 1.00 1.74 O ATOM 0 H GLU A 644 16.367 2.032 -10.935 1.00 1.26 H new ATOM 0 HA GLU A 644 18.848 3.122 -12.085 1.00 1.31 H new ATOM 0 HB2 GLU A 644 16.829 3.991 -9.941 1.00 1.32 H new ATOM 0 HB3 GLU A 644 18.198 4.965 -10.436 1.00 1.32 H new ATOM 0 HG2 GLU A 644 16.258 3.979 -12.538 1.00 1.40 H new ATOM 0 HG3 GLU A 644 15.800 5.337 -11.529 1.00 1.40 H new ATOM 1772 N TYR A 645 18.825 1.455 -9.384 1.00 1.29 N ATOM 1773 CA TYR A 645 19.488 0.901 -8.196 1.00 1.28 C ATOM 1774 C TYR A 645 19.727 -0.621 -8.332 1.00 1.37 C ATOM 1775 O TYR A 645 19.080 -1.407 -7.630 1.00 1.39 O ATOM 1776 CB TYR A 645 18.652 1.225 -6.943 1.00 1.24 C ATOM 1777 CG TYR A 645 18.477 2.704 -6.673 1.00 1.13 C ATOM 1778 CD1 TYR A 645 17.445 3.410 -7.314 1.00 2.19 C ATOM 1779 CD2 TYR A 645 19.358 3.376 -5.806 1.00 1.82 C ATOM 1780 CE1 TYR A 645 17.320 4.799 -7.140 1.00 2.12 C ATOM 1781 CE2 TYR A 645 19.224 4.762 -5.607 1.00 1.85 C ATOM 1782 CZ TYR A 645 18.220 5.481 -6.292 1.00 1.02 C ATOM 1783 OH TYR A 645 18.146 6.832 -6.161 1.00 1.06 O ATOM 0 H TYR A 645 17.993 0.921 -9.635 1.00 1.29 H new ATOM 0 HA TYR A 645 20.470 1.365 -8.098 1.00 1.28 H new ATOM 0 HB2 TYR A 645 17.668 0.769 -7.050 1.00 1.24 H new ATOM 0 HB3 TYR A 645 19.125 0.763 -6.076 1.00 1.24 H new ATOM 0 HD1 TYR A 645 16.744 2.882 -7.944 1.00 2.19 H new ATOM 0 HD2 TYR A 645 20.136 2.829 -5.294 1.00 1.82 H new ATOM 0 HE1 TYR A 645 16.540 5.342 -7.652 1.00 2.12 H new ATOM 0 HE2 TYR A 645 19.889 5.277 -4.930 1.00 1.85 H new ATOM 0 HH TYR A 645 18.838 7.139 -5.539 1.00 1.06 H new ATOM 1793 N PRO A 646 20.639 -1.085 -9.210 1.00 1.43 N ATOM 1794 CA PRO A 646 20.896 -2.515 -9.425 1.00 1.52 C ATOM 1795 C PRO A 646 21.282 -3.298 -8.154 1.00 1.52 C ATOM 1796 O PRO A 646 21.013 -4.502 -8.087 1.00 1.56 O ATOM 1797 CB PRO A 646 21.991 -2.578 -10.498 1.00 1.64 C ATOM 1798 CG PRO A 646 22.665 -1.207 -10.429 1.00 1.58 C ATOM 1799 CD PRO A 646 21.502 -0.288 -10.069 1.00 1.47 C ATOM 0 HA PRO A 646 19.977 -3.010 -9.741 1.00 1.52 H new ATOM 0 HB2 PRO A 646 22.700 -3.381 -10.296 1.00 1.64 H new ATOM 0 HB3 PRO A 646 21.570 -2.765 -11.486 1.00 1.64 H new ATOM 0 HG2 PRO A 646 23.453 -1.179 -9.676 1.00 1.58 H new ATOM 0 HG3 PRO A 646 23.122 -0.931 -11.379 1.00 1.58 H new ATOM 0 HD2 PRO A 646 21.852 0.607 -9.555 1.00 1.47 H new ATOM 0 HD3 PRO A 646 20.971 0.044 -10.961 1.00 1.47 H new ATOM 1807 N MET A 647 21.814 -2.651 -7.106 1.00 1.53 N ATOM 1808 CA MET A 647 22.067 -3.321 -5.819 1.00 1.66 C ATOM 1809 C MET A 647 20.765 -3.745 -5.105 1.00 1.59 C ATOM 1810 O MET A 647 20.742 -4.748 -4.388 1.00 1.75 O ATOM 1811 CB MET A 647 22.929 -2.415 -4.921 1.00 1.82 C ATOM 1812 CG MET A 647 22.073 -1.285 -4.355 1.00 2.42 C ATOM 1813 SD MET A 647 22.906 0.024 -3.444 1.00 2.81 S ATOM 1814 CE MET A 647 21.374 0.737 -2.796 1.00 2.51 C ATOM 0 H MET A 647 22.077 -1.666 -7.123 1.00 1.53 H new ATOM 0 HA MET A 647 22.612 -4.242 -6.025 1.00 1.66 H new ATOM 0 HB2 MET A 647 23.362 -2.998 -4.108 1.00 1.82 H new ATOM 0 HB3 MET A 647 23.759 -2.003 -5.494 1.00 1.82 H new ATOM 0 HG2 MET A 647 21.534 -0.826 -5.184 1.00 2.42 H new ATOM 0 HG3 MET A 647 21.326 -1.728 -3.696 1.00 2.42 H new ATOM 0 HE1 MET A 647 21.609 1.599 -2.172 1.00 2.51 H new ATOM 0 HE2 MET A 647 20.740 1.051 -3.625 1.00 2.51 H new ATOM 0 HE3 MET A 647 20.849 -0.009 -2.200 1.00 2.51 H new ATOM 1824 N MET A 648 19.666 -2.999 -5.296 1.00 1.46 N ATOM 1825 CA MET A 648 18.401 -3.213 -4.584 1.00 1.40 C ATOM 1826 C MET A 648 17.636 -4.430 -5.115 1.00 1.43 C ATOM 1827 O MET A 648 16.861 -5.026 -4.371 1.00 1.47 O ATOM 1828 CB MET A 648 17.529 -1.943 -4.611 1.00 1.31 C ATOM 1829 CG MET A 648 17.947 -0.887 -3.581 1.00 1.50 C ATOM 1830 SD MET A 648 17.854 -1.371 -1.827 1.00 1.75 S ATOM 1831 CE MET A 648 16.116 -1.882 -1.675 1.00 1.79 C ATOM 0 H MET A 648 19.632 -2.223 -5.957 1.00 1.46 H new ATOM 0 HA MET A 648 18.649 -3.428 -3.545 1.00 1.40 H new ATOM 0 HB2 MET A 648 17.573 -1.503 -5.607 1.00 1.31 H new ATOM 0 HB3 MET A 648 16.491 -2.222 -4.432 1.00 1.31 H new ATOM 0 HG2 MET A 648 18.973 -0.588 -3.797 1.00 1.50 H new ATOM 0 HG3 MET A 648 17.321 -0.006 -3.724 1.00 1.50 H new ATOM 0 HE1 MET A 648 15.881 -2.067 -0.627 1.00 1.79 H new ATOM 0 HE2 MET A 648 15.470 -1.092 -2.058 1.00 1.79 H new ATOM 0 HE3 MET A 648 15.953 -2.794 -2.249 1.00 1.79 H new ATOM 1841 N ARG A 649 17.897 -4.862 -6.359 1.00 1.61 N ATOM 1842 CA ARG A 649 17.438 -6.163 -6.874 1.00 2.01 C ATOM 1843 C ARG A 649 18.001 -7.280 -5.999 1.00 2.22 C ATOM 1844 O ARG A 649 17.242 -8.039 -5.401 1.00 2.58 O ATOM 1845 CB ARG A 649 17.812 -6.279 -8.368 1.00 2.30 C ATOM 1846 CG ARG A 649 17.792 -7.688 -8.997 1.00 3.30 C ATOM 1847 CD ARG A 649 16.564 -8.546 -8.669 1.00 3.01 C ATOM 1848 NE ARG A 649 15.298 -7.877 -9.024 1.00 3.27 N ATOM 1849 CZ ARG A 649 14.082 -8.250 -8.665 1.00 4.61 C ATOM 1850 NH1 ARG A 649 13.815 -9.308 -7.955 1.00 5.46 N ATOM 1851 NH2 ARG A 649 13.043 -7.560 -9.017 1.00 5.71 N ATOM 0 H ARG A 649 18.432 -4.319 -7.037 1.00 1.61 H new ATOM 0 HA ARG A 649 16.353 -6.253 -6.822 1.00 2.01 H new ATOM 0 HB2 ARG A 649 17.130 -5.647 -8.936 1.00 2.30 H new ATOM 0 HB3 ARG A 649 18.812 -5.866 -8.498 1.00 2.30 H new ATOM 0 HG2 ARG A 649 17.860 -7.583 -10.080 1.00 3.30 H new ATOM 0 HG3 ARG A 649 18.684 -8.224 -8.672 1.00 3.30 H new ATOM 0 HD2 ARG A 649 16.633 -9.493 -9.203 1.00 3.01 H new ATOM 0 HD3 ARG A 649 16.562 -8.780 -7.604 1.00 3.01 H new ATOM 0 HE ARG A 649 15.368 -7.042 -9.605 1.00 3.27 H new ATOM 0 HH11 ARG A 649 14.572 -9.913 -7.637 1.00 5.46 H new ATOM 0 HH12 ARG A 649 12.849 -9.532 -7.717 1.00 5.46 H new ATOM 0 HH21 ARG A 649 13.157 -6.716 -9.579 1.00 5.71 H new ATOM 0 HH22 ARG A 649 12.111 -7.861 -8.732 1.00 5.71 H new ATOM 1865 N ARG A 650 19.323 -7.321 -5.831 1.00 2.15 N ATOM 1866 CA ARG A 650 20.011 -8.325 -4.997 1.00 2.50 C ATOM 1867 C ARG A 650 19.512 -8.298 -3.546 1.00 2.62 C ATOM 1868 O ARG A 650 19.241 -9.332 -2.946 1.00 3.01 O ATOM 1869 CB ARG A 650 21.527 -8.047 -5.079 1.00 2.51 C ATOM 1870 CG ARG A 650 22.461 -9.090 -4.451 1.00 2.89 C ATOM 1871 CD ARG A 650 22.508 -9.149 -2.913 1.00 2.95 C ATOM 1872 NE ARG A 650 23.713 -9.838 -2.393 1.00 3.88 N ATOM 1873 CZ ARG A 650 23.764 -11.006 -1.769 1.00 4.80 C ATOM 1874 NH1 ARG A 650 22.770 -11.841 -1.753 1.00 5.28 N ATOM 1875 NH2 ARG A 650 24.844 -11.363 -1.142 1.00 5.91 N ATOM 0 H ARG A 650 19.958 -6.655 -6.271 1.00 2.15 H new ATOM 0 HA ARG A 650 19.794 -9.326 -5.370 1.00 2.50 H new ATOM 0 HB2 ARG A 650 21.796 -7.941 -6.130 1.00 2.51 H new ATOM 0 HB3 ARG A 650 21.722 -7.087 -4.602 1.00 2.51 H new ATOM 0 HG2 ARG A 650 22.167 -10.073 -4.819 1.00 2.89 H new ATOM 0 HG3 ARG A 650 23.471 -8.902 -4.814 1.00 2.89 H new ATOM 0 HD2 ARG A 650 22.477 -8.135 -2.516 1.00 2.95 H new ATOM 0 HD3 ARG A 650 21.618 -9.662 -2.548 1.00 2.95 H new ATOM 0 HE ARG A 650 24.603 -9.359 -2.531 1.00 3.88 H new ATOM 0 HH11 ARG A 650 21.901 -11.609 -2.235 1.00 5.28 H new ATOM 0 HH12 ARG A 650 22.858 -12.729 -1.258 1.00 5.28 H new ATOM 0 HH21 ARG A 650 25.655 -10.744 -1.129 1.00 5.91 H new ATOM 0 HH22 ARG A 650 24.882 -12.262 -0.662 1.00 5.91 H new ATOM 1889 N ALA A 651 19.319 -7.096 -3.018 1.00 2.37 N ATOM 1890 CA ALA A 651 18.755 -6.826 -1.687 1.00 2.54 C ATOM 1891 C ALA A 651 17.344 -7.420 -1.449 1.00 2.67 C ATOM 1892 O ALA A 651 16.959 -7.620 -0.295 1.00 3.01 O ATOM 1893 CB ALA A 651 18.718 -5.308 -1.465 1.00 2.31 C ATOM 0 H ALA A 651 19.559 -6.242 -3.521 1.00 2.37 H new ATOM 0 HA ALA A 651 19.407 -7.325 -0.970 1.00 2.54 H new ATOM 0 HB1 ALA A 651 18.301 -5.094 -0.481 1.00 2.31 H new ATOM 0 HB2 ALA A 651 19.730 -4.907 -1.526 1.00 2.31 H new ATOM 0 HB3 ALA A 651 18.097 -4.843 -2.231 1.00 2.31 H new ATOM 1899 N PHE A 652 16.575 -7.706 -2.505 1.00 2.52 N ATOM 1900 CA PHE A 652 15.351 -8.518 -2.463 1.00 2.80 C ATOM 1901 C PHE A 652 15.612 -10.015 -2.752 1.00 3.38 C ATOM 1902 O PHE A 652 14.985 -10.880 -2.137 1.00 3.86 O ATOM 1903 CB PHE A 652 14.339 -7.919 -3.456 1.00 2.52 C ATOM 1904 CG PHE A 652 13.478 -6.779 -2.934 1.00 2.07 C ATOM 1905 CD1 PHE A 652 12.499 -7.022 -1.951 1.00 2.45 C ATOM 1906 CD2 PHE A 652 13.587 -5.492 -3.495 1.00 2.41 C ATOM 1907 CE1 PHE A 652 11.627 -5.992 -1.549 1.00 2.11 C ATOM 1908 CE2 PHE A 652 12.712 -4.463 -3.097 1.00 2.24 C ATOM 1909 CZ PHE A 652 11.717 -4.716 -2.136 1.00 1.37 C ATOM 0 H PHE A 652 16.793 -7.369 -3.443 1.00 2.52 H new ATOM 0 HA PHE A 652 14.946 -8.487 -1.451 1.00 2.80 H new ATOM 0 HB2 PHE A 652 14.886 -7.563 -4.329 1.00 2.52 H new ATOM 0 HB3 PHE A 652 13.680 -8.718 -3.797 1.00 2.52 H new ATOM 0 HD1 PHE A 652 12.417 -8.002 -1.504 1.00 2.45 H new ATOM 0 HD2 PHE A 652 14.347 -5.293 -4.236 1.00 2.41 H new ATOM 0 HE1 PHE A 652 10.886 -6.182 -0.787 1.00 2.11 H new ATOM 0 HE2 PHE A 652 12.805 -3.478 -3.530 1.00 2.24 H new ATOM 0 HZ PHE A 652 11.026 -3.936 -1.850 1.00 1.37 H new ATOM 1919 N GLU A 653 16.566 -10.369 -3.617 1.00 3.41 N ATOM 1920 CA GLU A 653 16.932 -11.776 -3.879 1.00 4.00 C ATOM 1921 C GLU A 653 17.545 -12.495 -2.664 1.00 4.37 C ATOM 1922 O GLU A 653 17.406 -13.713 -2.559 1.00 4.82 O ATOM 1923 CB GLU A 653 17.922 -11.873 -5.053 1.00 4.11 C ATOM 1924 CG GLU A 653 17.345 -11.406 -6.392 1.00 3.32 C ATOM 1925 CD GLU A 653 16.128 -12.234 -6.817 1.00 3.90 C ATOM 1926 OE1 GLU A 653 16.259 -13.475 -6.959 1.00 4.99 O ATOM 1927 OE2 GLU A 653 15.025 -11.657 -6.984 1.00 4.02 O ATOM 0 H GLU A 653 17.109 -9.696 -4.157 1.00 3.41 H new ATOM 0 HA GLU A 653 15.993 -12.275 -4.120 1.00 4.00 H new ATOM 0 HB2 GLU A 653 18.805 -11.277 -4.821 1.00 4.11 H new ATOM 0 HB3 GLU A 653 18.253 -12.907 -5.152 1.00 4.11 H new ATOM 0 HG2 GLU A 653 17.060 -10.357 -6.317 1.00 3.32 H new ATOM 0 HG3 GLU A 653 18.115 -11.473 -7.161 1.00 3.32 H new ATOM 1934 N THR A 654 18.172 -11.752 -1.742 1.00 4.23 N ATOM 1935 CA THR A 654 18.858 -12.270 -0.536 1.00 4.68 C ATOM 1936 C THR A 654 17.896 -12.668 0.585 1.00 4.92 C ATOM 1937 O THR A 654 18.248 -13.443 1.472 1.00 5.67 O ATOM 1938 CB THR A 654 19.878 -11.238 -0.028 1.00 4.53 C ATOM 1939 OG1 THR A 654 20.693 -11.777 0.986 1.00 5.12 O ATOM 1940 CG2 THR A 654 19.232 -9.982 0.540 1.00 4.07 C ATOM 0 H THR A 654 18.221 -10.736 -1.812 1.00 4.23 H new ATOM 0 HA THR A 654 19.372 -13.183 -0.835 1.00 4.68 H new ATOM 0 HB THR A 654 20.465 -10.974 -0.908 1.00 4.53 H new ATOM 0 HG1 THR A 654 21.332 -11.098 1.288 1.00 5.12 H new ATOM 0 HG21 THR A 654 20.008 -9.296 0.880 1.00 4.07 H new ATOM 0 HG22 THR A 654 18.634 -9.499 -0.233 1.00 4.07 H new ATOM 0 HG23 THR A 654 18.591 -10.250 1.380 1.00 4.07 H new ATOM 1948 N VAL A 655 16.674 -12.132 0.524 1.00 4.37 N ATOM 1949 CA VAL A 655 15.570 -12.356 1.474 1.00 4.53 C ATOM 1950 C VAL A 655 14.545 -13.351 0.924 1.00 4.76 C ATOM 1951 O VAL A 655 14.000 -14.158 1.676 1.00 5.12 O ATOM 1952 CB VAL A 655 14.947 -11.007 1.887 1.00 4.16 C ATOM 1953 CG1 VAL A 655 14.410 -10.185 0.728 1.00 3.68 C ATOM 1954 CG2 VAL A 655 13.886 -11.142 2.980 1.00 4.41 C ATOM 0 H VAL A 655 16.410 -11.495 -0.228 1.00 4.37 H new ATOM 0 HA VAL A 655 15.968 -12.818 2.377 1.00 4.53 H new ATOM 0 HB VAL A 655 15.790 -10.454 2.301 1.00 4.16 H new ATOM 0 HG11 VAL A 655 13.990 -9.253 1.107 1.00 3.68 H new ATOM 0 HG12 VAL A 655 15.220 -9.962 0.034 1.00 3.68 H new ATOM 0 HG13 VAL A 655 13.634 -10.749 0.211 1.00 3.68 H new ATOM 0 HG21 VAL A 655 13.488 -10.157 3.224 1.00 4.41 H new ATOM 0 HG22 VAL A 655 13.078 -11.782 2.626 1.00 4.41 H new ATOM 0 HG23 VAL A 655 14.335 -11.583 3.870 1.00 4.41 H new ATOM 1964 N ALA A 656 14.346 -13.354 -0.399 1.00 4.63 N ATOM 1965 CA ALA A 656 13.403 -14.214 -1.129 1.00 4.87 C ATOM 1966 C ALA A 656 13.429 -15.694 -0.697 1.00 5.43 C ATOM 1967 O ALA A 656 12.376 -16.311 -0.529 1.00 5.85 O ATOM 1968 CB ALA A 656 13.745 -14.125 -2.622 1.00 4.96 C ATOM 0 H ALA A 656 14.861 -12.729 -1.020 1.00 4.63 H new ATOM 0 HA ALA A 656 12.399 -13.853 -0.905 1.00 4.87 H new ATOM 0 HB1 ALA A 656 13.060 -14.754 -3.190 1.00 4.96 H new ATOM 0 HB2 ALA A 656 13.650 -13.092 -2.956 1.00 4.96 H new ATOM 0 HB3 ALA A 656 14.768 -14.465 -2.782 1.00 4.96 H new ATOM 1974 N ILE A 657 14.627 -16.243 -0.470 1.00 5.51 N ATOM 1975 CA ILE A 657 14.836 -17.663 -0.138 1.00 5.95 C ATOM 1976 C ILE A 657 14.469 -18.035 1.311 1.00 5.97 C ATOM 1977 O ILE A 657 14.383 -19.220 1.641 1.00 6.38 O ATOM 1978 CB ILE A 657 16.268 -18.125 -0.505 1.00 6.37 C ATOM 1979 CG1 ILE A 657 17.382 -17.883 0.522 1.00 7.70 C ATOM 1980 CG2 ILE A 657 16.671 -17.697 -1.931 1.00 5.08 C ATOM 1981 CD1 ILE A 657 17.569 -16.419 0.824 1.00 8.65 C ATOM 0 H ILE A 657 15.494 -15.708 -0.512 1.00 5.51 H new ATOM 0 HA ILE A 657 14.129 -18.213 -0.759 1.00 5.95 H new ATOM 0 HB ILE A 657 16.175 -19.211 -0.478 1.00 6.37 H new ATOM 0 HG12 ILE A 657 17.146 -18.415 1.444 1.00 7.70 H new ATOM 0 HG13 ILE A 657 18.317 -18.297 0.145 1.00 7.70 H new ATOM 0 HG21 ILE A 657 17.683 -18.043 -2.143 1.00 5.08 H new ATOM 0 HG22 ILE A 657 15.980 -18.134 -2.651 1.00 5.08 H new ATOM 0 HG23 ILE A 657 16.636 -16.610 -2.008 1.00 5.08 H new ATOM 0 HD11 ILE A 657 18.368 -16.298 1.556 1.00 8.65 H new ATOM 0 HD12 ILE A 657 17.832 -15.889 -0.092 1.00 8.65 H new ATOM 0 HD13 ILE A 657 16.643 -16.009 1.227 1.00 8.65 H new ATOM 1993 N ASP A 658 14.251 -17.047 2.182 1.00 5.63 N ATOM 1994 CA ASP A 658 13.939 -17.208 3.610 1.00 5.82 C ATOM 1995 C ASP A 658 12.524 -16.731 3.971 1.00 5.64 C ATOM 1996 O ASP A 658 11.914 -17.269 4.893 1.00 6.02 O ATOM 1997 CB ASP A 658 14.988 -16.426 4.413 1.00 5.84 C ATOM 1998 CG ASP A 658 14.773 -16.524 5.925 1.00 6.37 C ATOM 1999 OD1 ASP A 658 14.979 -17.619 6.501 1.00 6.59 O ATOM 2000 OD2 ASP A 658 14.502 -15.485 6.570 1.00 7.03 O ATOM 0 H ASP A 658 14.288 -16.067 1.901 1.00 5.63 H new ATOM 0 HA ASP A 658 13.968 -18.270 3.853 1.00 5.82 H new ATOM 0 HB2 ASP A 658 15.981 -16.802 4.167 1.00 5.84 H new ATOM 0 HB3 ASP A 658 14.960 -15.378 4.114 1.00 5.84 H new ATOM 2005 N ARG A 659 11.992 -15.748 3.238 1.00 5.16 N ATOM 2006 CA ARG A 659 10.789 -14.959 3.559 1.00 5.18 C ATOM 2007 C ARG A 659 9.475 -15.756 3.691 1.00 5.72 C ATOM 2008 O ARG A 659 8.573 -15.309 4.403 1.00 6.14 O ATOM 2009 CB ARG A 659 10.712 -13.879 2.467 1.00 4.40 C ATOM 2010 CG ARG A 659 9.746 -12.724 2.735 1.00 5.01 C ATOM 2011 CD ARG A 659 9.757 -11.783 1.523 1.00 4.21 C ATOM 2012 NE ARG A 659 8.763 -10.706 1.660 1.00 4.70 N ATOM 2013 CZ ARG A 659 7.452 -10.798 1.518 1.00 4.70 C ATOM 2014 NH1 ARG A 659 6.851 -11.897 1.165 1.00 4.59 N ATOM 2015 NH2 ARG A 659 6.702 -9.765 1.751 1.00 5.56 N ATOM 0 H ARG A 659 12.410 -15.462 2.353 1.00 5.16 H new ATOM 0 HA ARG A 659 10.891 -14.543 4.561 1.00 5.18 H new ATOM 0 HB2 ARG A 659 11.710 -13.466 2.321 1.00 4.40 H new ATOM 0 HB3 ARG A 659 10.425 -14.357 1.530 1.00 4.40 H new ATOM 0 HG2 ARG A 659 8.740 -13.105 2.908 1.00 5.01 H new ATOM 0 HG3 ARG A 659 10.042 -12.185 3.635 1.00 5.01 H new ATOM 0 HD2 ARG A 659 10.750 -11.349 1.409 1.00 4.21 H new ATOM 0 HD3 ARG A 659 9.552 -12.354 0.617 1.00 4.21 H new ATOM 0 HE ARG A 659 9.128 -9.782 1.891 1.00 4.70 H new ATOM 0 HH11 ARG A 659 7.395 -12.740 0.984 1.00 4.59 H new ATOM 0 HH12 ARG A 659 5.836 -11.915 1.070 1.00 4.59 H new ATOM 0 HH21 ARG A 659 7.124 -8.884 2.043 1.00 5.56 H new ATOM 0 HH22 ARG A 659 5.690 -9.834 1.642 1.00 5.56 H new ATOM 2029 N LEU A 660 9.368 -16.931 3.065 1.00 5.89 N ATOM 2030 CA LEU A 660 8.125 -17.711 2.918 1.00 6.40 C ATOM 2031 C LEU A 660 7.388 -17.953 4.248 1.00 7.33 C ATOM 2032 O LEU A 660 6.233 -17.549 4.386 1.00 7.90 O ATOM 2033 CB LEU A 660 8.462 -19.020 2.168 1.00 6.80 C ATOM 2034 CG LEU A 660 7.273 -19.819 1.589 1.00 7.18 C ATOM 2035 CD1 LEU A 660 7.818 -20.902 0.656 1.00 7.54 C ATOM 2036 CD2 LEU A 660 6.419 -20.531 2.641 1.00 8.56 C ATOM 0 H LEU A 660 10.170 -17.386 2.629 1.00 5.89 H new ATOM 0 HA LEU A 660 7.413 -17.130 2.333 1.00 6.40 H new ATOM 0 HB2 LEU A 660 9.139 -18.777 1.349 1.00 6.80 H new ATOM 0 HB3 LEU A 660 9.008 -19.671 2.850 1.00 6.80 H new ATOM 0 HG LEU A 660 6.640 -19.088 1.085 1.00 7.18 H new ATOM 0 HD11 LEU A 660 6.989 -21.474 0.240 1.00 7.54 H new ATOM 0 HD12 LEU A 660 8.380 -20.436 -0.153 1.00 7.54 H new ATOM 0 HD13 LEU A 660 8.474 -21.568 1.216 1.00 7.54 H new ATOM 0 HD21 LEU A 660 5.608 -21.067 2.149 1.00 8.56 H new ATOM 0 HD22 LEU A 660 7.038 -21.238 3.194 1.00 8.56 H new ATOM 0 HD23 LEU A 660 6.003 -19.796 3.330 1.00 8.56 H new ATOM 2048 N ASP A 661 8.048 -18.566 5.234 1.00 7.66 N ATOM 2049 CA ASP A 661 7.446 -18.994 6.511 1.00 8.64 C ATOM 2050 C ASP A 661 7.478 -17.905 7.610 1.00 10.06 C ATOM 2051 O ASP A 661 7.060 -18.145 8.747 1.00 10.95 O ATOM 2052 CB ASP A 661 8.186 -20.266 6.960 1.00 8.70 C ATOM 2053 CG ASP A 661 7.446 -21.157 7.970 1.00 9.63 C ATOM 2054 OD1 ASP A 661 6.192 -21.197 7.996 1.00 9.79 O ATOM 2055 OD2 ASP A 661 8.128 -21.885 8.734 1.00 10.57 O ATOM 0 H ASP A 661 9.042 -18.787 5.170 1.00 7.66 H new ATOM 0 HA ASP A 661 6.385 -19.189 6.352 1.00 8.64 H new ATOM 0 HB2 ASP A 661 8.410 -20.863 6.076 1.00 8.70 H new ATOM 0 HB3 ASP A 661 9.140 -19.972 7.397 1.00 8.70 H new ATOM 2060 N ARG A 662 7.991 -16.705 7.296 1.00 10.82 N ATOM 2061 CA ARG A 662 8.304 -15.636 8.268 1.00 12.65 C ATOM 2062 C ARG A 662 7.095 -14.804 8.716 1.00 13.65 C ATOM 2063 O ARG A 662 7.134 -14.270 9.820 1.00 15.06 O ATOM 2064 CB ARG A 662 9.397 -14.726 7.687 1.00 13.64 C ATOM 2065 CG ARG A 662 10.702 -15.440 7.307 1.00 13.52 C ATOM 2066 CD ARG A 662 11.465 -16.091 8.464 1.00 14.42 C ATOM 2067 NE ARG A 662 11.863 -15.120 9.505 1.00 15.90 N ATOM 2068 CZ ARG A 662 13.087 -14.870 9.937 1.00 16.91 C ATOM 2069 NH1 ARG A 662 14.151 -15.321 9.346 1.00 16.81 N ATOM 2070 NH2 ARG A 662 13.262 -14.143 11.001 1.00 18.30 N ATOM 0 H ARG A 662 8.207 -16.441 6.335 1.00 10.82 H new ATOM 0 HA ARG A 662 8.654 -16.136 9.171 1.00 12.65 H new ATOM 0 HB2 ARG A 662 9.002 -14.229 6.801 1.00 13.64 H new ATOM 0 HB3 ARG A 662 9.625 -13.947 8.415 1.00 13.64 H new ATOM 0 HG2 ARG A 662 10.472 -16.209 6.570 1.00 13.52 H new ATOM 0 HG3 ARG A 662 11.361 -14.720 6.822 1.00 13.52 H new ATOM 0 HD2 ARG A 662 10.843 -16.865 8.914 1.00 14.42 H new ATOM 0 HD3 ARG A 662 12.355 -16.584 8.074 1.00 14.42 H new ATOM 0 HE ARG A 662 11.111 -14.584 9.937 1.00 15.90 H new ATOM 0 HH11 ARG A 662 14.064 -15.897 8.508 1.00 16.81 H new ATOM 0 HH12 ARG A 662 15.074 -15.100 9.719 1.00 16.81 H new ATOM 0 HH21 ARG A 662 12.456 -13.767 11.500 1.00 18.30 H new ATOM 0 HH22 ARG A 662 14.205 -13.949 11.336 1.00 18.30 H new ATOM 2084 N ILE A 663 6.060 -14.732 7.870 1.00 13.18 N ATOM 2085 CA ILE A 663 4.611 -14.588 8.148 1.00 14.05 C ATOM 2086 C ILE A 663 4.161 -13.482 9.138 1.00 15.93 C ATOM 2087 O ILE A 663 4.687 -13.295 10.235 1.00 16.87 O ATOM 2088 CB ILE A 663 4.044 -15.996 8.470 1.00 13.38 C ATOM 2089 CG1 ILE A 663 4.146 -16.959 7.261 1.00 11.64 C ATOM 2090 CG2 ILE A 663 2.609 -16.001 9.009 1.00 14.47 C ATOM 2091 CD1 ILE A 663 3.101 -16.750 6.167 1.00 11.47 C ATOM 0 H ILE A 663 6.227 -14.777 6.865 1.00 13.18 H new ATOM 0 HA ILE A 663 4.166 -14.185 7.238 1.00 14.05 H new ATOM 0 HB ILE A 663 4.684 -16.354 9.277 1.00 13.38 H new ATOM 0 HG12 ILE A 663 5.137 -16.855 6.818 1.00 11.64 H new ATOM 0 HG13 ILE A 663 4.065 -17.983 7.626 1.00 11.64 H new ATOM 0 HG21 ILE A 663 2.298 -17.027 9.205 1.00 14.47 H new ATOM 0 HG22 ILE A 663 2.566 -15.425 9.934 1.00 14.47 H new ATOM 0 HG23 ILE A 663 1.942 -15.554 8.272 1.00 14.47 H new ATOM 0 HD11 ILE A 663 3.261 -17.474 5.368 1.00 11.47 H new ATOM 0 HD12 ILE A 663 2.104 -16.886 6.586 1.00 11.47 H new ATOM 0 HD13 ILE A 663 3.192 -15.741 5.765 1.00 11.47 H new ATOM 2103 N GLY A 664 3.073 -12.786 8.793 1.00 16.73 N ATOM 2104 CA GLY A 664 2.486 -11.669 9.553 1.00 18.61 C ATOM 2105 C GLY A 664 1.747 -12.051 10.847 1.00 19.67 C ATOM 2106 O GLY A 664 0.889 -11.290 11.301 1.00 21.00 O ATOM 0 H GLY A 664 2.552 -12.992 7.940 1.00 16.73 H new ATOM 0 HA2 GLY A 664 3.282 -10.969 9.806 1.00 18.61 H new ATOM 0 HA3 GLY A 664 1.790 -11.139 8.903 1.00 18.61 H new ATOM 2110 N LYS A 665 2.038 -13.223 11.428 1.00 19.31 N ATOM 2111 CA LYS A 665 1.389 -13.769 12.631 1.00 20.45 C ATOM 2112 C LYS A 665 1.799 -13.026 13.908 1.00 22.19 C ATOM 2113 O LYS A 665 2.988 -12.786 14.151 1.00 22.48 O ATOM 2114 CB LYS A 665 1.612 -15.293 12.726 1.00 19.51 C ATOM 2115 CG LYS A 665 3.077 -15.744 12.890 1.00 18.62 C ATOM 2116 CD LYS A 665 3.291 -17.236 12.579 1.00 17.44 C ATOM 2117 CE LYS A 665 2.392 -18.169 13.400 1.00 18.27 C ATOM 2118 NZ LYS A 665 2.605 -19.584 13.025 1.00 17.58 N ATOM 0 H LYS A 665 2.760 -13.842 11.059 1.00 19.31 H new ATOM 0 HA LYS A 665 0.316 -13.603 12.534 1.00 20.45 H new ATOM 0 HB2 LYS A 665 1.037 -15.674 13.570 1.00 19.51 H new ATOM 0 HB3 LYS A 665 1.206 -15.758 11.828 1.00 19.51 H new ATOM 0 HG2 LYS A 665 3.710 -15.148 12.232 1.00 18.62 H new ATOM 0 HG3 LYS A 665 3.400 -15.542 13.911 1.00 18.62 H new ATOM 0 HD2 LYS A 665 3.107 -17.408 11.519 1.00 17.44 H new ATOM 0 HD3 LYS A 665 4.334 -17.492 12.767 1.00 17.44 H new ATOM 0 HE2 LYS A 665 2.599 -18.036 14.462 1.00 18.27 H new ATOM 0 HE3 LYS A 665 1.347 -17.902 13.243 1.00 18.27 H new ATOM 0 HZ1 LYS A 665 1.984 -20.192 13.596 1.00 17.58 H new ATOM 0 HZ2 LYS A 665 2.384 -19.713 12.017 1.00 17.58 H new ATOM 0 HZ3 LYS A 665 3.597 -19.843 13.198 1.00 17.58 H new ATOM 2132 N LYS A 666 0.809 -12.686 14.732 1.00 23.55 N ATOM 2133 CA LYS A 666 0.949 -11.924 15.982 1.00 25.39 C ATOM 2134 C LYS A 666 0.116 -12.542 17.104 1.00 26.56 C ATOM 2135 O LYS A 666 -0.823 -13.306 16.870 1.00 26.51 O ATOM 2136 CB LYS A 666 0.547 -10.455 15.733 1.00 26.35 C ATOM 2137 CG LYS A 666 1.717 -9.612 15.196 1.00 26.46 C ATOM 2138 CD LYS A 666 1.360 -8.129 14.992 1.00 27.39 C ATOM 2139 CE LYS A 666 0.979 -7.429 16.305 1.00 29.16 C ATOM 2140 NZ LYS A 666 0.717 -5.984 16.116 1.00 30.25 N ATOM 0 H LYS A 666 -0.159 -12.944 14.542 1.00 23.55 H new ATOM 0 HA LYS A 666 1.990 -11.958 16.302 1.00 25.39 H new ATOM 0 HB2 LYS A 666 -0.278 -10.422 15.022 1.00 26.35 H new ATOM 0 HB3 LYS A 666 0.184 -10.017 16.663 1.00 26.35 H new ATOM 0 HG2 LYS A 666 2.555 -9.684 15.889 1.00 26.46 H new ATOM 0 HG3 LYS A 666 2.051 -10.031 14.247 1.00 26.46 H new ATOM 0 HD2 LYS A 666 2.208 -7.613 14.542 1.00 27.39 H new ATOM 0 HD3 LYS A 666 0.531 -8.052 14.289 1.00 27.39 H new ATOM 0 HE2 LYS A 666 0.092 -7.905 16.724 1.00 29.16 H new ATOM 0 HE3 LYS A 666 1.783 -7.558 17.030 1.00 29.16 H new ATOM 0 HZ1 LYS A 666 0.464 -5.555 17.029 1.00 30.25 H new ATOM 0 HZ2 LYS A 666 1.570 -5.523 15.741 1.00 30.25 H new ATOM 0 HZ3 LYS A 666 -0.068 -5.858 15.445 1.00 30.25 H new ATOM 2154 N ASN A 667 0.405 -12.132 18.335 1.00 27.86 N ATOM 2155 CA ASN A 667 -0.388 -12.482 19.513 1.00 29.34 C ATOM 2156 C ASN A 667 -1.822 -11.891 19.448 1.00 30.26 C ATOM 2157 O ASN A 667 -2.723 -12.407 20.115 1.00 30.86 O ATOM 2158 CB ASN A 667 0.431 -12.032 20.733 1.00 30.45 C ATOM 2159 CG ASN A 667 -0.096 -12.556 22.052 1.00 31.80 C ATOM 2160 OD1 ASN A 667 -0.025 -13.744 22.350 1.00 31.75 O ATOM 2161 ND2 ASN A 667 -0.613 -11.682 22.875 1.00 33.18 N ATOM 0 H ASN A 667 1.207 -11.539 18.547 1.00 27.86 H new ATOM 0 HA ASN A 667 -0.566 -13.556 19.576 1.00 29.34 H new ATOM 0 HB2 ASN A 667 1.462 -12.362 20.608 1.00 30.45 H new ATOM 0 HB3 ASN A 667 0.447 -10.943 20.766 1.00 30.45 H new ATOM 0 HD21 ASN A 667 -0.966 -11.983 23.783 1.00 33.18 H new ATOM 0 HD22 ASN A 667 -0.663 -10.699 22.609 1.00 33.18 H new ATOM 2168 N SER A 668 -2.038 -10.873 18.600 1.00 30.48 N ATOM 2169 CA SER A 668 -3.336 -10.290 18.218 1.00 31.32 C ATOM 2170 C SER A 668 -4.032 -10.962 17.021 1.00 30.94 C ATOM 2171 O SER A 668 -5.255 -11.134 17.063 1.00 31.36 O ATOM 2172 CB SER A 668 -3.149 -8.795 17.919 1.00 31.85 C ATOM 2173 OG SER A 668 -2.144 -8.583 16.944 1.00 30.79 O ATOM 0 H SER A 668 -1.262 -10.405 18.133 1.00 30.48 H new ATOM 0 HA SER A 668 -3.994 -10.458 19.070 1.00 31.32 H new ATOM 0 HB2 SER A 668 -4.091 -8.372 17.570 1.00 31.85 H new ATOM 0 HB3 SER A 668 -2.884 -8.270 18.837 1.00 31.85 H new ATOM 0 HG SER A 668 -2.050 -7.622 16.774 1.00 30.79 H new ATOM 2179 N ILE A 669 -3.307 -11.305 15.946 1.00 30.33 N ATOM 2180 CA ILE A 669 -3.900 -11.587 14.621 1.00 30.20 C ATOM 2181 C ILE A 669 -3.194 -12.694 13.815 1.00 29.27 C ATOM 2182 O ILE A 669 -1.989 -12.924 13.936 1.00 28.68 O ATOM 2183 CB ILE A 669 -4.000 -10.295 13.764 1.00 30.78 C ATOM 2184 CG1 ILE A 669 -2.622 -9.643 13.518 1.00 30.53 C ATOM 2185 CG2 ILE A 669 -4.979 -9.291 14.403 1.00 31.89 C ATOM 2186 CD1 ILE A 669 -2.635 -8.502 12.495 1.00 31.14 C ATOM 0 H ILE A 669 -2.291 -11.396 15.966 1.00 30.33 H new ATOM 0 HA ILE A 669 -4.896 -11.968 14.845 1.00 30.20 H new ATOM 0 HB ILE A 669 -4.389 -10.588 12.789 1.00 30.78 H new ATOM 0 HG12 ILE A 669 -2.240 -9.261 14.465 1.00 30.53 H new ATOM 0 HG13 ILE A 669 -1.926 -10.410 13.179 1.00 30.53 H new ATOM 0 HG21 ILE A 669 -5.034 -8.394 13.787 1.00 31.89 H new ATOM 0 HG22 ILE A 669 -5.968 -9.743 14.475 1.00 31.89 H new ATOM 0 HG23 ILE A 669 -4.628 -9.025 15.400 1.00 31.89 H new ATOM 0 HD11 ILE A 669 -1.627 -8.102 12.384 1.00 31.14 H new ATOM 0 HD12 ILE A 669 -2.984 -8.879 11.534 1.00 31.14 H new ATOM 0 HD13 ILE A 669 -3.303 -7.712 12.839 1.00 31.14 H new ATOM 2198 N LEU A 670 -3.983 -13.319 12.936 1.00 29.32 N ATOM 2199 CA LEU A 670 -3.613 -14.292 11.897 1.00 28.70 C ATOM 2200 C LEU A 670 -4.388 -13.972 10.599 1.00 29.03 C ATOM 2201 O LEU A 670 -5.364 -13.208 10.639 1.00 29.88 O ATOM 2202 CB LEU A 670 -3.953 -15.720 12.377 1.00 28.83 C ATOM 2203 CG LEU A 670 -3.193 -16.230 13.614 1.00 29.15 C ATOM 2204 CD1 LEU A 670 -3.759 -17.587 14.041 1.00 29.71 C ATOM 2205 CD2 LEU A 670 -1.701 -16.401 13.333 1.00 28.27 C ATOM 0 H LEU A 670 -4.988 -13.143 12.931 1.00 29.32 H new ATOM 0 HA LEU A 670 -2.542 -14.230 11.702 1.00 28.70 H new ATOM 0 HB2 LEU A 670 -5.021 -15.762 12.592 1.00 28.83 H new ATOM 0 HB3 LEU A 670 -3.766 -16.410 11.554 1.00 28.83 H new ATOM 0 HG LEU A 670 -3.319 -15.488 14.403 1.00 29.15 H new ATOM 0 HD11 LEU A 670 -3.220 -17.947 14.917 1.00 29.71 H new ATOM 0 HD12 LEU A 670 -4.816 -17.480 14.284 1.00 29.71 H new ATOM 0 HD13 LEU A 670 -3.645 -18.302 13.226 1.00 29.71 H new ATOM 0 HD21 LEU A 670 -1.201 -16.762 14.231 1.00 28.27 H new ATOM 0 HD22 LEU A 670 -1.563 -17.121 12.526 1.00 28.27 H new ATOM 0 HD23 LEU A 670 -1.274 -15.442 13.041 1.00 28.27 H new ATOM 2217 N LEU A 671 -3.988 -14.554 9.456 1.00 28.54 N ATOM 2218 CA LEU A 671 -4.710 -14.383 8.184 1.00 29.04 C ATOM 2219 C LEU A 671 -4.665 -15.611 7.248 1.00 28.90 C ATOM 2220 O LEU A 671 -3.911 -15.640 6.271 1.00 28.00 O ATOM 2221 CB LEU A 671 -4.225 -13.085 7.503 1.00 28.96 C ATOM 2222 CG LEU A 671 -5.094 -12.634 6.311 1.00 29.64 C ATOM 2223 CD1 LEU A 671 -6.569 -12.467 6.692 1.00 31.03 C ATOM 2224 CD2 LEU A 671 -4.577 -11.292 5.793 1.00 29.52 C ATOM 0 H LEU A 671 -3.163 -15.150 9.387 1.00 28.54 H new ATOM 0 HA LEU A 671 -5.771 -14.293 8.417 1.00 29.04 H new ATOM 0 HB2 LEU A 671 -4.202 -12.286 8.244 1.00 28.96 H new ATOM 0 HB3 LEU A 671 -3.201 -13.230 7.158 1.00 28.96 H new ATOM 0 HG LEU A 671 -5.026 -13.410 5.549 1.00 29.64 H new ATOM 0 HD11 LEU A 671 -7.137 -12.149 5.818 1.00 31.03 H new ATOM 0 HD12 LEU A 671 -6.961 -13.418 7.053 1.00 31.03 H new ATOM 0 HD13 LEU A 671 -6.659 -11.716 7.477 1.00 31.03 H new ATOM 0 HD21 LEU A 671 -5.187 -10.968 4.950 1.00 29.52 H new ATOM 0 HD22 LEU A 671 -4.633 -10.549 6.589 1.00 29.52 H new ATOM 0 HD23 LEU A 671 -3.542 -11.401 5.470 1.00 29.52 H new ATOM 2236 N HIS A 672 -5.538 -16.585 7.531 1.00 29.97 N ATOM 2237 CA HIS A 672 -6.115 -17.580 6.602 1.00 30.52 C ATOM 2238 C HIS A 672 -5.112 -18.253 5.638 1.00 29.75 C ATOM 2239 O HIS A 672 -4.328 -19.101 6.135 1.00 29.56 O ATOM 2240 CB HIS A 672 -7.343 -16.917 5.942 1.00 31.65 C ATOM 2241 CG HIS A 672 -8.236 -17.829 5.132 1.00 32.64 C ATOM 2242 ND1 HIS A 672 -8.506 -17.689 3.793 1.00 32.75 N ATOM 2243 CD2 HIS A 672 -8.999 -18.874 5.584 1.00 33.80 C ATOM 2244 CE1 HIS A 672 -9.413 -18.612 3.438 1.00 33.94 C ATOM 2245 NE2 HIS A 672 -9.742 -19.377 4.499 1.00 34.61 N ATOM 0 H HIS A 672 -5.888 -16.713 8.480 1.00 29.97 H new ATOM 0 HA HIS A 672 -6.437 -18.460 7.160 1.00 30.52 H new ATOM 0 HB2 HIS A 672 -7.945 -16.454 6.724 1.00 31.65 H new ATOM 0 HB3 HIS A 672 -6.992 -16.115 5.293 1.00 31.65 H new ATOM 0 HD2 HIS A 672 -9.026 -19.247 6.597 1.00 33.80 H new ATOM 0 HE1 HIS A 672 -9.821 -18.726 2.445 1.00 33.94 H new ATOM 0 HE2 HIS A 672 -10.396 -20.160 4.513 1.00 34.61 H new TER 2253 HIS A 672