USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=32 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 647 MET CE :methyl -99:sc= -0.237 (180deg=-0.219) USER MOD Set 1.2: A 648 MET CE :methyl 160:sc= -0.011 (180deg=-0.306) USER MOD Set 2.1: A 593 THR OG1 : rot 180:sc=-0.000312 USER MOD Set 2.2: A 599 MET CE :methyl -164:sc= -0.159 (180deg=-0.62) USER MOD Set 3.1: A 590 SER OG : rot -175:sc= 0.535 USER MOD Set 3.2: A 600 LYS NZ :NH3+ 170:sc= 1.68 (180deg=1.24) USER MOD Set 4.1: A 581 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 631 TYR OH : rot 4:sc= 0.118 USER MOD Set 5.1: A 559 LYS NZ :NH3+ 168:sc= 1.17 (180deg=0) USER MOD Set 5.2: A 637 ASN : amide:sc= 0.533 K(o=1.7,f=-9.8!) USER MOD Single : A 534 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 535 CYS SG : rot 180:sc= 0 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 541 SER OG : rot 100:sc= 1.22 USER MOD Single : A 542 MET CE :methyl -150:sc= -0.28 (180deg=-2.56!) USER MOD Single : A 547 ASN : amide:sc= -0.0195 X(o=-0.019,f=0) USER MOD Single : A 551 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 554 THR OG1 : rot 104:sc= 1.24 USER MOD Single : A 556 MET CE :methyl -175:sc= 0 (180deg=-0.0224) 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= 0.693 K(o=0.69,f=-0.11) USER MOD Single : A 570 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 THR OG1 : rot 180:sc= -0.0103 USER MOD Single : A 579 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 582 TYR OH : rot 14:sc= 0.173 USER MOD Single : A 585 GLN : amide:sc= 0.837 K(o=0.84,f=-5.1!) USER MOD Single : A 586 HIS : no HD1:sc= 0 X(o=0,f=-0.079) USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 ASN : amide:sc= -0.388 K(o=-0.39,f=-2.8!) USER MOD Single : A 597 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 602 SER OG : rot 45:sc= 1.43 USER MOD Single : A 605 SER OG : rot 86:sc= 1.18 USER MOD Single : A 606 TYR OH : rot 180:sc= 0 USER MOD Single : A 611 CYS SG : rot 180:sc= 0.143 USER MOD Single : A 614 THR OG1 : rot 180:sc= 0 USER MOD Single : A 619 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 SER OG : rot 64:sc= 0.633 USER MOD Single : A 626 THR OG1 : rot 180:sc= 0 USER MOD Single : A 627 TYR OH : rot 180:sc= 0 USER MOD Single : A 628 CYS SG : rot -140:sc= -0.572 USER MOD Single : A 632 SER OG : rot 180:sc= 0 USER MOD Single : A 634 SER OG : rot 171:sc= -1.19 USER MOD Single : A 639 ASN : amide:sc= 1.09 K(o=1.1,f=-0.011) USER MOD Single : A 645 TYR OH : rot 180:sc= 0 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=-0.027) USER MOD Single : A 668 SER OG : rot 180:sc= 0 USER MOD Single : A 672 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 534 3.658 14.208 2.756 1.00 4.28 N ATOM 2 CA ASN A 534 3.127 13.465 3.906 1.00 4.03 C ATOM 3 C ASN A 534 3.481 11.963 3.884 1.00 3.31 C ATOM 4 O ASN A 534 3.592 11.347 4.943 1.00 3.66 O ATOM 5 CB ASN A 534 1.593 13.593 3.916 1.00 5.85 C ATOM 6 CG ASN A 534 1.110 15.017 4.065 1.00 6.97 C ATOM 7 OD1 ASN A 534 1.029 15.541 5.168 1.00 7.59 O ATOM 8 ND2 ASN A 534 0.787 15.683 2.984 1.00 7.89 N ATOM 0 HA ASN A 534 3.584 13.897 4.796 1.00 4.03 H new ATOM 0 HB2 ASN A 534 1.195 13.177 2.990 1.00 5.85 H new ATOM 0 HB3 ASN A 534 1.191 12.994 4.733 1.00 5.85 H new ATOM 0 HD21 ASN A 534 0.464 16.648 3.057 1.00 7.89 H new ATOM 0 HD22 ASN A 534 0.858 15.237 2.070 1.00 7.89 H new ATOM 15 N CYS A 535 3.626 11.344 2.707 1.00 2.91 N ATOM 16 CA CYS A 535 3.687 9.878 2.585 1.00 2.81 C ATOM 17 C CYS A 535 5.023 9.233 3.005 1.00 2.14 C ATOM 18 O CYS A 535 5.069 8.012 3.191 1.00 1.82 O ATOM 19 CB CYS A 535 3.325 9.478 1.146 1.00 3.65 C ATOM 20 SG CYS A 535 1.598 9.906 0.790 1.00 4.68 S ATOM 0 H CYS A 535 3.704 11.837 1.818 1.00 2.91 H new ATOM 0 HA CYS A 535 2.962 9.488 3.300 1.00 2.81 H new ATOM 0 HB2 CYS A 535 3.985 9.986 0.443 1.00 3.65 H new ATOM 0 HB3 CYS A 535 3.477 8.407 1.010 1.00 3.65 H new ATOM 0 HG CYS A 535 1.309 9.564 -0.430 1.00 4.68 H new ATOM 26 N ARG A 536 6.111 10.008 3.151 1.00 2.15 N ATOM 27 CA ARG A 536 7.473 9.469 3.334 1.00 1.86 C ATOM 28 C ARG A 536 7.583 8.610 4.598 1.00 1.80 C ATOM 29 O ARG A 536 8.005 7.462 4.498 1.00 1.70 O ATOM 30 CB ARG A 536 8.522 10.597 3.320 1.00 2.29 C ATOM 31 CG ARG A 536 9.941 10.030 3.152 1.00 2.05 C ATOM 32 CD ARG A 536 11.019 11.077 3.461 1.00 2.20 C ATOM 33 NE ARG A 536 12.373 10.534 3.252 1.00 2.61 N ATOM 34 CZ ARG A 536 12.993 9.618 3.975 1.00 3.62 C ATOM 35 NH1 ARG A 536 12.509 9.065 5.049 1.00 4.44 N ATOM 36 NH2 ARG A 536 14.168 9.211 3.623 1.00 4.83 N ATOM 0 H ARG A 536 6.073 11.027 3.146 1.00 2.15 H new ATOM 0 HA ARG A 536 7.681 8.813 2.489 1.00 1.86 H new ATOM 0 HB2 ARG A 536 8.305 11.290 2.507 1.00 2.29 H new ATOM 0 HB3 ARG A 536 8.462 11.166 4.248 1.00 2.29 H new ATOM 0 HG2 ARG A 536 10.069 9.172 3.812 1.00 2.05 H new ATOM 0 HG3 ARG A 536 10.069 9.669 2.132 1.00 2.05 H new ATOM 0 HD2 ARG A 536 10.873 11.950 2.825 1.00 2.20 H new ATOM 0 HD3 ARG A 536 10.916 11.414 4.492 1.00 2.20 H new ATOM 0 HE ARG A 536 12.891 10.909 2.457 1.00 2.61 H new ATOM 0 HH11 ARG A 536 11.585 9.333 5.389 1.00 4.44 H new ATOM 0 HH12 ARG A 536 13.053 8.364 5.551 1.00 4.44 H new ATOM 0 HH21 ARG A 536 14.613 9.597 2.790 1.00 4.83 H new ATOM 0 HH22 ARG A 536 14.650 8.504 4.178 1.00 4.83 H new ATOM 50 N LYS A 537 7.094 9.102 5.742 1.00 1.96 N ATOM 51 CA LYS A 537 7.088 8.389 7.038 1.00 1.92 C ATOM 52 C LYS A 537 6.359 7.039 6.994 1.00 1.50 C ATOM 53 O LYS A 537 6.658 6.157 7.800 1.00 1.47 O ATOM 54 CB LYS A 537 6.446 9.323 8.087 1.00 2.41 C ATOM 55 CG LYS A 537 6.437 8.815 9.540 1.00 2.53 C ATOM 56 CD LYS A 537 7.840 8.603 10.133 1.00 2.34 C ATOM 57 CE LYS A 537 7.798 8.421 11.657 1.00 2.89 C ATOM 58 NZ LYS A 537 7.115 7.170 12.065 1.00 3.75 N ATOM 0 H LYS A 537 6.679 10.032 5.800 1.00 1.96 H new ATOM 0 HA LYS A 537 8.118 8.148 7.300 1.00 1.92 H new ATOM 0 HB2 LYS A 537 6.972 10.278 8.062 1.00 2.41 H new ATOM 0 HB3 LYS A 537 5.416 9.518 7.787 1.00 2.41 H new ATOM 0 HG2 LYS A 537 5.894 9.528 10.161 1.00 2.53 H new ATOM 0 HG3 LYS A 537 5.889 7.874 9.582 1.00 2.53 H new ATOM 0 HD2 LYS A 537 8.298 7.726 9.676 1.00 2.34 H new ATOM 0 HD3 LYS A 537 8.471 9.457 9.887 1.00 2.34 H new ATOM 0 HE2 LYS A 537 8.816 8.418 12.047 1.00 2.89 H new ATOM 0 HE3 LYS A 537 7.287 9.272 12.107 1.00 2.89 H new ATOM 0 HZ1 LYS A 537 7.115 7.097 13.102 1.00 3.75 H new ATOM 0 HZ2 LYS A 537 6.134 7.181 11.719 1.00 3.75 H new ATOM 0 HZ3 LYS A 537 7.616 6.353 11.661 1.00 3.75 H new ATOM 72 N LEU A 538 5.421 6.852 6.062 1.00 1.36 N ATOM 73 CA LEU A 538 4.583 5.652 5.995 1.00 1.26 C ATOM 74 C LEU A 538 5.225 4.603 5.084 1.00 1.02 C ATOM 75 O LEU A 538 5.336 3.444 5.471 1.00 1.12 O ATOM 76 CB LEU A 538 3.135 6.003 5.596 1.00 1.66 C ATOM 77 CG LEU A 538 2.310 6.889 6.559 1.00 1.25 C ATOM 78 CD1 LEU A 538 2.606 6.658 8.043 1.00 2.13 C ATOM 79 CD2 LEU A 538 2.476 8.380 6.259 1.00 1.99 C ATOM 0 H LEU A 538 5.220 7.532 5.329 1.00 1.36 H new ATOM 0 HA LEU A 538 4.518 5.208 6.988 1.00 1.26 H new ATOM 0 HB2 LEU A 538 3.167 6.503 4.628 1.00 1.66 H new ATOM 0 HB3 LEU A 538 2.592 5.069 5.454 1.00 1.66 H new ATOM 0 HG LEU A 538 1.281 6.580 6.373 1.00 1.25 H new ATOM 0 HD11 LEU A 538 1.984 7.320 8.645 1.00 2.13 H new ATOM 0 HD12 LEU A 538 2.388 5.622 8.300 1.00 2.13 H new ATOM 0 HD13 LEU A 538 3.657 6.868 8.241 1.00 2.13 H new ATOM 0 HD21 LEU A 538 1.878 8.961 6.961 1.00 1.99 H new ATOM 0 HD22 LEU A 538 3.525 8.657 6.360 1.00 1.99 H new ATOM 0 HD23 LEU A 538 2.143 8.586 5.242 1.00 1.99 H new ATOM 91 N VAL A 539 5.783 5.020 3.943 1.00 0.88 N ATOM 92 CA VAL A 539 6.654 4.152 3.129 1.00 0.84 C ATOM 93 C VAL A 539 7.906 3.741 3.928 1.00 1.06 C ATOM 94 O VAL A 539 8.282 2.573 3.929 1.00 1.38 O ATOM 95 CB VAL A 539 6.934 4.820 1.759 1.00 0.75 C ATOM 96 CG1 VAL A 539 8.406 5.143 1.506 1.00 0.76 C ATOM 97 CG2 VAL A 539 6.395 3.946 0.625 1.00 0.80 C ATOM 0 H VAL A 539 5.649 5.955 3.558 1.00 0.88 H new ATOM 0 HA VAL A 539 6.152 3.213 2.896 1.00 0.84 H new ATOM 0 HB VAL A 539 6.413 5.777 1.787 1.00 0.75 H new ATOM 0 HG11 VAL A 539 8.513 5.608 0.526 1.00 0.76 H new ATOM 0 HG12 VAL A 539 8.765 5.828 2.274 1.00 0.76 H new ATOM 0 HG13 VAL A 539 8.991 4.224 1.538 1.00 0.76 H new ATOM 0 HG21 VAL A 539 6.598 4.426 -0.332 1.00 0.80 H new ATOM 0 HG22 VAL A 539 6.883 2.972 0.653 1.00 0.80 H new ATOM 0 HG23 VAL A 539 5.319 3.816 0.745 1.00 0.80 H new ATOM 107 N ALA A 540 8.480 4.656 4.720 1.00 1.18 N ATOM 108 CA ALA A 540 9.600 4.396 5.629 1.00 1.62 C ATOM 109 C ALA A 540 9.231 3.574 6.878 1.00 1.73 C ATOM 110 O ALA A 540 10.112 3.293 7.697 1.00 2.19 O ATOM 111 CB ALA A 540 10.180 5.737 6.079 1.00 1.94 C ATOM 0 H ALA A 540 8.167 5.626 4.745 1.00 1.18 H new ATOM 0 HA ALA A 540 10.319 3.796 5.070 1.00 1.62 H new ATOM 0 HB1 ALA A 540 11.016 5.563 6.757 1.00 1.94 H new ATOM 0 HB2 ALA A 540 10.529 6.293 5.209 1.00 1.94 H new ATOM 0 HB3 ALA A 540 9.410 6.312 6.593 1.00 1.94 H new ATOM 117 N SER A 541 7.956 3.222 7.070 1.00 1.47 N ATOM 118 CA SER A 541 7.497 2.371 8.166 1.00 1.55 C ATOM 119 C SER A 541 7.313 0.896 7.753 1.00 1.54 C ATOM 120 O SER A 541 7.076 0.023 8.597 1.00 1.61 O ATOM 121 CB SER A 541 6.183 2.917 8.690 1.00 1.64 C ATOM 122 OG SER A 541 6.349 4.103 9.449 1.00 2.51 O ATOM 0 H SER A 541 7.202 3.528 6.455 1.00 1.47 H new ATOM 0 HA SER A 541 8.268 2.387 8.937 1.00 1.55 H new ATOM 0 HB2 SER A 541 5.517 3.117 7.851 1.00 1.64 H new ATOM 0 HB3 SER A 541 5.700 2.160 9.307 1.00 1.64 H new ATOM 0 HG SER A 541 6.133 4.880 8.893 1.00 2.51 H new ATOM 128 N MET A 542 7.372 0.624 6.448 1.00 1.53 N ATOM 129 CA MET A 542 6.944 -0.617 5.811 1.00 1.51 C ATOM 130 C MET A 542 8.062 -1.684 5.850 1.00 1.41 C ATOM 131 O MET A 542 9.178 -1.386 5.420 1.00 1.37 O ATOM 132 CB MET A 542 6.534 -0.234 4.376 1.00 1.59 C ATOM 133 CG MET A 542 5.466 -1.129 3.758 1.00 1.55 C ATOM 134 SD MET A 542 5.977 -2.829 3.438 1.00 2.63 S ATOM 135 CE MET A 542 4.735 -3.277 2.206 1.00 1.58 C ATOM 0 H MET A 542 7.738 1.298 5.776 1.00 1.53 H new ATOM 0 HA MET A 542 6.105 -1.074 6.336 1.00 1.51 H new ATOM 0 HB2 MET A 542 6.170 0.794 4.379 1.00 1.59 H new ATOM 0 HB3 MET A 542 7.420 -0.257 3.741 1.00 1.59 H new ATOM 0 HG2 MET A 542 4.601 -1.146 4.421 1.00 1.55 H new ATOM 0 HG3 MET A 542 5.139 -0.682 2.819 1.00 1.55 H new ATOM 0 HE1 MET A 542 4.528 -4.345 2.270 1.00 1.58 H new ATOM 0 HE2 MET A 542 3.819 -2.717 2.393 1.00 1.58 H new ATOM 0 HE3 MET A 542 5.108 -3.039 1.210 1.00 1.58 H new ATOM 145 N PRO A 543 7.813 -2.933 6.301 1.00 1.46 N ATOM 146 CA PRO A 543 8.871 -3.942 6.492 1.00 1.48 C ATOM 147 C PRO A 543 9.585 -4.387 5.200 1.00 1.33 C ATOM 148 O PRO A 543 10.691 -4.928 5.253 1.00 1.32 O ATOM 149 CB PRO A 543 8.187 -5.116 7.205 1.00 1.68 C ATOM 150 CG PRO A 543 6.710 -4.965 6.838 1.00 1.66 C ATOM 151 CD PRO A 543 6.536 -3.450 6.774 1.00 1.60 C ATOM 0 HA PRO A 543 9.685 -3.513 7.076 1.00 1.48 H new ATOM 0 HB2 PRO A 543 8.585 -6.073 6.869 1.00 1.68 H new ATOM 0 HB3 PRO A 543 8.337 -5.069 8.284 1.00 1.68 H new ATOM 0 HG2 PRO A 543 6.479 -5.440 5.885 1.00 1.66 H new ATOM 0 HG3 PRO A 543 6.058 -5.417 7.586 1.00 1.66 H new ATOM 0 HD2 PRO A 543 5.726 -3.176 6.098 1.00 1.60 H new ATOM 0 HD3 PRO A 543 6.285 -3.042 7.753 1.00 1.60 H new ATOM 159 N LEU A 544 9.003 -4.131 4.026 1.00 1.28 N ATOM 160 CA LEU A 544 9.629 -4.342 2.712 1.00 1.21 C ATOM 161 C LEU A 544 10.689 -3.272 2.373 1.00 1.14 C ATOM 162 O LEU A 544 11.603 -3.525 1.588 1.00 1.19 O ATOM 163 CB LEU A 544 8.473 -4.412 1.703 1.00 1.24 C ATOM 164 CG LEU A 544 8.851 -4.700 0.246 1.00 1.72 C ATOM 165 CD1 LEU A 544 7.706 -5.486 -0.373 1.00 1.67 C ATOM 166 CD2 LEU A 544 8.987 -3.410 -0.569 1.00 2.80 C ATOM 0 H LEU A 544 8.055 -3.760 3.958 1.00 1.28 H new ATOM 0 HA LEU A 544 10.204 -5.268 2.692 1.00 1.21 H new ATOM 0 HB2 LEU A 544 7.778 -5.184 2.034 1.00 1.24 H new ATOM 0 HB3 LEU A 544 7.935 -3.464 1.735 1.00 1.24 H new ATOM 0 HG LEU A 544 9.801 -5.235 0.234 1.00 1.72 H new ATOM 0 HD11 LEU A 544 7.939 -5.710 -1.414 1.00 1.67 H new ATOM 0 HD12 LEU A 544 7.565 -6.417 0.176 1.00 1.67 H new ATOM 0 HD13 LEU A 544 6.791 -4.895 -0.326 1.00 1.67 H new ATOM 0 HD21 LEU A 544 9.256 -3.655 -1.596 1.00 2.80 H new ATOM 0 HD22 LEU A 544 8.039 -2.873 -0.560 1.00 2.80 H new ATOM 0 HD23 LEU A 544 9.763 -2.783 -0.131 1.00 2.80 H new ATOM 178 N PHE A 545 10.602 -2.105 3.014 1.00 1.10 N ATOM 179 CA PHE A 545 11.478 -0.936 2.894 1.00 1.08 C ATOM 180 C PHE A 545 12.398 -0.791 4.131 1.00 1.16 C ATOM 181 O PHE A 545 12.971 0.276 4.363 1.00 1.15 O ATOM 182 CB PHE A 545 10.614 0.332 2.717 1.00 1.07 C ATOM 183 CG PHE A 545 9.775 0.483 1.453 1.00 0.98 C ATOM 184 CD1 PHE A 545 8.654 -0.338 1.216 1.00 1.61 C ATOM 185 CD2 PHE A 545 10.035 1.553 0.575 1.00 2.26 C ATOM 186 CE1 PHE A 545 7.784 -0.063 0.145 1.00 1.63 C ATOM 187 CE2 PHE A 545 9.175 1.823 -0.504 1.00 2.25 C ATOM 188 CZ PHE A 545 8.035 1.027 -0.704 1.00 0.97 C ATOM 0 H PHE A 545 9.854 -1.939 3.687 1.00 1.10 H new ATOM 0 HA PHE A 545 12.119 -1.069 2.022 1.00 1.08 H new ATOM 0 HB2 PHE A 545 9.938 0.391 3.570 1.00 1.07 H new ATOM 0 HB3 PHE A 545 11.278 1.194 2.776 1.00 1.07 H new ATOM 0 HD1 PHE A 545 8.462 -1.183 1.860 1.00 1.61 H new ATOM 0 HD2 PHE A 545 10.905 2.173 0.732 1.00 2.26 H new ATOM 0 HE1 PHE A 545 6.922 -0.691 -0.024 1.00 1.63 H new ATOM 0 HE2 PHE A 545 9.390 2.640 -1.177 1.00 2.25 H new ATOM 0 HZ PHE A 545 7.352 1.253 -1.510 1.00 0.97 H new ATOM 198 N ALA A 546 12.556 -1.840 4.945 1.00 1.30 N ATOM 199 CA ALA A 546 13.231 -1.818 6.246 1.00 1.45 C ATOM 200 C ALA A 546 14.673 -1.319 6.148 1.00 1.49 C ATOM 201 O ALA A 546 15.177 -0.570 6.989 1.00 1.67 O ATOM 202 CB ALA A 546 13.267 -3.266 6.730 1.00 1.65 C ATOM 0 H ALA A 546 12.202 -2.766 4.705 1.00 1.30 H new ATOM 0 HA ALA A 546 12.696 -1.145 6.917 1.00 1.45 H new ATOM 0 HB1 ALA A 546 13.761 -3.313 7.700 1.00 1.65 H new ATOM 0 HB2 ALA A 546 12.249 -3.644 6.822 1.00 1.65 H new ATOM 0 HB3 ALA A 546 13.817 -3.876 6.013 1.00 1.65 H new ATOM 208 N ASN A 547 15.311 -1.780 5.079 1.00 1.42 N ATOM 209 CA ASN A 547 16.725 -1.718 4.781 1.00 1.49 C ATOM 210 C ASN A 547 17.005 -0.764 3.597 1.00 1.40 C ATOM 211 O ASN A 547 18.090 -0.786 3.012 1.00 1.48 O ATOM 212 CB ASN A 547 17.127 -3.184 4.541 1.00 1.69 C ATOM 213 CG ASN A 547 17.452 -3.945 5.811 1.00 2.22 C ATOM 214 OD1 ASN A 547 18.523 -3.794 6.395 1.00 3.07 O ATOM 215 ND2 ASN A 547 16.554 -4.775 6.276 1.00 2.32 N ATOM 0 H ASN A 547 14.797 -2.249 4.333 1.00 1.42 H new ATOM 0 HA ASN A 547 17.326 -1.293 5.585 1.00 1.49 H new ATOM 0 HB2 ASN A 547 16.315 -3.693 4.021 1.00 1.69 H new ATOM 0 HB3 ASN A 547 17.994 -3.210 3.881 1.00 1.69 H new ATOM 0 HD21 ASN A 547 16.740 -5.302 7.129 1.00 2.32 H new ATOM 0 HD22 ASN A 547 15.668 -4.895 5.786 1.00 2.32 H new ATOM 222 N ALA A 548 16.006 0.046 3.229 1.00 1.31 N ATOM 223 CA ALA A 548 16.012 0.907 2.051 1.00 1.23 C ATOM 224 C ALA A 548 16.863 2.184 2.205 1.00 1.28 C ATOM 225 O ALA A 548 16.797 2.867 3.231 1.00 1.41 O ATOM 226 CB ALA A 548 14.562 1.268 1.717 1.00 1.06 C ATOM 0 H ALA A 548 15.142 0.119 3.766 1.00 1.31 H new ATOM 0 HA ALA A 548 16.482 0.350 1.240 1.00 1.23 H new ATOM 0 HB1 ALA A 548 14.541 1.912 0.838 1.00 1.06 H new ATOM 0 HB2 ALA A 548 13.998 0.358 1.513 1.00 1.06 H new ATOM 0 HB3 ALA A 548 14.114 1.791 2.562 1.00 1.06 H new ATOM 232 N ASP A 549 17.590 2.563 1.148 1.00 1.30 N ATOM 233 CA ASP A 549 18.308 3.845 1.078 1.00 1.35 C ATOM 234 C ASP A 549 17.314 5.022 0.997 1.00 1.21 C ATOM 235 O ASP A 549 16.400 4.977 0.166 1.00 1.07 O ATOM 236 CB ASP A 549 19.249 3.864 -0.139 1.00 1.51 C ATOM 237 CG ASP A 549 20.348 4.927 -0.005 1.00 1.72 C ATOM 238 OD1 ASP A 549 20.110 6.100 -0.379 1.00 2.40 O ATOM 239 OD2 ASP A 549 21.451 4.613 0.506 1.00 2.37 O ATOM 0 H ASP A 549 17.699 1.988 0.312 1.00 1.30 H new ATOM 0 HA ASP A 549 18.902 3.955 1.985 1.00 1.35 H new ATOM 0 HB2 ASP A 549 19.708 2.882 -0.257 1.00 1.51 H new ATOM 0 HB3 ASP A 549 18.669 4.055 -1.042 1.00 1.51 H new ATOM 244 N PRO A 550 17.484 6.104 1.779 1.00 1.30 N ATOM 245 CA PRO A 550 16.510 7.201 1.890 1.00 1.27 C ATOM 246 C PRO A 550 16.189 7.939 0.576 1.00 1.14 C ATOM 247 O PRO A 550 15.196 8.663 0.501 1.00 1.13 O ATOM 248 CB PRO A 550 17.141 8.172 2.900 1.00 1.51 C ATOM 249 CG PRO A 550 18.631 7.891 2.777 1.00 1.57 C ATOM 250 CD PRO A 550 18.621 6.378 2.645 1.00 1.51 C ATOM 0 HA PRO A 550 15.545 6.793 2.192 1.00 1.27 H new ATOM 0 HB2 PRO A 550 16.907 9.209 2.660 1.00 1.51 H new ATOM 0 HB3 PRO A 550 16.780 7.989 3.912 1.00 1.51 H new ATOM 0 HG2 PRO A 550 19.074 8.379 1.909 1.00 1.57 H new ATOM 0 HG3 PRO A 550 19.189 8.227 3.651 1.00 1.57 H new ATOM 0 HD2 PRO A 550 19.550 6.010 2.211 1.00 1.51 H new ATOM 0 HD3 PRO A 550 18.509 5.894 3.615 1.00 1.51 H new ATOM 258 N ASN A 551 16.992 7.748 -0.472 1.00 1.09 N ATOM 259 CA ASN A 551 16.780 8.349 -1.793 1.00 1.00 C ATOM 260 C ASN A 551 15.941 7.455 -2.714 1.00 0.81 C ATOM 261 O ASN A 551 15.106 7.962 -3.460 1.00 0.78 O ATOM 262 CB ASN A 551 18.139 8.684 -2.419 1.00 1.12 C ATOM 263 CG ASN A 551 18.777 9.887 -1.753 1.00 1.75 C ATOM 264 OD1 ASN A 551 18.223 10.979 -1.722 1.00 2.66 O ATOM 265 ND2 ASN A 551 19.932 9.720 -1.160 1.00 2.09 N ATOM 0 H ASN A 551 17.824 7.160 -0.427 1.00 1.09 H new ATOM 0 HA ASN A 551 16.206 9.267 -1.665 1.00 1.00 H new ATOM 0 HB2 ASN A 551 18.803 7.824 -2.331 1.00 1.12 H new ATOM 0 HB3 ASN A 551 18.012 8.881 -3.483 1.00 1.12 H new ATOM 0 HD21 ASN A 551 20.372 10.500 -0.671 1.00 2.09 H new ATOM 0 HD22 ASN A 551 20.392 8.810 -1.187 1.00 2.09 H new ATOM 272 N PHE A 552 16.107 6.134 -2.610 1.00 0.76 N ATOM 273 CA PHE A 552 15.319 5.137 -3.351 1.00 0.64 C ATOM 274 C PHE A 552 13.840 5.223 -2.961 1.00 0.57 C ATOM 275 O PHE A 552 12.960 5.309 -3.816 1.00 0.53 O ATOM 276 CB PHE A 552 15.900 3.739 -3.061 1.00 0.73 C ATOM 277 CG PHE A 552 15.013 2.559 -3.428 1.00 0.73 C ATOM 278 CD1 PHE A 552 14.518 2.404 -4.737 1.00 1.90 C ATOM 279 CD2 PHE A 552 14.675 1.608 -2.444 1.00 1.82 C ATOM 280 CE1 PHE A 552 13.678 1.320 -5.052 1.00 1.96 C ATOM 281 CE2 PHE A 552 13.838 0.524 -2.758 1.00 1.87 C ATOM 282 CZ PHE A 552 13.334 0.383 -4.062 1.00 0.98 C ATOM 0 H PHE A 552 16.806 5.716 -1.997 1.00 0.76 H new ATOM 0 HA PHE A 552 15.379 5.333 -4.422 1.00 0.64 H new ATOM 0 HB2 PHE A 552 16.843 3.640 -3.599 1.00 0.73 H new ATOM 0 HB3 PHE A 552 16.132 3.677 -1.998 1.00 0.73 H new ATOM 0 HD1 PHE A 552 14.784 3.119 -5.501 1.00 1.90 H new ATOM 0 HD2 PHE A 552 15.062 1.713 -1.441 1.00 1.82 H new ATOM 0 HE1 PHE A 552 13.297 1.208 -6.056 1.00 1.96 H new ATOM 0 HE2 PHE A 552 13.582 -0.200 -1.998 1.00 1.87 H new ATOM 0 HZ PHE A 552 12.683 -0.444 -4.303 1.00 0.98 H new ATOM 292 N VAL A 553 13.577 5.287 -1.653 1.00 0.64 N ATOM 293 CA VAL A 553 12.206 5.356 -1.101 1.00 0.64 C ATOM 294 C VAL A 553 11.465 6.649 -1.446 1.00 0.66 C ATOM 295 O VAL A 553 10.246 6.674 -1.576 1.00 0.66 O ATOM 296 CB VAL A 553 12.221 5.158 0.424 1.00 0.77 C ATOM 297 CG1 VAL A 553 13.079 3.953 0.777 1.00 1.27 C ATOM 298 CG2 VAL A 553 12.817 6.283 1.266 1.00 1.43 C ATOM 0 H VAL A 553 14.305 5.293 -0.939 1.00 0.64 H new ATOM 0 HA VAL A 553 11.658 4.543 -1.578 1.00 0.64 H new ATOM 0 HB VAL A 553 11.160 5.075 0.658 1.00 0.77 H new ATOM 0 HG11 VAL A 553 13.087 3.816 1.858 1.00 1.27 H new ATOM 0 HG12 VAL A 553 12.668 3.062 0.302 1.00 1.27 H new ATOM 0 HG13 VAL A 553 14.097 4.116 0.424 1.00 1.27 H new ATOM 0 HG21 VAL A 553 12.765 6.015 2.321 1.00 1.43 H new ATOM 0 HG22 VAL A 553 13.858 6.438 0.982 1.00 1.43 H new ATOM 0 HG23 VAL A 553 12.254 7.201 1.097 1.00 1.43 H new ATOM 308 N THR A 554 12.236 7.718 -1.602 1.00 0.73 N ATOM 309 CA THR A 554 11.801 9.085 -1.901 1.00 0.81 C ATOM 310 C THR A 554 11.557 9.285 -3.396 1.00 0.77 C ATOM 311 O THR A 554 10.570 9.914 -3.775 1.00 0.83 O ATOM 312 CB THR A 554 12.831 10.095 -1.370 1.00 0.93 C ATOM 313 OG1 THR A 554 12.913 10.002 0.037 1.00 1.02 O ATOM 314 CG2 THR A 554 12.451 11.530 -1.717 1.00 1.04 C ATOM 0 H THR A 554 13.250 7.653 -1.518 1.00 0.73 H new ATOM 0 HA THR A 554 10.850 9.256 -1.396 1.00 0.81 H new ATOM 0 HB THR A 554 13.785 9.853 -1.839 1.00 0.93 H new ATOM 0 HG1 THR A 554 13.729 9.519 0.286 1.00 1.02 H new ATOM 0 HG21 THR A 554 13.205 12.211 -1.323 1.00 1.04 H new ATOM 0 HG22 THR A 554 12.393 11.639 -2.800 1.00 1.04 H new ATOM 0 HG23 THR A 554 11.483 11.767 -1.276 1.00 1.04 H new ATOM 322 N ALA A 555 12.401 8.708 -4.258 1.00 0.70 N ATOM 323 CA ALA A 555 12.290 8.834 -5.715 1.00 0.70 C ATOM 324 C ALA A 555 10.966 8.282 -6.293 1.00 0.71 C ATOM 325 O ALA A 555 10.574 8.620 -7.414 1.00 0.80 O ATOM 326 CB ALA A 555 13.504 8.139 -6.340 1.00 0.68 C ATOM 0 H ALA A 555 13.190 8.134 -3.960 1.00 0.70 H new ATOM 0 HA ALA A 555 12.276 9.895 -5.966 1.00 0.70 H new ATOM 0 HB1 ALA A 555 13.449 8.217 -7.426 1.00 0.68 H new ATOM 0 HB2 ALA A 555 14.418 8.617 -5.988 1.00 0.68 H new ATOM 0 HB3 ALA A 555 13.510 7.088 -6.051 1.00 0.68 H new ATOM 332 N MET A 556 10.260 7.445 -5.523 1.00 0.70 N ATOM 333 CA MET A 556 8.905 6.985 -5.879 1.00 0.81 C ATOM 334 C MET A 556 7.793 8.026 -5.641 1.00 0.81 C ATOM 335 O MET A 556 6.728 7.936 -6.251 1.00 0.91 O ATOM 336 CB MET A 556 8.582 5.701 -5.104 1.00 1.02 C ATOM 337 CG MET A 556 9.103 4.510 -5.899 1.00 1.46 C ATOM 338 SD MET A 556 8.939 2.914 -5.074 1.00 1.56 S ATOM 339 CE MET A 556 10.515 2.912 -4.188 1.00 0.99 C ATOM 0 H MET A 556 10.606 7.068 -4.641 1.00 0.70 H new ATOM 0 HA MET A 556 8.920 6.806 -6.954 1.00 0.81 H new ATOM 0 HB2 MET A 556 9.044 5.728 -4.117 1.00 1.02 H new ATOM 0 HB3 MET A 556 7.507 5.612 -4.950 1.00 1.02 H new ATOM 0 HG2 MET A 556 8.572 4.467 -6.850 1.00 1.46 H new ATOM 0 HG3 MET A 556 10.155 4.677 -6.128 1.00 1.46 H new ATOM 0 HE1 MET A 556 10.646 1.956 -3.680 1.00 0.99 H new ATOM 0 HE2 MET A 556 11.330 3.062 -4.896 1.00 0.99 H new ATOM 0 HE3 MET A 556 10.520 3.717 -3.453 1.00 0.99 H new ATOM 349 N LEU A 557 7.999 9.002 -4.750 1.00 0.76 N ATOM 350 CA LEU A 557 6.929 9.868 -4.231 1.00 0.77 C ATOM 351 C LEU A 557 6.616 11.071 -5.144 1.00 0.80 C ATOM 352 O LEU A 557 5.561 11.689 -5.010 1.00 0.84 O ATOM 353 CB LEU A 557 7.310 10.369 -2.820 1.00 0.79 C ATOM 354 CG LEU A 557 7.777 9.303 -1.809 1.00 0.79 C ATOM 355 CD1 LEU A 557 8.094 9.963 -0.467 1.00 0.86 C ATOM 356 CD2 LEU A 557 6.735 8.209 -1.564 1.00 0.85 C ATOM 0 H LEU A 557 8.919 9.217 -4.365 1.00 0.76 H new ATOM 0 HA LEU A 557 6.023 9.262 -4.194 1.00 0.77 H new ATOM 0 HB2 LEU A 557 8.103 11.109 -2.925 1.00 0.79 H new ATOM 0 HB3 LEU A 557 6.447 10.884 -2.397 1.00 0.79 H new ATOM 0 HG LEU A 557 8.661 8.838 -2.244 1.00 0.79 H new ATOM 0 HD11 LEU A 557 8.423 9.204 0.243 1.00 0.86 H new ATOM 0 HD12 LEU A 557 8.885 10.701 -0.602 1.00 0.86 H new ATOM 0 HD13 LEU A 557 7.200 10.455 -0.083 1.00 0.86 H new ATOM 0 HD21 LEU A 557 7.125 7.490 -0.843 1.00 0.85 H new ATOM 0 HD22 LEU A 557 5.822 8.657 -1.172 1.00 0.85 H new ATOM 0 HD23 LEU A 557 6.515 7.699 -2.502 1.00 0.85 H new ATOM 368 N THR A 558 7.501 11.418 -6.085 1.00 0.84 N ATOM 369 CA THR A 558 7.382 12.638 -6.914 1.00 0.94 C ATOM 370 C THR A 558 6.251 12.592 -7.952 1.00 0.87 C ATOM 371 O THR A 558 5.940 13.613 -8.563 1.00 1.10 O ATOM 372 CB THR A 558 8.708 12.972 -7.614 1.00 1.17 C ATOM 373 OG1 THR A 558 9.093 11.915 -8.460 1.00 1.39 O ATOM 374 CG2 THR A 558 9.852 13.205 -6.629 1.00 2.02 C ATOM 0 H THR A 558 8.328 10.861 -6.300 1.00 0.84 H new ATOM 0 HA THR A 558 7.125 13.427 -6.207 1.00 0.94 H new ATOM 0 HB THR A 558 8.529 13.889 -8.175 1.00 1.17 H new ATOM 0 HG1 THR A 558 9.938 12.141 -8.901 1.00 1.39 H new ATOM 0 HG21 THR A 558 10.764 13.437 -7.179 1.00 2.02 H new ATOM 0 HG22 THR A 558 9.602 14.038 -5.972 1.00 2.02 H new ATOM 0 HG23 THR A 558 10.007 12.306 -6.032 1.00 2.02 H new ATOM 382 N LYS A 559 5.621 11.425 -8.143 1.00 0.73 N ATOM 383 CA LYS A 559 4.498 11.165 -9.065 1.00 0.83 C ATOM 384 C LYS A 559 3.230 10.646 -8.359 1.00 0.91 C ATOM 385 O LYS A 559 2.371 10.025 -8.986 1.00 1.13 O ATOM 386 CB LYS A 559 4.984 10.187 -10.149 1.00 0.98 C ATOM 387 CG LYS A 559 5.448 8.836 -9.565 1.00 1.23 C ATOM 388 CD LYS A 559 5.020 7.648 -10.429 1.00 1.47 C ATOM 389 CE LYS A 559 3.504 7.421 -10.340 1.00 1.75 C ATOM 390 NZ LYS A 559 3.032 6.437 -11.345 1.00 2.55 N ATOM 0 H LYS A 559 5.894 10.587 -7.631 1.00 0.73 H new ATOM 0 HA LYS A 559 4.196 12.111 -9.514 1.00 0.83 H new ATOM 0 HB2 LYS A 559 4.179 10.013 -10.863 1.00 0.98 H new ATOM 0 HB3 LYS A 559 5.807 10.642 -10.701 1.00 0.98 H new ATOM 0 HG2 LYS A 559 6.534 8.839 -9.469 1.00 1.23 H new ATOM 0 HG3 LYS A 559 5.039 8.718 -8.562 1.00 1.23 H new ATOM 0 HD2 LYS A 559 5.304 7.827 -11.466 1.00 1.47 H new ATOM 0 HD3 LYS A 559 5.546 6.750 -10.105 1.00 1.47 H new ATOM 0 HE2 LYS A 559 3.248 7.070 -9.340 1.00 1.75 H new ATOM 0 HE3 LYS A 559 2.986 8.368 -10.488 1.00 1.75 H new ATOM 0 HZ1 LYS A 559 2.054 6.159 -11.126 1.00 2.55 H new ATOM 0 HZ2 LYS A 559 3.066 6.865 -12.292 1.00 2.55 H new ATOM 0 HZ3 LYS A 559 3.644 5.597 -11.322 1.00 2.55 H new ATOM 404 N LEU A 560 3.172 10.771 -7.035 1.00 0.94 N ATOM 405 CA LEU A 560 2.327 9.966 -6.154 1.00 0.88 C ATOM 406 C LEU A 560 0.898 10.512 -6.060 1.00 0.90 C ATOM 407 O LEU A 560 0.659 11.711 -6.214 1.00 1.15 O ATOM 408 CB LEU A 560 2.996 9.843 -4.774 1.00 1.02 C ATOM 409 CG LEU A 560 2.327 8.836 -3.818 1.00 0.97 C ATOM 410 CD1 LEU A 560 2.209 7.458 -4.457 1.00 2.21 C ATOM 411 CD2 LEU A 560 3.189 8.599 -2.586 1.00 1.21 C ATOM 0 H LEU A 560 3.730 11.458 -6.528 1.00 0.94 H new ATOM 0 HA LEU A 560 2.230 8.969 -6.583 1.00 0.88 H new ATOM 0 HB2 LEU A 560 4.037 9.552 -4.915 1.00 1.02 H new ATOM 0 HB3 LEU A 560 3.001 10.824 -4.300 1.00 1.02 H new ATOM 0 HG LEU A 560 1.355 9.265 -3.575 1.00 0.97 H new ATOM 0 HD11 LEU A 560 1.733 6.772 -3.757 1.00 2.21 H new ATOM 0 HD12 LEU A 560 1.607 7.527 -5.363 1.00 2.21 H new ATOM 0 HD13 LEU A 560 3.203 7.088 -4.709 1.00 2.21 H new ATOM 0 HD21 LEU A 560 2.694 7.885 -1.928 1.00 1.21 H new ATOM 0 HD22 LEU A 560 4.157 8.202 -2.890 1.00 1.21 H new ATOM 0 HD23 LEU A 560 3.333 9.541 -2.056 1.00 1.21 H new ATOM 423 N LYS A 561 -0.043 9.617 -5.760 1.00 0.74 N ATOM 424 CA LYS A 561 -1.458 9.919 -5.577 1.00 0.82 C ATOM 425 C LYS A 561 -2.020 9.376 -4.278 1.00 0.82 C ATOM 426 O LYS A 561 -1.605 8.329 -3.777 1.00 0.82 O ATOM 427 CB LYS A 561 -2.235 9.381 -6.786 1.00 1.05 C ATOM 428 CG LYS A 561 -2.876 10.540 -7.549 1.00 1.11 C ATOM 429 CD LYS A 561 -2.973 10.285 -9.054 1.00 1.69 C ATOM 430 CE LYS A 561 -1.578 10.287 -9.703 1.00 2.44 C ATOM 431 NZ LYS A 561 -1.687 10.026 -11.157 1.00 3.40 N ATOM 0 H LYS A 561 0.169 8.627 -5.634 1.00 0.74 H new ATOM 0 HA LYS A 561 -1.568 11.001 -5.510 1.00 0.82 H new ATOM 0 HB2 LYS A 561 -1.564 8.828 -7.444 1.00 1.05 H new ATOM 0 HB3 LYS A 561 -3.004 8.683 -6.454 1.00 1.05 H new ATOM 0 HG2 LYS A 561 -3.875 10.721 -7.152 1.00 1.11 H new ATOM 0 HG3 LYS A 561 -2.296 11.446 -7.376 1.00 1.11 H new ATOM 0 HD2 LYS A 561 -3.461 9.327 -9.234 1.00 1.69 H new ATOM 0 HD3 LYS A 561 -3.595 11.051 -9.517 1.00 1.69 H new ATOM 0 HE2 LYS A 561 -1.092 11.248 -9.535 1.00 2.44 H new ATOM 0 HE3 LYS A 561 -0.951 9.527 -9.236 1.00 2.44 H new ATOM 0 HZ1 LYS A 561 -0.738 10.030 -11.583 1.00 3.40 H new ATOM 0 HZ2 LYS A 561 -2.131 9.098 -11.311 1.00 3.40 H new ATOM 0 HZ3 LYS A 561 -2.268 10.766 -11.600 1.00 3.40 H new ATOM 445 N PHE A 562 -3.014 10.086 -3.768 1.00 1.02 N ATOM 446 CA PHE A 562 -3.815 9.684 -2.633 1.00 1.20 C ATOM 447 C PHE A 562 -5.309 9.935 -2.882 1.00 1.00 C ATOM 448 O PHE A 562 -5.694 10.631 -3.822 1.00 0.98 O ATOM 449 CB PHE A 562 -3.235 10.331 -1.371 1.00 1.61 C ATOM 450 CG PHE A 562 -3.497 11.803 -1.156 1.00 1.36 C ATOM 451 CD1 PHE A 562 -4.694 12.203 -0.536 1.00 1.65 C ATOM 452 CD2 PHE A 562 -2.519 12.757 -1.485 1.00 2.50 C ATOM 453 CE1 PHE A 562 -4.920 13.561 -0.251 1.00 1.65 C ATOM 454 CE2 PHE A 562 -2.734 14.114 -1.182 1.00 3.05 C ATOM 455 CZ PHE A 562 -3.932 14.513 -0.562 1.00 2.21 C ATOM 0 H PHE A 562 -3.291 10.990 -4.150 1.00 1.02 H new ATOM 0 HA PHE A 562 -3.764 8.606 -2.479 1.00 1.20 H new ATOM 0 HB2 PHE A 562 -3.624 9.791 -0.508 1.00 1.61 H new ATOM 0 HB3 PHE A 562 -2.156 10.180 -1.382 1.00 1.61 H new ATOM 0 HD1 PHE A 562 -5.441 11.466 -0.278 1.00 1.65 H new ATOM 0 HD2 PHE A 562 -1.604 12.449 -1.969 1.00 2.50 H new ATOM 0 HE1 PHE A 562 -5.848 13.872 0.205 1.00 1.65 H new ATOM 0 HE2 PHE A 562 -1.980 14.848 -1.425 1.00 3.05 H new ATOM 0 HZ PHE A 562 -4.094 15.554 -0.324 1.00 2.21 H new ATOM 465 N GLU A 563 -6.148 9.277 -2.094 1.00 0.95 N ATOM 466 CA GLU A 563 -7.611 9.303 -2.156 1.00 0.85 C ATOM 467 C GLU A 563 -8.200 9.281 -0.739 1.00 0.78 C ATOM 468 O GLU A 563 -7.577 8.771 0.192 1.00 0.90 O ATOM 469 CB GLU A 563 -8.082 8.098 -2.994 1.00 0.94 C ATOM 470 CG GLU A 563 -9.587 8.089 -3.299 1.00 1.78 C ATOM 471 CD GLU A 563 -9.913 7.239 -4.536 1.00 2.06 C ATOM 472 OE1 GLU A 563 -9.993 5.991 -4.455 1.00 2.76 O ATOM 473 OE2 GLU A 563 -10.104 7.825 -5.630 1.00 2.74 O ATOM 0 H GLU A 563 -5.809 8.672 -1.346 1.00 0.95 H new ATOM 0 HA GLU A 563 -7.960 10.220 -2.631 1.00 0.85 H new ATOM 0 HB2 GLU A 563 -7.533 8.088 -3.935 1.00 0.94 H new ATOM 0 HB3 GLU A 563 -7.825 7.180 -2.465 1.00 0.94 H new ATOM 0 HG2 GLU A 563 -10.130 7.700 -2.438 1.00 1.78 H new ATOM 0 HG3 GLU A 563 -9.932 9.111 -3.459 1.00 1.78 H new ATOM 480 N VAL A 564 -9.394 9.841 -0.552 1.00 0.70 N ATOM 481 CA VAL A 564 -10.078 9.866 0.750 1.00 0.73 C ATOM 482 C VAL A 564 -11.409 9.133 0.702 1.00 0.75 C ATOM 483 O VAL A 564 -12.177 9.239 -0.255 1.00 0.84 O ATOM 484 CB VAL A 564 -10.250 11.293 1.304 1.00 0.90 C ATOM 485 CG1 VAL A 564 -10.729 11.282 2.755 1.00 1.16 C ATOM 486 CG2 VAL A 564 -8.915 12.047 1.276 1.00 0.93 C ATOM 0 H VAL A 564 -9.921 10.293 -1.299 1.00 0.70 H new ATOM 0 HA VAL A 564 -9.427 9.334 1.444 1.00 0.73 H new ATOM 0 HB VAL A 564 -10.990 11.782 0.671 1.00 0.90 H new ATOM 0 HG11 VAL A 564 -10.838 12.307 3.110 1.00 1.16 H new ATOM 0 HG12 VAL A 564 -11.690 10.772 2.817 1.00 1.16 H new ATOM 0 HG13 VAL A 564 -10.000 10.759 3.375 1.00 1.16 H new ATOM 0 HG21 VAL A 564 -9.057 13.053 1.671 1.00 0.93 H new ATOM 0 HG22 VAL A 564 -8.185 11.517 1.887 1.00 0.93 H new ATOM 0 HG23 VAL A 564 -8.553 12.108 0.250 1.00 0.93 H new ATOM 496 N PHE A 565 -11.708 8.435 1.792 1.00 0.79 N ATOM 497 CA PHE A 565 -13.003 7.812 2.044 1.00 0.89 C ATOM 498 C PHE A 565 -13.684 8.457 3.247 1.00 0.87 C ATOM 499 O PHE A 565 -13.036 8.716 4.256 1.00 0.89 O ATOM 500 CB PHE A 565 -12.821 6.306 2.202 1.00 0.98 C ATOM 501 CG PHE A 565 -12.415 5.658 0.894 1.00 0.94 C ATOM 502 CD1 PHE A 565 -11.059 5.580 0.523 1.00 1.91 C ATOM 503 CD2 PHE A 565 -13.410 5.195 0.016 1.00 1.83 C ATOM 504 CE1 PHE A 565 -10.703 5.026 -0.719 1.00 1.79 C ATOM 505 CE2 PHE A 565 -13.052 4.638 -1.220 1.00 1.92 C ATOM 506 CZ PHE A 565 -11.699 4.535 -1.576 1.00 0.90 C ATOM 0 H PHE A 565 -11.038 8.283 2.546 1.00 0.79 H new ATOM 0 HA PHE A 565 -13.665 7.975 1.194 1.00 0.89 H new ATOM 0 HB2 PHE A 565 -12.063 6.107 2.959 1.00 0.98 H new ATOM 0 HB3 PHE A 565 -13.750 5.861 2.557 1.00 0.98 H new ATOM 0 HD1 PHE A 565 -10.294 5.945 1.192 1.00 1.91 H new ATOM 0 HD2 PHE A 565 -14.451 5.268 0.294 1.00 1.83 H new ATOM 0 HE1 PHE A 565 -9.665 4.979 -1.013 1.00 1.79 H new ATOM 0 HE2 PHE A 565 -13.817 4.289 -1.897 1.00 1.92 H new ATOM 0 HZ PHE A 565 -11.423 4.076 -2.514 1.00 0.90 H new ATOM 516 N GLN A 566 -14.975 8.759 3.119 1.00 0.88 N ATOM 517 CA GLN A 566 -15.788 9.400 4.163 1.00 0.95 C ATOM 518 C GLN A 566 -16.316 8.348 5.170 1.00 1.05 C ATOM 519 O GLN A 566 -16.330 7.153 4.850 1.00 1.08 O ATOM 520 CB GLN A 566 -16.975 10.124 3.485 1.00 1.00 C ATOM 521 CG GLN A 566 -16.649 11.090 2.337 1.00 1.15 C ATOM 522 CD GLN A 566 -15.658 12.143 2.778 1.00 1.54 C ATOM 523 OE1 GLN A 566 -15.996 13.125 3.420 1.00 2.99 O ATOM 524 NE2 GLN A 566 -14.388 11.931 2.537 1.00 1.38 N ATOM 0 H GLN A 566 -15.502 8.562 2.268 1.00 0.88 H new ATOM 0 HA GLN A 566 -15.175 10.114 4.713 1.00 0.95 H new ATOM 0 HB2 GLN A 566 -17.659 9.366 3.104 1.00 1.00 H new ATOM 0 HB3 GLN A 566 -17.513 10.681 4.252 1.00 1.00 H new ATOM 0 HG2 GLN A 566 -16.241 10.533 1.493 1.00 1.15 H new ATOM 0 HG3 GLN A 566 -17.564 11.570 1.990 1.00 1.15 H new ATOM 0 HE21 GLN A 566 -14.100 11.112 2.001 1.00 1.38 H new ATOM 0 HE22 GLN A 566 -13.687 12.585 2.885 1.00 1.38 H new ATOM 533 N PRO A 567 -16.805 8.746 6.363 1.00 1.15 N ATOM 534 CA PRO A 567 -17.296 7.796 7.360 1.00 1.22 C ATOM 535 C PRO A 567 -18.482 6.969 6.837 1.00 1.32 C ATOM 536 O PRO A 567 -19.528 7.518 6.468 1.00 1.53 O ATOM 537 CB PRO A 567 -17.675 8.623 8.598 1.00 1.39 C ATOM 538 CG PRO A 567 -17.003 9.978 8.385 1.00 1.37 C ATOM 539 CD PRO A 567 -16.902 10.108 6.870 1.00 1.23 C ATOM 0 HA PRO A 567 -16.527 7.063 7.604 1.00 1.22 H new ATOM 0 HB2 PRO A 567 -18.756 8.728 8.687 1.00 1.39 H new ATOM 0 HB3 PRO A 567 -17.324 8.147 9.514 1.00 1.39 H new ATOM 0 HG2 PRO A 567 -17.592 10.787 8.816 1.00 1.37 H new ATOM 0 HG3 PRO A 567 -16.020 10.014 8.855 1.00 1.37 H new ATOM 0 HD2 PRO A 567 -17.775 10.616 6.462 1.00 1.23 H new ATOM 0 HD3 PRO A 567 -16.029 10.695 6.585 1.00 1.23 H new ATOM 547 N GLY A 568 -18.330 5.641 6.830 1.00 1.21 N ATOM 548 CA GLY A 568 -19.388 4.683 6.511 1.00 1.37 C ATOM 549 C GLY A 568 -19.342 4.159 5.079 1.00 1.41 C ATOM 550 O GLY A 568 -20.302 3.516 4.653 1.00 1.84 O ATOM 0 H GLY A 568 -17.442 5.192 7.053 1.00 1.21 H new ATOM 0 HA2 GLY A 568 -19.319 3.839 7.198 1.00 1.37 H new ATOM 0 HA3 GLY A 568 -20.355 5.155 6.683 1.00 1.37 H new ATOM 554 N ASP A 569 -18.275 4.438 4.321 1.00 1.15 N ATOM 555 CA ASP A 569 -18.097 3.982 2.946 1.00 1.14 C ATOM 556 C ASP A 569 -17.216 2.723 2.862 1.00 1.16 C ATOM 557 O ASP A 569 -16.235 2.577 3.596 1.00 1.21 O ATOM 558 CB ASP A 569 -17.558 5.136 2.077 1.00 1.06 C ATOM 559 CG ASP A 569 -17.713 4.894 0.570 1.00 1.08 C ATOM 560 OD1 ASP A 569 -18.673 4.203 0.153 1.00 1.68 O ATOM 561 OD2 ASP A 569 -16.908 5.438 -0.218 1.00 1.85 O ATOM 0 H ASP A 569 -17.495 5.001 4.659 1.00 1.15 H new ATOM 0 HA ASP A 569 -19.070 3.687 2.552 1.00 1.14 H new ATOM 0 HB2 ASP A 569 -18.079 6.055 2.344 1.00 1.06 H new ATOM 0 HB3 ASP A 569 -16.503 5.290 2.305 1.00 1.06 H new ATOM 566 N TYR A 570 -17.557 1.817 1.948 1.00 1.20 N ATOM 567 CA TYR A 570 -16.748 0.633 1.624 1.00 1.23 C ATOM 568 C TYR A 570 -15.562 1.060 0.744 1.00 1.17 C ATOM 569 O TYR A 570 -15.767 1.649 -0.324 1.00 1.25 O ATOM 570 CB TYR A 570 -17.600 -0.456 0.946 1.00 1.39 C ATOM 571 CG TYR A 570 -18.961 -0.709 1.577 1.00 1.89 C ATOM 572 CD1 TYR A 570 -19.064 -1.402 2.797 1.00 2.33 C ATOM 573 CD2 TYR A 570 -20.129 -0.261 0.930 1.00 3.22 C ATOM 574 CE1 TYR A 570 -20.329 -1.634 3.379 1.00 2.72 C ATOM 575 CE2 TYR A 570 -21.395 -0.508 1.494 1.00 3.96 C ATOM 576 CZ TYR A 570 -21.503 -1.193 2.722 1.00 3.28 C ATOM 577 OH TYR A 570 -22.729 -1.458 3.250 1.00 4.02 O ATOM 0 H TYR A 570 -18.415 1.881 1.401 1.00 1.20 H new ATOM 0 HA TYR A 570 -16.362 0.196 2.545 1.00 1.23 H new ATOM 0 HB2 TYR A 570 -17.748 -0.179 -0.098 1.00 1.39 H new ATOM 0 HB3 TYR A 570 -17.037 -1.389 0.951 1.00 1.39 H new ATOM 0 HD1 TYR A 570 -18.172 -1.758 3.290 1.00 2.33 H new ATOM 0 HD2 TYR A 570 -20.053 0.275 -0.004 1.00 3.22 H new ATOM 0 HE1 TYR A 570 -20.401 -2.148 4.326 1.00 2.72 H new ATOM 0 HE2 TYR A 570 -22.286 -0.172 0.985 1.00 3.96 H new ATOM 0 HH TYR A 570 -23.423 -1.081 2.670 1.00 4.02 H new ATOM 587 N ILE A 571 -14.324 0.810 1.189 1.00 1.08 N ATOM 588 CA ILE A 571 -13.133 1.476 0.633 1.00 1.10 C ATOM 589 C ILE A 571 -12.456 0.714 -0.521 1.00 1.10 C ATOM 590 O ILE A 571 -11.682 1.294 -1.285 1.00 1.16 O ATOM 591 CB ILE A 571 -12.111 1.757 1.752 1.00 1.08 C ATOM 592 CG1 ILE A 571 -11.631 0.466 2.439 1.00 1.03 C ATOM 593 CG2 ILE A 571 -12.646 2.684 2.852 1.00 1.15 C ATOM 594 CD1 ILE A 571 -10.182 0.587 2.868 1.00 1.06 C ATOM 0 H ILE A 571 -14.118 0.148 1.937 1.00 1.08 H new ATOM 0 HA ILE A 571 -13.493 2.410 0.201 1.00 1.10 H new ATOM 0 HB ILE A 571 -11.286 2.249 1.237 1.00 1.08 H new ATOM 0 HG12 ILE A 571 -12.255 0.258 3.308 1.00 1.03 H new ATOM 0 HG13 ILE A 571 -11.743 -0.377 1.757 1.00 1.03 H new ATOM 0 HG21 ILE A 571 -11.874 2.838 3.606 1.00 1.15 H new ATOM 0 HG22 ILE A 571 -12.924 3.644 2.416 1.00 1.15 H new ATOM 0 HG23 ILE A 571 -13.521 2.230 3.317 1.00 1.15 H new ATOM 0 HD11 ILE A 571 -9.867 -0.338 3.351 1.00 1.06 H new ATOM 0 HD12 ILE A 571 -9.558 0.771 1.994 1.00 1.06 H new ATOM 0 HD13 ILE A 571 -10.078 1.415 3.569 1.00 1.06 H new ATOM 606 N ILE A 572 -12.693 -0.599 -0.608 1.00 1.09 N ATOM 607 CA ILE A 572 -12.006 -1.546 -1.491 1.00 1.12 C ATOM 608 C ILE A 572 -13.018 -2.499 -2.131 1.00 1.40 C ATOM 609 O ILE A 572 -13.774 -3.163 -1.412 1.00 1.73 O ATOM 610 CB ILE A 572 -10.940 -2.317 -0.668 1.00 1.18 C ATOM 611 CG1 ILE A 572 -9.755 -1.369 -0.394 1.00 1.42 C ATOM 612 CG2 ILE A 572 -10.452 -3.599 -1.359 1.00 1.28 C ATOM 613 CD1 ILE A 572 -8.621 -1.920 0.480 1.00 1.22 C ATOM 0 H ILE A 572 -13.405 -1.052 -0.035 1.00 1.09 H new ATOM 0 HA ILE A 572 -11.506 -1.011 -2.298 1.00 1.12 H new ATOM 0 HB ILE A 572 -11.404 -2.639 0.264 1.00 1.18 H new ATOM 0 HG12 ILE A 572 -9.331 -1.068 -1.352 1.00 1.42 H new ATOM 0 HG13 ILE A 572 -10.143 -0.467 0.080 1.00 1.42 H new ATOM 0 HG21 ILE A 572 -9.708 -4.090 -0.731 1.00 1.28 H new ATOM 0 HG22 ILE A 572 -11.295 -4.271 -1.516 1.00 1.28 H new ATOM 0 HG23 ILE A 572 -10.005 -3.347 -2.321 1.00 1.28 H new ATOM 0 HD11 ILE A 572 -7.850 -1.159 0.598 1.00 1.22 H new ATOM 0 HD12 ILE A 572 -9.015 -2.192 1.459 1.00 1.22 H new ATOM 0 HD13 ILE A 572 -8.191 -2.802 0.005 1.00 1.22 H new ATOM 625 N ARG A 573 -12.971 -2.620 -3.464 1.00 1.62 N ATOM 626 CA ARG A 573 -13.639 -3.679 -4.229 1.00 1.97 C ATOM 627 C ARG A 573 -12.788 -4.048 -5.456 1.00 1.87 C ATOM 628 O ARG A 573 -12.873 -3.443 -6.523 1.00 2.67 O ATOM 629 CB ARG A 573 -15.069 -3.198 -4.541 1.00 2.92 C ATOM 630 CG ARG A 573 -16.036 -4.314 -4.965 1.00 3.76 C ATOM 631 CD ARG A 573 -16.072 -4.536 -6.475 1.00 4.20 C ATOM 632 NE ARG A 573 -16.668 -3.384 -7.170 1.00 5.01 N ATOM 633 CZ ARG A 573 -16.735 -3.215 -8.473 1.00 6.12 C ATOM 634 NH1 ARG A 573 -16.269 -4.087 -9.318 1.00 6.74 N ATOM 635 NH2 ARG A 573 -17.287 -2.145 -8.958 1.00 7.15 N ATOM 0 H ARG A 573 -12.455 -1.968 -4.054 1.00 1.62 H new ATOM 0 HA ARG A 573 -13.733 -4.609 -3.668 1.00 1.97 H new ATOM 0 HB2 ARG A 573 -15.472 -2.700 -3.659 1.00 2.92 H new ATOM 0 HB3 ARG A 573 -15.023 -2.453 -5.335 1.00 2.92 H new ATOM 0 HG2 ARG A 573 -15.746 -5.243 -4.474 1.00 3.76 H new ATOM 0 HG3 ARG A 573 -17.039 -4.069 -4.616 1.00 3.76 H new ATOM 0 HD2 ARG A 573 -15.060 -4.703 -6.845 1.00 4.20 H new ATOM 0 HD3 ARG A 573 -16.646 -5.435 -6.699 1.00 4.20 H new ATOM 0 HE ARG A 573 -17.066 -2.648 -6.587 1.00 5.01 H new ATOM 0 HH11 ARG A 573 -15.830 -4.943 -8.978 1.00 6.74 H new ATOM 0 HH12 ARG A 573 -16.342 -3.915 -10.321 1.00 6.74 H new ATOM 0 HH21 ARG A 573 -17.668 -1.438 -8.329 1.00 7.15 H new ATOM 0 HH22 ARG A 573 -17.340 -2.012 -9.968 1.00 7.15 H new ATOM 649 N GLU A 574 -11.961 -5.079 -5.290 1.00 1.75 N ATOM 650 CA GLU A 574 -10.967 -5.528 -6.282 1.00 1.76 C ATOM 651 C GLU A 574 -11.585 -6.495 -7.316 1.00 1.98 C ATOM 652 O GLU A 574 -12.613 -7.141 -7.069 1.00 2.92 O ATOM 653 CB GLU A 574 -9.745 -6.102 -5.529 1.00 2.87 C ATOM 654 CG GLU A 574 -8.582 -6.657 -6.375 1.00 3.16 C ATOM 655 CD GLU A 574 -7.919 -5.618 -7.286 1.00 4.47 C ATOM 656 OE1 GLU A 574 -8.569 -5.224 -8.285 1.00 4.96 O ATOM 657 OE2 GLU A 574 -6.746 -5.260 -7.027 1.00 5.62 O ATOM 0 H GLU A 574 -11.958 -5.645 -4.441 1.00 1.75 H new ATOM 0 HA GLU A 574 -10.621 -4.684 -6.879 1.00 1.76 H new ATOM 0 HB2 GLU A 574 -9.348 -5.317 -4.886 1.00 2.87 H new ATOM 0 HB3 GLU A 574 -10.097 -6.901 -4.877 1.00 2.87 H new ATOM 0 HG2 GLU A 574 -7.828 -7.073 -5.707 1.00 3.16 H new ATOM 0 HG3 GLU A 574 -8.953 -7.478 -6.988 1.00 3.16 H new ATOM 664 N GLY A 575 -10.961 -6.593 -8.491 1.00 2.08 N ATOM 665 CA GLY A 575 -11.467 -7.289 -9.676 1.00 3.04 C ATOM 666 C GLY A 575 -10.440 -7.489 -10.799 1.00 2.88 C ATOM 667 O GLY A 575 -10.641 -8.388 -11.616 1.00 3.59 O ATOM 0 H GLY A 575 -10.047 -6.170 -8.650 1.00 2.08 H new ATOM 0 HA2 GLY A 575 -11.845 -8.265 -9.372 1.00 3.04 H new ATOM 0 HA3 GLY A 575 -12.314 -6.729 -10.074 1.00 3.04 H new ATOM 671 N THR A 576 -9.336 -6.728 -10.844 1.00 2.27 N ATOM 672 CA THR A 576 -8.325 -6.832 -11.918 1.00 2.32 C ATOM 673 C THR A 576 -7.045 -7.537 -11.477 1.00 1.79 C ATOM 674 O THR A 576 -6.681 -7.568 -10.298 1.00 1.68 O ATOM 675 CB THR A 576 -8.041 -5.482 -12.595 1.00 2.69 C ATOM 676 OG1 THR A 576 -7.240 -5.665 -13.745 1.00 2.84 O ATOM 677 CG2 THR A 576 -7.334 -4.464 -11.704 1.00 2.94 C ATOM 0 H THR A 576 -9.115 -6.023 -10.140 1.00 2.27 H new ATOM 0 HA THR A 576 -8.773 -7.474 -12.676 1.00 2.32 H new ATOM 0 HB THR A 576 -9.026 -5.085 -12.840 1.00 2.69 H new ATOM 0 HG1 THR A 576 -7.069 -4.797 -14.166 1.00 2.84 H new ATOM 0 HG21 THR A 576 -7.173 -3.542 -12.262 1.00 2.94 H new ATOM 0 HG22 THR A 576 -7.950 -4.256 -10.829 1.00 2.94 H new ATOM 0 HG23 THR A 576 -6.373 -4.866 -11.384 1.00 2.94 H new ATOM 685 N ILE A 577 -6.360 -8.126 -12.454 1.00 1.81 N ATOM 686 CA ILE A 577 -5.170 -8.955 -12.258 1.00 1.72 C ATOM 687 C ILE A 577 -3.923 -8.058 -12.152 1.00 1.42 C ATOM 688 O ILE A 577 -3.533 -7.401 -13.124 1.00 1.51 O ATOM 689 CB ILE A 577 -5.062 -10.024 -13.379 1.00 2.14 C ATOM 690 CG1 ILE A 577 -6.082 -11.182 -13.238 1.00 2.73 C ATOM 691 CG2 ILE A 577 -3.663 -10.665 -13.394 1.00 2.32 C ATOM 692 CD1 ILE A 577 -7.556 -10.830 -13.461 1.00 3.21 C ATOM 0 H ILE A 577 -6.625 -8.038 -13.435 1.00 1.81 H new ATOM 0 HA ILE A 577 -5.249 -9.504 -11.320 1.00 1.72 H new ATOM 0 HB ILE A 577 -5.270 -9.479 -14.300 1.00 2.14 H new ATOM 0 HG12 ILE A 577 -5.808 -11.965 -13.945 1.00 2.73 H new ATOM 0 HG13 ILE A 577 -5.980 -11.605 -12.239 1.00 2.73 H new ATOM 0 HG21 ILE A 577 -3.613 -11.410 -14.188 1.00 2.32 H new ATOM 0 HG22 ILE A 577 -2.912 -9.895 -13.571 1.00 2.32 H new ATOM 0 HG23 ILE A 577 -3.472 -11.144 -12.434 1.00 2.32 H new ATOM 0 HD11 ILE A 577 -8.167 -11.724 -13.334 1.00 3.21 H new ATOM 0 HD12 ILE A 577 -7.863 -10.075 -12.737 1.00 3.21 H new ATOM 0 HD13 ILE A 577 -7.688 -10.440 -14.470 1.00 3.21 H new ATOM 704 N GLY A 578 -3.278 -8.052 -10.982 1.00 1.68 N ATOM 705 CA GLY A 578 -1.983 -7.406 -10.755 1.00 2.00 C ATOM 706 C GLY A 578 -2.081 -5.888 -10.602 1.00 1.62 C ATOM 707 O GLY A 578 -1.365 -5.159 -11.294 1.00 2.05 O ATOM 0 H GLY A 578 -3.650 -8.506 -10.148 1.00 1.68 H new ATOM 0 HA2 GLY A 578 -1.528 -7.826 -9.858 1.00 2.00 H new ATOM 0 HA3 GLY A 578 -1.319 -7.638 -11.587 1.00 2.00 H new ATOM 711 N LYS A 579 -2.979 -5.410 -9.730 1.00 1.27 N ATOM 712 CA LYS A 579 -3.196 -3.974 -9.491 1.00 1.36 C ATOM 713 C LYS A 579 -1.995 -3.314 -8.770 1.00 1.39 C ATOM 714 O LYS A 579 -1.004 -3.971 -8.433 1.00 1.50 O ATOM 715 CB LYS A 579 -4.556 -3.779 -8.784 1.00 1.75 C ATOM 716 CG LYS A 579 -5.143 -2.359 -8.897 1.00 2.87 C ATOM 717 CD LYS A 579 -6.587 -2.295 -8.394 1.00 3.18 C ATOM 718 CE LYS A 579 -7.126 -0.867 -8.545 1.00 4.63 C ATOM 719 NZ LYS A 579 -8.527 -0.769 -8.088 1.00 4.93 N ATOM 0 H LYS A 579 -3.580 -6.011 -9.166 1.00 1.27 H new ATOM 0 HA LYS A 579 -3.250 -3.445 -10.442 1.00 1.36 H new ATOM 0 HB2 LYS A 579 -5.272 -4.487 -9.201 1.00 1.75 H new ATOM 0 HB3 LYS A 579 -4.440 -4.027 -7.729 1.00 1.75 H new ATOM 0 HG2 LYS A 579 -4.528 -1.666 -8.323 1.00 2.87 H new ATOM 0 HG3 LYS A 579 -5.106 -2.033 -9.936 1.00 2.87 H new ATOM 0 HD2 LYS A 579 -7.209 -2.990 -8.958 1.00 3.18 H new ATOM 0 HD3 LYS A 579 -6.632 -2.602 -7.349 1.00 3.18 H new ATOM 0 HE2 LYS A 579 -6.505 -0.179 -7.970 1.00 4.63 H new ATOM 0 HE3 LYS A 579 -7.060 -0.560 -9.589 1.00 4.63 H new ATOM 0 HZ1 LYS A 579 -8.862 0.209 -8.203 1.00 4.93 H new ATOM 0 HZ2 LYS A 579 -9.122 -1.408 -8.653 1.00 4.93 H new ATOM 0 HZ3 LYS A 579 -8.585 -1.039 -7.085 1.00 4.93 H new ATOM 733 N LYS A 580 -2.068 -1.999 -8.544 1.00 1.50 N ATOM 734 CA LYS A 580 -1.096 -1.174 -7.801 1.00 1.49 C ATOM 735 C LYS A 580 -1.425 -1.180 -6.297 1.00 1.34 C ATOM 736 O LYS A 580 -2.553 -1.508 -5.938 1.00 1.51 O ATOM 737 CB LYS A 580 -1.109 0.252 -8.392 1.00 1.80 C ATOM 738 CG LYS A 580 -0.841 0.376 -9.914 1.00 3.21 C ATOM 739 CD LYS A 580 0.053 -0.721 -10.531 1.00 4.71 C ATOM 740 CE LYS A 580 0.438 -0.517 -12.006 1.00 6.63 C ATOM 741 NZ LYS A 580 -0.723 -0.327 -12.905 1.00 6.52 N ATOM 0 H LYS A 580 -2.850 -1.445 -8.893 1.00 1.50 H new ATOM 0 HA LYS A 580 -0.092 -1.585 -7.904 1.00 1.49 H new ATOM 0 HB2 LYS A 580 -2.080 0.700 -8.180 1.00 1.80 H new ATOM 0 HB3 LYS A 580 -0.362 0.846 -7.865 1.00 1.80 H new ATOM 0 HG2 LYS A 580 -1.799 0.372 -10.434 1.00 3.21 H new ATOM 0 HG3 LYS A 580 -0.379 1.345 -10.105 1.00 3.21 H new ATOM 0 HD2 LYS A 580 0.968 -0.792 -9.942 1.00 4.71 H new ATOM 0 HD3 LYS A 580 -0.461 -1.678 -10.438 1.00 4.71 H new ATOM 0 HE2 LYS A 580 1.092 0.351 -12.084 1.00 6.63 H new ATOM 0 HE3 LYS A 580 1.011 -1.380 -12.345 1.00 6.63 H new ATOM 0 HZ1 LYS A 580 -0.389 -0.196 -13.881 1.00 6.52 H new ATOM 0 HZ2 LYS A 580 -1.338 -1.164 -12.859 1.00 6.52 H new ATOM 0 HZ3 LYS A 580 -1.259 0.513 -12.607 1.00 6.52 H new ATOM 755 N MET A 581 -0.470 -0.859 -5.414 1.00 1.21 N ATOM 756 CA MET A 581 -0.652 -1.094 -3.963 1.00 1.19 C ATOM 757 C MET A 581 -1.341 0.057 -3.204 1.00 1.09 C ATOM 758 O MET A 581 -1.200 1.229 -3.559 1.00 0.99 O ATOM 759 CB MET A 581 0.634 -1.575 -3.262 1.00 1.32 C ATOM 760 CG MET A 581 1.596 -0.490 -2.742 1.00 1.90 C ATOM 761 SD MET A 581 2.735 -1.077 -1.444 1.00 2.31 S ATOM 762 CE MET A 581 1.673 -1.084 0.044 1.00 1.61 C ATOM 0 H MET A 581 0.426 -0.442 -5.667 1.00 1.21 H new ATOM 0 HA MET A 581 -1.362 -1.920 -3.918 1.00 1.19 H new ATOM 0 HB2 MET A 581 0.345 -2.204 -2.420 1.00 1.32 H new ATOM 0 HB3 MET A 581 1.183 -2.208 -3.959 1.00 1.32 H new ATOM 0 HG2 MET A 581 2.180 -0.105 -3.578 1.00 1.90 H new ATOM 0 HG3 MET A 581 1.012 0.343 -2.350 1.00 1.90 H new ATOM 0 HE1 MET A 581 2.252 -1.423 0.903 1.00 1.61 H new ATOM 0 HE2 MET A 581 1.303 -0.076 0.231 1.00 1.61 H new ATOM 0 HE3 MET A 581 0.830 -1.757 -0.114 1.00 1.61 H new ATOM 772 N TYR A 582 -2.059 -0.288 -2.128 1.00 1.21 N ATOM 773 CA TYR A 582 -2.848 0.628 -1.291 1.00 1.19 C ATOM 774 C TYR A 582 -2.418 0.587 0.188 1.00 1.22 C ATOM 775 O TYR A 582 -2.146 -0.477 0.756 1.00 1.29 O ATOM 776 CB TYR A 582 -4.369 0.359 -1.394 1.00 1.30 C ATOM 777 CG TYR A 582 -4.900 -0.805 -2.231 1.00 2.24 C ATOM 778 CD1 TYR A 582 -4.687 -0.879 -3.623 1.00 2.79 C ATOM 779 CD2 TYR A 582 -5.695 -1.787 -1.611 1.00 3.63 C ATOM 780 CE1 TYR A 582 -5.237 -1.939 -4.381 1.00 3.62 C ATOM 781 CE2 TYR A 582 -6.270 -2.828 -2.367 1.00 4.69 C ATOM 782 CZ TYR A 582 -6.046 -2.912 -3.755 1.00 4.38 C ATOM 783 OH TYR A 582 -6.648 -3.915 -4.453 1.00 5.46 O ATOM 0 H TYR A 582 -2.109 -1.253 -1.802 1.00 1.21 H new ATOM 0 HA TYR A 582 -2.646 1.625 -1.683 1.00 1.19 H new ATOM 0 HB2 TYR A 582 -4.740 0.219 -0.379 1.00 1.30 H new ATOM 0 HB3 TYR A 582 -4.830 1.268 -1.780 1.00 1.30 H new ATOM 0 HD1 TYR A 582 -4.098 -0.119 -4.115 1.00 2.79 H new ATOM 0 HD2 TYR A 582 -5.866 -1.742 -0.546 1.00 3.63 H new ATOM 0 HE1 TYR A 582 -5.038 -2.004 -5.440 1.00 3.62 H new ATOM 0 HE2 TYR A 582 -6.887 -3.567 -1.878 1.00 4.69 H new ATOM 0 HH TYR A 582 -6.256 -3.970 -5.350 1.00 5.46 H new ATOM 793 N PHE A 583 -2.418 1.754 0.841 1.00 1.16 N ATOM 794 CA PHE A 583 -2.053 1.900 2.260 1.00 1.14 C ATOM 795 C PHE A 583 -2.679 3.120 2.940 1.00 1.13 C ATOM 796 O PHE A 583 -3.260 3.971 2.264 1.00 1.20 O ATOM 797 CB PHE A 583 -0.521 1.767 2.448 1.00 1.15 C ATOM 798 CG PHE A 583 0.482 2.917 2.442 1.00 1.13 C ATOM 799 CD1 PHE A 583 0.167 4.294 2.441 1.00 1.86 C ATOM 800 CD2 PHE A 583 1.836 2.534 2.491 1.00 2.37 C ATOM 801 CE1 PHE A 583 1.192 5.258 2.449 1.00 2.33 C ATOM 802 CE2 PHE A 583 2.860 3.495 2.486 1.00 2.68 C ATOM 803 CZ PHE A 583 2.538 4.860 2.436 1.00 2.16 C ATOM 0 H PHE A 583 -2.674 2.636 0.397 1.00 1.16 H new ATOM 0 HA PHE A 583 -2.504 1.068 2.801 1.00 1.14 H new ATOM 0 HB2 PHE A 583 -0.384 1.260 3.403 1.00 1.15 H new ATOM 0 HB3 PHE A 583 -0.187 1.079 1.671 1.00 1.15 H new ATOM 0 HD1 PHE A 583 -0.866 4.609 2.434 1.00 1.86 H new ATOM 0 HD2 PHE A 583 2.091 1.485 2.533 1.00 2.37 H new ATOM 0 HE1 PHE A 583 0.942 6.309 2.465 1.00 2.33 H new ATOM 0 HE2 PHE A 583 3.894 3.184 2.521 1.00 2.68 H new ATOM 0 HZ PHE A 583 3.322 5.601 2.388 1.00 2.16 H new ATOM 813 N ILE A 584 -2.569 3.211 4.269 1.00 1.06 N ATOM 814 CA ILE A 584 -3.276 4.215 5.085 1.00 1.03 C ATOM 815 C ILE A 584 -2.344 5.380 5.479 1.00 1.14 C ATOM 816 O ILE A 584 -1.469 5.202 6.323 1.00 1.20 O ATOM 817 CB ILE A 584 -3.924 3.525 6.315 1.00 1.00 C ATOM 818 CG1 ILE A 584 -4.677 2.232 5.907 1.00 0.91 C ATOM 819 CG2 ILE A 584 -4.907 4.514 6.986 1.00 0.98 C ATOM 820 CD1 ILE A 584 -5.355 1.505 7.063 1.00 0.91 C ATOM 0 H ILE A 584 -1.981 2.585 4.819 1.00 1.06 H new ATOM 0 HA ILE A 584 -4.075 4.660 4.492 1.00 1.03 H new ATOM 0 HB ILE A 584 -3.135 3.245 7.013 1.00 1.00 H new ATOM 0 HG12 ILE A 584 -5.431 2.485 5.161 1.00 0.91 H new ATOM 0 HG13 ILE A 584 -3.972 1.551 5.429 1.00 0.91 H new ATOM 0 HG21 ILE A 584 -5.368 4.038 7.852 1.00 0.98 H new ATOM 0 HG22 ILE A 584 -4.366 5.404 7.306 1.00 0.98 H new ATOM 0 HG23 ILE A 584 -5.681 4.797 6.273 1.00 0.98 H new ATOM 0 HD11 ILE A 584 -5.857 0.613 6.688 1.00 0.91 H new ATOM 0 HD12 ILE A 584 -4.606 1.216 7.801 1.00 0.91 H new ATOM 0 HD13 ILE A 584 -6.087 2.165 7.528 1.00 0.91 H new ATOM 832 N GLN A 585 -2.537 6.581 4.910 1.00 1.18 N ATOM 833 CA GLN A 585 -1.734 7.776 5.233 1.00 1.29 C ATOM 834 C GLN A 585 -2.195 8.505 6.513 1.00 1.29 C ATOM 835 O GLN A 585 -1.342 8.884 7.316 1.00 1.42 O ATOM 836 CB GLN A 585 -1.679 8.696 3.999 1.00 1.37 C ATOM 837 CG GLN A 585 -0.882 10.003 4.204 1.00 1.43 C ATOM 838 CD GLN A 585 -1.765 11.177 4.621 1.00 1.61 C ATOM 839 OE1 GLN A 585 -2.660 11.586 3.901 1.00 2.66 O ATOM 840 NE2 GLN A 585 -1.588 11.759 5.784 1.00 1.79 N ATOM 0 H GLN A 585 -3.258 6.753 4.209 1.00 1.18 H new ATOM 0 HA GLN A 585 -0.722 7.450 5.472 1.00 1.29 H new ATOM 0 HB2 GLN A 585 -1.237 8.143 3.170 1.00 1.37 H new ATOM 0 HB3 GLN A 585 -2.698 8.950 3.706 1.00 1.37 H new ATOM 0 HG2 GLN A 585 -0.118 9.841 4.964 1.00 1.43 H new ATOM 0 HG3 GLN A 585 -0.363 10.255 3.279 1.00 1.43 H new ATOM 0 HE21 GLN A 585 -0.847 11.438 6.407 1.00 1.79 H new ATOM 0 HE22 GLN A 585 -2.191 12.532 6.064 1.00 1.79 H new ATOM 849 N HIS A 586 -3.504 8.679 6.738 1.00 1.20 N ATOM 850 CA HIS A 586 -4.061 9.153 8.021 1.00 1.26 C ATOM 851 C HIS A 586 -5.534 8.746 8.204 1.00 1.13 C ATOM 852 O HIS A 586 -6.375 9.128 7.392 1.00 1.05 O ATOM 853 CB HIS A 586 -3.930 10.679 8.163 1.00 1.35 C ATOM 854 CG HIS A 586 -4.267 11.156 9.556 1.00 1.44 C ATOM 855 ND1 HIS A 586 -5.515 11.485 10.040 1.00 2.02 N ATOM 856 CD2 HIS A 586 -3.383 11.310 10.593 1.00 2.54 C ATOM 857 CE1 HIS A 586 -5.386 11.838 11.330 1.00 2.23 C ATOM 858 NE2 HIS A 586 -4.099 11.747 11.719 1.00 2.42 N ATOM 0 H HIS A 586 -4.216 8.494 6.031 1.00 1.20 H new ATOM 0 HA HIS A 586 -3.474 8.670 8.802 1.00 1.26 H new ATOM 0 HB2 HIS A 586 -2.912 10.979 7.915 1.00 1.35 H new ATOM 0 HB3 HIS A 586 -4.589 11.166 7.445 1.00 1.35 H new ATOM 0 HD2 HIS A 586 -2.319 11.127 10.551 1.00 2.54 H new ATOM 0 HE1 HIS A 586 -6.200 12.151 11.967 1.00 2.23 H new ATOM 0 HE2 HIS A 586 -3.722 11.954 12.644 1.00 2.42 H new ATOM 866 N GLY A 587 -5.873 8.022 9.277 1.00 1.14 N ATOM 867 CA GLY A 587 -7.253 7.786 9.697 1.00 1.08 C ATOM 868 C GLY A 587 -7.421 6.432 10.381 1.00 0.99 C ATOM 869 O GLY A 587 -6.456 5.866 10.907 1.00 1.04 O ATOM 0 H GLY A 587 -5.184 7.579 9.885 1.00 1.14 H new ATOM 0 HA2 GLY A 587 -7.564 8.577 10.379 1.00 1.08 H new ATOM 0 HA3 GLY A 587 -7.910 7.837 8.828 1.00 1.08 H new ATOM 873 N VAL A 588 -8.649 5.911 10.371 1.00 0.92 N ATOM 874 CA VAL A 588 -9.011 4.618 10.969 1.00 0.87 C ATOM 875 C VAL A 588 -9.974 3.854 10.041 1.00 0.82 C ATOM 876 O VAL A 588 -10.836 4.454 9.394 1.00 0.82 O ATOM 877 CB VAL A 588 -9.628 4.808 12.378 1.00 0.94 C ATOM 878 CG1 VAL A 588 -9.896 3.474 13.081 1.00 0.97 C ATOM 879 CG2 VAL A 588 -8.734 5.629 13.320 1.00 1.02 C ATOM 0 H VAL A 588 -9.441 6.385 9.937 1.00 0.92 H new ATOM 0 HA VAL A 588 -8.103 4.026 11.086 1.00 0.87 H new ATOM 0 HB VAL A 588 -10.560 5.340 12.189 1.00 0.94 H new ATOM 0 HG11 VAL A 588 -10.328 3.661 14.064 1.00 0.97 H new ATOM 0 HG12 VAL A 588 -10.591 2.882 12.486 1.00 0.97 H new ATOM 0 HG13 VAL A 588 -8.960 2.928 13.194 1.00 0.97 H new ATOM 0 HG21 VAL A 588 -9.221 5.727 14.290 1.00 1.02 H new ATOM 0 HG22 VAL A 588 -7.776 5.124 13.444 1.00 1.02 H new ATOM 0 HG23 VAL A 588 -8.570 6.619 12.895 1.00 1.02 H new ATOM 889 N VAL A 589 -9.849 2.527 9.964 1.00 0.79 N ATOM 890 CA VAL A 589 -10.709 1.652 9.137 1.00 0.75 C ATOM 891 C VAL A 589 -11.167 0.405 9.895 1.00 0.79 C ATOM 892 O VAL A 589 -10.424 -0.135 10.714 1.00 0.86 O ATOM 893 CB VAL A 589 -10.027 1.241 7.813 1.00 0.68 C ATOM 894 CG1 VAL A 589 -9.624 2.458 6.968 1.00 0.74 C ATOM 895 CG2 VAL A 589 -8.787 0.366 8.032 1.00 0.67 C ATOM 0 H VAL A 589 -9.136 2.013 10.481 1.00 0.79 H new ATOM 0 HA VAL A 589 -11.589 2.248 8.897 1.00 0.75 H new ATOM 0 HB VAL A 589 -10.777 0.659 7.277 1.00 0.68 H new ATOM 0 HG11 VAL A 589 -9.149 2.120 6.047 1.00 0.74 H new ATOM 0 HG12 VAL A 589 -10.512 3.042 6.725 1.00 0.74 H new ATOM 0 HG13 VAL A 589 -8.925 3.077 7.531 1.00 0.74 H new ATOM 0 HG21 VAL A 589 -8.349 0.108 7.068 1.00 0.67 H new ATOM 0 HG22 VAL A 589 -8.056 0.913 8.628 1.00 0.67 H new ATOM 0 HG23 VAL A 589 -9.073 -0.546 8.557 1.00 0.67 H new ATOM 905 N SER A 590 -12.372 -0.075 9.583 1.00 0.79 N ATOM 906 CA SER A 590 -12.907 -1.364 10.060 1.00 0.92 C ATOM 907 C SER A 590 -12.854 -2.444 8.964 1.00 1.01 C ATOM 908 O SER A 590 -13.564 -2.374 7.957 1.00 0.94 O ATOM 909 CB SER A 590 -14.358 -1.225 10.530 1.00 1.05 C ATOM 910 OG SER A 590 -14.602 -0.067 11.305 1.00 1.08 O ATOM 0 H SER A 590 -13.022 0.428 8.979 1.00 0.79 H new ATOM 0 HA SER A 590 -12.276 -1.666 10.896 1.00 0.92 H new ATOM 0 HB2 SER A 590 -15.012 -1.211 9.658 1.00 1.05 H new ATOM 0 HB3 SER A 590 -14.626 -2.105 11.115 1.00 1.05 H new ATOM 0 HG SER A 590 -15.525 -0.083 11.635 1.00 1.08 H new ATOM 916 N VAL A 591 -12.034 -3.473 9.169 1.00 1.19 N ATOM 917 CA VAL A 591 -11.919 -4.687 8.340 1.00 1.01 C ATOM 918 C VAL A 591 -12.952 -5.718 8.787 1.00 0.94 C ATOM 919 O VAL A 591 -13.159 -5.897 9.982 1.00 0.92 O ATOM 920 CB VAL A 591 -10.517 -5.327 8.469 1.00 1.50 C ATOM 921 CG1 VAL A 591 -10.246 -6.361 7.368 1.00 3.02 C ATOM 922 CG2 VAL A 591 -9.379 -4.305 8.434 1.00 1.00 C ATOM 0 H VAL A 591 -11.392 -3.490 9.962 1.00 1.19 H new ATOM 0 HA VAL A 591 -12.087 -4.393 7.304 1.00 1.01 H new ATOM 0 HB VAL A 591 -10.533 -5.811 9.446 1.00 1.50 H new ATOM 0 HG11 VAL A 591 -9.249 -6.782 7.502 1.00 3.02 H new ATOM 0 HG12 VAL A 591 -10.987 -7.158 7.427 1.00 3.02 H new ATOM 0 HG13 VAL A 591 -10.308 -5.879 6.393 1.00 3.02 H new ATOM 0 HG21 VAL A 591 -8.424 -4.821 8.529 1.00 1.00 H new ATOM 0 HG22 VAL A 591 -9.406 -3.763 7.489 1.00 1.00 H new ATOM 0 HG23 VAL A 591 -9.496 -3.602 9.259 1.00 1.00 H new ATOM 932 N LEU A 592 -13.535 -6.450 7.842 1.00 1.23 N ATOM 933 CA LEU A 592 -14.248 -7.716 8.078 1.00 1.68 C ATOM 934 C LEU A 592 -13.425 -8.871 7.482 1.00 2.01 C ATOM 935 O LEU A 592 -12.902 -8.731 6.373 1.00 1.92 O ATOM 936 CB LEU A 592 -15.657 -7.663 7.442 1.00 2.02 C ATOM 937 CG LEU A 592 -16.798 -7.028 8.263 1.00 2.18 C ATOM 938 CD1 LEU A 592 -17.166 -7.895 9.468 1.00 2.19 C ATOM 939 CD2 LEU A 592 -16.510 -5.605 8.740 1.00 2.46 C ATOM 0 H LEU A 592 -13.528 -6.176 6.859 1.00 1.23 H new ATOM 0 HA LEU A 592 -14.369 -7.876 9.149 1.00 1.68 H new ATOM 0 HB2 LEU A 592 -15.579 -7.118 6.502 1.00 2.02 H new ATOM 0 HB3 LEU A 592 -15.951 -8.683 7.195 1.00 2.02 H new ATOM 0 HG LEU A 592 -17.637 -6.970 7.570 1.00 2.18 H new ATOM 0 HD11 LEU A 592 -17.973 -7.419 10.026 1.00 2.19 H new ATOM 0 HD12 LEU A 592 -17.492 -8.877 9.124 1.00 2.19 H new ATOM 0 HD13 LEU A 592 -16.296 -8.008 10.115 1.00 2.19 H new ATOM 0 HD21 LEU A 592 -17.362 -5.233 9.309 1.00 2.46 H new ATOM 0 HD22 LEU A 592 -15.623 -5.606 9.374 1.00 2.46 H new ATOM 0 HD23 LEU A 592 -16.339 -4.960 7.878 1.00 2.46 H new ATOM 951 N THR A 593 -13.325 -10.017 8.169 1.00 2.49 N ATOM 952 CA THR A 593 -12.685 -11.227 7.614 1.00 2.86 C ATOM 953 C THR A 593 -13.687 -12.360 7.406 1.00 3.19 C ATOM 954 O THR A 593 -14.493 -12.638 8.296 1.00 3.23 O ATOM 955 CB THR A 593 -11.491 -11.706 8.456 1.00 3.05 C ATOM 956 OG1 THR A 593 -11.600 -11.338 9.818 1.00 2.88 O ATOM 957 CG2 THR A 593 -10.180 -11.131 7.943 1.00 3.02 C ATOM 0 H THR A 593 -13.681 -10.136 9.118 1.00 2.49 H new ATOM 0 HA THR A 593 -12.297 -10.936 6.638 1.00 2.86 H new ATOM 0 HB THR A 593 -11.501 -12.792 8.367 1.00 3.05 H new ATOM 0 HG1 THR A 593 -10.818 -11.667 10.309 1.00 2.88 H new ATOM 0 HG21 THR A 593 -9.358 -11.491 8.562 1.00 3.02 H new ATOM 0 HG22 THR A 593 -10.023 -11.447 6.912 1.00 3.02 H new ATOM 0 HG23 THR A 593 -10.218 -10.043 7.987 1.00 3.02 H new ATOM 965 N LYS A 594 -13.623 -13.037 6.251 1.00 3.48 N ATOM 966 CA LYS A 594 -14.482 -14.195 5.936 1.00 3.81 C ATOM 967 C LYS A 594 -14.332 -15.311 6.981 1.00 3.98 C ATOM 968 O LYS A 594 -13.221 -15.591 7.436 1.00 3.85 O ATOM 969 CB LYS A 594 -14.281 -14.669 4.480 1.00 4.06 C ATOM 970 CG LYS A 594 -13.087 -15.601 4.202 1.00 4.43 C ATOM 971 CD LYS A 594 -11.704 -14.986 4.465 1.00 4.31 C ATOM 972 CE LYS A 594 -10.550 -15.948 4.145 1.00 4.86 C ATOM 973 NZ LYS A 594 -10.240 -16.004 2.699 1.00 4.87 N ATOM 0 H LYS A 594 -12.972 -12.798 5.503 1.00 3.48 H new ATOM 0 HA LYS A 594 -15.522 -13.876 5.999 1.00 3.81 H new ATOM 0 HB2 LYS A 594 -15.190 -15.180 4.163 1.00 4.06 H new ATOM 0 HB3 LYS A 594 -14.175 -13.787 3.849 1.00 4.06 H new ATOM 0 HG2 LYS A 594 -13.193 -16.495 4.817 1.00 4.43 H new ATOM 0 HG3 LYS A 594 -13.132 -15.923 3.162 1.00 4.43 H new ATOM 0 HD2 LYS A 594 -11.594 -14.083 3.865 1.00 4.31 H new ATOM 0 HD3 LYS A 594 -11.639 -14.684 5.510 1.00 4.31 H new ATOM 0 HE2 LYS A 594 -9.660 -15.636 4.692 1.00 4.86 H new ATOM 0 HE3 LYS A 594 -10.807 -16.947 4.497 1.00 4.86 H new ATOM 0 HZ1 LYS A 594 -9.455 -16.667 2.538 1.00 4.87 H new ATOM 0 HZ2 LYS A 594 -11.079 -16.327 2.176 1.00 4.87 H new ATOM 0 HZ3 LYS A 594 -9.968 -15.057 2.365 1.00 4.87 H new ATOM 987 N GLY A 595 -15.450 -15.901 7.402 1.00 4.78 N ATOM 988 CA GLY A 595 -15.538 -16.808 8.556 1.00 4.99 C ATOM 989 C GLY A 595 -15.592 -16.137 9.929 1.00 4.61 C ATOM 990 O GLY A 595 -15.927 -16.798 10.917 1.00 4.82 O ATOM 0 H GLY A 595 -16.348 -15.760 6.939 1.00 4.78 H new ATOM 0 HA2 GLY A 595 -16.428 -17.427 8.440 1.00 4.99 H new ATOM 0 HA3 GLY A 595 -14.678 -17.478 8.534 1.00 4.99 H new ATOM 994 N ASN A 596 -15.192 -14.867 10.026 1.00 4.08 N ATOM 995 CA ASN A 596 -14.487 -14.369 11.203 1.00 3.66 C ATOM 996 C ASN A 596 -14.988 -12.980 11.657 1.00 3.18 C ATOM 997 O ASN A 596 -16.185 -12.677 11.586 1.00 3.46 O ATOM 998 CB ASN A 596 -12.981 -14.335 10.880 1.00 3.51 C ATOM 999 CG ASN A 596 -12.300 -15.599 10.387 1.00 4.11 C ATOM 1000 OD1 ASN A 596 -12.787 -16.714 10.478 1.00 4.66 O ATOM 1001 ND2 ASN A 596 -11.074 -15.481 9.949 1.00 4.13 N ATOM 0 H ASN A 596 -15.346 -14.166 9.301 1.00 4.08 H new ATOM 0 HA ASN A 596 -14.684 -15.040 12.039 1.00 3.66 H new ATOM 0 HB2 ASN A 596 -12.825 -13.563 10.127 1.00 3.51 H new ATOM 0 HB3 ASN A 596 -12.460 -14.012 11.781 1.00 3.51 H new ATOM 0 HD21 ASN A 596 -10.543 -16.312 9.691 1.00 4.13 H new ATOM 0 HD22 ASN A 596 -10.649 -14.558 9.866 1.00 4.13 H new ATOM 1008 N LYS A 597 -14.064 -12.170 12.204 1.00 2.60 N ATOM 1009 CA LYS A 597 -14.321 -10.990 13.022 1.00 2.23 C ATOM 1010 C LYS A 597 -14.184 -9.660 12.281 1.00 1.76 C ATOM 1011 O LYS A 597 -13.554 -9.560 11.223 1.00 1.70 O ATOM 1012 CB LYS A 597 -13.428 -11.007 14.286 1.00 2.15 C ATOM 1013 CG LYS A 597 -13.767 -12.056 15.363 1.00 2.76 C ATOM 1014 CD LYS A 597 -13.498 -13.540 15.057 1.00 2.98 C ATOM 1015 CE LYS A 597 -12.092 -13.859 14.532 1.00 2.90 C ATOM 1016 NZ LYS A 597 -11.018 -13.421 15.460 1.00 3.34 N ATOM 0 H LYS A 597 -13.066 -12.338 12.075 1.00 2.60 H new ATOM 0 HA LYS A 597 -15.371 -11.052 13.307 1.00 2.23 H new ATOM 0 HB2 LYS A 597 -12.397 -11.165 13.971 1.00 2.15 H new ATOM 0 HB3 LYS A 597 -13.473 -10.020 14.747 1.00 2.15 H new ATOM 0 HG2 LYS A 597 -13.210 -11.798 16.264 1.00 2.76 H new ATOM 0 HG3 LYS A 597 -14.825 -11.954 15.603 1.00 2.76 H new ATOM 0 HD2 LYS A 597 -13.668 -14.117 15.966 1.00 2.98 H new ATOM 0 HD3 LYS A 597 -14.228 -13.880 14.322 1.00 2.98 H new ATOM 0 HE2 LYS A 597 -12.006 -14.933 14.365 1.00 2.90 H new ATOM 0 HE3 LYS A 597 -11.951 -13.374 13.566 1.00 2.90 H new ATOM 0 HZ1 LYS A 597 -10.090 -13.661 15.056 1.00 3.34 H new ATOM 0 HZ2 LYS A 597 -11.079 -12.392 15.600 1.00 3.34 H new ATOM 0 HZ3 LYS A 597 -11.132 -13.902 16.375 1.00 3.34 H new ATOM 1030 N GLU A 598 -14.754 -8.633 12.908 1.00 1.67 N ATOM 1031 CA GLU A 598 -14.504 -7.219 12.622 1.00 1.40 C ATOM 1032 C GLU A 598 -13.275 -6.679 13.397 1.00 1.17 C ATOM 1033 O GLU A 598 -13.102 -6.973 14.587 1.00 1.23 O ATOM 1034 CB GLU A 598 -15.795 -6.400 12.837 1.00 1.74 C ATOM 1035 CG GLU A 598 -16.288 -6.353 14.293 1.00 2.34 C ATOM 1036 CD GLU A 598 -17.819 -6.320 14.390 1.00 2.58 C ATOM 1037 OE1 GLU A 598 -18.448 -5.255 14.187 1.00 3.28 O ATOM 1038 OE2 GLU A 598 -18.427 -7.373 14.697 1.00 3.09 O ATOM 0 H GLU A 598 -15.430 -8.767 13.660 1.00 1.67 H new ATOM 0 HA GLU A 598 -14.235 -7.110 11.572 1.00 1.40 H new ATOM 0 HB2 GLU A 598 -15.624 -5.380 12.492 1.00 1.74 H new ATOM 0 HB3 GLU A 598 -16.584 -6.820 12.213 1.00 1.74 H new ATOM 0 HG2 GLU A 598 -15.911 -7.224 14.830 1.00 2.34 H new ATOM 0 HG3 GLU A 598 -15.876 -5.472 14.785 1.00 2.34 H new ATOM 1045 N MET A 599 -12.393 -5.933 12.718 1.00 0.99 N ATOM 1046 CA MET A 599 -11.063 -5.517 13.205 1.00 0.93 C ATOM 1047 C MET A 599 -10.695 -4.087 12.802 1.00 1.16 C ATOM 1048 O MET A 599 -10.781 -3.728 11.631 1.00 1.72 O ATOM 1049 CB MET A 599 -9.983 -6.451 12.638 1.00 1.03 C ATOM 1050 CG MET A 599 -10.091 -7.875 13.179 1.00 1.52 C ATOM 1051 SD MET A 599 -8.944 -9.076 12.448 1.00 2.01 S ATOM 1052 CE MET A 599 -9.349 -8.935 10.684 1.00 2.03 C ATOM 0 H MET A 599 -12.590 -5.588 11.779 1.00 0.99 H new ATOM 0 HA MET A 599 -11.111 -5.567 14.293 1.00 0.93 H new ATOM 0 HB2 MET A 599 -10.062 -6.473 11.551 1.00 1.03 H new ATOM 0 HB3 MET A 599 -8.999 -6.049 12.878 1.00 1.03 H new ATOM 0 HG2 MET A 599 -9.926 -7.850 14.256 1.00 1.52 H new ATOM 0 HG3 MET A 599 -11.110 -8.229 13.021 1.00 1.52 H new ATOM 0 HE1 MET A 599 -8.943 -9.793 10.148 1.00 2.03 H new ATOM 0 HE2 MET A 599 -10.432 -8.909 10.560 1.00 2.03 H new ATOM 0 HE3 MET A 599 -8.916 -8.019 10.283 1.00 2.03 H new ATOM 1062 N LYS A 600 -10.196 -3.289 13.750 1.00 1.04 N ATOM 1063 CA LYS A 600 -9.756 -1.917 13.529 1.00 1.08 C ATOM 1064 C LYS A 600 -8.266 -1.782 13.170 1.00 1.10 C ATOM 1065 O LYS A 600 -7.394 -2.242 13.915 1.00 1.30 O ATOM 1066 CB LYS A 600 -10.137 -1.093 14.768 1.00 1.17 C ATOM 1067 CG LYS A 600 -10.594 0.304 14.355 1.00 1.45 C ATOM 1068 CD LYS A 600 -11.999 0.365 13.740 1.00 1.60 C ATOM 1069 CE LYS A 600 -13.069 -0.011 14.763 1.00 1.72 C ATOM 1070 NZ LYS A 600 -14.416 0.249 14.224 1.00 2.26 N ATOM 0 H LYS A 600 -10.086 -3.592 14.718 1.00 1.04 H new ATOM 0 HA LYS A 600 -10.266 -1.531 12.646 1.00 1.08 H new ATOM 0 HB2 LYS A 600 -10.933 -1.596 15.317 1.00 1.17 H new ATOM 0 HB3 LYS A 600 -9.283 -1.019 15.441 1.00 1.17 H new ATOM 0 HG2 LYS A 600 -10.567 0.953 15.230 1.00 1.45 H new ATOM 0 HG3 LYS A 600 -9.880 0.707 13.637 1.00 1.45 H new ATOM 0 HD2 LYS A 600 -12.190 1.370 13.363 1.00 1.60 H new ATOM 0 HD3 LYS A 600 -12.055 -0.311 12.887 1.00 1.60 H new ATOM 0 HE2 LYS A 600 -12.974 -1.064 15.026 1.00 1.72 H new ATOM 0 HE3 LYS A 600 -12.921 0.561 15.679 1.00 1.72 H new ATOM 0 HZ1 LYS A 600 -15.129 -0.166 14.857 1.00 2.26 H new ATOM 0 HZ2 LYS A 600 -14.570 1.275 14.154 1.00 2.26 H new ATOM 0 HZ3 LYS A 600 -14.501 -0.179 13.280 1.00 2.26 H new ATOM 1084 N LEU A 601 -7.988 -1.095 12.060 1.00 0.97 N ATOM 1085 CA LEU A 601 -6.654 -0.700 11.575 1.00 0.95 C ATOM 1086 C LEU A 601 -6.560 0.837 11.462 1.00 0.87 C ATOM 1087 O LEU A 601 -7.573 1.527 11.348 1.00 0.85 O ATOM 1088 CB LEU A 601 -6.362 -1.371 10.213 1.00 1.00 C ATOM 1089 CG LEU A 601 -5.743 -2.783 10.232 1.00 1.14 C ATOM 1090 CD1 LEU A 601 -6.625 -3.847 10.889 1.00 1.14 C ATOM 1091 CD2 LEU A 601 -5.480 -3.221 8.789 1.00 1.26 C ATOM 0 H LEU A 601 -8.729 -0.778 11.435 1.00 0.97 H new ATOM 0 HA LEU A 601 -5.903 -1.036 12.290 1.00 0.95 H new ATOM 0 HB2 LEU A 601 -7.297 -1.422 9.656 1.00 1.00 H new ATOM 0 HB3 LEU A 601 -5.692 -0.718 9.653 1.00 1.00 H new ATOM 0 HG LEU A 601 -4.832 -2.709 10.826 1.00 1.14 H new ATOM 0 HD11 LEU A 601 -6.116 -4.810 10.860 1.00 1.14 H new ATOM 0 HD12 LEU A 601 -6.819 -3.570 11.925 1.00 1.14 H new ATOM 0 HD13 LEU A 601 -7.570 -3.920 10.350 1.00 1.14 H new ATOM 0 HD21 LEU A 601 -5.042 -4.219 8.786 1.00 1.26 H new ATOM 0 HD22 LEU A 601 -6.419 -3.235 8.236 1.00 1.26 H new ATOM 0 HD23 LEU A 601 -4.791 -2.521 8.316 1.00 1.26 H new ATOM 1103 N SER A 602 -5.343 1.385 11.462 1.00 0.92 N ATOM 1104 CA SER A 602 -5.067 2.832 11.391 1.00 1.01 C ATOM 1105 C SER A 602 -3.766 3.128 10.631 1.00 1.17 C ATOM 1106 O SER A 602 -3.146 2.239 10.048 1.00 1.22 O ATOM 1107 CB SER A 602 -5.087 3.416 12.813 1.00 1.00 C ATOM 1108 OG SER A 602 -4.895 4.821 12.876 1.00 2.52 O ATOM 0 H SER A 602 -4.494 0.823 11.513 1.00 0.92 H new ATOM 0 HA SER A 602 -5.849 3.325 10.813 1.00 1.01 H new ATOM 0 HB2 SER A 602 -6.042 3.171 13.279 1.00 1.00 H new ATOM 0 HB3 SER A 602 -4.310 2.929 13.403 1.00 1.00 H new ATOM 0 HG SER A 602 -5.447 5.258 12.194 1.00 2.52 H new ATOM 1114 N ASP A 603 -3.402 4.404 10.546 1.00 1.32 N ATOM 1115 CA ASP A 603 -2.374 4.910 9.634 1.00 1.48 C ATOM 1116 C ASP A 603 -0.990 4.270 9.804 1.00 1.49 C ATOM 1117 O ASP A 603 -0.594 3.857 10.897 1.00 1.51 O ATOM 1118 CB ASP A 603 -2.356 6.437 9.613 1.00 1.72 C ATOM 1119 CG ASP A 603 -1.766 7.119 10.849 1.00 1.84 C ATOM 1120 OD1 ASP A 603 -2.511 7.332 11.835 1.00 1.92 O ATOM 1121 OD2 ASP A 603 -0.590 7.547 10.804 1.00 2.59 O ATOM 0 H ASP A 603 -3.822 5.134 11.121 1.00 1.32 H new ATOM 0 HA ASP A 603 -2.667 4.581 8.637 1.00 1.48 H new ATOM 0 HB2 ASP A 603 -1.791 6.762 8.739 1.00 1.72 H new ATOM 0 HB3 ASP A 603 -3.379 6.791 9.481 1.00 1.72 H new ATOM 1126 N GLY A 604 -0.290 4.107 8.681 1.00 1.51 N ATOM 1127 CA GLY A 604 0.889 3.251 8.556 1.00 1.57 C ATOM 1128 C GLY A 604 0.591 1.778 8.258 1.00 1.48 C ATOM 1129 O GLY A 604 1.476 1.076 7.771 1.00 1.68 O ATOM 0 H GLY A 604 -0.534 4.579 7.811 1.00 1.51 H new ATOM 0 HA2 GLY A 604 1.523 3.646 7.762 1.00 1.57 H new ATOM 0 HA3 GLY A 604 1.462 3.310 9.481 1.00 1.57 H new ATOM 1133 N SER A 605 -0.643 1.310 8.473 1.00 1.28 N ATOM 1134 CA SER A 605 -1.089 0.005 7.963 1.00 1.19 C ATOM 1135 C SER A 605 -1.225 0.036 6.432 1.00 1.11 C ATOM 1136 O SER A 605 -1.450 1.089 5.833 1.00 1.03 O ATOM 1137 CB SER A 605 -2.426 -0.418 8.578 1.00 1.12 C ATOM 1138 OG SER A 605 -2.423 -0.376 9.996 1.00 1.13 O ATOM 0 H SER A 605 -1.355 1.817 8.999 1.00 1.28 H new ATOM 0 HA SER A 605 -0.330 -0.723 8.248 1.00 1.19 H new ATOM 0 HB2 SER A 605 -3.215 0.234 8.203 1.00 1.12 H new ATOM 0 HB3 SER A 605 -2.666 -1.430 8.251 1.00 1.12 H new ATOM 0 HG SER A 605 -2.652 0.528 10.297 1.00 1.13 H new ATOM 1144 N TYR A 606 -1.144 -1.127 5.793 1.00 1.16 N ATOM 1145 CA TYR A 606 -1.231 -1.305 4.338 1.00 1.13 C ATOM 1146 C TYR A 606 -2.021 -2.564 3.974 1.00 1.16 C ATOM 1147 O TYR A 606 -1.977 -3.554 4.710 1.00 1.34 O ATOM 1148 CB TYR A 606 0.169 -1.314 3.708 1.00 1.26 C ATOM 1149 CG TYR A 606 0.995 -2.545 3.996 1.00 1.55 C ATOM 1150 CD1 TYR A 606 1.661 -2.662 5.227 1.00 1.77 C ATOM 1151 CD2 TYR A 606 1.113 -3.552 3.025 1.00 3.15 C ATOM 1152 CE1 TYR A 606 2.441 -3.805 5.496 1.00 2.33 C ATOM 1153 CE2 TYR A 606 1.911 -4.681 3.279 1.00 3.76 C ATOM 1154 CZ TYR A 606 2.577 -4.817 4.518 1.00 2.99 C ATOM 1155 OH TYR A 606 3.358 -5.906 4.769 1.00 3.81 O ATOM 0 H TYR A 606 -1.011 -2.008 6.289 1.00 1.16 H new ATOM 0 HA TYR A 606 -1.777 -0.456 3.927 1.00 1.13 H new ATOM 0 HB2 TYR A 606 0.065 -1.210 2.628 1.00 1.26 H new ATOM 0 HB3 TYR A 606 0.715 -0.439 4.061 1.00 1.26 H new ATOM 0 HD1 TYR A 606 1.576 -1.878 5.965 1.00 1.77 H new ATOM 0 HD2 TYR A 606 0.591 -3.459 2.084 1.00 3.15 H new ATOM 0 HE1 TYR A 606 2.935 -3.908 6.451 1.00 2.33 H new ATOM 0 HE2 TYR A 606 2.015 -5.447 2.525 1.00 3.76 H new ATOM 0 HH TYR A 606 3.342 -6.506 3.994 1.00 3.81 H new ATOM 1165 N PHE A 607 -2.783 -2.521 2.875 1.00 1.03 N ATOM 1166 CA PHE A 607 -3.808 -3.553 2.627 1.00 1.06 C ATOM 1167 C PHE A 607 -4.129 -3.810 1.151 1.00 1.29 C ATOM 1168 O PHE A 607 -3.636 -3.121 0.259 1.00 1.66 O ATOM 1169 CB PHE A 607 -5.068 -3.256 3.467 1.00 1.53 C ATOM 1170 CG PHE A 607 -5.726 -1.888 3.368 1.00 0.96 C ATOM 1171 CD1 PHE A 607 -5.368 -0.932 2.393 1.00 1.86 C ATOM 1172 CD2 PHE A 607 -6.739 -1.578 4.295 1.00 2.07 C ATOM 1173 CE1 PHE A 607 -5.982 0.330 2.382 1.00 2.21 C ATOM 1174 CE2 PHE A 607 -7.368 -0.324 4.265 1.00 1.79 C ATOM 1175 CZ PHE A 607 -6.972 0.637 3.327 1.00 1.13 C ATOM 0 H PHE A 607 -2.716 -1.802 2.155 1.00 1.03 H new ATOM 0 HA PHE A 607 -3.375 -4.498 2.955 1.00 1.06 H new ATOM 0 HB2 PHE A 607 -5.820 -4.000 3.204 1.00 1.53 H new ATOM 0 HB3 PHE A 607 -4.810 -3.420 4.513 1.00 1.53 H new ATOM 0 HD1 PHE A 607 -4.619 -1.173 1.653 1.00 1.86 H new ATOM 0 HD2 PHE A 607 -7.034 -2.309 5.033 1.00 2.07 H new ATOM 0 HE1 PHE A 607 -5.692 1.065 1.646 1.00 2.21 H new ATOM 0 HE2 PHE A 607 -8.158 -0.100 4.966 1.00 1.79 H new ATOM 0 HZ PHE A 607 -7.429 1.615 3.331 1.00 1.13 H new ATOM 1185 N GLY A 608 -4.915 -4.859 0.902 1.00 1.46 N ATOM 1186 CA GLY A 608 -4.896 -5.644 -0.333 1.00 1.87 C ATOM 1187 C GLY A 608 -3.625 -6.502 -0.405 1.00 1.92 C ATOM 1188 O GLY A 608 -2.520 -5.978 -0.277 1.00 2.76 O ATOM 0 H GLY A 608 -5.603 -5.196 1.575 1.00 1.46 H new ATOM 0 HA2 GLY A 608 -5.777 -6.284 -0.378 1.00 1.87 H new ATOM 0 HA3 GLY A 608 -4.942 -4.978 -1.195 1.00 1.87 H new ATOM 1192 N GLU A 609 -3.746 -7.813 -0.606 1.00 2.30 N ATOM 1193 CA GLU A 609 -2.635 -8.787 -0.512 1.00 2.53 C ATOM 1194 C GLU A 609 -1.634 -8.742 -1.700 1.00 2.06 C ATOM 1195 O GLU A 609 -1.007 -9.747 -2.044 1.00 3.01 O ATOM 1196 CB GLU A 609 -3.174 -10.218 -0.282 1.00 3.90 C ATOM 1197 CG GLU A 609 -4.115 -10.408 0.922 1.00 4.92 C ATOM 1198 CD GLU A 609 -5.589 -10.137 0.595 1.00 5.46 C ATOM 1199 OE1 GLU A 609 -5.986 -8.953 0.554 1.00 6.04 O ATOM 1200 OE2 GLU A 609 -6.351 -11.110 0.366 1.00 6.07 O ATOM 0 H GLU A 609 -4.637 -8.248 -0.845 1.00 2.30 H new ATOM 0 HA GLU A 609 -2.053 -8.482 0.357 1.00 2.53 H new ATOM 0 HB2 GLU A 609 -3.702 -10.533 -1.182 1.00 3.90 H new ATOM 0 HB3 GLU A 609 -2.323 -10.888 -0.160 1.00 3.90 H new ATOM 0 HG2 GLU A 609 -4.015 -11.428 1.294 1.00 4.92 H new ATOM 0 HG3 GLU A 609 -3.801 -9.743 1.727 1.00 4.92 H new ATOM 1207 N ILE A 610 -1.491 -7.589 -2.358 1.00 2.16 N ATOM 1208 CA ILE A 610 -0.693 -7.386 -3.573 1.00 2.85 C ATOM 1209 C ILE A 610 0.803 -7.410 -3.233 1.00 1.95 C ATOM 1210 O ILE A 610 1.327 -6.490 -2.604 1.00 2.98 O ATOM 1211 CB ILE A 610 -1.122 -6.074 -4.279 1.00 4.95 C ATOM 1212 CG1 ILE A 610 -2.608 -6.159 -4.681 1.00 6.52 C ATOM 1213 CG2 ILE A 610 -0.249 -5.774 -5.513 1.00 5.97 C ATOM 1214 CD1 ILE A 610 -3.160 -4.929 -5.407 1.00 8.44 C ATOM 0 H ILE A 610 -1.948 -6.732 -2.046 1.00 2.16 H new ATOM 0 HA ILE A 610 -0.875 -8.202 -4.273 1.00 2.85 H new ATOM 0 HB ILE A 610 -0.982 -5.254 -3.575 1.00 4.95 H new ATOM 0 HG12 ILE A 610 -2.745 -7.030 -5.321 1.00 6.52 H new ATOM 0 HG13 ILE A 610 -3.202 -6.327 -3.782 1.00 6.52 H new ATOM 0 HG21 ILE A 610 -0.583 -4.847 -5.978 1.00 5.97 H new ATOM 0 HG22 ILE A 610 0.792 -5.672 -5.206 1.00 5.97 H new ATOM 0 HG23 ILE A 610 -0.338 -6.591 -6.229 1.00 5.97 H new ATOM 0 HD11 ILE A 610 -4.211 -5.089 -5.646 1.00 8.44 H new ATOM 0 HD12 ILE A 610 -3.063 -4.053 -4.765 1.00 8.44 H new ATOM 0 HD13 ILE A 610 -2.599 -4.768 -6.328 1.00 8.44 H new ATOM 1226 N CYS A 611 1.493 -8.459 -3.683 1.00 1.87 N ATOM 1227 CA CYS A 611 2.947 -8.613 -3.600 1.00 2.59 C ATOM 1228 C CYS A 611 3.664 -7.933 -4.784 1.00 1.87 C ATOM 1229 O CYS A 611 3.162 -7.932 -5.911 1.00 1.96 O ATOM 1230 CB CYS A 611 3.250 -10.117 -3.471 1.00 4.48 C ATOM 1231 SG CYS A 611 5.027 -10.462 -3.374 1.00 6.14 S ATOM 0 H CYS A 611 1.038 -9.254 -4.132 1.00 1.87 H new ATOM 0 HA CYS A 611 3.340 -8.102 -2.721 1.00 2.59 H new ATOM 0 HB2 CYS A 611 2.758 -10.508 -2.580 1.00 4.48 H new ATOM 0 HB3 CYS A 611 2.827 -10.644 -4.326 1.00 4.48 H new ATOM 0 HG CYS A 611 5.215 -11.744 -3.265 1.00 6.14 H new ATOM 1237 N LEU A 612 4.884 -7.427 -4.574 1.00 2.21 N ATOM 1238 CA LEU A 612 5.736 -6.840 -5.631 1.00 1.87 C ATOM 1239 C LEU A 612 6.251 -7.854 -6.685 1.00 1.76 C ATOM 1240 O LEU A 612 6.932 -7.465 -7.641 1.00 2.02 O ATOM 1241 CB LEU A 612 6.849 -5.995 -4.968 1.00 2.10 C ATOM 1242 CG LEU A 612 6.454 -4.506 -4.877 1.00 1.60 C ATOM 1243 CD1 LEU A 612 7.205 -3.791 -3.761 1.00 2.08 C ATOM 1244 CD2 LEU A 612 6.761 -3.775 -6.185 1.00 1.55 C ATOM 0 H LEU A 612 5.320 -7.410 -3.652 1.00 2.21 H new ATOM 0 HA LEU A 612 5.114 -6.181 -6.237 1.00 1.87 H new ATOM 0 HB2 LEU A 612 7.052 -6.380 -3.969 1.00 2.10 H new ATOM 0 HB3 LEU A 612 7.771 -6.093 -5.541 1.00 2.10 H new ATOM 0 HG LEU A 612 5.384 -4.486 -4.672 1.00 1.60 H new ATOM 0 HD11 LEU A 612 6.900 -2.745 -3.729 1.00 2.08 H new ATOM 0 HD12 LEU A 612 6.976 -4.265 -2.807 1.00 2.08 H new ATOM 0 HD13 LEU A 612 8.277 -3.850 -3.948 1.00 2.08 H new ATOM 0 HD21 LEU A 612 6.473 -2.728 -6.093 1.00 1.55 H new ATOM 0 HD22 LEU A 612 7.828 -3.840 -6.396 1.00 1.55 H new ATOM 0 HD23 LEU A 612 6.201 -4.235 -6.999 1.00 1.55 H new ATOM 1256 N LEU A 613 5.872 -9.134 -6.566 1.00 1.78 N ATOM 1257 CA LEU A 613 5.986 -10.165 -7.613 1.00 2.10 C ATOM 1258 C LEU A 613 4.703 -10.991 -7.866 1.00 2.07 C ATOM 1259 O LEU A 613 4.762 -12.079 -8.440 1.00 2.51 O ATOM 1260 CB LEU A 613 7.251 -11.006 -7.377 1.00 2.81 C ATOM 1261 CG LEU A 613 7.414 -11.732 -6.024 1.00 3.43 C ATOM 1262 CD1 LEU A 613 6.359 -12.811 -5.786 1.00 4.44 C ATOM 1263 CD2 LEU A 613 8.785 -12.410 -5.966 1.00 4.01 C ATOM 0 H LEU A 613 5.461 -9.496 -5.705 1.00 1.78 H new ATOM 0 HA LEU A 613 6.100 -9.646 -8.565 1.00 2.10 H new ATOM 0 HB2 LEU A 613 7.300 -11.758 -8.164 1.00 2.81 H new ATOM 0 HB3 LEU A 613 8.113 -10.351 -7.507 1.00 2.81 H new ATOM 0 HG LEU A 613 7.302 -10.967 -5.255 1.00 3.43 H new ATOM 0 HD11 LEU A 613 6.532 -13.281 -4.818 1.00 4.44 H new ATOM 0 HD12 LEU A 613 5.367 -12.359 -5.798 1.00 4.44 H new ATOM 0 HD13 LEU A 613 6.424 -13.564 -6.572 1.00 4.44 H new ATOM 0 HD21 LEU A 613 8.898 -12.922 -5.010 1.00 4.01 H new ATOM 0 HD22 LEU A 613 8.868 -13.134 -6.777 1.00 4.01 H new ATOM 0 HD23 LEU A 613 9.567 -11.658 -6.069 1.00 4.01 H new ATOM 1275 N THR A 614 3.556 -10.496 -7.402 1.00 1.78 N ATOM 1276 CA THR A 614 2.249 -11.202 -7.369 1.00 1.93 C ATOM 1277 C THR A 614 1.715 -11.739 -8.711 1.00 1.92 C ATOM 1278 O THR A 614 2.142 -11.336 -9.798 1.00 2.61 O ATOM 1279 CB THR A 614 1.172 -10.315 -6.713 1.00 2.96 C ATOM 1280 OG1 THR A 614 0.124 -11.090 -6.182 1.00 3.33 O ATOM 1281 CG2 THR A 614 0.536 -9.267 -7.626 1.00 4.42 C ATOM 0 H THR A 614 3.496 -9.552 -7.019 1.00 1.78 H new ATOM 0 HA THR A 614 2.459 -12.092 -6.776 1.00 1.93 H new ATOM 0 HB THR A 614 1.727 -9.786 -5.938 1.00 2.96 H new ATOM 0 HG1 THR A 614 -0.543 -10.501 -5.771 1.00 3.33 H new ATOM 0 HG21 THR A 614 -0.207 -8.699 -7.066 1.00 4.42 H new ATOM 0 HG22 THR A 614 1.307 -8.591 -7.996 1.00 4.42 H new ATOM 0 HG23 THR A 614 0.054 -9.763 -8.468 1.00 4.42 H new ATOM 1289 N ARG A 615 0.703 -12.616 -8.619 1.00 1.93 N ATOM 1290 CA ARG A 615 -0.133 -13.099 -9.728 1.00 2.20 C ATOM 1291 C ARG A 615 -1.624 -13.035 -9.375 1.00 2.02 C ATOM 1292 O ARG A 615 -2.000 -13.277 -8.226 1.00 2.44 O ATOM 1293 CB ARG A 615 0.261 -14.536 -10.116 1.00 3.14 C ATOM 1294 CG ARG A 615 1.678 -14.638 -10.699 1.00 3.18 C ATOM 1295 CD ARG A 615 2.057 -16.057 -11.142 1.00 4.31 C ATOM 1296 NE ARG A 615 1.200 -16.561 -12.234 1.00 5.23 N ATOM 1297 CZ ARG A 615 1.272 -16.258 -13.518 1.00 5.84 C ATOM 1298 NH1 ARG A 615 2.103 -15.377 -14.001 1.00 5.69 N ATOM 1299 NH2 ARG A 615 0.484 -16.856 -14.356 1.00 7.12 N ATOM 0 H ARG A 615 0.433 -13.027 -7.726 1.00 1.93 H new ATOM 0 HA ARG A 615 0.039 -12.443 -10.581 1.00 2.20 H new ATOM 0 HB2 ARG A 615 0.190 -15.175 -9.236 1.00 3.14 H new ATOM 0 HB3 ARG A 615 -0.453 -14.917 -10.846 1.00 3.14 H new ATOM 0 HG2 ARG A 615 1.760 -13.965 -11.553 1.00 3.18 H new ATOM 0 HG3 ARG A 615 2.395 -14.295 -9.953 1.00 3.18 H new ATOM 0 HD2 ARG A 615 3.097 -16.066 -11.468 1.00 4.31 H new ATOM 0 HD3 ARG A 615 1.985 -16.731 -10.288 1.00 4.31 H new ATOM 0 HE ARG A 615 0.468 -17.219 -11.966 1.00 5.23 H new ATOM 0 HH11 ARG A 615 2.741 -14.882 -13.378 1.00 5.69 H new ATOM 0 HH12 ARG A 615 2.115 -15.183 -15.002 1.00 5.69 H new ATOM 0 HH21 ARG A 615 -0.182 -17.552 -14.022 1.00 7.12 H new ATOM 0 HH22 ARG A 615 0.530 -16.630 -15.350 1.00 7.12 H new ATOM 1313 N GLY A 616 -2.465 -12.769 -10.374 1.00 2.22 N ATOM 1314 CA GLY A 616 -3.932 -12.803 -10.266 1.00 2.37 C ATOM 1315 C GLY A 616 -4.594 -11.565 -9.638 1.00 2.15 C ATOM 1316 O GLY A 616 -3.936 -10.573 -9.305 1.00 2.48 O ATOM 0 H GLY A 616 -2.141 -12.517 -11.308 1.00 2.22 H new ATOM 0 HA2 GLY A 616 -4.346 -12.944 -11.264 1.00 2.37 H new ATOM 0 HA3 GLY A 616 -4.212 -13.677 -9.678 1.00 2.37 H new ATOM 1320 N ARG A 617 -5.927 -11.611 -9.495 1.00 2.10 N ATOM 1321 CA ARG A 617 -6.736 -10.644 -8.716 1.00 2.10 C ATOM 1322 C ARG A 617 -6.869 -11.074 -7.248 1.00 1.98 C ATOM 1323 O ARG A 617 -6.446 -12.173 -6.882 1.00 2.12 O ATOM 1324 CB ARG A 617 -8.103 -10.423 -9.390 1.00 2.92 C ATOM 1325 CG ARG A 617 -9.051 -11.629 -9.314 1.00 2.27 C ATOM 1326 CD ARG A 617 -10.314 -11.356 -10.134 1.00 2.42 C ATOM 1327 NE ARG A 617 -11.206 -12.530 -10.142 1.00 2.74 N ATOM 1328 CZ ARG A 617 -12.493 -12.569 -9.843 1.00 3.57 C ATOM 1329 NH1 ARG A 617 -13.133 -11.556 -9.338 1.00 4.45 N ATOM 1330 NH2 ARG A 617 -13.180 -13.651 -10.043 1.00 4.17 N ATOM 0 H ARG A 617 -6.494 -12.340 -9.928 1.00 2.10 H new ATOM 0 HA ARG A 617 -6.216 -9.686 -8.707 1.00 2.10 H new ATOM 0 HB2 ARG A 617 -8.589 -9.565 -8.926 1.00 2.92 H new ATOM 0 HB3 ARG A 617 -7.941 -10.169 -10.438 1.00 2.92 H new ATOM 0 HG2 ARG A 617 -8.549 -12.520 -9.690 1.00 2.27 H new ATOM 0 HG3 ARG A 617 -9.318 -11.827 -8.276 1.00 2.27 H new ATOM 0 HD2 ARG A 617 -10.842 -10.497 -9.719 1.00 2.42 H new ATOM 0 HD3 ARG A 617 -10.039 -11.098 -11.157 1.00 2.42 H new ATOM 0 HE ARG A 617 -10.780 -13.417 -10.410 1.00 2.74 H new ATOM 0 HH11 ARG A 617 -12.641 -10.681 -9.156 1.00 4.45 H new ATOM 0 HH12 ARG A 617 -14.127 -11.636 -9.124 1.00 4.45 H new ATOM 0 HH21 ARG A 617 -12.727 -14.478 -10.433 1.00 4.17 H new ATOM 0 HH22 ARG A 617 -14.173 -13.675 -9.810 1.00 4.17 H new ATOM 1344 N ARG A 618 -7.464 -10.216 -6.415 1.00 2.00 N ATOM 1345 CA ARG A 618 -7.860 -10.484 -5.017 1.00 2.14 C ATOM 1346 C ARG A 618 -9.298 -10.033 -4.745 1.00 2.34 C ATOM 1347 O ARG A 618 -9.935 -9.424 -5.605 1.00 2.71 O ATOM 1348 CB ARG A 618 -6.851 -9.832 -4.041 1.00 2.21 C ATOM 1349 CG ARG A 618 -5.506 -10.574 -3.934 1.00 2.33 C ATOM 1350 CD ARG A 618 -5.482 -11.749 -2.937 1.00 3.07 C ATOM 1351 NE ARG A 618 -6.478 -12.801 -3.212 1.00 4.36 N ATOM 1352 CZ ARG A 618 -7.595 -13.042 -2.548 1.00 5.77 C ATOM 1353 NH1 ARG A 618 -7.978 -12.386 -1.494 1.00 6.47 N ATOM 1354 NH2 ARG A 618 -8.414 -13.950 -2.967 1.00 7.05 N ATOM 0 H ARG A 618 -7.697 -9.266 -6.705 1.00 2.00 H new ATOM 0 HA ARG A 618 -7.837 -11.561 -4.851 1.00 2.14 H new ATOM 0 HB2 ARG A 618 -6.663 -8.807 -4.361 1.00 2.21 H new ATOM 0 HB3 ARG A 618 -7.303 -9.779 -3.051 1.00 2.21 H new ATOM 0 HG2 ARG A 618 -5.238 -10.950 -4.921 1.00 2.33 H new ATOM 0 HG3 ARG A 618 -4.736 -9.858 -3.646 1.00 2.33 H new ATOM 0 HD2 ARG A 618 -4.488 -12.196 -2.945 1.00 3.07 H new ATOM 0 HD3 ARG A 618 -5.649 -11.361 -1.932 1.00 3.07 H new ATOM 0 HE ARG A 618 -6.283 -13.412 -4.005 1.00 4.36 H new ATOM 0 HH11 ARG A 618 -7.402 -11.628 -1.128 1.00 6.47 H new ATOM 0 HH12 ARG A 618 -8.855 -12.629 -1.033 1.00 6.47 H new ATOM 0 HH21 ARG A 618 -8.198 -14.481 -3.811 1.00 7.05 H new ATOM 0 HH22 ARG A 618 -9.276 -14.135 -2.454 1.00 7.05 H new ATOM 1368 N THR A 619 -9.815 -10.332 -3.556 1.00 2.29 N ATOM 1369 CA THR A 619 -11.024 -9.698 -3.006 1.00 2.33 C ATOM 1370 C THR A 619 -10.906 -9.534 -1.484 1.00 2.00 C ATOM 1371 O THR A 619 -10.197 -10.294 -0.816 1.00 2.02 O ATOM 1372 CB THR A 619 -12.297 -10.448 -3.438 1.00 2.93 C ATOM 1373 OG1 THR A 619 -13.453 -9.760 -3.016 1.00 3.99 O ATOM 1374 CG2 THR A 619 -12.388 -11.871 -2.896 1.00 3.01 C ATOM 0 H THR A 619 -9.405 -11.030 -2.935 1.00 2.29 H new ATOM 0 HA THR A 619 -11.112 -8.695 -3.423 1.00 2.33 H new ATOM 0 HB THR A 619 -12.236 -10.497 -4.525 1.00 2.93 H new ATOM 0 HG1 THR A 619 -14.250 -10.253 -3.302 1.00 3.99 H new ATOM 0 HG21 THR A 619 -13.312 -12.334 -3.243 1.00 3.01 H new ATOM 0 HG22 THR A 619 -11.536 -12.451 -3.251 1.00 3.01 H new ATOM 0 HG23 THR A 619 -12.382 -11.846 -1.806 1.00 3.01 H new ATOM 1382 N ALA A 620 -11.546 -8.498 -0.946 1.00 1.85 N ATOM 1383 CA ALA A 620 -11.552 -8.124 0.467 1.00 1.60 C ATOM 1384 C ALA A 620 -12.860 -7.401 0.854 1.00 1.55 C ATOM 1385 O ALA A 620 -13.635 -6.960 -0.005 1.00 1.90 O ATOM 1386 CB ALA A 620 -10.323 -7.241 0.740 1.00 1.73 C ATOM 0 H ALA A 620 -12.105 -7.862 -1.515 1.00 1.85 H new ATOM 0 HA ALA A 620 -11.502 -9.023 1.082 1.00 1.60 H new ATOM 0 HB1 ALA A 620 -10.309 -6.951 1.791 1.00 1.73 H new ATOM 0 HB2 ALA A 620 -9.416 -7.798 0.505 1.00 1.73 H new ATOM 0 HB3 ALA A 620 -10.371 -6.347 0.118 1.00 1.73 H new ATOM 1392 N SER A 621 -13.086 -7.265 2.161 1.00 1.30 N ATOM 1393 CA SER A 621 -14.276 -6.675 2.786 1.00 1.40 C ATOM 1394 C SER A 621 -13.878 -5.685 3.886 1.00 1.23 C ATOM 1395 O SER A 621 -13.644 -6.084 5.026 1.00 1.24 O ATOM 1396 CB SER A 621 -15.187 -7.784 3.337 1.00 1.51 C ATOM 1397 OG SER A 621 -14.485 -8.825 4.006 1.00 2.76 O ATOM 0 H SER A 621 -12.407 -7.581 2.853 1.00 1.30 H new ATOM 0 HA SER A 621 -14.831 -6.120 2.030 1.00 1.40 H new ATOM 0 HB2 SER A 621 -15.906 -7.342 4.027 1.00 1.51 H new ATOM 0 HB3 SER A 621 -15.758 -8.214 2.514 1.00 1.51 H new ATOM 0 HG SER A 621 -14.047 -8.463 4.805 1.00 2.76 H new ATOM 1403 N VAL A 622 -13.762 -4.394 3.560 1.00 1.11 N ATOM 1404 CA VAL A 622 -13.285 -3.366 4.505 1.00 0.93 C ATOM 1405 C VAL A 622 -13.883 -1.973 4.238 1.00 0.90 C ATOM 1406 O VAL A 622 -14.054 -1.551 3.091 1.00 0.96 O ATOM 1407 CB VAL A 622 -11.741 -3.394 4.546 1.00 0.87 C ATOM 1408 CG1 VAL A 622 -11.067 -3.294 3.178 1.00 0.98 C ATOM 1409 CG2 VAL A 622 -11.152 -2.330 5.466 1.00 0.79 C ATOM 0 H VAL A 622 -13.994 -4.027 2.637 1.00 1.11 H new ATOM 0 HA VAL A 622 -13.650 -3.607 5.503 1.00 0.93 H new ATOM 0 HB VAL A 622 -11.523 -4.383 4.949 1.00 0.87 H new ATOM 0 HG11 VAL A 622 -9.985 -3.321 3.303 1.00 0.98 H new ATOM 0 HG12 VAL A 622 -11.382 -4.131 2.555 1.00 0.98 H new ATOM 0 HG13 VAL A 622 -11.353 -2.358 2.699 1.00 0.98 H new ATOM 0 HG21 VAL A 622 -10.064 -2.399 5.453 1.00 0.79 H new ATOM 0 HG22 VAL A 622 -11.457 -1.342 5.121 1.00 0.79 H new ATOM 0 HG23 VAL A 622 -11.514 -2.487 6.482 1.00 0.79 H new ATOM 1419 N ARG A 623 -14.223 -1.244 5.314 1.00 0.88 N ATOM 1420 CA ARG A 623 -14.942 0.047 5.297 1.00 0.93 C ATOM 1421 C ARG A 623 -14.357 1.094 6.255 1.00 0.89 C ATOM 1422 O ARG A 623 -13.598 0.782 7.169 1.00 0.78 O ATOM 1423 CB ARG A 623 -16.435 -0.217 5.560 1.00 1.09 C ATOM 1424 CG ARG A 623 -16.683 -0.777 6.972 1.00 1.19 C ATOM 1425 CD ARG A 623 -17.921 -1.670 7.088 1.00 1.25 C ATOM 1426 NE ARG A 623 -17.897 -2.843 6.189 1.00 2.48 N ATOM 1427 CZ ARG A 623 -18.771 -3.834 6.185 1.00 3.28 C ATOM 1428 NH1 ARG A 623 -19.671 -4.012 7.106 1.00 2.78 N ATOM 1429 NH2 ARG A 623 -18.772 -4.687 5.213 1.00 5.12 N ATOM 0 H ARG A 623 -13.996 -1.548 6.261 1.00 0.88 H new ATOM 0 HA ARG A 623 -14.816 0.491 4.310 1.00 0.93 H new ATOM 0 HB2 ARG A 623 -16.994 0.710 5.435 1.00 1.09 H new ATOM 0 HB3 ARG A 623 -16.814 -0.921 4.819 1.00 1.09 H new ATOM 0 HG2 ARG A 623 -15.808 -1.348 7.283 1.00 1.19 H new ATOM 0 HG3 ARG A 623 -16.784 0.056 7.668 1.00 1.19 H new ATOM 0 HD2 ARG A 623 -18.013 -2.015 8.118 1.00 1.25 H new ATOM 0 HD3 ARG A 623 -18.808 -1.075 6.870 1.00 1.25 H new ATOM 0 HE ARG A 623 -17.137 -2.892 5.510 1.00 2.48 H new ATOM 0 HH11 ARG A 623 -19.731 -3.365 7.892 1.00 2.78 H new ATOM 0 HH12 ARG A 623 -20.317 -4.799 7.043 1.00 2.78 H new ATOM 0 HH21 ARG A 623 -18.099 -4.594 4.452 1.00 5.12 H new ATOM 0 HH22 ARG A 623 -19.446 -5.453 5.207 1.00 5.12 H new ATOM 1443 N ALA A 624 -14.703 2.354 6.027 1.00 0.99 N ATOM 1444 CA ALA A 624 -14.142 3.509 6.729 1.00 0.85 C ATOM 1445 C ALA A 624 -14.835 3.794 8.079 1.00 0.95 C ATOM 1446 O ALA A 624 -16.047 4.030 8.137 1.00 1.17 O ATOM 1447 CB ALA A 624 -14.209 4.708 5.778 1.00 0.81 C ATOM 0 H ALA A 624 -15.401 2.612 5.330 1.00 0.99 H new ATOM 0 HA ALA A 624 -13.106 3.299 6.996 1.00 0.85 H new ATOM 0 HB1 ALA A 624 -13.797 5.588 6.272 1.00 0.81 H new ATOM 0 HB2 ALA A 624 -13.631 4.493 4.880 1.00 0.81 H new ATOM 0 HB3 ALA A 624 -15.247 4.898 5.504 1.00 0.81 H new ATOM 1453 N ASP A 625 -14.060 3.855 9.171 1.00 0.90 N ATOM 1454 CA ASP A 625 -14.567 4.241 10.504 1.00 1.09 C ATOM 1455 C ASP A 625 -14.912 5.740 10.572 1.00 1.12 C ATOM 1456 O ASP A 625 -15.747 6.169 11.373 1.00 1.28 O ATOM 1457 CB ASP A 625 -13.494 3.938 11.567 1.00 1.15 C ATOM 1458 CG ASP A 625 -14.098 3.702 12.958 1.00 1.70 C ATOM 1459 OD1 ASP A 625 -14.883 2.743 13.131 1.00 1.94 O ATOM 1460 OD2 ASP A 625 -13.806 4.479 13.897 1.00 3.07 O ATOM 0 H ASP A 625 -13.063 3.639 9.160 1.00 0.90 H new ATOM 0 HA ASP A 625 -15.475 3.667 10.691 1.00 1.09 H new ATOM 0 HB2 ASP A 625 -12.927 3.057 11.266 1.00 1.15 H new ATOM 0 HB3 ASP A 625 -12.790 4.769 11.616 1.00 1.15 H new ATOM 1465 N THR A 626 -14.227 6.514 9.728 1.00 0.97 N ATOM 1466 CA THR A 626 -13.985 7.968 9.804 1.00 1.04 C ATOM 1467 C THR A 626 -13.509 8.498 8.438 1.00 0.98 C ATOM 1468 O THR A 626 -13.227 7.690 7.553 1.00 0.94 O ATOM 1469 CB THR A 626 -12.920 8.210 10.888 1.00 1.12 C ATOM 1470 OG1 THR A 626 -12.666 9.570 11.124 1.00 1.29 O ATOM 1471 CG2 THR A 626 -11.582 7.522 10.620 1.00 1.03 C ATOM 0 H THR A 626 -13.787 6.111 8.901 1.00 0.97 H new ATOM 0 HA THR A 626 -14.902 8.498 10.060 1.00 1.04 H new ATOM 0 HB THR A 626 -13.373 7.761 11.772 1.00 1.12 H new ATOM 0 HG1 THR A 626 -11.984 9.659 11.822 1.00 1.29 H new ATOM 0 HG21 THR A 626 -10.889 7.744 11.432 1.00 1.03 H new ATOM 0 HG22 THR A 626 -11.733 6.444 10.557 1.00 1.03 H new ATOM 0 HG23 THR A 626 -11.168 7.886 9.680 1.00 1.03 H new ATOM 1479 N TYR A 627 -13.377 9.818 8.241 1.00 1.04 N ATOM 1480 CA TYR A 627 -12.733 10.395 7.052 1.00 1.02 C ATOM 1481 C TYR A 627 -11.248 9.974 7.044 1.00 0.99 C ATOM 1482 O TYR A 627 -10.464 10.391 7.900 1.00 1.12 O ATOM 1483 CB TYR A 627 -12.989 11.916 7.041 1.00 1.14 C ATOM 1484 CG TYR A 627 -12.352 12.794 5.962 1.00 1.24 C ATOM 1485 CD1 TYR A 627 -10.959 13.016 5.912 1.00 2.57 C ATOM 1486 CD2 TYR A 627 -13.181 13.495 5.064 1.00 1.95 C ATOM 1487 CE1 TYR A 627 -10.406 13.893 4.951 1.00 2.66 C ATOM 1488 CE2 TYR A 627 -12.637 14.374 4.102 1.00 2.38 C ATOM 1489 CZ TYR A 627 -11.244 14.594 4.056 1.00 1.95 C ATOM 1490 OH TYR A 627 -10.697 15.436 3.131 1.00 2.41 O ATOM 0 H TYR A 627 -13.714 10.517 8.903 1.00 1.04 H new ATOM 0 HA TYR A 627 -13.153 10.019 6.119 1.00 1.02 H new ATOM 0 HB2 TYR A 627 -14.068 12.062 6.982 1.00 1.14 H new ATOM 0 HB3 TYR A 627 -12.667 12.305 8.007 1.00 1.14 H new ATOM 0 HD1 TYR A 627 -10.311 12.512 6.613 1.00 2.57 H new ATOM 0 HD2 TYR A 627 -14.251 13.358 5.112 1.00 1.95 H new ATOM 0 HE1 TYR A 627 -9.336 14.028 4.901 1.00 2.66 H new ATOM 0 HE2 TYR A 627 -13.287 14.878 3.402 1.00 2.38 H new ATOM 0 HH TYR A 627 -11.410 15.839 2.593 1.00 2.41 H new ATOM 1500 N CYS A 628 -10.875 9.086 6.117 1.00 0.88 N ATOM 1501 CA CYS A 628 -9.591 8.377 6.103 1.00 0.84 C ATOM 1502 C CYS A 628 -8.847 8.603 4.780 1.00 0.87 C ATOM 1503 O CYS A 628 -9.386 8.333 3.703 1.00 0.94 O ATOM 1504 CB CYS A 628 -9.847 6.884 6.367 1.00 0.78 C ATOM 1505 SG CYS A 628 -8.313 6.033 6.815 1.00 2.75 S ATOM 0 H CYS A 628 -11.476 8.833 5.332 1.00 0.88 H new ATOM 0 HA CYS A 628 -8.947 8.770 6.890 1.00 0.84 H new ATOM 0 HB2 CYS A 628 -10.577 6.773 7.169 1.00 0.78 H new ATOM 0 HB3 CYS A 628 -10.277 6.422 5.478 1.00 0.78 H new ATOM 0 HG CYS A 628 -8.284 4.864 6.248 1.00 2.75 H new ATOM 1511 N ARG A 629 -7.603 9.086 4.873 1.00 0.92 N ATOM 1512 CA ARG A 629 -6.683 9.332 3.755 1.00 1.00 C ATOM 1513 C ARG A 629 -5.887 8.069 3.439 1.00 1.02 C ATOM 1514 O ARG A 629 -5.101 7.594 4.263 1.00 1.11 O ATOM 1515 CB ARG A 629 -5.730 10.493 4.096 1.00 1.27 C ATOM 1516 CG ARG A 629 -6.425 11.857 4.271 1.00 1.28 C ATOM 1517 CD ARG A 629 -6.106 12.835 3.133 1.00 1.55 C ATOM 1518 NE ARG A 629 -4.715 13.317 3.183 1.00 2.53 N ATOM 1519 CZ ARG A 629 -4.268 14.536 2.961 1.00 3.16 C ATOM 1520 NH1 ARG A 629 -5.039 15.557 2.736 1.00 3.23 N ATOM 1521 NH2 ARG A 629 -2.997 14.786 2.928 1.00 4.26 N ATOM 0 H ARG A 629 -7.190 9.328 5.774 1.00 0.92 H new ATOM 0 HA ARG A 629 -7.266 9.606 2.875 1.00 1.00 H new ATOM 0 HB2 ARG A 629 -5.196 10.251 5.015 1.00 1.27 H new ATOM 0 HB3 ARG A 629 -4.983 10.578 3.306 1.00 1.27 H new ATOM 0 HG2 ARG A 629 -7.503 11.707 4.324 1.00 1.28 H new ATOM 0 HG3 ARG A 629 -6.118 12.297 5.220 1.00 1.28 H new ATOM 0 HD2 ARG A 629 -6.284 12.345 2.176 1.00 1.55 H new ATOM 0 HD3 ARG A 629 -6.785 13.686 3.187 1.00 1.55 H new ATOM 0 HE ARG A 629 -4.009 12.619 3.419 1.00 2.53 H new ATOM 0 HH11 ARG A 629 -6.052 15.438 2.725 1.00 3.23 H new ATOM 0 HH12 ARG A 629 -4.631 16.477 2.571 1.00 3.23 H new ATOM 0 HH21 ARG A 629 -2.325 14.033 3.075 1.00 4.26 H new ATOM 0 HH22 ARG A 629 -2.668 15.736 2.755 1.00 4.26 H new ATOM 1535 N LEU A 630 -6.060 7.561 2.225 1.00 0.99 N ATOM 1536 CA LEU A 630 -5.360 6.393 1.684 1.00 1.03 C ATOM 1537 C LEU A 630 -4.462 6.796 0.515 1.00 1.12 C ATOM 1538 O LEU A 630 -4.784 7.723 -0.215 1.00 1.33 O ATOM 1539 CB LEU A 630 -6.362 5.334 1.199 1.00 0.96 C ATOM 1540 CG LEU A 630 -7.405 4.845 2.216 1.00 0.95 C ATOM 1541 CD1 LEU A 630 -8.136 3.654 1.602 1.00 0.92 C ATOM 1542 CD2 LEU A 630 -6.782 4.383 3.530 1.00 1.09 C ATOM 0 H LEU A 630 -6.719 7.966 1.559 1.00 0.99 H new ATOM 0 HA LEU A 630 -4.750 5.975 2.485 1.00 1.03 H new ATOM 0 HB2 LEU A 630 -6.893 5.739 0.337 1.00 0.96 H new ATOM 0 HB3 LEU A 630 -5.798 4.469 0.849 1.00 0.96 H new ATOM 0 HG LEU A 630 -8.069 5.680 2.438 1.00 0.95 H new ATOM 0 HD11 LEU A 630 -8.884 3.285 2.304 1.00 0.92 H new ATOM 0 HD12 LEU A 630 -8.626 3.964 0.679 1.00 0.92 H new ATOM 0 HD13 LEU A 630 -7.421 2.861 1.384 1.00 0.92 H new ATOM 0 HD21 LEU A 630 -7.568 4.049 4.208 1.00 1.09 H new ATOM 0 HD22 LEU A 630 -6.095 3.559 3.337 1.00 1.09 H new ATOM 0 HD23 LEU A 630 -6.237 5.210 3.985 1.00 1.09 H new ATOM 1554 N TYR A 631 -3.366 6.079 0.283 1.00 1.03 N ATOM 1555 CA TYR A 631 -2.491 6.321 -0.873 1.00 1.04 C ATOM 1556 C TYR A 631 -2.761 5.318 -2.011 1.00 1.08 C ATOM 1557 O TYR A 631 -3.402 4.282 -1.801 1.00 1.35 O ATOM 1558 CB TYR A 631 -1.027 6.447 -0.399 1.00 1.32 C ATOM 1559 CG TYR A 631 -0.012 5.335 -0.649 1.00 2.81 C ATOM 1560 CD1 TYR A 631 -0.363 3.972 -0.731 1.00 4.39 C ATOM 1561 CD2 TYR A 631 1.350 5.690 -0.668 1.00 3.47 C ATOM 1562 CE1 TYR A 631 0.629 2.984 -0.871 1.00 5.90 C ATOM 1563 CE2 TYR A 631 2.350 4.707 -0.771 1.00 4.94 C ATOM 1564 CZ TYR A 631 1.989 3.347 -0.876 1.00 5.98 C ATOM 1565 OH TYR A 631 2.941 2.384 -0.966 1.00 7.55 O ATOM 0 H TYR A 631 -3.056 5.316 0.885 1.00 1.03 H new ATOM 0 HA TYR A 631 -2.723 7.280 -1.337 1.00 1.04 H new ATOM 0 HB2 TYR A 631 -0.624 7.353 -0.852 1.00 1.32 H new ATOM 0 HB3 TYR A 631 -1.055 6.615 0.678 1.00 1.32 H new ATOM 0 HD1 TYR A 631 -1.403 3.684 -0.686 1.00 4.39 H new ATOM 0 HD2 TYR A 631 1.630 6.731 -0.603 1.00 3.47 H new ATOM 0 HE1 TYR A 631 0.347 1.947 -0.975 1.00 5.90 H new ATOM 0 HE2 TYR A 631 3.392 4.992 -0.770 1.00 4.94 H new ATOM 0 HH TYR A 631 2.513 1.511 -1.086 1.00 7.55 H new ATOM 1575 N SER A 632 -2.260 5.570 -3.221 1.00 0.98 N ATOM 1576 CA SER A 632 -2.069 4.503 -4.225 1.00 1.04 C ATOM 1577 C SER A 632 -0.724 4.629 -4.959 1.00 0.91 C ATOM 1578 O SER A 632 -0.529 5.593 -5.701 1.00 1.09 O ATOM 1579 CB SER A 632 -3.241 4.482 -5.218 1.00 1.31 C ATOM 1580 OG SER A 632 -4.483 4.409 -4.528 1.00 1.79 O ATOM 0 H SER A 632 -1.978 6.498 -3.536 1.00 0.98 H new ATOM 0 HA SER A 632 -2.048 3.553 -3.691 1.00 1.04 H new ATOM 0 HB2 SER A 632 -3.216 5.379 -5.837 1.00 1.31 H new ATOM 0 HB3 SER A 632 -3.141 3.628 -5.888 1.00 1.31 H new ATOM 0 HG SER A 632 -5.217 4.398 -5.177 1.00 1.79 H new ATOM 1586 N LEU A 633 0.182 3.653 -4.796 1.00 0.79 N ATOM 1587 CA LEU A 633 1.540 3.641 -5.385 1.00 0.81 C ATOM 1588 C LEU A 633 1.730 2.425 -6.316 1.00 0.98 C ATOM 1589 O LEU A 633 1.444 1.278 -5.959 1.00 0.99 O ATOM 1590 CB LEU A 633 2.598 3.683 -4.258 1.00 0.80 C ATOM 1591 CG LEU A 633 3.996 4.283 -4.568 1.00 0.97 C ATOM 1592 CD1 LEU A 633 4.952 3.961 -3.416 1.00 1.17 C ATOM 1593 CD2 LEU A 633 4.666 3.785 -5.848 1.00 1.36 C ATOM 0 H LEU A 633 -0.011 2.823 -4.235 1.00 0.79 H new ATOM 0 HA LEU A 633 1.670 4.530 -6.003 1.00 0.81 H new ATOM 0 HB2 LEU A 633 2.173 4.247 -3.427 1.00 0.80 H new ATOM 0 HB3 LEU A 633 2.747 2.662 -3.907 1.00 0.80 H new ATOM 0 HG LEU A 633 3.809 5.349 -4.700 1.00 0.97 H new ATOM 0 HD11 LEU A 633 5.935 4.381 -3.631 1.00 1.17 H new ATOM 0 HD12 LEU A 633 4.567 4.392 -2.492 1.00 1.17 H new ATOM 0 HD13 LEU A 633 5.036 2.880 -3.304 1.00 1.17 H new ATOM 0 HD21 LEU A 633 5.635 4.270 -5.964 1.00 1.36 H new ATOM 0 HD22 LEU A 633 4.805 2.705 -5.790 1.00 1.36 H new ATOM 0 HD23 LEU A 633 4.036 4.024 -6.705 1.00 1.36 H new ATOM 1605 N SER A 634 2.234 2.677 -7.520 1.00 1.21 N ATOM 1606 CA SER A 634 2.421 1.687 -8.577 1.00 1.36 C ATOM 1607 C SER A 634 3.662 0.805 -8.416 1.00 1.35 C ATOM 1608 O SER A 634 4.788 1.291 -8.290 1.00 1.36 O ATOM 1609 CB SER A 634 2.458 2.406 -9.917 1.00 1.60 C ATOM 1610 OG SER A 634 2.628 1.462 -10.947 1.00 2.28 O ATOM 0 H SER A 634 2.535 3.611 -7.797 1.00 1.21 H new ATOM 0 HA SER A 634 1.577 1.001 -8.515 1.00 1.36 H new ATOM 0 HB2 SER A 634 1.534 2.964 -10.069 1.00 1.60 H new ATOM 0 HB3 SER A 634 3.274 3.129 -9.932 1.00 1.60 H new ATOM 0 HG SER A 634 2.507 1.900 -11.815 1.00 2.28 H new ATOM 1616 N VAL A 635 3.469 -0.516 -8.544 1.00 1.38 N ATOM 1617 CA VAL A 635 4.590 -1.460 -8.655 1.00 1.43 C ATOM 1618 C VAL A 635 5.383 -1.271 -9.939 1.00 1.38 C ATOM 1619 O VAL A 635 6.575 -1.553 -9.942 1.00 1.48 O ATOM 1620 CB VAL A 635 4.180 -2.937 -8.553 1.00 1.53 C ATOM 1621 CG1 VAL A 635 3.307 -3.212 -7.333 1.00 1.90 C ATOM 1622 CG2 VAL A 635 3.526 -3.524 -9.799 1.00 1.70 C ATOM 0 H VAL A 635 2.548 -0.954 -8.573 1.00 1.38 H new ATOM 0 HA VAL A 635 5.213 -1.221 -7.793 1.00 1.43 H new ATOM 0 HB VAL A 635 5.135 -3.452 -8.444 1.00 1.53 H new ATOM 0 HG11 VAL A 635 3.043 -4.269 -7.305 1.00 1.90 H new ATOM 0 HG12 VAL A 635 3.854 -2.950 -6.427 1.00 1.90 H new ATOM 0 HG13 VAL A 635 2.398 -2.613 -7.393 1.00 1.90 H new ATOM 0 HG21 VAL A 635 3.276 -4.570 -9.620 1.00 1.70 H new ATOM 0 HG22 VAL A 635 2.617 -2.968 -10.029 1.00 1.70 H new ATOM 0 HG23 VAL A 635 4.216 -3.454 -10.640 1.00 1.70 H new ATOM 1632 N ASP A 636 4.764 -0.789 -11.020 1.00 1.31 N ATOM 1633 CA ASP A 636 5.471 -0.542 -12.275 1.00 1.39 C ATOM 1634 C ASP A 636 6.607 0.455 -12.023 1.00 1.43 C ATOM 1635 O ASP A 636 7.735 0.219 -12.453 1.00 1.66 O ATOM 1636 CB ASP A 636 4.522 0.000 -13.352 1.00 1.46 C ATOM 1637 CG ASP A 636 3.498 -1.005 -13.897 1.00 1.73 C ATOM 1638 OD1 ASP A 636 3.017 -1.911 -13.181 1.00 2.31 O ATOM 1639 OD2 ASP A 636 3.153 -0.892 -15.095 1.00 2.64 O ATOM 0 H ASP A 636 3.770 -0.562 -11.049 1.00 1.31 H new ATOM 0 HA ASP A 636 5.879 -1.485 -12.638 1.00 1.39 H new ATOM 0 HB2 ASP A 636 3.984 0.854 -12.941 1.00 1.46 H new ATOM 0 HB3 ASP A 636 5.120 0.371 -14.185 1.00 1.46 H new ATOM 1644 N ASN A 637 6.335 1.497 -11.229 1.00 1.32 N ATOM 1645 CA ASN A 637 7.339 2.465 -10.805 1.00 1.38 C ATOM 1646 C ASN A 637 8.337 1.882 -9.790 1.00 1.41 C ATOM 1647 O ASN A 637 9.516 2.177 -9.911 1.00 1.63 O ATOM 1648 CB ASN A 637 6.653 3.725 -10.270 1.00 1.50 C ATOM 1649 CG ASN A 637 5.892 4.418 -11.376 1.00 1.59 C ATOM 1650 OD1 ASN A 637 4.691 4.264 -11.510 1.00 2.18 O ATOM 1651 ND2 ASN A 637 6.544 5.207 -12.193 1.00 1.83 N ATOM 0 H ASN A 637 5.403 1.689 -10.863 1.00 1.32 H new ATOM 0 HA ASN A 637 7.933 2.733 -11.679 1.00 1.38 H new ATOM 0 HB2 ASN A 637 5.972 3.461 -9.461 1.00 1.50 H new ATOM 0 HB3 ASN A 637 7.397 4.403 -9.852 1.00 1.50 H new ATOM 0 HD21 ASN A 637 6.046 5.691 -12.940 1.00 1.83 H new ATOM 0 HD22 ASN A 637 7.550 5.337 -12.082 1.00 1.83 H new ATOM 1658 N PHE A 638 7.927 1.013 -8.855 1.00 1.28 N ATOM 1659 CA PHE A 638 8.864 0.290 -7.963 1.00 1.32 C ATOM 1660 C PHE A 638 9.913 -0.505 -8.771 1.00 1.34 C ATOM 1661 O PHE A 638 11.116 -0.418 -8.528 1.00 1.35 O ATOM 1662 CB PHE A 638 8.090 -0.637 -7.020 1.00 1.45 C ATOM 1663 CG PHE A 638 8.910 -1.075 -5.816 1.00 1.55 C ATOM 1664 CD1 PHE A 638 9.911 -2.062 -5.940 1.00 2.66 C ATOM 1665 CD2 PHE A 638 8.682 -0.479 -4.562 1.00 1.81 C ATOM 1666 CE1 PHE A 638 10.672 -2.444 -4.822 1.00 2.78 C ATOM 1667 CE2 PHE A 638 9.455 -0.849 -3.449 1.00 1.98 C ATOM 1668 CZ PHE A 638 10.450 -1.829 -3.579 1.00 1.92 C ATOM 0 H PHE A 638 6.946 0.788 -8.691 1.00 1.28 H new ATOM 0 HA PHE A 638 9.400 1.029 -7.367 1.00 1.32 H new ATOM 0 HB2 PHE A 638 7.191 -0.127 -6.675 1.00 1.45 H new ATOM 0 HB3 PHE A 638 7.764 -1.519 -7.572 1.00 1.45 H new ATOM 0 HD1 PHE A 638 10.093 -2.526 -6.898 1.00 2.66 H new ATOM 0 HD2 PHE A 638 7.908 0.267 -4.455 1.00 1.81 H new ATOM 0 HE1 PHE A 638 11.427 -3.210 -4.919 1.00 2.78 H new ATOM 0 HE2 PHE A 638 9.283 -0.378 -2.492 1.00 1.98 H new ATOM 0 HZ PHE A 638 11.045 -2.111 -2.723 1.00 1.92 H new ATOM 1678 N ASN A 639 9.457 -1.248 -9.784 1.00 1.35 N ATOM 1679 CA ASN A 639 10.291 -2.044 -10.689 1.00 1.38 C ATOM 1680 C ASN A 639 11.110 -1.173 -11.681 1.00 1.34 C ATOM 1681 O ASN A 639 12.126 -1.639 -12.205 1.00 1.41 O ATOM 1682 CB ASN A 639 9.352 -3.024 -11.428 1.00 1.37 C ATOM 1683 CG ASN A 639 8.791 -4.183 -10.609 1.00 1.55 C ATOM 1684 OD1 ASN A 639 9.442 -5.205 -10.424 1.00 2.05 O ATOM 1685 ND2 ASN A 639 7.559 -4.129 -10.160 1.00 1.48 N ATOM 0 H ASN A 639 8.463 -1.314 -10.004 1.00 1.35 H new ATOM 0 HA ASN A 639 11.041 -2.586 -10.113 1.00 1.38 H new ATOM 0 HB2 ASN A 639 8.514 -2.455 -11.831 1.00 1.37 H new ATOM 0 HB3 ASN A 639 9.893 -3.439 -12.278 1.00 1.37 H new ATOM 0 HD21 ASN A 639 7.160 -4.928 -9.667 1.00 1.48 H new ATOM 0 HD22 ASN A 639 7.000 -3.288 -10.304 1.00 1.48 H new ATOM 1692 N GLU A 640 10.710 0.082 -11.927 1.00 1.29 N ATOM 1693 CA GLU A 640 11.447 1.093 -12.710 1.00 1.31 C ATOM 1694 C GLU A 640 12.647 1.672 -11.936 1.00 1.35 C ATOM 1695 O GLU A 640 13.794 1.577 -12.388 1.00 1.58 O ATOM 1696 CB GLU A 640 10.511 2.267 -13.064 1.00 1.32 C ATOM 1697 CG GLU A 640 9.567 2.078 -14.263 1.00 1.69 C ATOM 1698 CD GLU A 640 10.180 2.467 -15.608 1.00 2.31 C ATOM 1699 OE1 GLU A 640 10.500 3.664 -15.805 1.00 2.86 O ATOM 1700 OE2 GLU A 640 10.306 1.608 -16.515 1.00 3.50 O ATOM 0 H GLU A 640 9.824 0.440 -11.571 1.00 1.29 H new ATOM 0 HA GLU A 640 11.812 0.589 -13.605 1.00 1.31 H new ATOM 0 HB2 GLU A 640 9.903 2.490 -12.187 1.00 1.32 H new ATOM 0 HB3 GLU A 640 11.128 3.145 -13.255 1.00 1.32 H new ATOM 0 HG2 GLU A 640 9.256 1.034 -14.306 1.00 1.69 H new ATOM 0 HG3 GLU A 640 8.668 2.672 -14.101 1.00 1.69 H new ATOM 1707 N VAL A 641 12.368 2.298 -10.786 1.00 1.21 N ATOM 1708 CA VAL A 641 13.313 3.061 -9.937 1.00 1.17 C ATOM 1709 C VAL A 641 14.365 2.170 -9.282 1.00 1.20 C ATOM 1710 O VAL A 641 15.491 2.614 -9.067 1.00 1.23 O ATOM 1711 CB VAL A 641 12.521 3.898 -8.904 1.00 1.10 C ATOM 1712 CG1 VAL A 641 11.590 3.066 -8.025 1.00 1.13 C ATOM 1713 CG2 VAL A 641 13.362 4.768 -7.964 1.00 1.08 C ATOM 0 H VAL A 641 11.426 2.290 -10.394 1.00 1.21 H new ATOM 0 HA VAL A 641 13.875 3.742 -10.576 1.00 1.17 H new ATOM 0 HB VAL A 641 11.951 4.553 -9.563 1.00 1.10 H new ATOM 0 HG11 VAL A 641 11.069 3.720 -7.326 1.00 1.13 H new ATOM 0 HG12 VAL A 641 10.862 2.551 -8.652 1.00 1.13 H new ATOM 0 HG13 VAL A 641 12.174 2.332 -7.469 1.00 1.13 H new ATOM 0 HG21 VAL A 641 12.705 5.310 -7.284 1.00 1.08 H new ATOM 0 HG22 VAL A 641 14.037 4.135 -7.389 1.00 1.08 H new ATOM 0 HG23 VAL A 641 13.944 5.480 -8.550 1.00 1.08 H new ATOM 1723 N LEU A 642 14.044 0.895 -9.041 1.00 1.24 N ATOM 1724 CA LEU A 642 14.982 -0.117 -8.542 1.00 1.32 C ATOM 1725 C LEU A 642 16.343 -0.149 -9.273 1.00 1.49 C ATOM 1726 O LEU A 642 17.373 -0.306 -8.620 1.00 1.57 O ATOM 1727 CB LEU A 642 14.292 -1.500 -8.614 1.00 1.41 C ATOM 1728 CG LEU A 642 13.748 -2.044 -7.278 1.00 1.35 C ATOM 1729 CD1 LEU A 642 13.273 -3.484 -7.498 1.00 1.56 C ATOM 1730 CD2 LEU A 642 14.798 -2.069 -6.166 1.00 2.24 C ATOM 0 H LEU A 642 13.104 0.529 -9.191 1.00 1.24 H new ATOM 0 HA LEU A 642 15.226 0.152 -7.514 1.00 1.32 H new ATOM 0 HB2 LEU A 642 13.467 -1.438 -9.323 1.00 1.41 H new ATOM 0 HB3 LEU A 642 15.004 -2.221 -9.016 1.00 1.41 H new ATOM 0 HG LEU A 642 12.943 -1.378 -6.966 1.00 1.35 H new ATOM 0 HD11 LEU A 642 12.884 -3.886 -6.562 1.00 1.56 H new ATOM 0 HD12 LEU A 642 12.487 -3.496 -8.253 1.00 1.56 H new ATOM 0 HD13 LEU A 642 14.110 -4.096 -7.836 1.00 1.56 H new ATOM 0 HD21 LEU A 642 14.351 -2.462 -5.253 1.00 2.24 H new ATOM 0 HD22 LEU A 642 15.631 -2.705 -6.466 1.00 2.24 H new ATOM 0 HD23 LEU A 642 15.161 -1.057 -5.986 1.00 2.24 H new ATOM 1742 N GLU A 643 16.386 0.028 -10.598 1.00 1.64 N ATOM 1743 CA GLU A 643 17.633 -0.007 -11.380 1.00 1.86 C ATOM 1744 C GLU A 643 18.620 1.144 -11.108 1.00 1.76 C ATOM 1745 O GLU A 643 19.805 1.010 -11.421 1.00 1.91 O ATOM 1746 CB GLU A 643 17.258 -0.039 -12.865 1.00 2.15 C ATOM 1747 CG GLU A 643 16.688 -1.400 -13.271 1.00 2.79 C ATOM 1748 CD GLU A 643 17.748 -2.266 -13.967 1.00 3.51 C ATOM 1749 OE1 GLU A 643 18.111 -1.966 -15.133 1.00 3.70 O ATOM 1750 OE2 GLU A 643 18.270 -3.220 -13.341 1.00 4.59 O ATOM 0 H GLU A 643 15.555 0.201 -11.163 1.00 1.64 H new ATOM 0 HA GLU A 643 18.171 -0.902 -11.068 1.00 1.86 H new ATOM 0 HB2 GLU A 643 16.525 0.740 -13.073 1.00 2.15 H new ATOM 0 HB3 GLU A 643 18.138 0.182 -13.468 1.00 2.15 H new ATOM 0 HG2 GLU A 643 16.315 -1.918 -12.388 1.00 2.79 H new ATOM 0 HG3 GLU A 643 15.838 -1.256 -13.938 1.00 2.79 H new ATOM 1757 N GLU A 644 18.178 2.251 -10.504 1.00 1.55 N ATOM 1758 CA GLU A 644 19.047 3.358 -10.085 1.00 1.50 C ATOM 1759 C GLU A 644 19.865 3.028 -8.823 1.00 1.44 C ATOM 1760 O GLU A 644 20.902 3.646 -8.559 1.00 1.51 O ATOM 1761 CB GLU A 644 18.160 4.567 -9.818 1.00 1.38 C ATOM 1762 CG GLU A 644 17.439 5.041 -11.081 1.00 1.49 C ATOM 1763 CD GLU A 644 18.303 5.982 -11.920 1.00 1.76 C ATOM 1764 OE1 GLU A 644 18.280 7.221 -11.720 1.00 2.02 O ATOM 1765 OE2 GLU A 644 19.029 5.495 -12.811 1.00 3.00 O ATOM 0 H GLU A 644 17.193 2.407 -10.289 1.00 1.55 H new ATOM 0 HA GLU A 644 19.767 3.553 -10.880 1.00 1.50 H new ATOM 0 HB2 GLU A 644 17.424 4.315 -9.054 1.00 1.38 H new ATOM 0 HB3 GLU A 644 18.767 5.381 -9.420 1.00 1.38 H new ATOM 0 HG2 GLU A 644 17.157 4.177 -11.682 1.00 1.49 H new ATOM 0 HG3 GLU A 644 16.516 5.550 -10.801 1.00 1.49 H new ATOM 1772 N TYR A 645 19.394 2.043 -8.051 1.00 1.37 N ATOM 1773 CA TYR A 645 19.898 1.642 -6.734 1.00 1.35 C ATOM 1774 C TYR A 645 20.247 0.133 -6.726 1.00 1.55 C ATOM 1775 O TYR A 645 19.559 -0.667 -6.083 1.00 1.51 O ATOM 1776 CB TYR A 645 18.867 2.053 -5.664 1.00 1.10 C ATOM 1777 CG TYR A 645 18.510 3.532 -5.700 1.00 0.97 C ATOM 1778 CD1 TYR A 645 19.337 4.482 -5.069 1.00 2.07 C ATOM 1779 CD2 TYR A 645 17.380 3.963 -6.422 1.00 1.78 C ATOM 1780 CE1 TYR A 645 19.049 5.858 -5.185 1.00 1.95 C ATOM 1781 CE2 TYR A 645 17.099 5.337 -6.557 1.00 1.92 C ATOM 1782 CZ TYR A 645 17.942 6.288 -5.947 1.00 0.96 C ATOM 1783 OH TYR A 645 17.728 7.617 -6.133 1.00 1.08 O ATOM 0 H TYR A 645 18.603 1.470 -8.347 1.00 1.37 H new ATOM 0 HA TYR A 645 20.830 2.156 -6.498 1.00 1.35 H new ATOM 0 HB2 TYR A 645 17.959 1.465 -5.801 1.00 1.10 H new ATOM 0 HB3 TYR A 645 19.261 1.807 -4.678 1.00 1.10 H new ATOM 0 HD1 TYR A 645 20.192 4.156 -4.496 1.00 2.07 H new ATOM 0 HD2 TYR A 645 16.724 3.235 -6.876 1.00 1.78 H new ATOM 0 HE1 TYR A 645 19.677 6.584 -4.690 1.00 1.95 H new ATOM 0 HE2 TYR A 645 16.240 5.661 -7.126 1.00 1.92 H new ATOM 0 HH TYR A 645 16.926 7.746 -6.681 1.00 1.08 H new ATOM 1793 N PRO A 646 21.301 -0.294 -7.456 1.00 1.83 N ATOM 1794 CA PRO A 646 21.609 -1.704 -7.731 1.00 2.05 C ATOM 1795 C PRO A 646 21.723 -2.629 -6.504 1.00 1.99 C ATOM 1796 O PRO A 646 21.406 -3.816 -6.627 1.00 2.04 O ATOM 1797 CB PRO A 646 22.912 -1.683 -8.544 1.00 2.43 C ATOM 1798 CG PRO A 646 23.505 -0.296 -8.306 1.00 2.39 C ATOM 1799 CD PRO A 646 22.247 0.552 -8.172 1.00 2.00 C ATOM 0 HA PRO A 646 20.768 -2.144 -8.267 1.00 2.05 H new ATOM 0 HB2 PRO A 646 23.595 -2.466 -8.215 1.00 2.43 H new ATOM 0 HB3 PRO A 646 22.719 -1.853 -9.603 1.00 2.43 H new ATOM 0 HG2 PRO A 646 24.121 -0.262 -7.407 1.00 2.39 H new ATOM 0 HG3 PRO A 646 24.133 0.030 -9.135 1.00 2.39 H new ATOM 0 HD2 PRO A 646 22.447 1.473 -7.624 1.00 2.00 H new ATOM 0 HD3 PRO A 646 21.859 0.840 -9.149 1.00 2.00 H new ATOM 1807 N MET A 647 22.105 -2.122 -5.324 1.00 1.92 N ATOM 1808 CA MET A 647 22.088 -2.874 -4.055 1.00 1.95 C ATOM 1809 C MET A 647 20.673 -3.337 -3.673 1.00 1.79 C ATOM 1810 O MET A 647 20.484 -4.473 -3.230 1.00 1.85 O ATOM 1811 CB MET A 647 22.645 -1.973 -2.941 1.00 1.98 C ATOM 1812 CG MET A 647 22.595 -2.609 -1.545 1.00 2.26 C ATOM 1813 SD MET A 647 22.801 -1.447 -0.174 1.00 2.17 S ATOM 1814 CE MET A 647 21.175 -0.648 -0.241 1.00 1.64 C ATOM 0 H MET A 647 22.440 -1.164 -5.219 1.00 1.92 H new ATOM 0 HA MET A 647 22.702 -3.766 -4.182 1.00 1.95 H new ATOM 0 HB2 MET A 647 23.678 -1.717 -3.176 1.00 1.98 H new ATOM 0 HB3 MET A 647 22.081 -1.040 -2.925 1.00 1.98 H new ATOM 0 HG2 MET A 647 21.640 -3.121 -1.428 1.00 2.26 H new ATOM 0 HG3 MET A 647 23.374 -3.369 -1.479 1.00 2.26 H new ATOM 0 HE1 MET A 647 21.257 0.300 -0.773 1.00 1.64 H new ATOM 0 HE2 MET A 647 20.472 -1.297 -0.762 1.00 1.64 H new ATOM 0 HE3 MET A 647 20.818 -0.465 0.772 1.00 1.64 H new ATOM 1824 N MET A 648 19.672 -2.469 -3.845 1.00 1.63 N ATOM 1825 CA MET A 648 18.268 -2.808 -3.617 1.00 1.41 C ATOM 1826 C MET A 648 17.742 -3.717 -4.731 1.00 1.56 C ATOM 1827 O MET A 648 17.019 -4.665 -4.438 1.00 1.59 O ATOM 1828 CB MET A 648 17.433 -1.526 -3.484 1.00 1.24 C ATOM 1829 CG MET A 648 17.533 -0.873 -2.099 1.00 1.32 C ATOM 1830 SD MET A 648 16.452 -1.606 -0.835 1.00 1.29 S ATOM 1831 CE MET A 648 17.602 -2.638 0.118 1.00 2.26 C ATOM 0 H MET A 648 19.816 -1.506 -4.148 1.00 1.63 H new ATOM 0 HA MET A 648 18.183 -3.363 -2.682 1.00 1.41 H new ATOM 0 HB2 MET A 648 17.758 -0.810 -4.239 1.00 1.24 H new ATOM 0 HB3 MET A 648 16.389 -1.758 -3.693 1.00 1.24 H new ATOM 0 HG2 MET A 648 18.566 -0.937 -1.756 1.00 1.32 H new ATOM 0 HG3 MET A 648 17.293 0.186 -2.193 1.00 1.32 H new ATOM 0 HE1 MET A 648 17.174 -2.850 1.098 1.00 2.26 H new ATOM 0 HE2 MET A 648 17.776 -3.574 -0.413 1.00 2.26 H new ATOM 0 HE3 MET A 648 18.547 -2.110 0.242 1.00 2.26 H new ATOM 1841 N ARG A 649 18.162 -3.524 -5.993 1.00 1.74 N ATOM 1842 CA ARG A 649 17.724 -4.387 -7.108 1.00 1.91 C ATOM 1843 C ARG A 649 18.042 -5.859 -6.841 1.00 1.95 C ATOM 1844 O ARG A 649 17.137 -6.683 -6.906 1.00 2.00 O ATOM 1845 CB ARG A 649 18.266 -3.847 -8.446 1.00 2.10 C ATOM 1846 CG ARG A 649 17.460 -4.316 -9.677 1.00 2.17 C ATOM 1847 CD ARG A 649 17.830 -5.708 -10.210 1.00 2.42 C ATOM 1848 NE ARG A 649 19.215 -5.752 -10.710 1.00 3.91 N ATOM 1849 CZ ARG A 649 19.920 -6.836 -10.977 1.00 4.85 C ATOM 1850 NH1 ARG A 649 19.422 -8.034 -10.989 1.00 4.68 N ATOM 1851 NH2 ARG A 649 21.189 -6.770 -11.220 1.00 6.49 N ATOM 0 H ARG A 649 18.803 -2.780 -6.268 1.00 1.74 H new ATOM 0 HA ARG A 649 16.637 -4.352 -7.186 1.00 1.91 H new ATOM 0 HB2 ARG A 649 18.264 -2.757 -8.415 1.00 2.10 H new ATOM 0 HB3 ARG A 649 19.303 -4.161 -8.561 1.00 2.10 H new ATOM 0 HG2 ARG A 649 16.401 -4.313 -9.420 1.00 2.17 H new ATOM 0 HG3 ARG A 649 17.596 -3.590 -10.478 1.00 2.17 H new ATOM 0 HD2 ARG A 649 17.706 -6.446 -9.417 1.00 2.42 H new ATOM 0 HD3 ARG A 649 17.145 -5.984 -11.012 1.00 2.42 H new ATOM 0 HE ARG A 649 19.675 -4.855 -10.866 1.00 3.91 H new ATOM 0 HH11 ARG A 649 18.433 -8.177 -10.784 1.00 4.68 H new ATOM 0 HH12 ARG A 649 20.019 -8.833 -11.203 1.00 4.68 H new ATOM 0 HH21 ARG A 649 21.664 -5.868 -11.208 1.00 6.49 H new ATOM 0 HH22 ARG A 649 21.714 -7.620 -11.424 1.00 6.49 H new ATOM 1865 N ARG A 650 19.270 -6.195 -6.424 1.00 1.97 N ATOM 1866 CA ARG A 650 19.629 -7.579 -6.034 1.00 1.98 C ATOM 1867 C ARG A 650 18.888 -8.096 -4.793 1.00 1.84 C ATOM 1868 O ARG A 650 18.497 -9.258 -4.750 1.00 1.94 O ATOM 1869 CB ARG A 650 21.148 -7.740 -5.891 1.00 2.05 C ATOM 1870 CG ARG A 650 21.792 -6.857 -4.818 1.00 2.67 C ATOM 1871 CD ARG A 650 23.305 -7.053 -4.717 1.00 2.91 C ATOM 1872 NE ARG A 650 24.057 -6.269 -5.722 1.00 4.07 N ATOM 1873 CZ ARG A 650 25.275 -5.784 -5.558 1.00 5.33 C ATOM 1874 NH1 ARG A 650 25.873 -5.829 -4.401 1.00 5.74 N ATOM 1875 NH2 ARG A 650 25.920 -5.237 -6.548 1.00 6.69 N ATOM 0 H ARG A 650 20.039 -5.530 -6.345 1.00 1.97 H new ATOM 0 HA ARG A 650 19.288 -8.211 -6.854 1.00 1.98 H new ATOM 0 HB2 ARG A 650 21.368 -8.783 -5.663 1.00 2.05 H new ATOM 0 HB3 ARG A 650 21.614 -7.518 -6.851 1.00 2.05 H new ATOM 0 HG2 ARG A 650 21.580 -5.811 -5.040 1.00 2.67 H new ATOM 0 HG3 ARG A 650 21.337 -7.077 -3.852 1.00 2.67 H new ATOM 0 HD2 ARG A 650 23.637 -6.768 -3.719 1.00 2.91 H new ATOM 0 HD3 ARG A 650 23.538 -8.111 -4.840 1.00 2.91 H new ATOM 0 HE ARG A 650 23.597 -6.088 -6.614 1.00 4.07 H new ATOM 0 HH11 ARG A 650 25.400 -6.245 -3.598 1.00 5.74 H new ATOM 0 HH12 ARG A 650 26.814 -5.448 -4.298 1.00 5.74 H new ATOM 0 HH21 ARG A 650 25.486 -5.178 -7.469 1.00 6.69 H new ATOM 0 HH22 ARG A 650 26.860 -4.868 -6.403 1.00 6.69 H new ATOM 1889 N ALA A 651 18.617 -7.224 -3.825 1.00 1.65 N ATOM 1890 CA ALA A 651 17.871 -7.548 -2.599 1.00 1.56 C ATOM 1891 C ALA A 651 16.428 -8.034 -2.863 1.00 1.59 C ATOM 1892 O ALA A 651 15.867 -8.782 -2.060 1.00 1.65 O ATOM 1893 CB ALA A 651 17.860 -6.317 -1.683 1.00 1.44 C ATOM 0 H ALA A 651 18.914 -6.249 -3.866 1.00 1.65 H new ATOM 0 HA ALA A 651 18.382 -8.382 -2.119 1.00 1.56 H new ATOM 0 HB1 ALA A 651 17.309 -6.547 -0.771 1.00 1.44 H new ATOM 0 HB2 ALA A 651 18.884 -6.043 -1.429 1.00 1.44 H new ATOM 0 HB3 ALA A 651 17.379 -5.485 -2.197 1.00 1.44 H new ATOM 1899 N PHE A 652 15.834 -7.651 -3.996 1.00 1.63 N ATOM 1900 CA PHE A 652 14.551 -8.166 -4.493 1.00 1.75 C ATOM 1901 C PHE A 652 14.688 -9.388 -5.426 1.00 2.04 C ATOM 1902 O PHE A 652 13.709 -10.088 -5.686 1.00 2.30 O ATOM 1903 CB PHE A 652 13.765 -7.009 -5.118 1.00 1.66 C ATOM 1904 CG PHE A 652 13.107 -6.128 -4.072 1.00 1.50 C ATOM 1905 CD1 PHE A 652 11.887 -6.516 -3.485 1.00 1.59 C ATOM 1906 CD2 PHE A 652 13.738 -4.949 -3.638 1.00 2.61 C ATOM 1907 CE1 PHE A 652 11.311 -5.730 -2.471 1.00 1.65 C ATOM 1908 CE2 PHE A 652 13.171 -4.166 -2.620 1.00 2.58 C ATOM 1909 CZ PHE A 652 11.956 -4.559 -2.033 1.00 1.51 C ATOM 0 H PHE A 652 16.244 -6.951 -4.614 1.00 1.63 H new ATOM 0 HA PHE A 652 13.988 -8.560 -3.647 1.00 1.75 H new ATOM 0 HB2 PHE A 652 14.436 -6.405 -5.729 1.00 1.66 H new ATOM 0 HB3 PHE A 652 13.001 -7.410 -5.785 1.00 1.66 H new ATOM 0 HD1 PHE A 652 11.393 -7.418 -3.814 1.00 1.59 H new ATOM 0 HD2 PHE A 652 14.669 -4.642 -4.092 1.00 2.61 H new ATOM 0 HE1 PHE A 652 10.372 -6.026 -2.028 1.00 1.65 H new ATOM 0 HE2 PHE A 652 13.667 -3.265 -2.289 1.00 2.58 H new ATOM 0 HZ PHE A 652 11.518 -3.963 -1.246 1.00 1.51 H new ATOM 1919 N GLU A 653 15.886 -9.673 -5.936 1.00 2.16 N ATOM 1920 CA GLU A 653 16.180 -10.838 -6.786 1.00 2.47 C ATOM 1921 C GLU A 653 16.473 -12.119 -5.982 1.00 2.49 C ATOM 1922 O GLU A 653 16.346 -13.214 -6.530 1.00 2.80 O ATOM 1923 CB GLU A 653 17.368 -10.519 -7.708 1.00 2.76 C ATOM 1924 CG GLU A 653 17.096 -9.354 -8.669 1.00 2.37 C ATOM 1925 CD GLU A 653 16.489 -9.790 -10.001 1.00 2.67 C ATOM 1926 OE1 GLU A 653 15.644 -10.718 -10.036 1.00 2.65 O ATOM 1927 OE2 GLU A 653 16.884 -9.211 -11.041 1.00 3.75 O ATOM 0 H GLU A 653 16.704 -9.087 -5.768 1.00 2.16 H new ATOM 0 HA GLU A 653 15.283 -11.035 -7.373 1.00 2.47 H new ATOM 0 HB2 GLU A 653 18.239 -10.281 -7.097 1.00 2.76 H new ATOM 0 HB3 GLU A 653 17.618 -11.408 -8.287 1.00 2.76 H new ATOM 0 HG2 GLU A 653 16.422 -8.646 -8.187 1.00 2.37 H new ATOM 0 HG3 GLU A 653 18.030 -8.826 -8.860 1.00 2.37 H new ATOM 1934 N THR A 654 16.830 -11.997 -4.697 1.00 2.23 N ATOM 1935 CA THR A 654 17.037 -13.131 -3.767 1.00 2.27 C ATOM 1936 C THR A 654 15.719 -13.718 -3.247 1.00 2.33 C ATOM 1937 O THR A 654 15.512 -14.931 -3.274 1.00 2.70 O ATOM 1938 CB THR A 654 17.972 -12.760 -2.602 1.00 2.17 C ATOM 1939 OG1 THR A 654 17.949 -13.779 -1.624 1.00 2.42 O ATOM 1940 CG2 THR A 654 17.609 -11.438 -1.930 1.00 1.91 C ATOM 0 H THR A 654 16.988 -11.090 -4.259 1.00 2.23 H new ATOM 0 HA THR A 654 17.526 -13.910 -4.352 1.00 2.27 H new ATOM 0 HB THR A 654 18.966 -12.649 -3.035 1.00 2.17 H new ATOM 0 HG1 THR A 654 18.547 -13.538 -0.886 1.00 2.42 H new ATOM 0 HG21 THR A 654 18.308 -11.238 -1.118 1.00 1.91 H new ATOM 0 HG22 THR A 654 17.662 -10.631 -2.661 1.00 1.91 H new ATOM 0 HG23 THR A 654 16.597 -11.499 -1.530 1.00 1.91 H new ATOM 1948 N VAL A 655 14.776 -12.864 -2.845 1.00 2.15 N ATOM 1949 CA VAL A 655 13.422 -13.263 -2.420 1.00 2.36 C ATOM 1950 C VAL A 655 12.690 -14.001 -3.542 1.00 2.73 C ATOM 1951 O VAL A 655 12.042 -15.013 -3.298 1.00 3.05 O ATOM 1952 CB VAL A 655 12.637 -12.047 -1.891 1.00 2.34 C ATOM 1953 CG1 VAL A 655 12.686 -10.837 -2.816 1.00 2.21 C ATOM 1954 CG2 VAL A 655 11.187 -12.379 -1.524 1.00 2.89 C ATOM 0 H VAL A 655 14.929 -11.856 -2.803 1.00 2.15 H new ATOM 0 HA VAL A 655 13.507 -13.967 -1.592 1.00 2.36 H new ATOM 0 HB VAL A 655 13.159 -11.774 -0.974 1.00 2.34 H new ATOM 0 HG11 VAL A 655 12.112 -10.021 -2.378 1.00 2.21 H new ATOM 0 HG12 VAL A 655 13.721 -10.522 -2.949 1.00 2.21 H new ATOM 0 HG13 VAL A 655 12.260 -11.102 -3.784 1.00 2.21 H new ATOM 0 HG21 VAL A 655 10.689 -11.481 -1.158 1.00 2.89 H new ATOM 0 HG22 VAL A 655 10.664 -12.750 -2.406 1.00 2.89 H new ATOM 0 HG23 VAL A 655 11.174 -13.143 -0.746 1.00 2.89 H new ATOM 1964 N ALA A 656 12.912 -13.579 -4.787 1.00 2.82 N ATOM 1965 CA ALA A 656 12.420 -14.225 -6.009 1.00 3.36 C ATOM 1966 C ALA A 656 12.937 -15.665 -6.271 1.00 3.81 C ATOM 1967 O ALA A 656 12.513 -16.282 -7.251 1.00 4.62 O ATOM 1968 CB ALA A 656 12.733 -13.293 -7.183 1.00 3.37 C ATOM 0 H ALA A 656 13.462 -12.743 -4.982 1.00 2.82 H new ATOM 0 HA ALA A 656 11.348 -14.374 -5.883 1.00 3.36 H new ATOM 0 HB1 ALA A 656 12.379 -13.744 -8.110 1.00 3.37 H new ATOM 0 HB2 ALA A 656 12.233 -12.336 -7.031 1.00 3.37 H new ATOM 0 HB3 ALA A 656 13.810 -13.134 -7.244 1.00 3.37 H new ATOM 1974 N ILE A 657 13.808 -16.214 -5.412 1.00 3.43 N ATOM 1975 CA ILE A 657 14.173 -17.644 -5.369 1.00 3.73 C ATOM 1976 C ILE A 657 14.026 -18.263 -3.960 1.00 3.71 C ATOM 1977 O ILE A 657 13.693 -19.440 -3.842 1.00 3.92 O ATOM 1978 CB ILE A 657 15.557 -17.876 -6.022 1.00 3.89 C ATOM 1979 CG1 ILE A 657 15.871 -19.385 -6.108 1.00 4.41 C ATOM 1980 CG2 ILE A 657 16.683 -17.095 -5.323 1.00 3.86 C ATOM 1981 CD1 ILE A 657 16.998 -19.718 -7.093 1.00 5.42 C ATOM 0 H ILE A 657 14.294 -15.662 -4.706 1.00 3.43 H new ATOM 0 HA ILE A 657 13.450 -18.192 -5.972 1.00 3.73 H new ATOM 0 HB ILE A 657 15.506 -17.480 -7.036 1.00 3.89 H new ATOM 0 HG12 ILE A 657 16.145 -19.748 -5.118 1.00 4.41 H new ATOM 0 HG13 ILE A 657 14.969 -19.920 -6.405 1.00 4.41 H new ATOM 0 HG21 ILE A 657 17.630 -17.296 -5.823 1.00 3.86 H new ATOM 0 HG22 ILE A 657 16.468 -16.027 -5.369 1.00 3.86 H new ATOM 0 HG23 ILE A 657 16.750 -17.407 -4.281 1.00 3.86 H new ATOM 0 HD11 ILE A 657 17.166 -20.795 -7.103 1.00 5.42 H new ATOM 0 HD12 ILE A 657 16.718 -19.385 -8.092 1.00 5.42 H new ATOM 0 HD13 ILE A 657 17.912 -19.211 -6.785 1.00 5.42 H new ATOM 1993 N ASP A 658 14.162 -17.494 -2.871 1.00 3.54 N ATOM 1994 CA ASP A 658 13.876 -17.977 -1.505 1.00 3.57 C ATOM 1995 C ASP A 658 12.383 -18.312 -1.290 1.00 3.69 C ATOM 1996 O ASP A 658 12.041 -19.302 -0.632 1.00 4.03 O ATOM 1997 CB ASP A 658 14.333 -16.924 -0.482 1.00 3.28 C ATOM 1998 CG ASP A 658 14.120 -17.418 0.952 1.00 3.48 C ATOM 1999 OD1 ASP A 658 14.894 -18.300 1.395 1.00 3.99 O ATOM 2000 OD2 ASP A 658 13.142 -16.996 1.615 1.00 3.94 O ATOM 0 H ASP A 658 14.472 -16.523 -2.907 1.00 3.54 H new ATOM 0 HA ASP A 658 14.431 -18.905 -1.364 1.00 3.57 H new ATOM 0 HB2 ASP A 658 15.387 -16.695 -0.638 1.00 3.28 H new ATOM 0 HB3 ASP A 658 13.779 -15.998 -0.637 1.00 3.28 H new ATOM 2005 N ARG A 659 11.496 -17.501 -1.877 1.00 3.61 N ATOM 2006 CA ARG A 659 10.027 -17.595 -1.791 1.00 4.00 C ATOM 2007 C ARG A 659 9.422 -18.613 -2.770 1.00 4.69 C ATOM 2008 O ARG A 659 8.267 -19.006 -2.621 1.00 5.21 O ATOM 2009 CB ARG A 659 9.506 -16.172 -2.045 1.00 3.79 C ATOM 2010 CG ARG A 659 8.029 -15.935 -1.733 1.00 3.87 C ATOM 2011 CD ARG A 659 7.724 -14.463 -2.028 1.00 3.74 C ATOM 2012 NE ARG A 659 6.287 -14.187 -1.894 1.00 4.30 N ATOM 2013 CZ ARG A 659 5.652 -13.594 -0.905 1.00 4.45 C ATOM 2014 NH1 ARG A 659 6.246 -13.140 0.160 1.00 4.50 N ATOM 2015 NH2 ARG A 659 4.369 -13.454 -1.007 1.00 5.31 N ATOM 0 H ARG A 659 11.796 -16.718 -2.457 1.00 3.61 H new ATOM 0 HA ARG A 659 9.727 -17.967 -0.811 1.00 4.00 H new ATOM 0 HB2 ARG A 659 10.099 -15.477 -1.450 1.00 3.79 H new ATOM 0 HB3 ARG A 659 9.680 -15.924 -3.092 1.00 3.79 H new ATOM 0 HG2 ARG A 659 7.400 -16.586 -2.341 1.00 3.87 H new ATOM 0 HG3 ARG A 659 7.816 -16.169 -0.690 1.00 3.87 H new ATOM 0 HD2 ARG A 659 8.286 -13.827 -1.344 1.00 3.74 H new ATOM 0 HD3 ARG A 659 8.053 -14.215 -3.037 1.00 3.74 H new ATOM 0 HE ARG A 659 5.703 -14.496 -2.671 1.00 4.30 H new ATOM 0 HH11 ARG A 659 7.257 -13.235 0.260 1.00 4.50 H new ATOM 0 HH12 ARG A 659 5.701 -12.689 0.895 1.00 4.50 H new ATOM 0 HH21 ARG A 659 3.883 -13.798 -1.835 1.00 5.31 H new ATOM 0 HH22 ARG A 659 3.845 -12.999 -0.260 1.00 5.31 H new ATOM 2029 N LEU A 660 10.196 -19.040 -3.768 1.00 4.85 N ATOM 2030 CA LEU A 660 9.790 -19.990 -4.818 1.00 5.59 C ATOM 2031 C LEU A 660 10.142 -21.447 -4.469 1.00 6.45 C ATOM 2032 O LEU A 660 9.683 -22.364 -5.149 1.00 7.40 O ATOM 2033 CB LEU A 660 10.424 -19.562 -6.161 1.00 5.62 C ATOM 2034 CG LEU A 660 9.739 -18.398 -6.911 1.00 5.66 C ATOM 2035 CD1 LEU A 660 8.389 -18.815 -7.497 1.00 5.46 C ATOM 2036 CD2 LEU A 660 9.522 -17.153 -6.049 1.00 5.55 C ATOM 0 H LEU A 660 11.160 -18.725 -3.876 1.00 4.85 H new ATOM 0 HA LEU A 660 8.704 -19.960 -4.902 1.00 5.59 H new ATOM 0 HB2 LEU A 660 11.461 -19.283 -5.974 1.00 5.62 H new ATOM 0 HB3 LEU A 660 10.441 -20.429 -6.821 1.00 5.62 H new ATOM 0 HG LEU A 660 10.436 -18.143 -7.710 1.00 5.66 H new ATOM 0 HD11 LEU A 660 7.940 -17.968 -8.016 1.00 5.46 H new ATOM 0 HD12 LEU A 660 8.535 -19.635 -8.200 1.00 5.46 H new ATOM 0 HD13 LEU A 660 7.728 -19.139 -6.693 1.00 5.46 H new ATOM 0 HD21 LEU A 660 9.037 -16.379 -6.644 1.00 5.55 H new ATOM 0 HD22 LEU A 660 8.890 -17.406 -5.197 1.00 5.55 H new ATOM 0 HD23 LEU A 660 10.484 -16.786 -5.691 1.00 5.55 H new ATOM 2048 N ASP A 661 10.886 -21.652 -3.377 1.00 6.20 N ATOM 2049 CA ASP A 661 11.474 -22.926 -2.939 1.00 7.12 C ATOM 2050 C ASP A 661 12.485 -23.536 -3.941 1.00 8.89 C ATOM 2051 O ASP A 661 12.698 -23.020 -5.040 1.00 9.72 O ATOM 2052 CB ASP A 661 10.333 -23.864 -2.503 1.00 6.68 C ATOM 2053 CG ASP A 661 10.798 -25.137 -1.794 1.00 7.22 C ATOM 2054 OD1 ASP A 661 11.814 -25.084 -1.068 1.00 7.87 O ATOM 2055 OD2 ASP A 661 10.223 -26.226 -2.021 1.00 7.56 O ATOM 0 H ASP A 661 11.108 -20.890 -2.737 1.00 6.20 H new ATOM 0 HA ASP A 661 12.112 -22.748 -2.074 1.00 7.12 H new ATOM 0 HB2 ASP A 661 9.663 -23.317 -1.840 1.00 6.68 H new ATOM 0 HB3 ASP A 661 9.753 -24.144 -3.382 1.00 6.68 H new ATOM 2060 N ARG A 662 13.158 -24.621 -3.532 1.00 9.80 N ATOM 2061 CA ARG A 662 14.228 -25.313 -4.269 1.00 11.68 C ATOM 2062 C ARG A 662 13.826 -25.670 -5.701 1.00 12.71 C ATOM 2063 O ARG A 662 14.455 -25.171 -6.635 1.00 14.15 O ATOM 2064 CB ARG A 662 14.652 -26.570 -3.484 1.00 12.33 C ATOM 2065 CG ARG A 662 15.215 -26.271 -2.079 1.00 12.05 C ATOM 2066 CD ARG A 662 14.824 -27.356 -1.066 1.00 12.15 C ATOM 2067 NE ARG A 662 13.377 -27.347 -0.792 1.00 11.36 N ATOM 2068 CZ ARG A 662 12.696 -28.140 0.006 1.00 11.40 C ATOM 2069 NH1 ARG A 662 13.242 -29.095 0.701 1.00 12.07 N ATOM 2070 NH2 ARG A 662 11.413 -27.963 0.125 1.00 11.14 N ATOM 0 H ARG A 662 12.962 -25.063 -2.634 1.00 9.80 H new ATOM 0 HA ARG A 662 15.072 -24.629 -4.356 1.00 11.68 H new ATOM 0 HB2 ARG A 662 13.792 -27.232 -3.386 1.00 12.33 H new ATOM 0 HB3 ARG A 662 15.405 -27.108 -4.059 1.00 12.33 H new ATOM 0 HG2 ARG A 662 16.301 -26.197 -2.131 1.00 12.05 H new ATOM 0 HG3 ARG A 662 14.845 -25.304 -1.737 1.00 12.05 H new ATOM 0 HD2 ARG A 662 15.116 -28.334 -1.449 1.00 12.15 H new ATOM 0 HD3 ARG A 662 15.372 -27.201 -0.136 1.00 12.15 H new ATOM 0 HE ARG A 662 12.835 -26.636 -1.283 1.00 11.36 H new ATOM 0 HH11 ARG A 662 14.247 -29.258 0.642 1.00 12.07 H new ATOM 0 HH12 ARG A 662 12.665 -29.681 1.305 1.00 12.07 H new ATOM 0 HH21 ARG A 662 10.950 -27.218 -0.396 1.00 11.14 H new ATOM 0 HH22 ARG A 662 10.869 -28.569 0.740 1.00 11.14 H new ATOM 2084 N ILE A 663 12.776 -26.491 -5.840 1.00 12.29 N ATOM 2085 CA ILE A 663 12.242 -27.069 -7.084 1.00 13.53 C ATOM 2086 C ILE A 663 13.276 -27.906 -7.866 1.00 15.40 C ATOM 2087 O ILE A 663 14.472 -27.626 -7.871 1.00 16.16 O ATOM 2088 CB ILE A 663 11.531 -25.983 -7.932 1.00 13.53 C ATOM 2089 CG1 ILE A 663 10.504 -25.142 -7.140 1.00 11.83 C ATOM 2090 CG2 ILE A 663 10.859 -26.577 -9.182 1.00 15.00 C ATOM 2091 CD1 ILE A 663 9.364 -25.941 -6.506 1.00 11.40 C ATOM 0 H ILE A 663 12.237 -26.791 -5.028 1.00 12.29 H new ATOM 0 HA ILE A 663 11.481 -27.799 -6.808 1.00 13.53 H new ATOM 0 HB ILE A 663 12.330 -25.308 -8.239 1.00 13.53 H new ATOM 0 HG12 ILE A 663 11.030 -24.601 -6.353 1.00 11.83 H new ATOM 0 HG13 ILE A 663 10.076 -24.395 -7.809 1.00 11.83 H new ATOM 0 HG21 ILE A 663 10.373 -25.781 -9.747 1.00 15.00 H new ATOM 0 HG22 ILE A 663 11.612 -27.057 -9.807 1.00 15.00 H new ATOM 0 HG23 ILE A 663 10.115 -27.314 -8.880 1.00 15.00 H new ATOM 0 HD11 ILE A 663 8.697 -25.263 -5.973 1.00 11.40 H new ATOM 0 HD12 ILE A 663 8.806 -26.460 -7.285 1.00 11.40 H new ATOM 0 HD13 ILE A 663 9.775 -26.670 -5.807 1.00 11.40 H new ATOM 2103 N GLY A 664 12.819 -28.957 -8.549 1.00 16.41 N ATOM 2104 CA GLY A 664 13.661 -29.761 -9.439 1.00 18.33 C ATOM 2105 C GLY A 664 13.991 -28.985 -10.714 1.00 19.21 C ATOM 2106 O GLY A 664 13.170 -28.958 -11.634 1.00 20.03 O ATOM 0 H GLY A 664 11.851 -29.276 -8.501 1.00 16.41 H new ATOM 0 HA2 GLY A 664 14.582 -30.037 -8.926 1.00 18.33 H new ATOM 0 HA3 GLY A 664 13.148 -30.689 -9.694 1.00 18.33 H new ATOM 2110 N LYS A 665 15.157 -28.327 -10.763 1.00 19.28 N ATOM 2111 CA LYS A 665 15.570 -27.490 -11.902 1.00 20.26 C ATOM 2112 C LYS A 665 16.381 -28.264 -12.942 1.00 21.83 C ATOM 2113 O LYS A 665 17.108 -29.205 -12.602 1.00 22.31 O ATOM 2114 CB LYS A 665 16.326 -26.231 -11.449 1.00 19.82 C ATOM 2115 CG LYS A 665 15.652 -25.378 -10.359 1.00 18.40 C ATOM 2116 CD LYS A 665 14.222 -24.912 -10.670 1.00 17.67 C ATOM 2117 CE LYS A 665 14.167 -23.961 -11.870 1.00 18.56 C ATOM 2118 NZ LYS A 665 12.777 -23.539 -12.150 1.00 18.03 N ATOM 0 H LYS A 665 15.845 -28.359 -10.011 1.00 19.28 H new ATOM 0 HA LYS A 665 14.646 -27.172 -12.385 1.00 20.26 H new ATOM 0 HB2 LYS A 665 17.308 -26.535 -11.085 1.00 19.82 H new ATOM 0 HB3 LYS A 665 16.491 -25.600 -12.322 1.00 19.82 H new ATOM 0 HG2 LYS A 665 15.634 -25.952 -9.433 1.00 18.40 H new ATOM 0 HG3 LYS A 665 16.270 -24.499 -10.177 1.00 18.40 H new ATOM 0 HD2 LYS A 665 13.595 -25.781 -10.869 1.00 17.67 H new ATOM 0 HD3 LYS A 665 13.807 -24.413 -9.795 1.00 17.67 H new ATOM 0 HE2 LYS A 665 14.784 -23.084 -11.672 1.00 18.56 H new ATOM 0 HE3 LYS A 665 14.585 -24.453 -12.748 1.00 18.56 H new ATOM 0 HZ1 LYS A 665 12.767 -22.896 -12.967 1.00 18.03 H new ATOM 0 HZ2 LYS A 665 12.196 -24.375 -12.361 1.00 18.03 H new ATOM 0 HZ3 LYS A 665 12.389 -23.049 -11.319 1.00 18.03 H new ATOM 2132 N LYS A 666 16.304 -27.819 -14.199 1.00 22.80 N ATOM 2133 CA LYS A 666 17.213 -28.215 -15.292 1.00 24.44 C ATOM 2134 C LYS A 666 18.519 -27.400 -15.284 1.00 25.02 C ATOM 2135 O LYS A 666 18.601 -26.358 -14.628 1.00 24.65 O ATOM 2136 CB LYS A 666 16.454 -28.168 -16.630 1.00 25.44 C ATOM 2137 CG LYS A 666 16.095 -26.747 -17.094 1.00 25.57 C ATOM 2138 CD LYS A 666 15.122 -26.799 -18.276 1.00 26.49 C ATOM 2139 CE LYS A 666 14.649 -25.392 -18.651 1.00 26.82 C ATOM 2140 NZ LYS A 666 13.715 -25.446 -19.796 1.00 27.73 N ATOM 0 H LYS A 666 15.590 -27.155 -14.499 1.00 22.80 H new ATOM 0 HA LYS A 666 17.537 -29.244 -15.138 1.00 24.44 H new ATOM 0 HB2 LYS A 666 17.061 -28.648 -17.398 1.00 25.44 H new ATOM 0 HB3 LYS A 666 15.538 -28.751 -16.537 1.00 25.44 H new ATOM 0 HG2 LYS A 666 15.647 -26.191 -16.270 1.00 25.57 H new ATOM 0 HG3 LYS A 666 17.000 -26.213 -17.383 1.00 25.57 H new ATOM 0 HD2 LYS A 666 15.608 -27.265 -19.133 1.00 26.49 H new ATOM 0 HD3 LYS A 666 14.264 -27.420 -18.020 1.00 26.49 H new ATOM 0 HE2 LYS A 666 14.158 -24.927 -17.796 1.00 26.82 H new ATOM 0 HE3 LYS A 666 15.507 -24.769 -18.903 1.00 26.82 H new ATOM 0 HZ1 LYS A 666 13.405 -24.483 -20.036 1.00 27.73 H new ATOM 0 HZ2 LYS A 666 14.195 -25.870 -20.616 1.00 27.73 H new ATOM 0 HZ3 LYS A 666 12.888 -26.023 -19.542 1.00 27.73 H new ATOM 2154 N ASN A 667 19.540 -27.883 -16.002 1.00 26.11 N ATOM 2155 CA ASN A 667 20.900 -27.324 -15.952 1.00 26.88 C ATOM 2156 C ASN A 667 20.982 -25.858 -16.426 1.00 27.42 C ATOM 2157 O ASN A 667 21.571 -25.038 -15.721 1.00 27.40 O ATOM 2158 CB ASN A 667 21.864 -28.217 -16.759 1.00 28.10 C ATOM 2159 CG ASN A 667 22.155 -29.555 -16.099 1.00 28.21 C ATOM 2160 OD1 ASN A 667 22.507 -29.644 -14.928 1.00 27.84 O ATOM 2161 ND2 ASN A 667 22.044 -30.634 -16.836 1.00 28.90 N ATOM 0 H ASN A 667 19.448 -28.676 -16.637 1.00 26.11 H new ATOM 0 HA ASN A 667 21.198 -27.313 -14.904 1.00 26.88 H new ATOM 0 HB2 ASN A 667 21.440 -28.394 -17.747 1.00 28.10 H new ATOM 0 HB3 ASN A 667 22.803 -27.683 -16.906 1.00 28.10 H new ATOM 0 HD21 ASN A 667 22.251 -31.549 -16.435 1.00 28.90 H new ATOM 0 HD22 ASN A 667 21.751 -30.558 -17.810 1.00 28.90 H new ATOM 2168 N SER A 668 20.382 -25.514 -17.573 1.00 28.06 N ATOM 2169 CA SER A 668 20.346 -24.148 -18.132 1.00 28.78 C ATOM 2170 C SER A 668 21.737 -23.493 -18.305 1.00 29.64 C ATOM 2171 O SER A 668 22.757 -24.184 -18.418 1.00 30.31 O ATOM 2172 CB SER A 668 19.352 -23.289 -17.327 1.00 28.11 C ATOM 2173 OG SER A 668 18.035 -23.793 -17.462 1.00 27.62 O ATOM 0 H SER A 668 19.894 -26.193 -18.157 1.00 28.06 H new ATOM 0 HA SER A 668 19.984 -24.220 -19.158 1.00 28.78 H new ATOM 0 HB2 SER A 668 19.638 -23.281 -16.275 1.00 28.11 H new ATOM 0 HB3 SER A 668 19.390 -22.257 -17.675 1.00 28.11 H new ATOM 0 HG SER A 668 17.417 -23.237 -16.943 1.00 27.62 H new ATOM 2179 N ILE A 669 21.764 -22.160 -18.426 1.00 29.84 N ATOM 2180 CA ILE A 669 22.921 -21.322 -18.782 1.00 30.84 C ATOM 2181 C ILE A 669 24.006 -21.244 -17.695 1.00 30.66 C ATOM 2182 O ILE A 669 23.741 -21.441 -16.506 1.00 29.72 O ATOM 2183 CB ILE A 669 22.444 -19.901 -19.174 1.00 31.34 C ATOM 2184 CG1 ILE A 669 21.716 -19.183 -18.010 1.00 30.49 C ATOM 2185 CG2 ILE A 669 21.574 -19.981 -20.443 1.00 31.93 C ATOM 2186 CD1 ILE A 669 21.295 -17.744 -18.326 1.00 31.13 C ATOM 0 H ILE A 669 20.926 -21.600 -18.268 1.00 29.84 H new ATOM 0 HA ILE A 669 23.396 -21.810 -19.633 1.00 30.84 H new ATOM 0 HB ILE A 669 23.321 -19.291 -19.392 1.00 31.34 H new ATOM 0 HG12 ILE A 669 20.830 -19.758 -17.740 1.00 30.49 H new ATOM 0 HG13 ILE A 669 22.369 -19.175 -17.137 1.00 30.49 H new ATOM 0 HG21 ILE A 669 21.239 -18.981 -20.718 1.00 31.93 H new ATOM 0 HG22 ILE A 669 22.159 -20.405 -21.259 1.00 31.93 H new ATOM 0 HG23 ILE A 669 20.708 -20.614 -20.251 1.00 31.93 H new ATOM 0 HD11 ILE A 669 20.793 -17.313 -17.460 1.00 31.13 H new ATOM 0 HD12 ILE A 669 22.178 -17.151 -18.565 1.00 31.13 H new ATOM 0 HD13 ILE A 669 20.615 -17.743 -19.178 1.00 31.13 H new ATOM 2198 N LEU A 670 25.231 -20.910 -18.113 1.00 31.73 N ATOM 2199 CA LEU A 670 26.370 -20.680 -17.216 1.00 31.96 C ATOM 2200 C LEU A 670 26.390 -19.259 -16.618 1.00 32.19 C ATOM 2201 O LEU A 670 25.550 -18.409 -16.940 1.00 32.28 O ATOM 2202 CB LEU A 670 27.692 -21.084 -17.915 1.00 32.98 C ATOM 2203 CG LEU A 670 28.090 -20.386 -19.232 1.00 34.09 C ATOM 2204 CD1 LEU A 670 28.183 -18.861 -19.144 1.00 34.16 C ATOM 2205 CD2 LEU A 670 29.470 -20.894 -19.656 1.00 35.17 C ATOM 0 H LEU A 670 25.464 -20.790 -19.099 1.00 31.73 H new ATOM 0 HA LEU A 670 26.254 -21.329 -16.348 1.00 31.96 H new ATOM 0 HB2 LEU A 670 28.502 -20.926 -17.202 1.00 32.98 H new ATOM 0 HB3 LEU A 670 27.645 -22.155 -18.112 1.00 32.98 H new ATOM 0 HG LEU A 670 27.299 -20.624 -19.944 1.00 34.09 H new ATOM 0 HD11 LEU A 670 28.468 -18.457 -20.115 1.00 34.16 H new ATOM 0 HD12 LEU A 670 27.215 -18.454 -18.852 1.00 34.16 H new ATOM 0 HD13 LEU A 670 28.932 -18.584 -18.402 1.00 34.16 H new ATOM 0 HD21 LEU A 670 29.766 -20.410 -20.586 1.00 35.17 H new ATOM 0 HD22 LEU A 670 30.198 -20.662 -18.879 1.00 35.17 H new ATOM 0 HD23 LEU A 670 29.430 -21.973 -19.805 1.00 35.17 H new ATOM 2217 N LEU A 671 27.377 -18.990 -15.760 1.00 32.46 N ATOM 2218 CA LEU A 671 27.733 -17.640 -15.315 1.00 33.08 C ATOM 2219 C LEU A 671 29.259 -17.504 -15.161 1.00 34.04 C ATOM 2220 O LEU A 671 29.875 -18.274 -14.415 1.00 33.79 O ATOM 2221 CB LEU A 671 26.939 -17.326 -14.025 1.00 32.20 C ATOM 2222 CG LEU A 671 26.980 -15.890 -13.461 1.00 32.69 C ATOM 2223 CD1 LEU A 671 28.194 -15.632 -12.575 1.00 33.78 C ATOM 2224 CD2 LEU A 671 26.891 -14.805 -14.537 1.00 33.35 C ATOM 0 H LEU A 671 27.962 -19.717 -15.348 1.00 32.46 H new ATOM 0 HA LEU A 671 27.455 -16.895 -16.060 1.00 33.08 H new ATOM 0 HB2 LEU A 671 25.895 -17.579 -14.210 1.00 32.20 H new ATOM 0 HB3 LEU A 671 27.297 -17.998 -13.245 1.00 32.20 H new ATOM 0 HG LEU A 671 26.082 -15.824 -12.846 1.00 32.69 H new ATOM 0 HD11 LEU A 671 28.166 -14.606 -12.209 1.00 33.78 H new ATOM 0 HD12 LEU A 671 28.180 -16.319 -11.729 1.00 33.78 H new ATOM 0 HD13 LEU A 671 29.105 -15.787 -13.153 1.00 33.78 H new ATOM 0 HD21 LEU A 671 26.926 -13.822 -14.067 1.00 33.35 H new ATOM 0 HD22 LEU A 671 27.729 -14.907 -15.227 1.00 33.35 H new ATOM 0 HD23 LEU A 671 25.955 -14.912 -15.085 1.00 33.35 H new ATOM 2236 N HIS A 672 29.830 -16.501 -15.846 1.00 35.24 N ATOM 2237 CA HIS A 672 31.246 -16.079 -15.831 1.00 36.43 C ATOM 2238 C HIS A 672 32.244 -17.165 -16.268 1.00 36.90 C ATOM 2239 O HIS A 672 32.383 -17.358 -17.500 1.00 37.22 O ATOM 2240 CB HIS A 672 31.547 -15.404 -14.481 1.00 36.80 C ATOM 2241 CG HIS A 672 32.864 -14.682 -14.392 1.00 38.12 C ATOM 2242 ND1 HIS A 672 33.085 -13.368 -14.725 1.00 38.78 N ATOM 2243 CD2 HIS A 672 34.006 -15.146 -13.802 1.00 38.92 C ATOM 2244 CE1 HIS A 672 34.329 -13.040 -14.341 1.00 39.92 C ATOM 2245 NE2 HIS A 672 34.927 -14.089 -13.743 1.00 40.04 N ATOM 0 H HIS A 672 29.275 -15.918 -16.473 1.00 35.24 H new ATOM 0 HA HIS A 672 31.399 -15.336 -16.614 1.00 36.43 H new ATOM 0 HB2 HIS A 672 30.749 -14.694 -14.265 1.00 36.80 H new ATOM 0 HB3 HIS A 672 31.517 -16.164 -13.701 1.00 36.80 H new ATOM 0 HD2 HIS A 672 34.171 -16.151 -13.444 1.00 38.92 H new ATOM 0 HE1 HIS A 672 34.786 -12.073 -14.490 1.00 39.92 H new ATOM 0 HE2 HIS A 672 35.860 -14.110 -13.331 1.00 40.04 H new TER 2253 HIS A 672