USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=34 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 156:sc= -0.0603 (180deg=-0.27) USER MOD Set 1.2: A 648 MET CE :methyl 166:sc= -0.306 (180deg=-0.478) USER MOD Set 2.1: A 593 THR OG1 : rot 180:sc= -0.103 USER MOD Set 2.2: A 599 MET CE :methyl -161:sc= -0.0745 (180deg=-0.484) USER MOD Set 3.1: A 559 LYS NZ :NH3+ 173:sc= 1.11 (180deg=0) USER MOD Set 3.2: A 634 SER OG : rot 135:sc= 2.15 USER MOD Set 3.3: A 637 ASN : amide:sc= 1.09 K(o=4.4,f=3.3) USER MOD Single : A 534 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 535 CYS SG : rot 180:sc= -0.0208 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 541 SER OG : rot 72:sc= 1.26 USER MOD Single : A 542 MET CE :methyl 144:sc=-0.00219 (180deg=-1.43) USER MOD Single : A 547 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 551 ASN : amide:sc= 0.899 K(o=0.9,f=0) USER MOD Single : A 554 THR OG1 : rot 114:sc= 1.24 USER MOD Single : A 556 MET CE :methyl -167:sc= -0.331 (180deg=-0.687) 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= -0.0132 X(o=-0.013,f=-0.013) USER MOD Single : A 570 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 THR OG1 : rot 180:sc=-0.00683 USER MOD Single : A 579 LYS NZ :NH3+ -124:sc= 0.373 (180deg=0) USER MOD Single : A 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 581 MET CE :methyl -170:sc= -0.427 (180deg=-0.607) USER MOD Single : A 582 TYR OH : rot 150:sc=-0.00507 USER MOD Single : A 585 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 586 HIS : no HD1:sc= -0.07 X(o=-0.07,f=0) USER MOD Single : A 590 SER OG : rot 129:sc= 1.23 USER MOD Single : A 594 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 596 ASN : amide:sc= -0.279 K(o=-0.28,f=-6.3!) USER MOD Single : A 597 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 600 LYS NZ :NH3+ 174:sc=-0.00939 (180deg=-0.0718) USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 605 SER OG : rot 180:sc= 0 USER MOD Single : A 606 TYR OH : rot 180:sc= 0 USER MOD Single : A 611 CYS SG : rot 140:sc= -0.0325 USER MOD Single : A 614 THR OG1 : rot 180:sc=-0.00546 USER MOD Single : A 619 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 SER OG : rot 180:sc= 0 USER MOD Single : A 626 THR OG1 : rot 180:sc= -0.0341 USER MOD Single : A 627 TYR OH : rot 180:sc= 0.451 USER MOD Single : A 628 CYS SG : rot -160:sc= -0.351 USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 632 SER OG : rot 156:sc= 1.26 USER MOD Single : A 639 ASN : amide:sc= 0.00518 K(o=0.0052,f=-0.61) 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) USER MOD Single : A 668 SER OG : rot 180:sc= -0.0371 USER MOD Single : A 672 HIS : no HD1:sc= 0 X(o=0,f=-0.0085) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 534 4.676 14.128 4.971 1.00 3.47 N ATOM 2 CA ASN A 534 4.400 12.877 5.703 1.00 3.57 C ATOM 3 C ASN A 534 4.711 11.577 4.929 1.00 2.65 C ATOM 4 O ASN A 534 5.410 10.706 5.451 1.00 2.93 O ATOM 5 CB ASN A 534 2.930 12.938 6.178 1.00 5.27 C ATOM 6 CG ASN A 534 2.539 11.918 7.245 1.00 6.62 C ATOM 7 OD1 ASN A 534 3.284 11.027 7.626 1.00 6.75 O ATOM 8 ND2 ASN A 534 1.346 12.037 7.780 1.00 8.12 N ATOM 0 HA ASN A 534 5.088 12.821 6.547 1.00 3.57 H new ATOM 0 HB2 ASN A 534 2.734 13.937 6.567 1.00 5.27 H new ATOM 0 HB3 ASN A 534 2.281 12.799 5.313 1.00 5.27 H new ATOM 0 HD21 ASN A 534 1.047 11.389 8.508 1.00 8.12 H new ATOM 0 HD22 ASN A 534 0.719 12.778 7.467 1.00 8.12 H new ATOM 15 N CYS A 535 4.290 11.461 3.663 1.00 2.24 N ATOM 16 CA CYS A 535 4.559 10.295 2.814 1.00 2.08 C ATOM 17 C CYS A 535 6.035 9.834 2.799 1.00 1.58 C ATOM 18 O CYS A 535 6.278 8.626 2.785 1.00 1.44 O ATOM 19 CB CYS A 535 4.023 10.551 1.400 1.00 3.02 C ATOM 20 SG CYS A 535 4.988 11.813 0.523 1.00 4.00 S ATOM 0 H CYS A 535 3.746 12.185 3.194 1.00 2.24 H new ATOM 0 HA CYS A 535 4.026 9.456 3.260 1.00 2.08 H new ATOM 0 HB2 CYS A 535 4.042 9.621 0.832 1.00 3.02 H new ATOM 0 HB3 CYS A 535 2.982 10.868 1.459 1.00 3.02 H new ATOM 0 HG CYS A 535 4.494 11.988 -0.667 1.00 4.00 H new ATOM 26 N ARG A 536 7.019 10.745 2.897 1.00 1.77 N ATOM 27 CA ARG A 536 8.461 10.416 2.876 1.00 1.90 C ATOM 28 C ARG A 536 8.936 9.621 4.098 1.00 1.93 C ATOM 29 O ARG A 536 9.830 8.786 3.958 1.00 2.28 O ATOM 30 CB ARG A 536 9.293 11.696 2.638 1.00 2.59 C ATOM 31 CG ARG A 536 9.457 12.598 3.877 1.00 3.28 C ATOM 32 CD ARG A 536 9.965 14.003 3.531 1.00 4.23 C ATOM 33 NE ARG A 536 11.354 14.000 3.040 1.00 3.85 N ATOM 34 CZ ARG A 536 12.111 15.062 2.845 1.00 4.79 C ATOM 35 NH1 ARG A 536 11.715 16.280 3.081 1.00 6.07 N ATOM 36 NH2 ARG A 536 13.320 14.919 2.392 1.00 5.08 N ATOM 0 H ARG A 536 6.836 11.744 2.994 1.00 1.77 H new ATOM 0 HA ARG A 536 8.622 9.737 2.038 1.00 1.90 H new ATOM 0 HB2 ARG A 536 10.282 11.409 2.281 1.00 2.59 H new ATOM 0 HB3 ARG A 536 8.823 12.276 1.843 1.00 2.59 H new ATOM 0 HG2 ARG A 536 8.499 12.680 4.390 1.00 3.28 H new ATOM 0 HG3 ARG A 536 10.151 12.127 4.573 1.00 3.28 H new ATOM 0 HD2 ARG A 536 9.317 14.443 2.773 1.00 4.23 H new ATOM 0 HD3 ARG A 536 9.898 14.637 4.415 1.00 4.23 H new ATOM 0 HE ARG A 536 11.769 13.092 2.831 1.00 3.85 H new ATOM 0 HH11 ARG A 536 10.774 16.451 3.436 1.00 6.07 H new ATOM 0 HH12 ARG A 536 12.346 17.063 2.911 1.00 6.07 H new ATOM 0 HH21 ARG A 536 13.681 13.987 2.188 1.00 5.08 H new ATOM 0 HH22 ARG A 536 13.908 15.739 2.240 1.00 5.08 H new ATOM 50 N LYS A 537 8.345 9.854 5.278 1.00 1.82 N ATOM 51 CA LYS A 537 8.499 8.995 6.470 1.00 1.80 C ATOM 52 C LYS A 537 7.512 7.822 6.522 1.00 1.60 C ATOM 53 O LYS A 537 7.846 6.745 7.015 1.00 1.69 O ATOM 54 CB LYS A 537 8.603 9.784 7.793 1.00 1.81 C ATOM 55 CG LYS A 537 7.519 10.810 8.158 1.00 3.16 C ATOM 56 CD LYS A 537 7.641 12.172 7.454 1.00 4.95 C ATOM 57 CE LYS A 537 8.956 12.944 7.637 1.00 6.44 C ATOM 58 NZ LYS A 537 9.201 13.367 9.037 1.00 6.79 N ATOM 0 H LYS A 537 7.736 10.656 5.438 1.00 1.82 H new ATOM 0 HA LYS A 537 9.475 8.525 6.350 1.00 1.80 H new ATOM 0 HB2 LYS A 537 8.647 9.056 8.603 1.00 1.81 H new ATOM 0 HB3 LYS A 537 9.558 10.309 7.784 1.00 1.81 H new ATOM 0 HG2 LYS A 537 6.544 10.384 7.922 1.00 3.16 H new ATOM 0 HG3 LYS A 537 7.544 10.973 9.236 1.00 3.16 H new ATOM 0 HD2 LYS A 537 7.488 12.015 6.386 1.00 4.95 H new ATOM 0 HD3 LYS A 537 6.826 12.806 7.803 1.00 4.95 H new ATOM 0 HE2 LYS A 537 9.785 12.319 7.304 1.00 6.44 H new ATOM 0 HE3 LYS A 537 8.943 13.825 6.996 1.00 6.44 H new ATOM 0 HZ1 LYS A 537 10.103 13.882 9.091 1.00 6.79 H new ATOM 0 HZ2 LYS A 537 8.428 13.988 9.352 1.00 6.79 H new ATOM 0 HZ3 LYS A 537 9.244 12.528 9.651 1.00 6.79 H new ATOM 72 N LEU A 538 6.309 7.996 5.975 1.00 1.44 N ATOM 73 CA LEU A 538 5.208 7.030 6.080 1.00 1.33 C ATOM 74 C LEU A 538 5.434 5.798 5.187 1.00 1.23 C ATOM 75 O LEU A 538 5.216 4.670 5.632 1.00 1.30 O ATOM 76 CB LEU A 538 3.894 7.758 5.739 1.00 1.34 C ATOM 77 CG LEU A 538 2.606 7.001 6.102 1.00 1.17 C ATOM 78 CD1 LEU A 538 2.365 6.971 7.611 1.00 1.91 C ATOM 79 CD2 LEU A 538 1.409 7.688 5.444 1.00 2.51 C ATOM 0 H LEU A 538 6.065 8.827 5.436 1.00 1.44 H new ATOM 0 HA LEU A 538 5.157 6.646 7.099 1.00 1.33 H new ATOM 0 HB2 LEU A 538 3.887 8.719 6.253 1.00 1.34 H new ATOM 0 HB3 LEU A 538 3.882 7.968 4.670 1.00 1.34 H new ATOM 0 HG LEU A 538 2.720 5.977 5.746 1.00 1.17 H new ATOM 0 HD11 LEU A 538 1.445 6.426 7.822 1.00 1.91 H new ATOM 0 HD12 LEU A 538 3.201 6.475 8.103 1.00 1.91 H new ATOM 0 HD13 LEU A 538 2.277 7.991 7.986 1.00 1.91 H new ATOM 0 HD21 LEU A 538 0.495 7.152 5.701 1.00 2.51 H new ATOM 0 HD22 LEU A 538 1.339 8.716 5.800 1.00 2.51 H new ATOM 0 HD23 LEU A 538 1.538 7.687 4.362 1.00 2.51 H new ATOM 91 N VAL A 539 5.932 6.002 3.960 1.00 1.14 N ATOM 92 CA VAL A 539 6.329 4.924 3.034 1.00 1.11 C ATOM 93 C VAL A 539 7.564 4.183 3.562 1.00 1.24 C ATOM 94 O VAL A 539 7.584 2.957 3.623 1.00 1.29 O ATOM 95 CB VAL A 539 6.466 5.465 1.593 1.00 1.03 C ATOM 96 CG1 VAL A 539 7.873 5.956 1.232 1.00 1.22 C ATOM 97 CG2 VAL A 539 6.004 4.401 0.598 1.00 0.95 C ATOM 0 H VAL A 539 6.074 6.935 3.573 1.00 1.14 H new ATOM 0 HA VAL A 539 5.542 4.171 2.985 1.00 1.11 H new ATOM 0 HB VAL A 539 5.827 6.346 1.537 1.00 1.03 H new ATOM 0 HG11 VAL A 539 7.879 6.318 0.204 1.00 1.22 H new ATOM 0 HG12 VAL A 539 8.159 6.765 1.904 1.00 1.22 H new ATOM 0 HG13 VAL A 539 8.582 5.134 1.331 1.00 1.22 H new ATOM 0 HG21 VAL A 539 6.102 4.785 -0.417 1.00 0.95 H new ATOM 0 HG22 VAL A 539 6.619 3.508 0.709 1.00 0.95 H new ATOM 0 HG23 VAL A 539 4.961 4.150 0.792 1.00 0.95 H new ATOM 107 N ALA A 540 8.545 4.922 4.089 1.00 1.38 N ATOM 108 CA ALA A 540 9.780 4.384 4.659 1.00 1.60 C ATOM 109 C ALA A 540 9.571 3.532 5.930 1.00 1.70 C ATOM 110 O ALA A 540 10.481 2.806 6.337 1.00 1.82 O ATOM 111 CB ALA A 540 10.703 5.575 4.943 1.00 1.77 C ATOM 0 H ALA A 540 8.499 5.940 4.131 1.00 1.38 H new ATOM 0 HA ALA A 540 10.220 3.694 3.939 1.00 1.60 H new ATOM 0 HB1 ALA A 540 11.639 5.216 5.371 1.00 1.77 H new ATOM 0 HB2 ALA A 540 10.909 6.106 4.013 1.00 1.77 H new ATOM 0 HB3 ALA A 540 10.218 6.251 5.647 1.00 1.77 H new ATOM 117 N SER A 541 8.388 3.584 6.552 1.00 1.72 N ATOM 118 CA SER A 541 8.067 2.955 7.832 1.00 1.94 C ATOM 119 C SER A 541 7.429 1.570 7.677 1.00 1.90 C ATOM 120 O SER A 541 7.223 0.854 8.654 1.00 2.04 O ATOM 121 CB SER A 541 7.162 3.898 8.601 1.00 2.24 C ATOM 122 OG SER A 541 7.891 5.020 9.067 1.00 3.38 O ATOM 0 H SER A 541 7.595 4.089 6.157 1.00 1.72 H new ATOM 0 HA SER A 541 8.993 2.782 8.380 1.00 1.94 H new ATOM 0 HB2 SER A 541 6.345 4.229 7.961 1.00 2.24 H new ATOM 0 HB3 SER A 541 6.713 3.373 9.444 1.00 2.24 H new ATOM 0 HG SER A 541 8.115 5.601 8.311 1.00 3.38 H new ATOM 128 N MET A 542 7.135 1.170 6.440 1.00 1.74 N ATOM 129 CA MET A 542 6.632 -0.152 6.089 1.00 1.72 C ATOM 130 C MET A 542 7.716 -1.239 6.273 1.00 1.61 C ATOM 131 O MET A 542 8.901 -0.965 6.056 1.00 1.52 O ATOM 132 CB MET A 542 6.152 -0.085 4.632 1.00 1.62 C ATOM 133 CG MET A 542 4.765 0.553 4.498 1.00 2.30 C ATOM 134 SD MET A 542 4.258 0.998 2.812 1.00 3.44 S ATOM 135 CE MET A 542 4.447 -0.590 1.959 1.00 2.71 C ATOM 0 H MET A 542 7.245 1.780 5.630 1.00 1.74 H new ATOM 0 HA MET A 542 5.810 -0.430 6.749 1.00 1.72 H new ATOM 0 HB2 MET A 542 6.869 0.486 4.043 1.00 1.62 H new ATOM 0 HB3 MET A 542 6.127 -1.092 4.215 1.00 1.62 H new ATOM 0 HG2 MET A 542 4.028 -0.137 4.909 1.00 2.30 H new ATOM 0 HG3 MET A 542 4.738 1.452 5.114 1.00 2.30 H new ATOM 0 HE1 MET A 542 3.660 -0.698 1.213 1.00 2.71 H new ATOM 0 HE2 MET A 542 5.419 -0.626 1.468 1.00 2.71 H new ATOM 0 HE3 MET A 542 4.376 -1.402 2.682 1.00 2.71 H new ATOM 145 N PRO A 543 7.343 -2.499 6.572 1.00 1.66 N ATOM 146 CA PRO A 543 8.287 -3.622 6.699 1.00 1.62 C ATOM 147 C PRO A 543 8.827 -4.102 5.338 1.00 1.47 C ATOM 148 O PRO A 543 9.886 -4.727 5.246 1.00 1.43 O ATOM 149 CB PRO A 543 7.499 -4.707 7.441 1.00 1.92 C ATOM 150 CG PRO A 543 6.050 -4.456 7.017 1.00 1.95 C ATOM 151 CD PRO A 543 5.982 -2.938 6.843 1.00 1.85 C ATOM 0 HA PRO A 543 9.187 -3.335 7.242 1.00 1.62 H new ATOM 0 HB2 PRO A 543 7.831 -5.706 7.160 1.00 1.92 H new ATOM 0 HB3 PRO A 543 7.621 -4.623 8.521 1.00 1.92 H new ATOM 0 HG2 PRO A 543 5.808 -4.977 6.091 1.00 1.95 H new ATOM 0 HG3 PRO A 543 5.345 -4.805 7.772 1.00 1.95 H new ATOM 0 HD2 PRO A 543 5.316 -2.670 6.023 1.00 1.85 H new ATOM 0 HD3 PRO A 543 5.590 -2.460 7.741 1.00 1.85 H new ATOM 159 N LEU A 544 8.135 -3.722 4.264 1.00 1.51 N ATOM 160 CA LEU A 544 8.561 -3.796 2.863 1.00 1.54 C ATOM 161 C LEU A 544 9.705 -2.799 2.548 1.00 1.38 C ATOM 162 O LEU A 544 10.484 -3.001 1.620 1.00 1.43 O ATOM 163 CB LEU A 544 7.261 -3.561 2.067 1.00 1.82 C ATOM 164 CG LEU A 544 7.298 -3.850 0.558 1.00 1.62 C ATOM 165 CD1 LEU A 544 5.882 -4.203 0.105 1.00 1.78 C ATOM 166 CD2 LEU A 544 7.713 -2.640 -0.276 1.00 2.87 C ATOM 0 H LEU A 544 7.199 -3.328 4.354 1.00 1.51 H new ATOM 0 HA LEU A 544 9.008 -4.753 2.596 1.00 1.54 H new ATOM 0 HB2 LEU A 544 6.478 -4.177 2.510 1.00 1.82 H new ATOM 0 HB3 LEU A 544 6.964 -2.521 2.204 1.00 1.82 H new ATOM 0 HG LEU A 544 8.023 -4.650 0.409 1.00 1.62 H new ATOM 0 HD11 LEU A 544 5.884 -4.412 -0.965 1.00 1.78 H new ATOM 0 HD12 LEU A 544 5.536 -5.083 0.647 1.00 1.78 H new ATOM 0 HD13 LEU A 544 5.215 -3.365 0.310 1.00 1.78 H new ATOM 0 HD21 LEU A 544 7.719 -2.911 -1.332 1.00 2.87 H new ATOM 0 HD22 LEU A 544 7.006 -1.827 -0.114 1.00 2.87 H new ATOM 0 HD23 LEU A 544 8.711 -2.318 0.022 1.00 2.87 H new ATOM 178 N PHE A 545 9.859 -1.761 3.378 1.00 1.27 N ATOM 179 CA PHE A 545 10.880 -0.705 3.312 1.00 1.15 C ATOM 180 C PHE A 545 11.885 -0.762 4.486 1.00 1.15 C ATOM 181 O PHE A 545 12.647 0.181 4.698 1.00 1.12 O ATOM 182 CB PHE A 545 10.183 0.665 3.247 1.00 1.18 C ATOM 183 CG PHE A 545 9.545 1.040 1.922 1.00 1.18 C ATOM 184 CD1 PHE A 545 8.342 0.446 1.502 1.00 1.61 C ATOM 185 CD2 PHE A 545 10.108 2.077 1.156 1.00 2.50 C ATOM 186 CE1 PHE A 545 7.670 0.941 0.372 1.00 1.51 C ATOM 187 CE2 PHE A 545 9.457 2.550 0.004 1.00 2.69 C ATOM 188 CZ PHE A 545 8.225 1.994 -0.374 1.00 1.43 C ATOM 0 H PHE A 545 9.230 -1.626 4.170 1.00 1.27 H new ATOM 0 HA PHE A 545 11.470 -0.865 2.409 1.00 1.15 H new ATOM 0 HB2 PHE A 545 9.411 0.692 4.016 1.00 1.18 H new ATOM 0 HB3 PHE A 545 10.914 1.432 3.502 1.00 1.18 H new ATOM 0 HD1 PHE A 545 7.934 -0.392 2.048 1.00 1.61 H new ATOM 0 HD2 PHE A 545 11.049 2.514 1.456 1.00 2.50 H new ATOM 0 HE1 PHE A 545 6.725 0.511 0.076 1.00 1.51 H new ATOM 0 HE2 PHE A 545 9.902 3.337 -0.587 1.00 2.69 H new ATOM 0 HZ PHE A 545 7.703 2.376 -1.239 1.00 1.43 H new ATOM 198 N ALA A 546 11.920 -1.864 5.243 1.00 1.23 N ATOM 199 CA ALA A 546 12.773 -2.084 6.421 1.00 1.35 C ATOM 200 C ALA A 546 14.258 -1.771 6.192 1.00 1.32 C ATOM 201 O ALA A 546 14.983 -1.359 7.102 1.00 1.42 O ATOM 202 CB ALA A 546 12.687 -3.578 6.715 1.00 1.52 C ATOM 0 H ALA A 546 11.325 -2.668 5.043 1.00 1.23 H new ATOM 0 HA ALA A 546 12.425 -1.426 7.217 1.00 1.35 H new ATOM 0 HB1 ALA A 546 13.301 -3.814 7.584 1.00 1.52 H new ATOM 0 HB2 ALA A 546 11.651 -3.850 6.918 1.00 1.52 H new ATOM 0 HB3 ALA A 546 13.047 -4.140 5.853 1.00 1.52 H new ATOM 208 N ASN A 547 14.700 -2.017 4.964 1.00 1.28 N ATOM 209 CA ASN A 547 16.081 -1.976 4.513 1.00 1.33 C ATOM 210 C ASN A 547 16.302 -0.903 3.428 1.00 1.26 C ATOM 211 O ASN A 547 17.397 -0.807 2.870 1.00 1.39 O ATOM 212 CB ASN A 547 16.404 -3.415 4.056 1.00 1.61 C ATOM 213 CG ASN A 547 17.483 -4.051 4.881 1.00 2.09 C ATOM 214 OD1 ASN A 547 18.600 -4.284 4.437 1.00 2.69 O ATOM 215 ND2 ASN A 547 17.176 -4.365 6.108 1.00 2.55 N ATOM 0 H ASN A 547 14.060 -2.266 4.210 1.00 1.28 H new ATOM 0 HA ASN A 547 16.767 -1.673 5.304 1.00 1.33 H new ATOM 0 HB2 ASN A 547 15.501 -4.023 4.114 1.00 1.61 H new ATOM 0 HB3 ASN A 547 16.712 -3.400 3.010 1.00 1.61 H new ATOM 0 HD21 ASN A 547 17.870 -4.810 6.709 1.00 2.55 H new ATOM 0 HD22 ASN A 547 16.242 -4.166 6.467 1.00 2.55 H new ATOM 222 N ALA A 548 15.264 -0.116 3.111 1.00 1.17 N ATOM 223 CA ALA A 548 15.258 0.798 1.963 1.00 1.14 C ATOM 224 C ALA A 548 16.311 1.923 2.049 1.00 1.12 C ATOM 225 O ALA A 548 16.398 2.637 3.053 1.00 1.32 O ATOM 226 CB ALA A 548 13.858 1.389 1.743 1.00 1.14 C ATOM 0 H ALA A 548 14.398 -0.097 3.650 1.00 1.17 H new ATOM 0 HA ALA A 548 15.537 0.190 1.103 1.00 1.14 H new ATOM 0 HB1 ALA A 548 13.878 2.063 0.887 1.00 1.14 H new ATOM 0 HB2 ALA A 548 13.149 0.583 1.554 1.00 1.14 H new ATOM 0 HB3 ALA A 548 13.552 1.940 2.632 1.00 1.14 H new ATOM 232 N ASP A 549 17.056 2.126 0.959 1.00 0.93 N ATOM 233 CA ASP A 549 17.980 3.253 0.783 1.00 0.88 C ATOM 234 C ASP A 549 17.188 4.577 0.662 1.00 0.87 C ATOM 235 O ASP A 549 16.280 4.659 -0.173 1.00 0.85 O ATOM 236 CB ASP A 549 18.851 2.988 -0.460 1.00 0.84 C ATOM 237 CG ASP A 549 19.896 4.077 -0.722 1.00 0.97 C ATOM 238 OD1 ASP A 549 19.515 5.238 -0.979 1.00 1.85 O ATOM 239 OD2 ASP A 549 21.115 3.770 -0.676 1.00 1.82 O ATOM 0 H ASP A 549 17.034 1.498 0.156 1.00 0.93 H new ATOM 0 HA ASP A 549 18.633 3.348 1.650 1.00 0.88 H new ATOM 0 HB2 ASP A 549 19.359 2.031 -0.340 1.00 0.84 H new ATOM 0 HB3 ASP A 549 18.205 2.899 -1.333 1.00 0.84 H new ATOM 244 N PRO A 550 17.517 5.634 1.433 1.00 0.97 N ATOM 245 CA PRO A 550 16.733 6.876 1.491 1.00 1.09 C ATOM 246 C PRO A 550 16.615 7.616 0.144 1.00 1.06 C ATOM 247 O PRO A 550 15.749 8.476 -0.025 1.00 1.22 O ATOM 248 CB PRO A 550 17.440 7.745 2.537 1.00 1.25 C ATOM 249 CG PRO A 550 18.884 7.251 2.484 1.00 1.13 C ATOM 250 CD PRO A 550 18.696 5.752 2.278 1.00 1.05 C ATOM 0 HA PRO A 550 15.699 6.648 1.751 1.00 1.09 H new ATOM 0 HB2 PRO A 550 17.368 8.805 2.294 1.00 1.25 H new ATOM 0 HB3 PRO A 550 17.006 7.615 3.528 1.00 1.25 H new ATOM 0 HG2 PRO A 550 19.443 7.709 1.667 1.00 1.13 H new ATOM 0 HG3 PRO A 550 19.425 7.472 3.404 1.00 1.13 H new ATOM 0 HD2 PRO A 550 19.569 5.306 1.802 1.00 1.05 H new ATOM 0 HD3 PRO A 550 18.554 5.238 3.228 1.00 1.05 H new ATOM 258 N ASN A 551 17.448 7.277 -0.839 1.00 0.95 N ATOM 259 CA ASN A 551 17.474 7.903 -2.162 1.00 1.03 C ATOM 260 C ASN A 551 16.560 7.149 -3.138 1.00 0.99 C ATOM 261 O ASN A 551 15.845 7.777 -3.922 1.00 1.17 O ATOM 262 CB ASN A 551 18.923 7.984 -2.670 1.00 1.08 C ATOM 263 CG ASN A 551 19.861 8.669 -1.690 1.00 1.20 C ATOM 264 OD1 ASN A 551 19.985 9.889 -1.669 1.00 1.62 O ATOM 265 ND2 ASN A 551 20.513 7.905 -0.850 1.00 1.87 N ATOM 0 H ASN A 551 18.144 6.538 -0.735 1.00 0.95 H new ATOM 0 HA ASN A 551 17.088 8.920 -2.089 1.00 1.03 H new ATOM 0 HB2 ASN A 551 19.288 6.977 -2.870 1.00 1.08 H new ATOM 0 HB3 ASN A 551 18.940 8.523 -3.617 1.00 1.08 H new ATOM 0 HD21 ASN A 551 21.139 8.322 -0.161 1.00 1.87 H new ATOM 0 HD22 ASN A 551 20.395 6.892 -0.885 1.00 1.87 H new ATOM 272 N PHE A 552 16.521 5.817 -3.019 1.00 0.81 N ATOM 273 CA PHE A 552 15.581 4.938 -3.724 1.00 0.75 C ATOM 274 C PHE A 552 14.135 5.280 -3.342 1.00 0.82 C ATOM 275 O PHE A 552 13.303 5.524 -4.216 1.00 0.89 O ATOM 276 CB PHE A 552 15.928 3.470 -3.406 1.00 0.66 C ATOM 277 CG PHE A 552 14.790 2.478 -3.581 1.00 0.62 C ATOM 278 CD1 PHE A 552 14.396 2.062 -4.865 1.00 1.86 C ATOM 279 CD2 PHE A 552 14.101 1.996 -2.453 1.00 1.75 C ATOM 280 CE1 PHE A 552 13.304 1.191 -5.023 1.00 1.84 C ATOM 281 CE2 PHE A 552 13.010 1.122 -2.607 1.00 1.85 C ATOM 282 CZ PHE A 552 12.607 0.725 -3.895 1.00 0.80 C ATOM 0 H PHE A 552 17.161 5.306 -2.412 1.00 0.81 H new ATOM 0 HA PHE A 552 15.669 5.088 -4.800 1.00 0.75 H new ATOM 0 HB2 PHE A 552 16.756 3.164 -4.045 1.00 0.66 H new ATOM 0 HB3 PHE A 552 16.282 3.413 -2.377 1.00 0.66 H new ATOM 0 HD1 PHE A 552 14.934 2.413 -5.733 1.00 1.86 H new ATOM 0 HD2 PHE A 552 14.411 2.299 -1.464 1.00 1.75 H new ATOM 0 HE1 PHE A 552 13.000 0.880 -6.012 1.00 1.84 H new ATOM 0 HE2 PHE A 552 12.483 0.756 -1.738 1.00 1.85 H new ATOM 0 HZ PHE A 552 11.763 0.063 -4.017 1.00 0.80 H new ATOM 292 N VAL A 553 13.848 5.392 -2.038 1.00 0.87 N ATOM 293 CA VAL A 553 12.480 5.689 -1.562 1.00 1.04 C ATOM 294 C VAL A 553 12.013 7.072 -2.013 1.00 1.21 C ATOM 295 O VAL A 553 10.859 7.257 -2.377 1.00 1.42 O ATOM 296 CB VAL A 553 12.313 5.543 -0.040 1.00 1.15 C ATOM 297 CG1 VAL A 553 12.901 4.218 0.400 1.00 1.37 C ATOM 298 CG2 VAL A 553 13.005 6.582 0.833 1.00 1.73 C ATOM 0 H VAL A 553 14.537 5.283 -1.294 1.00 0.87 H new ATOM 0 HA VAL A 553 11.846 4.933 -2.024 1.00 1.04 H new ATOM 0 HB VAL A 553 11.238 5.653 0.102 1.00 1.15 H new ATOM 0 HG11 VAL A 553 12.786 4.109 1.478 1.00 1.37 H new ATOM 0 HG12 VAL A 553 12.381 3.404 -0.105 1.00 1.37 H new ATOM 0 HG13 VAL A 553 13.960 4.187 0.144 1.00 1.37 H new ATOM 0 HG21 VAL A 553 12.808 6.365 1.883 1.00 1.73 H new ATOM 0 HG22 VAL A 553 14.079 6.552 0.652 1.00 1.73 H new ATOM 0 HG23 VAL A 553 12.623 7.574 0.590 1.00 1.73 H new ATOM 308 N THR A 554 12.941 8.029 -2.052 1.00 1.19 N ATOM 309 CA THR A 554 12.707 9.423 -2.447 1.00 1.36 C ATOM 310 C THR A 554 12.477 9.555 -3.951 1.00 1.33 C ATOM 311 O THR A 554 11.591 10.307 -4.369 1.00 1.46 O ATOM 312 CB THR A 554 13.879 10.319 -2.018 1.00 1.49 C ATOM 313 OG1 THR A 554 13.968 10.363 -0.611 1.00 1.57 O ATOM 314 CG2 THR A 554 13.678 11.753 -2.492 1.00 1.74 C ATOM 0 H THR A 554 13.913 7.850 -1.800 1.00 1.19 H new ATOM 0 HA THR A 554 11.802 9.751 -1.935 1.00 1.36 H new ATOM 0 HB THR A 554 14.781 9.897 -2.460 1.00 1.49 H new ATOM 0 HG1 THR A 554 14.798 9.929 -0.322 1.00 1.57 H new ATOM 0 HG21 THR A 554 14.523 12.363 -2.174 1.00 1.74 H new ATOM 0 HG22 THR A 554 13.607 11.770 -3.580 1.00 1.74 H new ATOM 0 HG23 THR A 554 12.759 12.153 -2.062 1.00 1.74 H new ATOM 322 N ALA A 555 13.217 8.804 -4.776 1.00 1.17 N ATOM 323 CA ALA A 555 13.053 8.829 -6.230 1.00 1.16 C ATOM 324 C ALA A 555 11.653 8.349 -6.663 1.00 1.06 C ATOM 325 O ALA A 555 11.194 8.664 -7.762 1.00 1.15 O ATOM 326 CB ALA A 555 14.164 7.975 -6.854 1.00 1.09 C ATOM 0 H ALA A 555 13.943 8.165 -4.453 1.00 1.17 H new ATOM 0 HA ALA A 555 13.136 9.856 -6.585 1.00 1.16 H new ATOM 0 HB1 ALA A 555 14.061 7.980 -7.939 1.00 1.09 H new ATOM 0 HB2 ALA A 555 15.136 8.386 -6.580 1.00 1.09 H new ATOM 0 HB3 ALA A 555 14.086 6.952 -6.487 1.00 1.09 H new ATOM 332 N MET A 556 10.954 7.629 -5.779 1.00 0.95 N ATOM 333 CA MET A 556 9.603 7.115 -6.017 1.00 0.95 C ATOM 334 C MET A 556 8.491 8.173 -5.865 1.00 1.06 C ATOM 335 O MET A 556 7.426 8.038 -6.469 1.00 1.12 O ATOM 336 CB MET A 556 9.391 5.953 -5.042 1.00 0.98 C ATOM 337 CG MET A 556 8.300 4.978 -5.490 1.00 0.93 C ATOM 338 SD MET A 556 8.072 3.545 -4.397 1.00 0.97 S ATOM 339 CE MET A 556 9.778 3.076 -3.981 1.00 0.76 C ATOM 0 H MET A 556 11.320 7.383 -4.859 1.00 0.95 H new ATOM 0 HA MET A 556 9.530 6.793 -7.056 1.00 0.95 H new ATOM 0 HB2 MET A 556 10.329 5.410 -4.926 1.00 0.98 H new ATOM 0 HB3 MET A 556 9.131 6.353 -4.062 1.00 0.98 H new ATOM 0 HG2 MET A 556 7.356 5.518 -5.562 1.00 0.93 H new ATOM 0 HG3 MET A 556 8.539 4.620 -6.491 1.00 0.93 H new ATOM 0 HE1 MET A 556 9.781 2.090 -3.516 1.00 0.76 H new ATOM 0 HE2 MET A 556 10.380 3.050 -4.889 1.00 0.76 H new ATOM 0 HE3 MET A 556 10.197 3.806 -3.288 1.00 0.76 H new ATOM 349 N LEU A 557 8.719 9.232 -5.076 1.00 1.12 N ATOM 350 CA LEU A 557 7.663 10.144 -4.592 1.00 1.16 C ATOM 351 C LEU A 557 7.251 11.226 -5.611 1.00 1.13 C ATOM 352 O LEU A 557 6.245 11.913 -5.421 1.00 1.16 O ATOM 353 CB LEU A 557 8.091 10.777 -3.250 1.00 1.27 C ATOM 354 CG LEU A 557 8.742 9.815 -2.237 1.00 1.36 C ATOM 355 CD1 LEU A 557 9.116 10.552 -0.959 1.00 1.47 C ATOM 356 CD2 LEU A 557 7.871 8.624 -1.838 1.00 1.37 C ATOM 0 H LEU A 557 9.651 9.486 -4.750 1.00 1.12 H new ATOM 0 HA LEU A 557 6.770 9.536 -4.445 1.00 1.16 H new ATOM 0 HB2 LEU A 557 8.792 11.586 -3.458 1.00 1.27 H new ATOM 0 HB3 LEU A 557 7.214 11.227 -2.785 1.00 1.27 H new ATOM 0 HG LEU A 557 9.618 9.429 -2.758 1.00 1.36 H new ATOM 0 HD11 LEU A 557 9.574 9.855 -0.258 1.00 1.47 H new ATOM 0 HD12 LEU A 557 9.822 11.349 -1.192 1.00 1.47 H new ATOM 0 HD13 LEU A 557 8.220 10.981 -0.511 1.00 1.47 H new ATOM 0 HD21 LEU A 557 8.410 8.002 -1.123 1.00 1.37 H new ATOM 0 HD22 LEU A 557 6.949 8.984 -1.383 1.00 1.37 H new ATOM 0 HD23 LEU A 557 7.632 8.035 -2.724 1.00 1.37 H new ATOM 368 N THR A 558 7.998 11.358 -6.707 1.00 1.14 N ATOM 369 CA THR A 558 7.769 12.287 -7.841 1.00 1.32 C ATOM 370 C THR A 558 6.303 12.441 -8.281 1.00 0.99 C ATOM 371 O THR A 558 5.843 13.561 -8.510 1.00 1.05 O ATOM 372 CB THR A 558 8.563 11.821 -9.074 1.00 1.74 C ATOM 373 OG1 THR A 558 8.279 10.461 -9.353 1.00 2.19 O ATOM 374 CG2 THR A 558 10.072 11.948 -8.874 1.00 2.14 C ATOM 0 H THR A 558 8.833 10.789 -6.847 1.00 1.14 H new ATOM 0 HA THR A 558 8.099 13.255 -7.464 1.00 1.32 H new ATOM 0 HB THR A 558 8.258 12.465 -9.899 1.00 1.74 H new ATOM 0 HG1 THR A 558 8.788 10.175 -10.140 1.00 2.19 H new ATOM 0 HG21 THR A 558 10.588 11.607 -9.771 1.00 2.14 H new ATOM 0 HG22 THR A 558 10.327 12.990 -8.683 1.00 2.14 H new ATOM 0 HG23 THR A 558 10.379 11.338 -8.025 1.00 2.14 H new ATOM 382 N LYS A 559 5.555 11.331 -8.367 1.00 0.80 N ATOM 383 CA LYS A 559 4.144 11.277 -8.805 1.00 0.80 C ATOM 384 C LYS A 559 3.136 10.914 -7.703 1.00 0.87 C ATOM 385 O LYS A 559 1.981 10.630 -8.005 1.00 1.20 O ATOM 386 CB LYS A 559 4.017 10.338 -10.024 1.00 1.12 C ATOM 387 CG LYS A 559 4.285 8.851 -9.693 1.00 1.56 C ATOM 388 CD LYS A 559 3.192 7.896 -10.210 1.00 1.87 C ATOM 389 CE LYS A 559 1.849 8.079 -9.482 1.00 2.31 C ATOM 390 NZ LYS A 559 0.830 7.115 -9.953 1.00 3.21 N ATOM 0 H LYS A 559 5.925 10.412 -8.126 1.00 0.80 H new ATOM 0 HA LYS A 559 3.872 12.294 -9.087 1.00 0.80 H new ATOM 0 HB2 LYS A 559 3.015 10.433 -10.442 1.00 1.12 H new ATOM 0 HB3 LYS A 559 4.716 10.661 -10.795 1.00 1.12 H new ATOM 0 HG2 LYS A 559 5.243 8.559 -10.123 1.00 1.56 H new ATOM 0 HG3 LYS A 559 4.372 8.738 -8.612 1.00 1.56 H new ATOM 0 HD2 LYS A 559 3.047 8.061 -11.278 1.00 1.87 H new ATOM 0 HD3 LYS A 559 3.528 6.866 -10.089 1.00 1.87 H new ATOM 0 HE2 LYS A 559 1.998 7.955 -8.409 1.00 2.31 H new ATOM 0 HE3 LYS A 559 1.487 9.095 -9.638 1.00 2.31 H new ATOM 0 HZ1 LYS A 559 -0.020 7.191 -9.359 1.00 3.21 H new ATOM 0 HZ2 LYS A 559 0.582 7.327 -10.941 1.00 3.21 H new ATOM 0 HZ3 LYS A 559 1.211 6.149 -9.891 1.00 3.21 H new ATOM 404 N LEU A 560 3.561 10.822 -6.440 1.00 0.82 N ATOM 405 CA LEU A 560 2.745 10.224 -5.380 1.00 1.00 C ATOM 406 C LEU A 560 1.434 10.995 -5.156 1.00 1.14 C ATOM 407 O LEU A 560 1.424 12.229 -5.137 1.00 1.32 O ATOM 408 CB LEU A 560 3.553 10.120 -4.068 1.00 1.22 C ATOM 409 CG LEU A 560 3.877 8.701 -3.564 1.00 1.34 C ATOM 410 CD1 LEU A 560 4.343 8.810 -2.113 1.00 2.76 C ATOM 411 CD2 LEU A 560 2.695 7.732 -3.587 1.00 1.34 C ATOM 0 H LEU A 560 4.472 11.157 -6.125 1.00 0.82 H new ATOM 0 HA LEU A 560 2.474 9.219 -5.704 1.00 1.00 H new ATOM 0 HB2 LEU A 560 4.493 10.655 -4.204 1.00 1.22 H new ATOM 0 HB3 LEU A 560 3.000 10.641 -3.286 1.00 1.22 H new ATOM 0 HG LEU A 560 4.633 8.302 -4.240 1.00 1.34 H new ATOM 0 HD11 LEU A 560 4.579 7.817 -1.731 1.00 2.76 H new ATOM 0 HD12 LEU A 560 5.232 9.439 -2.063 1.00 2.76 H new ATOM 0 HD13 LEU A 560 3.551 9.252 -1.509 1.00 2.76 H new ATOM 0 HD21 LEU A 560 3.015 6.759 -3.216 1.00 1.34 H new ATOM 0 HD22 LEU A 560 1.896 8.117 -2.953 1.00 1.34 H new ATOM 0 HD23 LEU A 560 2.329 7.628 -4.609 1.00 1.34 H new ATOM 423 N LYS A 561 0.337 10.264 -4.932 1.00 1.16 N ATOM 424 CA LYS A 561 -1.023 10.818 -4.838 1.00 1.27 C ATOM 425 C LYS A 561 -1.773 10.344 -3.594 1.00 1.07 C ATOM 426 O LYS A 561 -1.718 9.165 -3.250 1.00 0.80 O ATOM 427 CB LYS A 561 -1.789 10.435 -6.112 1.00 1.49 C ATOM 428 CG LYS A 561 -2.923 11.407 -6.462 1.00 1.77 C ATOM 429 CD LYS A 561 -2.522 12.426 -7.545 1.00 2.32 C ATOM 430 CE LYS A 561 -1.296 13.271 -7.166 1.00 2.59 C ATOM 431 NZ LYS A 561 -0.982 14.249 -8.230 1.00 3.03 N ATOM 0 H LYS A 561 0.367 9.252 -4.808 1.00 1.16 H new ATOM 0 HA LYS A 561 -0.947 11.901 -4.746 1.00 1.27 H new ATOM 0 HB2 LYS A 561 -1.090 10.390 -6.947 1.00 1.49 H new ATOM 0 HB3 LYS A 561 -2.204 9.435 -5.990 1.00 1.49 H new ATOM 0 HG2 LYS A 561 -3.788 10.840 -6.805 1.00 1.77 H new ATOM 0 HG3 LYS A 561 -3.228 11.941 -5.562 1.00 1.77 H new ATOM 0 HD2 LYS A 561 -2.314 11.895 -8.474 1.00 2.32 H new ATOM 0 HD3 LYS A 561 -3.365 13.089 -7.739 1.00 2.32 H new ATOM 0 HE2 LYS A 561 -1.485 13.795 -6.229 1.00 2.59 H new ATOM 0 HE3 LYS A 561 -0.438 12.620 -6.999 1.00 2.59 H new ATOM 0 HZ1 LYS A 561 -0.151 14.809 -7.953 1.00 3.03 H new ATOM 0 HZ2 LYS A 561 -0.780 13.744 -9.117 1.00 3.03 H new ATOM 0 HZ3 LYS A 561 -1.795 14.883 -8.370 1.00 3.03 H new ATOM 445 N PHE A 562 -2.497 11.254 -2.952 1.00 1.35 N ATOM 446 CA PHE A 562 -3.318 10.972 -1.771 1.00 1.24 C ATOM 447 C PHE A 562 -4.821 11.053 -2.074 1.00 1.23 C ATOM 448 O PHE A 562 -5.246 11.738 -3.009 1.00 1.32 O ATOM 449 CB PHE A 562 -2.855 11.812 -0.565 1.00 1.46 C ATOM 450 CG PHE A 562 -3.631 13.081 -0.269 1.00 1.41 C ATOM 451 CD1 PHE A 562 -4.855 13.008 0.425 1.00 2.29 C ATOM 452 CD2 PHE A 562 -3.118 14.335 -0.647 1.00 2.55 C ATOM 453 CE1 PHE A 562 -5.588 14.179 0.689 1.00 2.30 C ATOM 454 CE2 PHE A 562 -3.841 15.508 -0.363 1.00 2.74 C ATOM 455 CZ PHE A 562 -5.078 15.429 0.297 1.00 1.75 C ATOM 0 H PHE A 562 -2.533 12.231 -3.241 1.00 1.35 H new ATOM 0 HA PHE A 562 -3.162 9.933 -1.481 1.00 1.24 H new ATOM 0 HB2 PHE A 562 -2.890 11.179 0.322 1.00 1.46 H new ATOM 0 HB3 PHE A 562 -1.811 12.083 -0.722 1.00 1.46 H new ATOM 0 HD1 PHE A 562 -5.231 12.051 0.755 1.00 2.29 H new ATOM 0 HD2 PHE A 562 -2.168 14.397 -1.156 1.00 2.55 H new ATOM 0 HE1 PHE A 562 -6.542 14.118 1.192 1.00 2.30 H new ATOM 0 HE2 PHE A 562 -3.444 16.470 -0.653 1.00 2.74 H new ATOM 0 HZ PHE A 562 -5.638 16.329 0.504 1.00 1.75 H new ATOM 465 N GLU A 563 -5.621 10.323 -1.300 1.00 1.14 N ATOM 466 CA GLU A 563 -7.069 10.165 -1.478 1.00 1.10 C ATOM 467 C GLU A 563 -7.808 10.130 -0.130 1.00 1.05 C ATOM 468 O GLU A 563 -7.213 9.944 0.930 1.00 1.19 O ATOM 469 CB GLU A 563 -7.353 8.879 -2.282 1.00 1.13 C ATOM 470 CG GLU A 563 -6.878 9.010 -3.734 1.00 2.16 C ATOM 471 CD GLU A 563 -7.283 7.808 -4.582 1.00 2.24 C ATOM 472 OE1 GLU A 563 -8.388 7.831 -5.176 1.00 2.31 O ATOM 473 OE2 GLU A 563 -6.501 6.834 -4.692 1.00 3.34 O ATOM 0 H GLU A 563 -5.267 9.802 -0.498 1.00 1.14 H new ATOM 0 HA GLU A 563 -7.441 11.029 -2.029 1.00 1.10 H new ATOM 0 HB2 GLU A 563 -6.852 8.034 -1.809 1.00 1.13 H new ATOM 0 HB3 GLU A 563 -8.422 8.666 -2.265 1.00 1.13 H new ATOM 0 HG2 GLU A 563 -7.295 9.918 -4.171 1.00 2.16 H new ATOM 0 HG3 GLU A 563 -5.793 9.116 -3.752 1.00 2.16 H new ATOM 480 N VAL A 564 -9.127 10.309 -0.158 1.00 0.91 N ATOM 481 CA VAL A 564 -10.009 10.255 1.014 1.00 0.83 C ATOM 482 C VAL A 564 -11.218 9.369 0.757 1.00 0.78 C ATOM 483 O VAL A 564 -11.825 9.412 -0.317 1.00 0.81 O ATOM 484 CB VAL A 564 -10.483 11.657 1.434 1.00 0.89 C ATOM 485 CG1 VAL A 564 -11.227 11.667 2.769 1.00 0.95 C ATOM 486 CG2 VAL A 564 -9.286 12.602 1.549 1.00 0.94 C ATOM 0 H VAL A 564 -9.631 10.502 -1.023 1.00 0.91 H new ATOM 0 HA VAL A 564 -9.421 9.827 1.826 1.00 0.83 H new ATOM 0 HB VAL A 564 -11.176 11.986 0.659 1.00 0.89 H new ATOM 0 HG11 VAL A 564 -11.534 12.685 3.007 1.00 0.95 H new ATOM 0 HG12 VAL A 564 -12.108 11.029 2.699 1.00 0.95 H new ATOM 0 HG13 VAL A 564 -10.570 11.293 3.554 1.00 0.95 H new ATOM 0 HG21 VAL A 564 -9.631 13.592 1.847 1.00 0.94 H new ATOM 0 HG22 VAL A 564 -8.591 12.220 2.297 1.00 0.94 H new ATOM 0 HG23 VAL A 564 -8.781 12.669 0.585 1.00 0.94 H new ATOM 496 N PHE A 565 -11.619 8.638 1.791 1.00 0.75 N ATOM 497 CA PHE A 565 -12.908 7.948 1.866 1.00 0.77 C ATOM 498 C PHE A 565 -13.728 8.461 3.056 1.00 0.74 C ATOM 499 O PHE A 565 -13.176 8.745 4.119 1.00 0.76 O ATOM 500 CB PHE A 565 -12.682 6.436 1.906 1.00 0.79 C ATOM 501 CG PHE A 565 -12.152 5.868 0.600 1.00 0.74 C ATOM 502 CD1 PHE A 565 -10.772 5.902 0.315 1.00 2.15 C ATOM 503 CD2 PHE A 565 -13.037 5.267 -0.317 1.00 1.81 C ATOM 504 CE1 PHE A 565 -10.279 5.314 -0.864 1.00 2.12 C ATOM 505 CE2 PHE A 565 -12.543 4.679 -1.495 1.00 1.85 C ATOM 506 CZ PHE A 565 -11.162 4.683 -1.757 1.00 0.74 C ATOM 0 H PHE A 565 -11.044 8.503 2.623 1.00 0.75 H new ATOM 0 HA PHE A 565 -13.495 8.165 0.973 1.00 0.77 H new ATOM 0 HB2 PHE A 565 -11.980 6.203 2.706 1.00 0.79 H new ATOM 0 HB3 PHE A 565 -13.622 5.942 2.153 1.00 0.79 H new ATOM 0 HD1 PHE A 565 -10.091 6.381 1.004 1.00 2.15 H new ATOM 0 HD2 PHE A 565 -14.098 5.258 -0.115 1.00 1.81 H new ATOM 0 HE1 PHE A 565 -9.222 5.347 -1.083 1.00 2.12 H new ATOM 0 HE2 PHE A 565 -13.225 4.224 -2.198 1.00 1.85 H new ATOM 0 HZ PHE A 565 -10.779 4.201 -2.645 1.00 0.74 H new ATOM 516 N GLN A 566 -15.041 8.599 2.870 1.00 0.74 N ATOM 517 CA GLN A 566 -15.994 9.014 3.911 1.00 0.77 C ATOM 518 C GLN A 566 -16.438 7.808 4.777 1.00 0.80 C ATOM 519 O GLN A 566 -16.216 6.660 4.376 1.00 0.86 O ATOM 520 CB GLN A 566 -17.207 9.679 3.228 1.00 0.91 C ATOM 521 CG GLN A 566 -16.939 10.841 2.283 1.00 1.15 C ATOM 522 CD GLN A 566 -16.045 11.858 2.937 1.00 1.53 C ATOM 523 OE1 GLN A 566 -16.302 12.367 4.017 1.00 3.14 O ATOM 524 NE2 GLN A 566 -14.922 12.143 2.344 1.00 1.13 N ATOM 0 H GLN A 566 -15.487 8.422 1.970 1.00 0.74 H new ATOM 0 HA GLN A 566 -15.513 9.727 4.581 1.00 0.77 H new ATOM 0 HB2 GLN A 566 -17.741 8.910 2.670 1.00 0.91 H new ATOM 0 HB3 GLN A 566 -17.880 10.031 4.010 1.00 0.91 H new ATOM 0 HG2 GLN A 566 -16.473 10.473 1.369 1.00 1.15 H new ATOM 0 HG3 GLN A 566 -17.881 11.308 1.995 1.00 1.15 H new ATOM 0 HE21 GLN A 566 -14.700 11.722 1.442 1.00 1.13 H new ATOM 0 HE22 GLN A 566 -14.264 12.788 2.781 1.00 1.13 H new ATOM 533 N PRO A 567 -17.103 8.018 5.934 1.00 0.82 N ATOM 534 CA PRO A 567 -17.541 6.919 6.795 1.00 0.83 C ATOM 535 C PRO A 567 -18.448 5.914 6.065 1.00 0.88 C ATOM 536 O PRO A 567 -19.396 6.303 5.371 1.00 1.03 O ATOM 537 CB PRO A 567 -18.272 7.568 7.978 1.00 0.92 C ATOM 538 CG PRO A 567 -17.796 9.017 7.989 1.00 0.93 C ATOM 539 CD PRO A 567 -17.466 9.301 6.527 1.00 0.88 C ATOM 0 HA PRO A 567 -16.681 6.335 7.123 1.00 0.83 H new ATOM 0 HB2 PRO A 567 -19.353 7.509 7.854 1.00 0.92 H new ATOM 0 HB3 PRO A 567 -18.030 7.066 8.915 1.00 0.92 H new ATOM 0 HG2 PRO A 567 -18.568 9.689 8.363 1.00 0.93 H new ATOM 0 HG3 PRO A 567 -16.923 9.147 8.629 1.00 0.93 H new ATOM 0 HD2 PRO A 567 -18.322 9.739 6.013 1.00 0.88 H new ATOM 0 HD3 PRO A 567 -16.645 10.014 6.445 1.00 0.88 H new ATOM 547 N GLY A 568 -18.170 4.620 6.236 1.00 0.86 N ATOM 548 CA GLY A 568 -18.969 3.498 5.752 1.00 0.95 C ATOM 549 C GLY A 568 -18.563 3.011 4.361 1.00 0.98 C ATOM 550 O GLY A 568 -19.146 2.036 3.872 1.00 1.11 O ATOM 0 H GLY A 568 -17.339 4.313 6.742 1.00 0.86 H new ATOM 0 HA2 GLY A 568 -18.883 2.671 6.457 1.00 0.95 H new ATOM 0 HA3 GLY A 568 -20.018 3.792 5.733 1.00 0.95 H new ATOM 554 N ASP A 569 -17.589 3.661 3.718 1.00 0.94 N ATOM 555 CA ASP A 569 -17.254 3.481 2.312 1.00 0.96 C ATOM 556 C ASP A 569 -16.153 2.425 2.113 1.00 0.93 C ATOM 557 O ASP A 569 -15.100 2.478 2.753 1.00 0.91 O ATOM 558 CB ASP A 569 -16.889 4.849 1.704 1.00 1.04 C ATOM 559 CG ASP A 569 -17.089 4.969 0.187 1.00 1.12 C ATOM 560 OD1 ASP A 569 -17.598 4.029 -0.470 1.00 1.89 O ATOM 561 OD2 ASP A 569 -16.806 6.063 -0.359 1.00 2.38 O ATOM 0 H ASP A 569 -16.995 4.349 4.182 1.00 0.94 H new ATOM 0 HA ASP A 569 -18.122 3.090 1.782 1.00 0.96 H new ATOM 0 HB2 ASP A 569 -17.487 5.617 2.194 1.00 1.04 H new ATOM 0 HB3 ASP A 569 -15.845 5.063 1.934 1.00 1.04 H new ATOM 566 N TYR A 570 -16.395 1.453 1.236 1.00 0.98 N ATOM 567 CA TYR A 570 -15.439 0.386 0.916 1.00 1.00 C ATOM 568 C TYR A 570 -14.282 0.921 0.057 1.00 0.97 C ATOM 569 O TYR A 570 -14.498 1.522 -1.001 1.00 1.01 O ATOM 570 CB TYR A 570 -16.145 -0.807 0.255 1.00 1.12 C ATOM 571 CG TYR A 570 -17.018 -1.634 1.190 1.00 1.21 C ATOM 572 CD1 TYR A 570 -18.347 -1.246 1.451 1.00 1.80 C ATOM 573 CD2 TYR A 570 -16.512 -2.813 1.775 1.00 2.48 C ATOM 574 CE1 TYR A 570 -19.166 -2.030 2.286 1.00 1.91 C ATOM 575 CE2 TYR A 570 -17.332 -3.608 2.603 1.00 2.59 C ATOM 576 CZ TYR A 570 -18.667 -3.222 2.853 1.00 1.54 C ATOM 577 OH TYR A 570 -19.486 -3.990 3.621 1.00 1.75 O ATOM 0 H TYR A 570 -17.271 1.380 0.719 1.00 0.98 H new ATOM 0 HA TYR A 570 -15.006 0.025 1.849 1.00 1.00 H new ATOM 0 HB2 TYR A 570 -16.763 -0.437 -0.563 1.00 1.12 H new ATOM 0 HB3 TYR A 570 -15.390 -1.459 -0.185 1.00 1.12 H new ATOM 0 HD1 TYR A 570 -18.740 -0.343 1.008 1.00 1.80 H new ATOM 0 HD2 TYR A 570 -15.490 -3.109 1.588 1.00 2.48 H new ATOM 0 HE1 TYR A 570 -20.179 -1.718 2.493 1.00 1.91 H new ATOM 0 HE2 TYR A 570 -16.939 -4.511 3.045 1.00 2.59 H new ATOM 0 HH TYR A 570 -18.995 -4.777 3.937 1.00 1.75 H new ATOM 587 N ILE A 571 -13.042 0.699 0.507 1.00 0.98 N ATOM 588 CA ILE A 571 -11.839 1.313 -0.083 1.00 1.00 C ATOM 589 C ILE A 571 -11.204 0.478 -1.213 1.00 1.02 C ATOM 590 O ILE A 571 -10.453 1.003 -2.035 1.00 1.14 O ATOM 591 CB ILE A 571 -10.804 1.626 1.018 1.00 1.01 C ATOM 592 CG1 ILE A 571 -10.353 0.362 1.770 1.00 1.01 C ATOM 593 CG2 ILE A 571 -11.318 2.625 2.063 1.00 1.06 C ATOM 594 CD1 ILE A 571 -8.941 0.504 2.303 1.00 1.07 C ATOM 0 H ILE A 571 -12.840 0.085 1.296 1.00 0.98 H new ATOM 0 HA ILE A 571 -12.166 2.241 -0.551 1.00 1.00 H new ATOM 0 HB ILE A 571 -9.964 2.066 0.480 1.00 1.01 H new ATOM 0 HG12 ILE A 571 -11.036 0.166 2.596 1.00 1.01 H new ATOM 0 HG13 ILE A 571 -10.406 -0.498 1.102 1.00 1.01 H new ATOM 0 HG21 ILE A 571 -10.543 2.802 2.809 1.00 1.06 H new ATOM 0 HG22 ILE A 571 -11.572 3.565 1.573 1.00 1.06 H new ATOM 0 HG23 ILE A 571 -12.204 2.218 2.550 1.00 1.06 H new ATOM 0 HD11 ILE A 571 -8.657 -0.408 2.828 1.00 1.07 H new ATOM 0 HD12 ILE A 571 -8.254 0.674 1.474 1.00 1.07 H new ATOM 0 HD13 ILE A 571 -8.895 1.348 2.991 1.00 1.07 H new ATOM 606 N ILE A 572 -11.467 -0.833 -1.220 1.00 0.97 N ATOM 607 CA ILE A 572 -10.828 -1.854 -2.055 1.00 0.98 C ATOM 608 C ILE A 572 -11.885 -2.779 -2.677 1.00 1.12 C ATOM 609 O ILE A 572 -12.850 -3.169 -2.011 1.00 1.46 O ATOM 610 CB ILE A 572 -9.803 -2.635 -1.192 1.00 1.22 C ATOM 611 CG1 ILE A 572 -8.576 -1.734 -0.953 1.00 1.57 C ATOM 612 CG2 ILE A 572 -9.363 -3.965 -1.822 1.00 1.30 C ATOM 613 CD1 ILE A 572 -7.500 -2.298 -0.019 1.00 1.34 C ATOM 0 H ILE A 572 -12.175 -1.233 -0.605 1.00 0.97 H new ATOM 0 HA ILE A 572 -10.296 -1.385 -2.883 1.00 0.98 H new ATOM 0 HB ILE A 572 -10.291 -2.893 -0.252 1.00 1.22 H new ATOM 0 HG12 ILE A 572 -8.115 -1.518 -1.917 1.00 1.57 H new ATOM 0 HG13 ILE A 572 -8.922 -0.784 -0.545 1.00 1.57 H new ATOM 0 HG21 ILE A 572 -8.646 -4.459 -1.166 1.00 1.30 H new ATOM 0 HG22 ILE A 572 -10.232 -4.608 -1.959 1.00 1.30 H new ATOM 0 HG23 ILE A 572 -8.898 -3.773 -2.789 1.00 1.30 H new ATOM 0 HD11 ILE A 572 -6.686 -1.579 0.075 1.00 1.34 H new ATOM 0 HD12 ILE A 572 -7.933 -2.486 0.963 1.00 1.34 H new ATOM 0 HD13 ILE A 572 -7.114 -3.231 -0.430 1.00 1.34 H new ATOM 625 N ARG A 573 -11.662 -3.166 -3.940 1.00 1.20 N ATOM 626 CA ARG A 573 -12.387 -4.223 -4.662 1.00 1.55 C ATOM 627 C ARG A 573 -11.461 -4.821 -5.731 1.00 1.31 C ATOM 628 O ARG A 573 -11.032 -4.113 -6.643 1.00 1.65 O ATOM 629 CB ARG A 573 -13.664 -3.599 -5.264 1.00 2.24 C ATOM 630 CG ARG A 573 -14.676 -4.597 -5.845 1.00 3.35 C ATOM 631 CD ARG A 573 -15.373 -5.460 -4.785 1.00 4.16 C ATOM 632 NE ARG A 573 -16.476 -6.243 -5.374 1.00 5.39 N ATOM 633 CZ ARG A 573 -17.205 -7.165 -4.764 1.00 6.61 C ATOM 634 NH1 ARG A 573 -17.030 -7.531 -3.528 1.00 7.09 N ATOM 635 NH2 ARG A 573 -18.147 -7.805 -5.383 1.00 7.83 N ATOM 0 H ARG A 573 -10.939 -2.732 -4.513 1.00 1.20 H new ATOM 0 HA ARG A 573 -12.685 -5.037 -4.001 1.00 1.55 H new ATOM 0 HB2 ARG A 573 -14.161 -3.013 -4.491 1.00 2.24 H new ATOM 0 HB3 ARG A 573 -13.372 -2.904 -6.052 1.00 2.24 H new ATOM 0 HG2 ARG A 573 -15.431 -4.048 -6.407 1.00 3.35 H new ATOM 0 HG3 ARG A 573 -14.164 -5.250 -6.552 1.00 3.35 H new ATOM 0 HD2 ARG A 573 -14.649 -6.134 -4.328 1.00 4.16 H new ATOM 0 HD3 ARG A 573 -15.760 -4.822 -3.991 1.00 4.16 H new ATOM 0 HE ARG A 573 -16.700 -6.055 -6.351 1.00 5.39 H new ATOM 0 HH11 ARG A 573 -16.294 -7.100 -2.968 1.00 7.09 H new ATOM 0 HH12 ARG A 573 -17.628 -8.249 -3.119 1.00 7.09 H new ATOM 0 HH21 ARG A 573 -18.342 -7.603 -6.364 1.00 7.83 H new ATOM 0 HH22 ARG A 573 -18.694 -8.511 -4.889 1.00 7.83 H new ATOM 649 N GLU A 574 -11.115 -6.099 -5.620 1.00 1.65 N ATOM 650 CA GLU A 574 -10.169 -6.800 -6.509 1.00 1.54 C ATOM 651 C GLU A 574 -10.795 -7.297 -7.829 1.00 1.93 C ATOM 652 O GLU A 574 -12.006 -7.199 -8.050 1.00 2.86 O ATOM 653 CB GLU A 574 -9.476 -7.952 -5.754 1.00 2.64 C ATOM 654 CG GLU A 574 -8.355 -7.481 -4.806 1.00 3.44 C ATOM 655 CD GLU A 574 -8.765 -7.434 -3.329 1.00 5.10 C ATOM 656 OE1 GLU A 574 -9.975 -7.272 -3.045 1.00 5.90 O ATOM 657 OE2 GLU A 574 -7.876 -7.583 -2.453 1.00 6.35 O ATOM 0 H GLU A 574 -11.492 -6.703 -4.889 1.00 1.65 H new ATOM 0 HA GLU A 574 -9.425 -6.060 -6.804 1.00 1.54 H new ATOM 0 HB2 GLU A 574 -10.222 -8.499 -5.178 1.00 2.64 H new ATOM 0 HB3 GLU A 574 -9.058 -8.651 -6.479 1.00 2.64 H new ATOM 0 HG2 GLU A 574 -7.499 -8.147 -4.914 1.00 3.44 H new ATOM 0 HG3 GLU A 574 -8.027 -6.488 -5.113 1.00 3.44 H new ATOM 664 N GLY A 575 -9.956 -7.821 -8.731 1.00 1.92 N ATOM 665 CA GLY A 575 -10.389 -8.457 -9.987 1.00 2.92 C ATOM 666 C GLY A 575 -9.298 -8.643 -11.052 1.00 2.74 C ATOM 667 O GLY A 575 -9.584 -9.182 -12.126 1.00 3.59 O ATOM 0 H GLY A 575 -8.943 -7.816 -8.610 1.00 1.92 H new ATOM 0 HA2 GLY A 575 -10.811 -9.434 -9.751 1.00 2.92 H new ATOM 0 HA3 GLY A 575 -11.192 -7.859 -10.417 1.00 2.92 H new ATOM 671 N THR A 576 -8.061 -8.210 -10.777 1.00 1.85 N ATOM 672 CA THR A 576 -6.960 -8.156 -11.760 1.00 1.87 C ATOM 673 C THR A 576 -5.588 -8.462 -11.160 1.00 1.51 C ATOM 674 O THR A 576 -5.344 -8.263 -9.966 1.00 1.53 O ATOM 675 CB THR A 576 -6.936 -6.804 -12.491 1.00 2.24 C ATOM 676 OG1 THR A 576 -5.933 -6.758 -13.476 1.00 2.69 O ATOM 677 CG2 THR A 576 -6.706 -5.610 -11.563 1.00 2.56 C ATOM 0 H THR A 576 -7.788 -7.881 -9.851 1.00 1.85 H new ATOM 0 HA THR A 576 -7.167 -8.949 -12.479 1.00 1.87 H new ATOM 0 HB THR A 576 -7.927 -6.727 -12.938 1.00 2.24 H new ATOM 0 HG1 THR A 576 -5.950 -5.884 -13.920 1.00 2.69 H new ATOM 0 HG21 THR A 576 -6.701 -4.690 -12.148 1.00 2.56 H new ATOM 0 HG22 THR A 576 -7.505 -5.565 -10.823 1.00 2.56 H new ATOM 0 HG23 THR A 576 -5.748 -5.723 -11.056 1.00 2.56 H new ATOM 685 N ILE A 577 -4.680 -8.947 -12.001 1.00 1.59 N ATOM 686 CA ILE A 577 -3.264 -9.148 -11.680 1.00 1.57 C ATOM 687 C ILE A 577 -2.490 -7.826 -11.837 1.00 1.61 C ATOM 688 O ILE A 577 -2.630 -7.131 -12.847 1.00 1.80 O ATOM 689 CB ILE A 577 -2.676 -10.273 -12.548 1.00 1.82 C ATOM 690 CG1 ILE A 577 -3.266 -11.613 -12.063 1.00 1.89 C ATOM 691 CG2 ILE A 577 -1.142 -10.348 -12.468 1.00 2.05 C ATOM 692 CD1 ILE A 577 -3.311 -12.646 -13.175 1.00 3.02 C ATOM 0 H ILE A 577 -4.913 -9.221 -12.956 1.00 1.59 H new ATOM 0 HA ILE A 577 -3.169 -9.458 -10.639 1.00 1.57 H new ATOM 0 HB ILE A 577 -2.935 -10.066 -13.586 1.00 1.82 H new ATOM 0 HG12 ILE A 577 -2.668 -11.995 -11.236 1.00 1.89 H new ATOM 0 HG13 ILE A 577 -4.273 -11.449 -11.679 1.00 1.89 H new ATOM 0 HG21 ILE A 577 -0.784 -11.160 -13.101 1.00 2.05 H new ATOM 0 HG22 ILE A 577 -0.713 -9.406 -12.810 1.00 2.05 H new ATOM 0 HG23 ILE A 577 -0.840 -10.531 -11.437 1.00 2.05 H new ATOM 0 HD11 ILE A 577 -3.733 -13.575 -12.792 1.00 3.02 H new ATOM 0 HD12 ILE A 577 -3.931 -12.275 -13.991 1.00 3.02 H new ATOM 0 HD13 ILE A 577 -2.301 -12.830 -13.542 1.00 3.02 H new ATOM 704 N GLY A 578 -1.635 -7.495 -10.868 1.00 1.66 N ATOM 705 CA GLY A 578 -0.754 -6.326 -10.924 1.00 1.84 C ATOM 706 C GLY A 578 -1.417 -5.044 -10.427 1.00 1.60 C ATOM 707 O GLY A 578 -1.074 -3.959 -10.904 1.00 1.80 O ATOM 0 H GLY A 578 -1.533 -8.038 -10.011 1.00 1.66 H new ATOM 0 HA2 GLY A 578 0.136 -6.522 -10.326 1.00 1.84 H new ATOM 0 HA3 GLY A 578 -0.421 -6.180 -11.952 1.00 1.84 H new ATOM 711 N LYS A 579 -2.402 -5.165 -9.522 1.00 1.36 N ATOM 712 CA LYS A 579 -3.178 -4.049 -8.955 1.00 1.23 C ATOM 713 C LYS A 579 -2.315 -3.181 -8.011 1.00 1.07 C ATOM 714 O LYS A 579 -1.158 -3.501 -7.735 1.00 1.29 O ATOM 715 CB LYS A 579 -4.443 -4.618 -8.288 1.00 1.43 C ATOM 716 CG LYS A 579 -5.635 -3.643 -8.203 1.00 2.14 C ATOM 717 CD LYS A 579 -6.841 -4.371 -7.589 1.00 2.22 C ATOM 718 CE LYS A 579 -7.799 -3.476 -6.795 1.00 3.39 C ATOM 719 NZ LYS A 579 -8.638 -2.608 -7.646 1.00 3.97 N ATOM 0 H LYS A 579 -2.690 -6.071 -9.153 1.00 1.36 H new ATOM 0 HA LYS A 579 -3.494 -3.369 -9.746 1.00 1.23 H new ATOM 0 HB2 LYS A 579 -4.758 -5.504 -8.839 1.00 1.43 H new ATOM 0 HB3 LYS A 579 -4.188 -4.943 -7.280 1.00 1.43 H new ATOM 0 HG2 LYS A 579 -5.370 -2.778 -7.596 1.00 2.14 H new ATOM 0 HG3 LYS A 579 -5.887 -3.270 -9.196 1.00 2.14 H new ATOM 0 HD2 LYS A 579 -7.400 -4.857 -8.389 1.00 2.22 H new ATOM 0 HD3 LYS A 579 -6.475 -5.160 -6.932 1.00 2.22 H new ATOM 0 HE2 LYS A 579 -8.445 -4.104 -6.182 1.00 3.39 H new ATOM 0 HE3 LYS A 579 -7.220 -2.853 -6.113 1.00 3.39 H new ATOM 0 HZ1 LYS A 579 -8.505 -1.615 -7.367 1.00 3.97 H new ATOM 0 HZ2 LYS A 579 -8.363 -2.728 -8.642 1.00 3.97 H new ATOM 0 HZ3 LYS A 579 -9.638 -2.869 -7.529 1.00 3.97 H new ATOM 733 N LYS A 580 -2.855 -2.061 -7.526 1.00 0.94 N ATOM 734 CA LYS A 580 -2.099 -1.002 -6.828 1.00 0.93 C ATOM 735 C LYS A 580 -1.952 -1.291 -5.329 1.00 0.85 C ATOM 736 O LYS A 580 -2.665 -2.140 -4.793 1.00 1.04 O ATOM 737 CB LYS A 580 -2.779 0.370 -7.028 1.00 1.22 C ATOM 738 CG LYS A 580 -3.368 0.678 -8.416 1.00 1.53 C ATOM 739 CD LYS A 580 -2.425 0.367 -9.583 1.00 2.64 C ATOM 740 CE LYS A 580 -2.942 1.066 -10.853 1.00 3.76 C ATOM 741 NZ LYS A 580 -2.323 0.526 -12.087 1.00 4.94 N ATOM 0 H LYS A 580 -3.851 -1.854 -7.606 1.00 0.94 H new ATOM 0 HA LYS A 580 -1.101 -0.982 -7.265 1.00 0.93 H new ATOM 0 HB2 LYS A 580 -3.582 0.457 -6.296 1.00 1.22 H new ATOM 0 HB3 LYS A 580 -2.048 1.144 -6.794 1.00 1.22 H new ATOM 0 HG2 LYS A 580 -4.287 0.105 -8.544 1.00 1.53 H new ATOM 0 HG3 LYS A 580 -3.642 1.732 -8.456 1.00 1.53 H new ATOM 0 HD2 LYS A 580 -1.416 0.708 -9.351 1.00 2.64 H new ATOM 0 HD3 LYS A 580 -2.369 -0.710 -9.744 1.00 2.64 H new ATOM 0 HE2 LYS A 580 -4.024 0.951 -10.913 1.00 3.76 H new ATOM 0 HE3 LYS A 580 -2.738 2.135 -10.785 1.00 3.76 H new ATOM 0 HZ1 LYS A 580 -2.703 1.028 -12.915 1.00 4.94 H new ATOM 0 HZ2 LYS A 580 -1.292 0.658 -12.045 1.00 4.94 H new ATOM 0 HZ3 LYS A 580 -2.539 -0.488 -12.169 1.00 4.94 H new ATOM 755 N MET A 581 -1.066 -0.551 -4.655 1.00 0.78 N ATOM 756 CA MET A 581 -1.016 -0.541 -3.174 1.00 0.82 C ATOM 757 C MET A 581 -1.501 0.771 -2.527 1.00 0.84 C ATOM 758 O MET A 581 -1.437 1.845 -3.131 1.00 0.79 O ATOM 759 CB MET A 581 0.352 -0.991 -2.635 1.00 0.98 C ATOM 760 CG MET A 581 1.478 0.028 -2.852 1.00 2.06 C ATOM 761 SD MET A 581 2.646 0.177 -1.466 1.00 2.46 S ATOM 762 CE MET A 581 1.645 1.150 -0.299 1.00 2.58 C ATOM 0 H MET A 581 -0.373 0.049 -5.101 1.00 0.78 H new ATOM 0 HA MET A 581 -1.748 -1.287 -2.864 1.00 0.82 H new ATOM 0 HB2 MET A 581 0.261 -1.194 -1.568 1.00 0.98 H new ATOM 0 HB3 MET A 581 0.629 -1.930 -3.115 1.00 0.98 H new ATOM 0 HG2 MET A 581 2.033 -0.249 -3.748 1.00 2.06 H new ATOM 0 HG3 MET A 581 1.034 1.005 -3.042 1.00 2.06 H new ATOM 0 HE1 MET A 581 2.271 1.481 0.529 1.00 2.58 H new ATOM 0 HE2 MET A 581 1.231 2.019 -0.811 1.00 2.58 H new ATOM 0 HE3 MET A 581 0.832 0.534 0.085 1.00 2.58 H new ATOM 772 N TYR A 582 -1.958 0.680 -1.273 1.00 0.99 N ATOM 773 CA TYR A 582 -2.560 1.781 -0.510 1.00 1.01 C ATOM 774 C TYR A 582 -2.085 1.760 0.950 1.00 1.05 C ATOM 775 O TYR A 582 -1.890 0.699 1.544 1.00 1.10 O ATOM 776 CB TYR A 582 -4.099 1.712 -0.556 1.00 1.06 C ATOM 777 CG TYR A 582 -4.688 1.086 -1.807 1.00 1.15 C ATOM 778 CD1 TYR A 582 -4.929 1.852 -2.965 1.00 2.00 C ATOM 779 CD2 TYR A 582 -4.922 -0.302 -1.821 1.00 2.46 C ATOM 780 CE1 TYR A 582 -5.390 1.225 -4.141 1.00 2.16 C ATOM 781 CE2 TYR A 582 -5.367 -0.931 -2.993 1.00 2.99 C ATOM 782 CZ TYR A 582 -5.582 -0.174 -4.163 1.00 2.21 C ATOM 783 OH TYR A 582 -5.929 -0.802 -5.314 1.00 2.89 O ATOM 0 H TYR A 582 -1.918 -0.191 -0.743 1.00 0.99 H new ATOM 0 HA TYR A 582 -2.238 2.714 -0.973 1.00 1.01 H new ATOM 0 HB2 TYR A 582 -4.446 1.148 0.310 1.00 1.06 H new ATOM 0 HB3 TYR A 582 -4.494 2.723 -0.456 1.00 1.06 H new ATOM 0 HD1 TYR A 582 -4.761 2.919 -2.952 1.00 2.00 H new ATOM 0 HD2 TYR A 582 -4.758 -0.884 -0.926 1.00 2.46 H new ATOM 0 HE1 TYR A 582 -5.596 1.813 -5.023 1.00 2.16 H new ATOM 0 HE2 TYR A 582 -5.545 -1.996 -2.999 1.00 2.99 H new ATOM 0 HH TYR A 582 -5.571 -1.714 -5.310 1.00 2.89 H new ATOM 793 N PHE A 583 -1.908 2.931 1.557 1.00 1.06 N ATOM 794 CA PHE A 583 -1.342 3.041 2.904 1.00 1.16 C ATOM 795 C PHE A 583 -1.957 4.219 3.675 1.00 1.11 C ATOM 796 O PHE A 583 -2.321 5.242 3.094 1.00 1.26 O ATOM 797 CB PHE A 583 0.199 2.998 2.815 1.00 1.25 C ATOM 798 CG PHE A 583 0.931 4.130 2.110 1.00 1.36 C ATOM 799 CD1 PHE A 583 0.836 4.278 0.713 1.00 2.16 C ATOM 800 CD2 PHE A 583 1.819 4.949 2.831 1.00 2.46 C ATOM 801 CE1 PHE A 583 1.628 5.228 0.043 1.00 2.52 C ATOM 802 CE2 PHE A 583 2.601 5.912 2.165 1.00 2.67 C ATOM 803 CZ PHE A 583 2.507 6.049 0.769 1.00 2.13 C ATOM 0 H PHE A 583 -2.150 3.827 1.134 1.00 1.06 H new ATOM 0 HA PHE A 583 -1.615 2.183 3.518 1.00 1.16 H new ATOM 0 HB2 PHE A 583 0.585 2.940 3.833 1.00 1.25 H new ATOM 0 HB3 PHE A 583 0.474 2.068 2.317 1.00 1.25 H new ATOM 0 HD1 PHE A 583 0.151 3.659 0.153 1.00 2.16 H new ATOM 0 HD2 PHE A 583 1.901 4.838 3.902 1.00 2.46 H new ATOM 0 HE1 PHE A 583 1.560 5.326 -1.030 1.00 2.52 H new ATOM 0 HE2 PHE A 583 3.273 6.545 2.726 1.00 2.67 H new ATOM 0 HZ PHE A 583 3.109 6.784 0.256 1.00 2.13 H new ATOM 813 N ILE A 584 -2.205 4.028 4.972 1.00 0.92 N ATOM 814 CA ILE A 584 -3.130 4.879 5.751 1.00 0.83 C ATOM 815 C ILE A 584 -2.402 6.090 6.350 1.00 0.87 C ATOM 816 O ILE A 584 -1.461 5.916 7.122 1.00 0.91 O ATOM 817 CB ILE A 584 -3.879 4.059 6.836 1.00 0.77 C ATOM 818 CG1 ILE A 584 -4.463 2.753 6.242 1.00 0.77 C ATOM 819 CG2 ILE A 584 -5.012 4.917 7.450 1.00 0.74 C ATOM 820 CD1 ILE A 584 -5.289 1.925 7.224 1.00 0.74 C ATOM 0 H ILE A 584 -1.775 3.282 5.519 1.00 0.92 H new ATOM 0 HA ILE A 584 -3.884 5.263 5.064 1.00 0.83 H new ATOM 0 HB ILE A 584 -3.167 3.787 7.615 1.00 0.77 H new ATOM 0 HG12 ILE A 584 -5.087 3.006 5.385 1.00 0.77 H new ATOM 0 HG13 ILE A 584 -3.643 2.140 5.869 1.00 0.77 H new ATOM 0 HG21 ILE A 584 -5.535 4.338 8.211 1.00 0.74 H new ATOM 0 HG22 ILE A 584 -4.586 5.812 7.904 1.00 0.74 H new ATOM 0 HG23 ILE A 584 -5.714 5.206 6.668 1.00 0.74 H new ATOM 0 HD11 ILE A 584 -5.658 1.030 6.724 1.00 0.74 H new ATOM 0 HD12 ILE A 584 -4.666 1.637 8.071 1.00 0.74 H new ATOM 0 HD13 ILE A 584 -6.133 2.517 7.579 1.00 0.74 H new ATOM 832 N GLN A 585 -2.855 7.315 6.051 1.00 0.99 N ATOM 833 CA GLN A 585 -2.229 8.549 6.558 1.00 1.12 C ATOM 834 C GLN A 585 -2.882 9.070 7.848 1.00 1.14 C ATOM 835 O GLN A 585 -2.170 9.372 8.805 1.00 1.24 O ATOM 836 CB GLN A 585 -2.230 9.621 5.455 1.00 1.24 C ATOM 837 CG GLN A 585 -1.446 10.882 5.858 1.00 1.77 C ATOM 838 CD GLN A 585 -1.533 11.943 4.772 1.00 1.55 C ATOM 839 OE1 GLN A 585 -0.704 12.027 3.881 1.00 2.60 O ATOM 840 NE2 GLN A 585 -2.551 12.773 4.768 1.00 1.98 N ATOM 0 H GLN A 585 -3.664 7.481 5.452 1.00 0.99 H new ATOM 0 HA GLN A 585 -1.200 8.309 6.826 1.00 1.12 H new ATOM 0 HB2 GLN A 585 -1.797 9.203 4.546 1.00 1.24 H new ATOM 0 HB3 GLN A 585 -3.258 9.896 5.221 1.00 1.24 H new ATOM 0 HG2 GLN A 585 -1.842 11.279 6.793 1.00 1.77 H new ATOM 0 HG3 GLN A 585 -0.402 10.625 6.038 1.00 1.77 H new ATOM 0 HE21 GLN A 585 -3.255 12.720 5.504 1.00 1.98 H new ATOM 0 HE22 GLN A 585 -2.637 13.471 4.029 1.00 1.98 H new ATOM 849 N HIS A 586 -4.212 9.202 7.876 1.00 1.06 N ATOM 850 CA HIS A 586 -4.957 9.753 9.020 1.00 1.03 C ATOM 851 C HIS A 586 -6.413 9.250 9.049 1.00 0.98 C ATOM 852 O HIS A 586 -7.281 9.768 8.335 1.00 1.14 O ATOM 853 CB HIS A 586 -4.906 11.299 8.971 1.00 1.01 C ATOM 854 CG HIS A 586 -3.773 11.930 9.746 1.00 1.65 C ATOM 855 ND1 HIS A 586 -2.925 12.906 9.276 1.00 3.15 N ATOM 856 CD2 HIS A 586 -3.427 11.697 11.051 1.00 2.51 C ATOM 857 CE1 HIS A 586 -2.084 13.256 10.260 1.00 3.99 C ATOM 858 NE2 HIS A 586 -2.355 12.544 11.370 1.00 3.48 N ATOM 0 H HIS A 586 -4.811 8.927 7.098 1.00 1.06 H new ATOM 0 HA HIS A 586 -4.485 9.406 9.939 1.00 1.03 H new ATOM 0 HB2 HIS A 586 -4.831 11.611 7.929 1.00 1.01 H new ATOM 0 HB3 HIS A 586 -5.849 11.690 9.354 1.00 1.01 H new ATOM 0 HD2 HIS A 586 -3.896 10.987 11.716 1.00 2.51 H new ATOM 0 HE1 HIS A 586 -1.305 13.999 10.175 1.00 3.99 H new ATOM 0 HE2 HIS A 586 -1.875 12.608 12.268 1.00 3.48 H new ATOM 866 N GLY A 587 -6.701 8.261 9.897 1.00 0.89 N ATOM 867 CA GLY A 587 -8.050 7.797 10.203 1.00 0.95 C ATOM 868 C GLY A 587 -8.052 6.354 10.690 1.00 0.84 C ATOM 869 O GLY A 587 -7.018 5.821 11.101 1.00 0.87 O ATOM 0 H GLY A 587 -5.979 7.748 10.403 1.00 0.89 H new ATOM 0 HA2 GLY A 587 -8.492 8.439 10.965 1.00 0.95 H new ATOM 0 HA3 GLY A 587 -8.675 7.882 9.314 1.00 0.95 H new ATOM 873 N VAL A 588 -9.226 5.727 10.633 1.00 0.79 N ATOM 874 CA VAL A 588 -9.465 4.358 11.095 1.00 0.77 C ATOM 875 C VAL A 588 -10.291 3.612 10.041 1.00 0.72 C ATOM 876 O VAL A 588 -11.177 4.188 9.402 1.00 0.73 O ATOM 877 CB VAL A 588 -10.170 4.352 12.475 1.00 0.85 C ATOM 878 CG1 VAL A 588 -10.465 2.939 12.992 1.00 0.85 C ATOM 879 CG2 VAL A 588 -9.330 5.061 13.547 1.00 0.99 C ATOM 0 H VAL A 588 -10.063 6.170 10.253 1.00 0.79 H new ATOM 0 HA VAL A 588 -8.511 3.848 11.224 1.00 0.77 H new ATOM 0 HB VAL A 588 -11.108 4.880 12.307 1.00 0.85 H new ATOM 0 HG11 VAL A 588 -10.959 3.002 13.962 1.00 0.85 H new ATOM 0 HG12 VAL A 588 -11.115 2.422 12.287 1.00 0.85 H new ATOM 0 HG13 VAL A 588 -9.531 2.387 13.096 1.00 0.85 H new ATOM 0 HG21 VAL A 588 -9.859 5.035 14.500 1.00 0.99 H new ATOM 0 HG22 VAL A 588 -8.370 4.555 13.651 1.00 0.99 H new ATOM 0 HG23 VAL A 588 -9.164 6.097 13.252 1.00 0.99 H new ATOM 889 N VAL A 589 -10.015 2.325 9.845 1.00 0.71 N ATOM 890 CA VAL A 589 -10.730 1.459 8.892 1.00 0.70 C ATOM 891 C VAL A 589 -11.126 0.140 9.557 1.00 0.85 C ATOM 892 O VAL A 589 -10.373 -0.389 10.374 1.00 0.98 O ATOM 893 CB VAL A 589 -9.914 1.229 7.599 1.00 0.70 C ATOM 894 CG1 VAL A 589 -9.508 2.546 6.918 1.00 0.79 C ATOM 895 CG2 VAL A 589 -8.633 0.428 7.836 1.00 0.74 C ATOM 0 H VAL A 589 -9.275 1.839 10.351 1.00 0.71 H new ATOM 0 HA VAL A 589 -11.644 1.972 8.594 1.00 0.70 H new ATOM 0 HB VAL A 589 -10.588 0.663 6.955 1.00 0.70 H new ATOM 0 HG11 VAL A 589 -8.937 2.328 6.015 1.00 0.79 H new ATOM 0 HG12 VAL A 589 -10.403 3.110 6.654 1.00 0.79 H new ATOM 0 HG13 VAL A 589 -8.896 3.135 7.601 1.00 0.79 H new ATOM 0 HG21 VAL A 589 -8.104 0.300 6.892 1.00 0.74 H new ATOM 0 HG22 VAL A 589 -7.995 0.962 8.540 1.00 0.74 H new ATOM 0 HG23 VAL A 589 -8.886 -0.550 8.246 1.00 0.74 H new ATOM 905 N SER A 590 -12.290 -0.397 9.195 1.00 0.86 N ATOM 906 CA SER A 590 -12.701 -1.766 9.544 1.00 1.11 C ATOM 907 C SER A 590 -12.456 -2.717 8.365 1.00 1.27 C ATOM 908 O SER A 590 -13.105 -2.621 7.320 1.00 1.13 O ATOM 909 CB SER A 590 -14.180 -1.821 9.943 1.00 1.30 C ATOM 910 OG SER A 590 -14.374 -1.346 11.261 1.00 1.54 O ATOM 0 H SER A 590 -12.985 0.107 8.645 1.00 0.86 H new ATOM 0 HA SER A 590 -12.099 -2.080 10.397 1.00 1.11 H new ATOM 0 HB2 SER A 590 -14.769 -1.223 9.248 1.00 1.30 H new ATOM 0 HB3 SER A 590 -14.542 -2.846 9.867 1.00 1.30 H new ATOM 0 HG SER A 590 -15.077 -0.663 11.262 1.00 1.54 H new ATOM 916 N VAL A 591 -11.541 -3.666 8.555 1.00 1.54 N ATOM 917 CA VAL A 591 -11.391 -4.882 7.741 1.00 1.26 C ATOM 918 C VAL A 591 -12.449 -5.891 8.181 1.00 0.84 C ATOM 919 O VAL A 591 -12.799 -5.945 9.360 1.00 0.79 O ATOM 920 CB VAL A 591 -9.994 -5.524 7.922 1.00 1.78 C ATOM 921 CG1 VAL A 591 -9.682 -6.550 6.826 1.00 3.46 C ATOM 922 CG2 VAL A 591 -8.834 -4.525 7.963 1.00 1.13 C ATOM 0 H VAL A 591 -10.855 -3.612 9.308 1.00 1.54 H new ATOM 0 HA VAL A 591 -11.509 -4.610 6.692 1.00 1.26 H new ATOM 0 HB VAL A 591 -10.065 -6.006 8.897 1.00 1.78 H new ATOM 0 HG11 VAL A 591 -8.692 -6.973 6.995 1.00 3.46 H new ATOM 0 HG12 VAL A 591 -10.426 -7.346 6.850 1.00 3.46 H new ATOM 0 HG13 VAL A 591 -9.706 -6.061 5.852 1.00 3.46 H new ATOM 0 HG21 VAL A 591 -7.895 -5.063 8.092 1.00 1.13 H new ATOM 0 HG22 VAL A 591 -8.805 -3.963 7.030 1.00 1.13 H new ATOM 0 HG23 VAL A 591 -8.976 -3.837 8.796 1.00 1.13 H new ATOM 932 N LEU A 592 -12.920 -6.717 7.255 1.00 0.88 N ATOM 933 CA LEU A 592 -13.671 -7.943 7.544 1.00 1.22 C ATOM 934 C LEU A 592 -12.866 -9.159 7.059 1.00 1.64 C ATOM 935 O LEU A 592 -12.200 -9.068 6.026 1.00 1.52 O ATOM 936 CB LEU A 592 -15.051 -7.918 6.850 1.00 1.48 C ATOM 937 CG LEU A 592 -16.090 -6.852 7.258 1.00 1.66 C ATOM 938 CD1 LEU A 592 -16.307 -6.789 8.769 1.00 1.97 C ATOM 939 CD2 LEU A 592 -15.794 -5.442 6.738 1.00 1.80 C ATOM 0 H LEU A 592 -12.790 -6.553 6.257 1.00 0.88 H new ATOM 0 HA LEU A 592 -13.831 -8.011 8.620 1.00 1.22 H new ATOM 0 HB2 LEU A 592 -14.876 -7.810 5.780 1.00 1.48 H new ATOM 0 HB3 LEU A 592 -15.510 -8.895 7.001 1.00 1.48 H new ATOM 0 HG LEU A 592 -17.004 -7.194 6.772 1.00 1.66 H new ATOM 0 HD11 LEU A 592 -17.047 -6.023 8.999 1.00 1.97 H new ATOM 0 HD12 LEU A 592 -16.663 -7.756 9.126 1.00 1.97 H new ATOM 0 HD13 LEU A 592 -15.366 -6.544 9.262 1.00 1.97 H new ATOM 0 HD21 LEU A 592 -16.575 -4.759 7.073 1.00 1.80 H new ATOM 0 HD22 LEU A 592 -14.830 -5.107 7.122 1.00 1.80 H new ATOM 0 HD23 LEU A 592 -15.766 -5.455 5.648 1.00 1.80 H new ATOM 951 N THR A 593 -12.964 -10.311 7.730 1.00 2.29 N ATOM 952 CA THR A 593 -12.554 -11.604 7.141 1.00 2.88 C ATOM 953 C THR A 593 -13.750 -12.558 6.989 1.00 3.26 C ATOM 954 O THR A 593 -14.615 -12.628 7.861 1.00 3.27 O ATOM 955 CB THR A 593 -11.325 -12.235 7.835 1.00 3.15 C ATOM 956 OG1 THR A 593 -11.157 -11.865 9.184 1.00 2.79 O ATOM 957 CG2 THR A 593 -10.028 -11.838 7.138 1.00 3.37 C ATOM 0 H THR A 593 -13.323 -10.382 8.682 1.00 2.29 H new ATOM 0 HA THR A 593 -12.203 -11.396 6.130 1.00 2.88 H new ATOM 0 HB THR A 593 -11.526 -13.305 7.776 1.00 3.15 H new ATOM 0 HG1 THR A 593 -10.361 -12.307 9.548 1.00 2.79 H new ATOM 0 HG21 THR A 593 -9.184 -12.298 7.651 1.00 3.37 H new ATOM 0 HG22 THR A 593 -10.053 -12.178 6.103 1.00 3.37 H new ATOM 0 HG23 THR A 593 -9.919 -10.754 7.162 1.00 3.37 H new ATOM 965 N LYS A 594 -13.839 -13.254 5.842 1.00 3.67 N ATOM 966 CA LYS A 594 -15.047 -13.940 5.325 1.00 4.15 C ATOM 967 C LYS A 594 -15.757 -14.938 6.257 1.00 4.95 C ATOM 968 O LYS A 594 -16.979 -14.901 6.390 1.00 6.39 O ATOM 969 CB LYS A 594 -14.761 -14.551 3.934 1.00 4.37 C ATOM 970 CG LYS A 594 -13.768 -15.728 3.852 1.00 4.95 C ATOM 971 CD LYS A 594 -12.278 -15.342 3.902 1.00 4.78 C ATOM 972 CE LYS A 594 -11.340 -16.552 3.999 1.00 5.64 C ATOM 973 NZ LYS A 594 -11.264 -17.350 2.755 1.00 6.11 N ATOM 0 H LYS A 594 -13.038 -13.361 5.219 1.00 3.67 H new ATOM 0 HA LYS A 594 -15.786 -13.143 5.250 1.00 4.15 H new ATOM 0 HB2 LYS A 594 -15.710 -14.884 3.514 1.00 4.37 H new ATOM 0 HB3 LYS A 594 -14.389 -13.755 3.289 1.00 4.37 H new ATOM 0 HG2 LYS A 594 -13.976 -16.414 4.673 1.00 4.95 H new ATOM 0 HG3 LYS A 594 -13.953 -16.273 2.927 1.00 4.95 H new ATOM 0 HD2 LYS A 594 -12.028 -14.768 3.009 1.00 4.78 H new ATOM 0 HD3 LYS A 594 -12.108 -14.689 4.758 1.00 4.78 H new ATOM 0 HE2 LYS A 594 -10.340 -16.205 4.259 1.00 5.64 H new ATOM 0 HE3 LYS A 594 -11.675 -17.195 4.812 1.00 5.64 H new ATOM 0 HZ1 LYS A 594 -10.613 -18.149 2.894 1.00 6.11 H new ATOM 0 HZ2 LYS A 594 -12.210 -17.711 2.516 1.00 6.11 H new ATOM 0 HZ3 LYS A 594 -10.916 -16.751 1.979 1.00 6.11 H new ATOM 987 N GLY A 595 -15.010 -15.793 6.949 1.00 4.37 N ATOM 988 CA GLY A 595 -15.511 -16.730 7.965 1.00 4.87 C ATOM 989 C GLY A 595 -15.692 -16.115 9.352 1.00 4.58 C ATOM 990 O GLY A 595 -16.101 -16.805 10.287 1.00 4.83 O ATOM 0 H GLY A 595 -14.001 -15.859 6.817 1.00 4.37 H new ATOM 0 HA2 GLY A 595 -16.467 -17.133 7.631 1.00 4.87 H new ATOM 0 HA3 GLY A 595 -14.820 -17.570 8.040 1.00 4.87 H new ATOM 994 N ASN A 596 -15.303 -14.852 9.503 1.00 4.07 N ATOM 995 CA ASN A 596 -14.709 -14.331 10.718 1.00 3.74 C ATOM 996 C ASN A 596 -15.351 -12.986 11.139 1.00 3.33 C ATOM 997 O ASN A 596 -16.492 -12.676 10.778 1.00 3.49 O ATOM 998 CB ASN A 596 -13.176 -14.185 10.525 1.00 3.60 C ATOM 999 CG ASN A 596 -12.373 -15.120 9.626 1.00 4.03 C ATOM 1000 OD1 ASN A 596 -12.712 -15.473 8.508 1.00 4.48 O ATOM 1001 ND2 ASN A 596 -11.181 -15.471 10.036 1.00 4.22 N ATOM 0 H ASN A 596 -15.396 -14.153 8.766 1.00 4.07 H new ATOM 0 HA ASN A 596 -14.900 -15.037 11.526 1.00 3.74 H new ATOM 0 HB2 ASN A 596 -13.002 -13.173 10.158 1.00 3.60 H new ATOM 0 HB3 ASN A 596 -12.729 -14.245 11.517 1.00 3.60 H new ATOM 0 HD21 ASN A 596 -10.573 -16.020 9.427 1.00 4.22 H new ATOM 0 HD22 ASN A 596 -10.859 -15.196 10.964 1.00 4.22 H new ATOM 1008 N LYS A 597 -14.612 -12.200 11.931 1.00 2.91 N ATOM 1009 CA LYS A 597 -15.013 -10.947 12.574 1.00 2.52 C ATOM 1010 C LYS A 597 -14.490 -9.732 11.807 1.00 1.83 C ATOM 1011 O LYS A 597 -13.755 -9.840 10.823 1.00 1.83 O ATOM 1012 CB LYS A 597 -14.505 -10.934 14.040 1.00 2.55 C ATOM 1013 CG LYS A 597 -15.024 -12.032 14.992 1.00 3.25 C ATOM 1014 CD LYS A 597 -14.629 -13.492 14.702 1.00 3.57 C ATOM 1015 CE LYS A 597 -13.138 -13.718 14.402 1.00 3.28 C ATOM 1016 NZ LYS A 597 -12.328 -13.791 15.639 1.00 3.62 N ATOM 0 H LYS A 597 -13.647 -12.443 12.154 1.00 2.91 H new ATOM 0 HA LYS A 597 -16.101 -10.886 12.569 1.00 2.52 H new ATOM 0 HB2 LYS A 597 -13.417 -10.997 14.018 1.00 2.55 H new ATOM 0 HB3 LYS A 597 -14.759 -9.967 14.474 1.00 2.55 H new ATOM 0 HG2 LYS A 597 -14.683 -11.788 15.998 1.00 3.25 H new ATOM 0 HG3 LYS A 597 -16.113 -11.977 15.002 1.00 3.25 H new ATOM 0 HD2 LYS A 597 -14.908 -14.104 15.559 1.00 3.57 H new ATOM 0 HD3 LYS A 597 -15.212 -13.848 13.853 1.00 3.57 H new ATOM 0 HE2 LYS A 597 -13.018 -14.641 13.835 1.00 3.28 H new ATOM 0 HE3 LYS A 597 -12.768 -12.908 13.774 1.00 3.28 H new ATOM 0 HZ1 LYS A 597 -11.330 -13.944 15.392 1.00 3.62 H new ATOM 0 HZ2 LYS A 597 -12.421 -12.900 16.168 1.00 3.62 H new ATOM 0 HZ3 LYS A 597 -12.664 -14.580 16.228 1.00 3.62 H new ATOM 1030 N GLU A 598 -14.872 -8.561 12.297 1.00 1.57 N ATOM 1031 CA GLU A 598 -14.251 -7.293 11.943 1.00 1.16 C ATOM 1032 C GLU A 598 -12.889 -7.079 12.633 1.00 0.99 C ATOM 1033 O GLU A 598 -12.614 -7.664 13.683 1.00 1.19 O ATOM 1034 CB GLU A 598 -15.220 -6.136 12.236 1.00 1.69 C ATOM 1035 CG GLU A 598 -15.313 -5.725 13.716 1.00 2.46 C ATOM 1036 CD GLU A 598 -15.792 -6.831 14.678 1.00 2.99 C ATOM 1037 OE1 GLU A 598 -16.666 -7.658 14.315 1.00 3.14 O ATOM 1038 OE2 GLU A 598 -15.296 -6.875 15.831 1.00 4.42 O ATOM 0 H GLU A 598 -15.637 -8.464 12.965 1.00 1.57 H new ATOM 0 HA GLU A 598 -14.041 -7.318 10.874 1.00 1.16 H new ATOM 0 HB2 GLU A 598 -14.913 -5.268 11.652 1.00 1.69 H new ATOM 0 HB3 GLU A 598 -16.214 -6.418 11.890 1.00 1.69 H new ATOM 0 HG2 GLU A 598 -14.332 -5.382 14.043 1.00 2.46 H new ATOM 0 HG3 GLU A 598 -15.991 -4.876 13.798 1.00 2.46 H new ATOM 1045 N MET A 599 -12.054 -6.205 12.069 1.00 0.90 N ATOM 1046 CA MET A 599 -10.729 -5.822 12.585 1.00 1.10 C ATOM 1047 C MET A 599 -10.412 -4.356 12.282 1.00 1.38 C ATOM 1048 O MET A 599 -10.457 -3.933 11.130 1.00 2.03 O ATOM 1049 CB MET A 599 -9.628 -6.696 11.964 1.00 1.30 C ATOM 1050 CG MET A 599 -9.698 -8.157 12.406 1.00 1.65 C ATOM 1051 SD MET A 599 -8.638 -9.294 11.472 1.00 2.26 S ATOM 1052 CE MET A 599 -9.434 -9.214 9.839 1.00 2.39 C ATOM 0 H MET A 599 -12.288 -5.721 11.202 1.00 0.90 H new ATOM 0 HA MET A 599 -10.756 -5.969 13.665 1.00 1.10 H new ATOM 0 HB2 MET A 599 -9.704 -6.648 10.878 1.00 1.30 H new ATOM 0 HB3 MET A 599 -8.654 -6.288 12.234 1.00 1.30 H new ATOM 0 HG2 MET A 599 -9.427 -8.215 13.460 1.00 1.65 H new ATOM 0 HG3 MET A 599 -10.730 -8.497 12.323 1.00 1.65 H new ATOM 0 HE1 MET A 599 -9.138 -10.080 9.247 1.00 2.39 H new ATOM 0 HE2 MET A 599 -10.517 -9.212 9.962 1.00 2.39 H new ATOM 0 HE3 MET A 599 -9.125 -8.302 9.328 1.00 2.39 H new ATOM 1062 N LYS A 600 -10.049 -3.582 13.308 1.00 1.11 N ATOM 1063 CA LYS A 600 -9.644 -2.171 13.159 1.00 1.05 C ATOM 1064 C LYS A 600 -8.168 -1.991 12.773 1.00 1.05 C ATOM 1065 O LYS A 600 -7.274 -2.524 13.434 1.00 1.19 O ATOM 1066 CB LYS A 600 -9.995 -1.334 14.408 1.00 1.15 C ATOM 1067 CG LYS A 600 -11.228 -0.444 14.194 1.00 1.11 C ATOM 1068 CD LYS A 600 -12.537 -1.231 14.049 1.00 1.30 C ATOM 1069 CE LYS A 600 -12.954 -1.994 15.320 1.00 1.56 C ATOM 1070 NZ LYS A 600 -13.138 -1.098 16.491 1.00 2.61 N ATOM 0 H LYS A 600 -10.026 -3.913 14.273 1.00 1.11 H new ATOM 0 HA LYS A 600 -10.228 -1.793 12.320 1.00 1.05 H new ATOM 0 HB2 LYS A 600 -10.175 -2.002 15.250 1.00 1.15 H new ATOM 0 HB3 LYS A 600 -9.142 -0.709 14.674 1.00 1.15 H new ATOM 0 HG2 LYS A 600 -11.319 0.244 15.034 1.00 1.11 H new ATOM 0 HG3 LYS A 600 -11.077 0.162 13.301 1.00 1.11 H new ATOM 0 HD2 LYS A 600 -13.335 -0.541 13.774 1.00 1.30 H new ATOM 0 HD3 LYS A 600 -12.433 -1.942 13.229 1.00 1.30 H new ATOM 0 HE2 LYS A 600 -13.883 -2.531 15.128 1.00 1.56 H new ATOM 0 HE3 LYS A 600 -12.197 -2.742 15.555 1.00 1.56 H new ATOM 0 HZ1 LYS A 600 -13.515 -1.645 17.291 1.00 2.61 H new ATOM 0 HZ2 LYS A 600 -12.223 -0.682 16.757 1.00 2.61 H new ATOM 0 HZ3 LYS A 600 -13.805 -0.339 16.246 1.00 2.61 H new ATOM 1084 N LEU A 601 -7.935 -1.157 11.760 1.00 0.93 N ATOM 1085 CA LEU A 601 -6.624 -0.640 11.312 1.00 0.90 C ATOM 1086 C LEU A 601 -6.595 0.904 11.360 1.00 0.82 C ATOM 1087 O LEU A 601 -7.644 1.548 11.362 1.00 0.79 O ATOM 1088 CB LEU A 601 -6.290 -1.164 9.896 1.00 0.92 C ATOM 1089 CG LEU A 601 -5.393 -2.412 9.822 1.00 0.94 C ATOM 1090 CD1 LEU A 601 -6.043 -3.635 10.464 1.00 0.90 C ATOM 1091 CD2 LEU A 601 -5.119 -2.744 8.354 1.00 0.98 C ATOM 0 H LEU A 601 -8.699 -0.796 11.189 1.00 0.93 H new ATOM 0 HA LEU A 601 -5.858 -1.005 11.996 1.00 0.90 H new ATOM 0 HB2 LEU A 601 -7.226 -1.386 9.384 1.00 0.92 H new ATOM 0 HB3 LEU A 601 -5.805 -0.361 9.340 1.00 0.92 H new ATOM 0 HG LEU A 601 -4.476 -2.183 10.365 1.00 0.94 H new ATOM 0 HD11 LEU A 601 -5.370 -4.488 10.385 1.00 0.90 H new ATOM 0 HD12 LEU A 601 -6.247 -3.429 11.515 1.00 0.90 H new ATOM 0 HD13 LEU A 601 -6.978 -3.862 9.951 1.00 0.90 H new ATOM 0 HD21 LEU A 601 -4.484 -3.628 8.293 1.00 0.98 H new ATOM 0 HD22 LEU A 601 -6.062 -2.939 7.843 1.00 0.98 H new ATOM 0 HD23 LEU A 601 -4.616 -1.902 7.878 1.00 0.98 H new ATOM 1103 N SER A 602 -5.397 1.500 11.398 1.00 0.87 N ATOM 1104 CA SER A 602 -5.167 2.925 11.718 1.00 0.85 C ATOM 1105 C SER A 602 -3.996 3.548 10.935 1.00 0.87 C ATOM 1106 O SER A 602 -3.349 2.872 10.133 1.00 0.90 O ATOM 1107 CB SER A 602 -4.926 3.045 13.231 1.00 1.00 C ATOM 1108 OG SER A 602 -3.820 2.248 13.625 1.00 1.74 O ATOM 0 H SER A 602 -4.533 0.995 11.202 1.00 0.87 H new ATOM 0 HA SER A 602 -6.052 3.485 11.416 1.00 0.85 H new ATOM 0 HB2 SER A 602 -4.743 4.087 13.494 1.00 1.00 H new ATOM 0 HB3 SER A 602 -5.818 2.732 13.773 1.00 1.00 H new ATOM 0 HG SER A 602 -3.680 2.338 14.591 1.00 1.74 H new ATOM 1114 N ASP A 603 -3.699 4.836 11.156 1.00 0.93 N ATOM 1115 CA ASP A 603 -2.559 5.532 10.526 1.00 1.05 C ATOM 1116 C ASP A 603 -1.232 4.751 10.606 1.00 1.06 C ATOM 1117 O ASP A 603 -0.850 4.236 11.659 1.00 1.13 O ATOM 1118 CB ASP A 603 -2.381 6.962 11.068 1.00 1.30 C ATOM 1119 CG ASP A 603 -2.013 7.072 12.556 1.00 1.42 C ATOM 1120 OD1 ASP A 603 -2.934 7.122 13.406 1.00 1.90 O ATOM 1121 OD2 ASP A 603 -0.809 7.194 12.889 1.00 1.95 O ATOM 0 H ASP A 603 -4.244 5.431 11.780 1.00 0.93 H new ATOM 0 HA ASP A 603 -2.819 5.594 9.469 1.00 1.05 H new ATOM 0 HB2 ASP A 603 -1.606 7.458 10.484 1.00 1.30 H new ATOM 0 HB3 ASP A 603 -3.307 7.512 10.901 1.00 1.30 H new ATOM 1126 N GLY A 604 -0.522 4.646 9.480 1.00 1.04 N ATOM 1127 CA GLY A 604 0.711 3.866 9.331 1.00 1.09 C ATOM 1128 C GLY A 604 0.528 2.401 8.915 1.00 1.04 C ATOM 1129 O GLY A 604 1.505 1.773 8.502 1.00 1.16 O ATOM 0 H GLY A 604 -0.798 5.117 8.618 1.00 1.04 H new ATOM 0 HA2 GLY A 604 1.343 4.358 8.591 1.00 1.09 H new ATOM 0 HA3 GLY A 604 1.251 3.890 10.278 1.00 1.09 H new ATOM 1133 N SER A 605 -0.694 1.859 8.968 1.00 0.97 N ATOM 1134 CA SER A 605 -1.025 0.542 8.403 1.00 0.92 C ATOM 1135 C SER A 605 -1.061 0.583 6.862 1.00 0.92 C ATOM 1136 O SER A 605 -1.180 1.650 6.254 1.00 0.92 O ATOM 1137 CB SER A 605 -2.360 0.052 8.973 1.00 0.86 C ATOM 1138 OG SER A 605 -2.296 -0.163 10.377 1.00 1.01 O ATOM 0 H SER A 605 -1.488 2.324 9.407 1.00 0.97 H new ATOM 0 HA SER A 605 -0.243 -0.162 8.687 1.00 0.92 H new ATOM 0 HB2 SER A 605 -3.138 0.784 8.754 1.00 0.86 H new ATOM 0 HB3 SER A 605 -2.647 -0.876 8.477 1.00 0.86 H new ATOM 0 HG SER A 605 -3.168 -0.473 10.701 1.00 1.01 H new ATOM 1144 N TYR A 606 -0.943 -0.577 6.213 1.00 0.99 N ATOM 1145 CA TYR A 606 -0.728 -0.700 4.759 1.00 1.17 C ATOM 1146 C TYR A 606 -1.344 -1.989 4.167 1.00 1.36 C ATOM 1147 O TYR A 606 -1.213 -3.066 4.759 1.00 1.69 O ATOM 1148 CB TYR A 606 0.791 -0.591 4.478 1.00 1.38 C ATOM 1149 CG TYR A 606 1.333 -1.597 3.482 1.00 1.72 C ATOM 1150 CD1 TYR A 606 1.001 -1.477 2.121 1.00 3.37 C ATOM 1151 CD2 TYR A 606 2.071 -2.707 3.937 1.00 2.08 C ATOM 1152 CE1 TYR A 606 1.364 -2.498 1.217 1.00 4.70 C ATOM 1153 CE2 TYR A 606 2.446 -3.721 3.036 1.00 3.08 C ATOM 1154 CZ TYR A 606 2.077 -3.627 1.676 1.00 4.35 C ATOM 1155 OH TYR A 606 2.365 -4.659 0.837 1.00 5.78 O ATOM 0 H TYR A 606 -0.994 -1.478 6.687 1.00 0.99 H new ATOM 0 HA TYR A 606 -1.250 0.113 4.255 1.00 1.17 H new ATOM 0 HB2 TYR A 606 1.006 0.413 4.111 1.00 1.38 H new ATOM 0 HB3 TYR A 606 1.328 -0.708 5.419 1.00 1.38 H new ATOM 0 HD1 TYR A 606 0.469 -0.606 1.768 1.00 3.37 H new ATOM 0 HD2 TYR A 606 2.349 -2.780 4.978 1.00 2.08 H new ATOM 0 HE1 TYR A 606 1.096 -2.416 0.174 1.00 4.70 H new ATOM 0 HE2 TYR A 606 3.015 -4.570 3.384 1.00 3.08 H new ATOM 0 HH TYR A 606 2.862 -5.349 1.325 1.00 5.78 H new ATOM 1165 N PHE A 607 -1.975 -1.884 2.987 1.00 1.23 N ATOM 1166 CA PHE A 607 -2.596 -3.009 2.255 1.00 1.51 C ATOM 1167 C PHE A 607 -2.654 -2.814 0.717 1.00 1.61 C ATOM 1168 O PHE A 607 -2.167 -1.820 0.177 1.00 1.84 O ATOM 1169 CB PHE A 607 -3.976 -3.319 2.876 1.00 1.72 C ATOM 1170 CG PHE A 607 -4.809 -2.135 3.341 1.00 1.45 C ATOM 1171 CD1 PHE A 607 -5.022 -1.015 2.512 1.00 1.97 C ATOM 1172 CD2 PHE A 607 -5.379 -2.164 4.627 1.00 2.52 C ATOM 1173 CE1 PHE A 607 -5.786 0.072 2.975 1.00 1.98 C ATOM 1174 CE2 PHE A 607 -6.144 -1.082 5.086 1.00 2.50 C ATOM 1175 CZ PHE A 607 -6.337 0.043 4.267 1.00 1.43 C ATOM 0 H PHE A 607 -2.072 -0.993 2.500 1.00 1.23 H new ATOM 0 HA PHE A 607 -1.949 -3.878 2.375 1.00 1.51 H new ATOM 0 HB2 PHE A 607 -4.559 -3.876 2.143 1.00 1.72 H new ATOM 0 HB3 PHE A 607 -3.822 -3.980 3.729 1.00 1.72 H new ATOM 0 HD1 PHE A 607 -4.598 -0.991 1.519 1.00 1.97 H new ATOM 0 HD2 PHE A 607 -5.227 -3.023 5.263 1.00 2.52 H new ATOM 0 HE1 PHE A 607 -5.949 0.928 2.337 1.00 1.98 H new ATOM 0 HE2 PHE A 607 -6.586 -1.114 6.071 1.00 2.50 H new ATOM 0 HZ PHE A 607 -6.908 0.885 4.630 1.00 1.43 H new ATOM 1185 N GLY A 608 -3.232 -3.780 -0.007 1.00 1.91 N ATOM 1186 CA GLY A 608 -3.251 -3.857 -1.479 1.00 2.35 C ATOM 1187 C GLY A 608 -2.564 -5.124 -1.997 1.00 2.56 C ATOM 1188 O GLY A 608 -1.401 -5.077 -2.401 1.00 3.78 O ATOM 0 H GLY A 608 -3.719 -4.562 0.431 1.00 1.91 H new ATOM 0 HA2 GLY A 608 -4.283 -3.835 -1.830 1.00 2.35 H new ATOM 0 HA3 GLY A 608 -2.754 -2.980 -1.894 1.00 2.35 H new ATOM 1192 N GLU A 609 -3.273 -6.258 -1.932 1.00 2.17 N ATOM 1193 CA GLU A 609 -2.781 -7.617 -2.218 1.00 2.55 C ATOM 1194 C GLU A 609 -1.380 -7.881 -1.602 1.00 1.82 C ATOM 1195 O GLU A 609 -1.106 -7.429 -0.483 1.00 2.52 O ATOM 1196 CB GLU A 609 -2.912 -7.920 -3.731 1.00 3.93 C ATOM 1197 CG GLU A 609 -4.364 -8.106 -4.207 1.00 5.07 C ATOM 1198 CD GLU A 609 -4.870 -6.969 -5.098 1.00 6.79 C ATOM 1199 OE1 GLU A 609 -5.140 -5.866 -4.567 1.00 7.55 O ATOM 1200 OE2 GLU A 609 -5.019 -7.200 -6.325 1.00 7.94 O ATOM 0 H GLU A 609 -4.257 -6.255 -1.665 1.00 2.17 H new ATOM 0 HA GLU A 609 -3.414 -8.346 -1.712 1.00 2.55 H new ATOM 0 HB2 GLU A 609 -2.457 -7.106 -4.295 1.00 3.93 H new ATOM 0 HB3 GLU A 609 -2.346 -8.823 -3.961 1.00 3.93 H new ATOM 0 HG2 GLU A 609 -4.440 -9.046 -4.754 1.00 5.07 H new ATOM 0 HG3 GLU A 609 -5.014 -8.190 -3.336 1.00 5.07 H new ATOM 1207 N ILE A 610 -0.498 -8.621 -2.287 1.00 2.09 N ATOM 1208 CA ILE A 610 0.948 -8.681 -2.002 1.00 2.20 C ATOM 1209 C ILE A 610 1.686 -7.968 -3.145 1.00 1.97 C ATOM 1210 O ILE A 610 2.345 -6.950 -2.919 1.00 3.04 O ATOM 1211 CB ILE A 610 1.416 -10.142 -1.794 1.00 3.24 C ATOM 1212 CG1 ILE A 610 0.695 -10.798 -0.598 1.00 4.38 C ATOM 1213 CG2 ILE A 610 2.947 -10.194 -1.616 1.00 3.74 C ATOM 1214 CD1 ILE A 610 0.945 -12.305 -0.454 1.00 5.73 C ATOM 0 H ILE A 610 -0.773 -9.209 -3.074 1.00 2.09 H new ATOM 0 HA ILE A 610 1.178 -8.170 -1.067 1.00 2.20 H new ATOM 0 HB ILE A 610 1.153 -10.713 -2.685 1.00 3.24 H new ATOM 0 HG12 ILE A 610 1.012 -10.301 0.319 1.00 4.38 H new ATOM 0 HG13 ILE A 610 -0.377 -10.628 -0.698 1.00 4.38 H new ATOM 0 HG21 ILE A 610 3.262 -11.227 -1.471 1.00 3.74 H new ATOM 0 HG22 ILE A 610 3.431 -9.789 -2.505 1.00 3.74 H new ATOM 0 HG23 ILE A 610 3.232 -9.602 -0.746 1.00 3.74 H new ATOM 0 HD11 ILE A 610 0.401 -12.683 0.411 1.00 5.73 H new ATOM 0 HD12 ILE A 610 0.601 -12.818 -1.352 1.00 5.73 H new ATOM 0 HD13 ILE A 610 2.011 -12.486 -0.319 1.00 5.73 H new ATOM 1226 N CYS A 611 1.475 -8.432 -4.381 1.00 1.96 N ATOM 1227 CA CYS A 611 1.834 -7.772 -5.639 1.00 2.31 C ATOM 1228 C CYS A 611 3.340 -7.433 -5.803 1.00 1.64 C ATOM 1229 O CYS A 611 4.209 -8.117 -5.252 1.00 2.34 O ATOM 1230 CB CYS A 611 0.891 -6.566 -5.775 1.00 3.71 C ATOM 1231 SG CYS A 611 0.651 -6.108 -7.517 1.00 5.40 S ATOM 0 H CYS A 611 1.022 -9.332 -4.539 1.00 1.96 H new ATOM 0 HA CYS A 611 1.694 -8.463 -6.470 1.00 2.31 H new ATOM 0 HB2 CYS A 611 -0.072 -6.802 -5.323 1.00 3.71 H new ATOM 0 HB3 CYS A 611 1.301 -5.718 -5.227 1.00 3.71 H new ATOM 0 HG CYS A 611 -0.594 -5.790 -7.714 1.00 5.40 H new ATOM 1237 N LEU A 612 3.643 -6.395 -6.599 1.00 1.88 N ATOM 1238 CA LEU A 612 4.943 -5.980 -7.160 1.00 1.61 C ATOM 1239 C LEU A 612 5.634 -7.096 -7.961 1.00 1.75 C ATOM 1240 O LEU A 612 5.663 -7.043 -9.190 1.00 2.01 O ATOM 1241 CB LEU A 612 5.895 -5.418 -6.076 1.00 1.63 C ATOM 1242 CG LEU A 612 5.542 -4.018 -5.569 1.00 1.29 C ATOM 1243 CD1 LEU A 612 6.268 -3.735 -4.260 1.00 1.84 C ATOM 1244 CD2 LEU A 612 5.935 -2.925 -6.568 1.00 1.02 C ATOM 0 H LEU A 612 2.906 -5.757 -6.898 1.00 1.88 H new ATOM 0 HA LEU A 612 4.714 -5.175 -7.859 1.00 1.61 H new ATOM 0 HB2 LEU A 612 5.902 -6.104 -5.229 1.00 1.63 H new ATOM 0 HB3 LEU A 612 6.908 -5.398 -6.478 1.00 1.63 H new ATOM 0 HG LEU A 612 4.461 -4.000 -5.430 1.00 1.29 H new ATOM 0 HD11 LEU A 612 6.009 -2.736 -3.909 1.00 1.84 H new ATOM 0 HD12 LEU A 612 5.971 -4.471 -3.513 1.00 1.84 H new ATOM 0 HD13 LEU A 612 7.344 -3.795 -4.421 1.00 1.84 H new ATOM 0 HD21 LEU A 612 5.665 -1.949 -6.165 1.00 1.02 H new ATOM 0 HD22 LEU A 612 7.010 -2.961 -6.742 1.00 1.02 H new ATOM 0 HD23 LEU A 612 5.410 -3.086 -7.509 1.00 1.02 H new ATOM 1256 N LEU A 613 6.177 -8.087 -7.249 1.00 1.81 N ATOM 1257 CA LEU A 613 6.951 -9.225 -7.750 1.00 2.06 C ATOM 1258 C LEU A 613 6.184 -10.557 -7.766 1.00 1.95 C ATOM 1259 O LEU A 613 6.665 -11.518 -8.370 1.00 2.31 O ATOM 1260 CB LEU A 613 8.302 -9.334 -7.011 1.00 2.46 C ATOM 1261 CG LEU A 613 8.341 -9.617 -5.491 1.00 2.54 C ATOM 1262 CD1 LEU A 613 7.835 -8.447 -4.653 1.00 2.96 C ATOM 1263 CD2 LEU A 613 7.622 -10.883 -5.020 1.00 3.37 C ATOM 0 H LEU A 613 6.080 -8.117 -6.234 1.00 1.81 H new ATOM 0 HA LEU A 613 7.149 -9.017 -8.802 1.00 2.06 H new ATOM 0 HB2 LEU A 613 8.875 -10.122 -7.500 1.00 2.46 H new ATOM 0 HB3 LEU A 613 8.838 -8.400 -7.179 1.00 2.46 H new ATOM 0 HG LEU A 613 9.407 -9.775 -5.329 1.00 2.54 H new ATOM 0 HD11 LEU A 613 7.887 -8.707 -3.596 1.00 2.96 H new ATOM 0 HD12 LEU A 613 8.454 -7.570 -4.842 1.00 2.96 H new ATOM 0 HD13 LEU A 613 6.802 -8.227 -4.922 1.00 2.96 H new ATOM 0 HD21 LEU A 613 7.718 -10.975 -3.938 1.00 3.37 H new ATOM 0 HD22 LEU A 613 6.567 -10.823 -5.287 1.00 3.37 H new ATOM 0 HD23 LEU A 613 8.068 -11.754 -5.499 1.00 3.37 H new ATOM 1275 N THR A 614 5.019 -10.627 -7.113 1.00 1.66 N ATOM 1276 CA THR A 614 4.126 -11.802 -7.169 1.00 1.72 C ATOM 1277 C THR A 614 2.844 -11.508 -7.949 1.00 1.60 C ATOM 1278 O THR A 614 2.445 -10.347 -8.085 1.00 1.74 O ATOM 1279 CB THR A 614 3.841 -12.400 -5.783 1.00 2.18 C ATOM 1280 OG1 THR A 614 3.236 -13.655 -5.972 1.00 2.98 O ATOM 1281 CG2 THR A 614 2.915 -11.564 -4.910 1.00 2.29 C ATOM 0 H THR A 614 4.663 -9.871 -6.528 1.00 1.66 H new ATOM 0 HA THR A 614 4.665 -12.571 -7.722 1.00 1.72 H new ATOM 0 HB THR A 614 4.798 -12.451 -5.263 1.00 2.18 H new ATOM 0 HG1 THR A 614 3.045 -14.060 -5.101 1.00 2.98 H new ATOM 0 HG21 THR A 614 2.770 -12.063 -3.952 1.00 2.29 H new ATOM 0 HG22 THR A 614 3.359 -10.582 -4.745 1.00 2.29 H new ATOM 0 HG23 THR A 614 1.952 -11.448 -5.408 1.00 2.29 H new ATOM 1289 N ARG A 615 2.209 -12.557 -8.484 1.00 1.73 N ATOM 1290 CA ARG A 615 1.014 -12.473 -9.337 1.00 1.85 C ATOM 1291 C ARG A 615 0.050 -13.647 -9.173 1.00 1.98 C ATOM 1292 O ARG A 615 0.450 -14.772 -8.865 1.00 2.59 O ATOM 1293 CB ARG A 615 1.406 -12.240 -10.811 1.00 2.63 C ATOM 1294 CG ARG A 615 2.462 -13.190 -11.401 1.00 3.00 C ATOM 1295 CD ARG A 615 2.743 -12.834 -12.869 1.00 3.85 C ATOM 1296 NE ARG A 615 1.630 -13.209 -13.760 1.00 4.72 N ATOM 1297 CZ ARG A 615 1.296 -12.672 -14.918 1.00 5.85 C ATOM 1298 NH1 ARG A 615 1.875 -11.628 -15.431 1.00 6.30 N ATOM 1299 NH2 ARG A 615 0.337 -13.223 -15.597 1.00 7.03 N ATOM 0 H ARG A 615 2.520 -13.516 -8.332 1.00 1.73 H new ATOM 0 HA ARG A 615 0.453 -11.605 -8.992 1.00 1.85 H new ATOM 0 HB2 ARG A 615 0.504 -12.313 -11.419 1.00 2.63 H new ATOM 0 HB3 ARG A 615 1.774 -11.219 -10.908 1.00 2.63 H new ATOM 0 HG2 ARG A 615 3.383 -13.125 -10.822 1.00 3.00 H new ATOM 0 HG3 ARG A 615 2.113 -14.220 -11.330 1.00 3.00 H new ATOM 0 HD2 ARG A 615 2.926 -11.763 -12.952 1.00 3.85 H new ATOM 0 HD3 ARG A 615 3.652 -13.339 -13.195 1.00 3.85 H new ATOM 0 HE ARG A 615 1.044 -13.981 -13.441 1.00 4.72 H new ATOM 0 HH11 ARG A 615 2.639 -11.172 -14.932 1.00 6.30 H new ATOM 0 HH12 ARG A 615 1.566 -11.265 -16.333 1.00 6.30 H new ATOM 0 HH21 ARG A 615 -0.137 -14.049 -15.232 1.00 7.03 H new ATOM 0 HH22 ARG A 615 0.057 -12.830 -16.496 1.00 7.03 H new ATOM 1313 N GLY A 616 -1.224 -13.344 -9.408 1.00 1.93 N ATOM 1314 CA GLY A 616 -2.406 -14.190 -9.202 1.00 2.23 C ATOM 1315 C GLY A 616 -3.407 -13.479 -8.283 1.00 2.03 C ATOM 1316 O GLY A 616 -3.008 -12.832 -7.314 1.00 2.36 O ATOM 0 H GLY A 616 -1.482 -12.429 -9.777 1.00 1.93 H new ATOM 0 HA2 GLY A 616 -2.875 -14.413 -10.160 1.00 2.23 H new ATOM 0 HA3 GLY A 616 -2.109 -15.142 -8.763 1.00 2.23 H new ATOM 1320 N ARG A 617 -4.698 -13.521 -8.618 1.00 1.83 N ATOM 1321 CA ARG A 617 -5.745 -12.686 -8.001 1.00 1.61 C ATOM 1322 C ARG A 617 -6.082 -13.113 -6.567 1.00 1.76 C ATOM 1323 O ARG A 617 -6.057 -14.298 -6.225 1.00 2.11 O ATOM 1324 CB ARG A 617 -6.993 -12.671 -8.898 1.00 1.73 C ATOM 1325 CG ARG A 617 -6.703 -12.006 -10.252 1.00 2.13 C ATOM 1326 CD ARG A 617 -7.921 -11.948 -11.178 1.00 1.82 C ATOM 1327 NE ARG A 617 -8.298 -13.286 -11.670 1.00 2.52 N ATOM 1328 CZ ARG A 617 -7.853 -13.885 -12.763 1.00 3.92 C ATOM 1329 NH1 ARG A 617 -7.054 -13.325 -13.627 1.00 5.02 N ATOM 1330 NH2 ARG A 617 -8.212 -15.097 -13.052 1.00 4.81 N ATOM 0 H ARG A 617 -5.058 -14.146 -9.339 1.00 1.83 H new ATOM 0 HA ARG A 617 -5.354 -11.672 -7.920 1.00 1.61 H new ATOM 0 HB2 ARG A 617 -7.339 -13.692 -9.059 1.00 1.73 H new ATOM 0 HB3 ARG A 617 -7.799 -12.137 -8.394 1.00 1.73 H new ATOM 0 HG2 ARG A 617 -6.339 -10.993 -10.080 1.00 2.13 H new ATOM 0 HG3 ARG A 617 -5.902 -12.552 -10.752 1.00 2.13 H new ATOM 0 HD2 ARG A 617 -8.763 -11.506 -10.645 1.00 1.82 H new ATOM 0 HD3 ARG A 617 -7.703 -11.297 -12.025 1.00 1.82 H new ATOM 0 HE ARG A 617 -8.973 -13.805 -11.108 1.00 2.52 H new ATOM 0 HH11 ARG A 617 -6.734 -12.368 -13.480 1.00 5.02 H new ATOM 0 HH12 ARG A 617 -6.748 -13.844 -14.450 1.00 5.02 H new ATOM 0 HH21 ARG A 617 -8.846 -15.602 -12.433 1.00 4.81 H new ATOM 0 HH22 ARG A 617 -7.860 -15.545 -13.898 1.00 4.81 H new ATOM 1344 N ARG A 618 -6.416 -12.125 -5.733 1.00 1.74 N ATOM 1345 CA ARG A 618 -6.811 -12.236 -4.309 1.00 2.00 C ATOM 1346 C ARG A 618 -8.098 -11.428 -4.064 1.00 1.90 C ATOM 1347 O ARG A 618 -8.561 -10.763 -4.991 1.00 2.21 O ATOM 1348 CB ARG A 618 -5.633 -11.795 -3.413 1.00 2.47 C ATOM 1349 CG ARG A 618 -4.417 -12.740 -3.534 1.00 3.21 C ATOM 1350 CD ARG A 618 -3.151 -12.193 -2.864 1.00 2.95 C ATOM 1351 NE ARG A 618 -3.295 -12.059 -1.404 1.00 3.46 N ATOM 1352 CZ ARG A 618 -2.881 -12.887 -0.466 1.00 4.49 C ATOM 1353 NH1 ARG A 618 -2.331 -14.038 -0.717 1.00 5.13 N ATOM 1354 NH2 ARG A 618 -3.024 -12.540 0.775 1.00 5.64 N ATOM 0 H ARG A 618 -6.421 -11.155 -6.048 1.00 1.74 H new ATOM 0 HA ARG A 618 -7.037 -13.270 -4.050 1.00 2.00 H new ATOM 0 HB2 ARG A 618 -5.332 -10.783 -3.685 1.00 2.47 H new ATOM 0 HB3 ARG A 618 -5.962 -11.762 -2.374 1.00 2.47 H new ATOM 0 HG2 ARG A 618 -4.668 -13.702 -3.088 1.00 3.21 H new ATOM 0 HG3 ARG A 618 -4.211 -12.922 -4.589 1.00 3.21 H new ATOM 0 HD2 ARG A 618 -2.313 -12.855 -3.083 1.00 2.95 H new ATOM 0 HD3 ARG A 618 -2.909 -11.220 -3.292 1.00 2.95 H new ATOM 0 HE ARG A 618 -3.775 -11.220 -1.078 1.00 3.46 H new ATOM 0 HH11 ARG A 618 -2.201 -14.341 -1.682 1.00 5.13 H new ATOM 0 HH12 ARG A 618 -2.030 -14.638 0.051 1.00 5.13 H new ATOM 0 HH21 ARG A 618 -3.449 -11.643 1.008 1.00 5.64 H new ATOM 0 HH22 ARG A 618 -2.711 -13.164 1.518 1.00 5.64 H new ATOM 1368 N THR A 619 -8.699 -11.507 -2.871 1.00 1.77 N ATOM 1369 CA THR A 619 -9.971 -10.822 -2.547 1.00 1.76 C ATOM 1370 C THR A 619 -10.010 -10.293 -1.108 1.00 1.54 C ATOM 1371 O THR A 619 -9.709 -11.025 -0.162 1.00 1.78 O ATOM 1372 CB THR A 619 -11.159 -11.770 -2.792 1.00 2.15 C ATOM 1373 OG1 THR A 619 -11.296 -11.991 -4.178 1.00 3.13 O ATOM 1374 CG2 THR A 619 -12.514 -11.227 -2.341 1.00 3.11 C ATOM 0 H THR A 619 -8.320 -12.049 -2.094 1.00 1.77 H new ATOM 0 HA THR A 619 -10.044 -9.958 -3.207 1.00 1.76 H new ATOM 0 HB THR A 619 -10.926 -12.663 -2.212 1.00 2.15 H new ATOM 0 HG1 THR A 619 -12.050 -12.596 -4.340 1.00 3.13 H new ATOM 0 HG21 THR A 619 -13.290 -11.963 -2.553 1.00 3.11 H new ATOM 0 HG22 THR A 619 -12.487 -11.027 -1.270 1.00 3.11 H new ATOM 0 HG23 THR A 619 -12.733 -10.304 -2.877 1.00 3.11 H new ATOM 1382 N ALA A 620 -10.433 -9.040 -0.928 1.00 1.39 N ATOM 1383 CA ALA A 620 -10.655 -8.367 0.353 1.00 1.21 C ATOM 1384 C ALA A 620 -12.061 -7.744 0.473 1.00 1.21 C ATOM 1385 O ALA A 620 -12.667 -7.325 -0.520 1.00 1.53 O ATOM 1386 CB ALA A 620 -9.598 -7.266 0.518 1.00 1.47 C ATOM 0 H ALA A 620 -10.642 -8.432 -1.720 1.00 1.39 H new ATOM 0 HA ALA A 620 -10.574 -9.119 1.138 1.00 1.21 H new ATOM 0 HB1 ALA A 620 -9.750 -6.755 1.469 1.00 1.47 H new ATOM 0 HB2 ALA A 620 -8.603 -7.711 0.501 1.00 1.47 H new ATOM 0 HB3 ALA A 620 -9.689 -6.549 -0.298 1.00 1.47 H new ATOM 1392 N SER A 621 -12.524 -7.589 1.715 1.00 1.06 N ATOM 1393 CA SER A 621 -13.685 -6.775 2.104 1.00 1.06 C ATOM 1394 C SER A 621 -13.278 -5.819 3.228 1.00 0.95 C ATOM 1395 O SER A 621 -13.121 -6.229 4.377 1.00 1.00 O ATOM 1396 CB SER A 621 -14.843 -7.672 2.558 1.00 1.20 C ATOM 1397 OG SER A 621 -15.272 -8.503 1.495 1.00 1.93 O ATOM 0 H SER A 621 -12.084 -8.045 2.514 1.00 1.06 H new ATOM 0 HA SER A 621 -14.023 -6.197 1.243 1.00 1.06 H new ATOM 0 HB2 SER A 621 -14.527 -8.285 3.402 1.00 1.20 H new ATOM 0 HB3 SER A 621 -15.673 -7.057 2.904 1.00 1.20 H new ATOM 0 HG SER A 621 -16.010 -9.071 1.801 1.00 1.93 H new ATOM 1403 N VAL A 622 -13.053 -4.541 2.906 1.00 0.88 N ATOM 1404 CA VAL A 622 -12.566 -3.543 3.878 1.00 0.88 C ATOM 1405 C VAL A 622 -13.083 -2.129 3.581 1.00 0.86 C ATOM 1406 O VAL A 622 -13.138 -1.703 2.424 1.00 0.84 O ATOM 1407 CB VAL A 622 -11.027 -3.621 3.982 1.00 1.02 C ATOM 1408 CG1 VAL A 622 -10.295 -3.453 2.651 1.00 1.02 C ATOM 1409 CG2 VAL A 622 -10.458 -2.618 4.983 1.00 1.09 C ATOM 0 H VAL A 622 -13.201 -4.165 1.969 1.00 0.88 H new ATOM 0 HA VAL A 622 -12.977 -3.786 4.858 1.00 0.88 H new ATOM 0 HB VAL A 622 -10.847 -4.637 4.333 1.00 1.02 H new ATOM 0 HG11 VAL A 622 -9.220 -3.521 2.816 1.00 1.02 H new ATOM 0 HG12 VAL A 622 -10.607 -4.238 1.963 1.00 1.02 H new ATOM 0 HG13 VAL A 622 -10.535 -2.479 2.224 1.00 1.02 H new ATOM 0 HG21 VAL A 622 -9.373 -2.714 5.018 1.00 1.09 H new ATOM 0 HG22 VAL A 622 -10.723 -1.606 4.675 1.00 1.09 H new ATOM 0 HG23 VAL A 622 -10.872 -2.816 5.972 1.00 1.09 H new ATOM 1419 N ARG A 623 -13.472 -1.400 4.638 1.00 0.90 N ATOM 1420 CA ARG A 623 -14.150 -0.091 4.567 1.00 0.87 C ATOM 1421 C ARG A 623 -13.630 0.917 5.589 1.00 0.84 C ATOM 1422 O ARG A 623 -13.098 0.555 6.636 1.00 0.80 O ATOM 1423 CB ARG A 623 -15.675 -0.297 4.694 1.00 0.93 C ATOM 1424 CG ARG A 623 -16.112 -0.631 6.132 1.00 1.04 C ATOM 1425 CD ARG A 623 -17.471 -1.336 6.195 1.00 0.96 C ATOM 1426 NE ARG A 623 -18.576 -0.468 5.741 1.00 1.88 N ATOM 1427 CZ ARG A 623 -19.746 -0.299 6.332 1.00 2.58 C ATOM 1428 NH1 ARG A 623 -20.068 -0.842 7.468 1.00 2.76 N ATOM 1429 NH2 ARG A 623 -20.638 0.462 5.777 1.00 3.72 N ATOM 0 H ARG A 623 -13.320 -1.713 5.597 1.00 0.90 H new ATOM 0 HA ARG A 623 -13.922 0.347 3.595 1.00 0.87 H new ATOM 0 HB2 ARG A 623 -16.188 0.606 4.363 1.00 0.93 H new ATOM 0 HB3 ARG A 623 -15.985 -1.102 4.028 1.00 0.93 H new ATOM 0 HG2 ARG A 623 -15.358 -1.265 6.597 1.00 1.04 H new ATOM 0 HG3 ARG A 623 -16.158 0.289 6.715 1.00 1.04 H new ATOM 0 HD2 ARG A 623 -17.441 -2.234 5.578 1.00 0.96 H new ATOM 0 HD3 ARG A 623 -17.663 -1.659 7.218 1.00 0.96 H new ATOM 0 HE ARG A 623 -18.420 0.057 4.880 1.00 1.88 H new ATOM 0 HH11 ARG A 623 -19.400 -1.438 7.956 1.00 2.76 H new ATOM 0 HH12 ARG A 623 -20.989 -0.672 7.872 1.00 2.76 H new ATOM 0 HH21 ARG A 623 -20.434 0.925 4.891 1.00 3.72 H new ATOM 0 HH22 ARG A 623 -21.544 0.598 6.226 1.00 3.72 H new ATOM 1443 N ALA A 624 -13.822 2.195 5.297 1.00 0.87 N ATOM 1444 CA ALA A 624 -13.483 3.289 6.198 1.00 0.82 C ATOM 1445 C ALA A 624 -14.514 3.387 7.338 1.00 0.75 C ATOM 1446 O ALA A 624 -15.716 3.451 7.087 1.00 0.85 O ATOM 1447 CB ALA A 624 -13.353 4.574 5.373 1.00 0.99 C ATOM 0 H ALA A 624 -14.224 2.507 4.413 1.00 0.87 H new ATOM 0 HA ALA A 624 -12.525 3.112 6.686 1.00 0.82 H new ATOM 0 HB1 ALA A 624 -13.099 5.405 6.031 1.00 0.99 H new ATOM 0 HB2 ALA A 624 -12.568 4.449 4.627 1.00 0.99 H new ATOM 0 HB3 ALA A 624 -14.299 4.783 4.873 1.00 0.99 H new ATOM 1453 N ASP A 625 -14.053 3.404 8.593 1.00 0.72 N ATOM 1454 CA ASP A 625 -14.930 3.449 9.784 1.00 0.90 C ATOM 1455 C ASP A 625 -15.467 4.862 10.080 1.00 0.99 C ATOM 1456 O ASP A 625 -16.343 5.083 10.913 1.00 1.17 O ATOM 1457 CB ASP A 625 -14.131 2.945 10.997 1.00 1.05 C ATOM 1458 CG ASP A 625 -15.011 2.110 11.924 1.00 1.55 C ATOM 1459 OD1 ASP A 625 -15.493 1.038 11.489 1.00 2.94 O ATOM 1460 OD2 ASP A 625 -15.221 2.503 13.097 1.00 1.77 O ATOM 0 H ASP A 625 -13.059 3.387 8.820 1.00 0.72 H new ATOM 0 HA ASP A 625 -15.795 2.816 9.584 1.00 0.90 H new ATOM 0 HB2 ASP A 625 -13.285 2.347 10.657 1.00 1.05 H new ATOM 0 HB3 ASP A 625 -13.722 3.794 11.545 1.00 1.05 H new ATOM 1465 N THR A 626 -14.840 5.821 9.416 1.00 0.92 N ATOM 1466 CA THR A 626 -14.824 7.262 9.657 1.00 0.96 C ATOM 1467 C THR A 626 -14.283 7.926 8.379 1.00 0.88 C ATOM 1468 O THR A 626 -13.846 7.227 7.462 1.00 0.82 O ATOM 1469 CB THR A 626 -13.935 7.554 10.887 1.00 1.05 C ATOM 1470 OG1 THR A 626 -13.809 8.937 11.132 1.00 1.12 O ATOM 1471 CG2 THR A 626 -12.527 6.967 10.771 1.00 1.05 C ATOM 0 H THR A 626 -14.266 5.586 8.606 1.00 0.92 H new ATOM 0 HA THR A 626 -15.816 7.658 9.873 1.00 0.96 H new ATOM 0 HB THR A 626 -14.451 7.069 11.716 1.00 1.05 H new ATOM 0 HG1 THR A 626 -13.241 9.080 11.918 1.00 1.12 H new ATOM 0 HG21 THR A 626 -11.957 7.209 11.668 1.00 1.05 H new ATOM 0 HG22 THR A 626 -12.592 5.884 10.664 1.00 1.05 H new ATOM 0 HG23 THR A 626 -12.028 7.389 9.899 1.00 1.05 H new ATOM 1479 N TYR A 627 -14.270 9.254 8.293 1.00 0.93 N ATOM 1480 CA TYR A 627 -13.494 9.962 7.272 1.00 0.94 C ATOM 1481 C TYR A 627 -12.010 9.566 7.413 1.00 1.02 C ATOM 1482 O TYR A 627 -11.422 9.712 8.487 1.00 1.38 O ATOM 1483 CB TYR A 627 -13.765 11.472 7.402 1.00 1.05 C ATOM 1484 CG TYR A 627 -12.641 12.400 6.975 1.00 1.51 C ATOM 1485 CD1 TYR A 627 -11.625 12.743 7.892 1.00 2.87 C ATOM 1486 CD2 TYR A 627 -12.626 12.948 5.679 1.00 1.85 C ATOM 1487 CE1 TYR A 627 -10.576 13.598 7.507 1.00 3.41 C ATOM 1488 CE2 TYR A 627 -11.595 13.833 5.301 1.00 2.19 C ATOM 1489 CZ TYR A 627 -10.561 14.149 6.210 1.00 2.65 C ATOM 1490 OH TYR A 627 -9.557 14.986 5.839 1.00 3.24 O ATOM 0 H TYR A 627 -14.791 9.866 8.921 1.00 0.93 H new ATOM 0 HA TYR A 627 -13.791 9.683 6.261 1.00 0.94 H new ATOM 0 HB2 TYR A 627 -14.649 11.712 6.811 1.00 1.05 H new ATOM 0 HB3 TYR A 627 -14.009 11.687 8.442 1.00 1.05 H new ATOM 0 HD1 TYR A 627 -11.653 12.347 8.896 1.00 2.87 H new ATOM 0 HD2 TYR A 627 -13.403 12.691 4.974 1.00 1.85 H new ATOM 0 HE1 TYR A 627 -9.784 13.831 8.204 1.00 3.41 H new ATOM 0 HE2 TYR A 627 -11.596 14.270 4.314 1.00 2.19 H new ATOM 0 HH TYR A 627 -9.697 15.275 4.913 1.00 3.24 H new ATOM 1500 N CYS A 628 -11.407 9.016 6.356 1.00 0.76 N ATOM 1501 CA CYS A 628 -10.043 8.482 6.379 1.00 0.74 C ATOM 1502 C CYS A 628 -9.223 8.982 5.184 1.00 0.77 C ATOM 1503 O CYS A 628 -9.605 8.797 4.024 1.00 0.80 O ATOM 1504 CB CYS A 628 -10.087 6.946 6.450 1.00 0.70 C ATOM 1505 SG CYS A 628 -8.489 6.308 7.022 1.00 2.76 S ATOM 0 H CYS A 628 -11.860 8.928 5.446 1.00 0.76 H new ATOM 0 HA CYS A 628 -9.537 8.849 7.272 1.00 0.74 H new ATOM 0 HB2 CYS A 628 -10.879 6.627 7.127 1.00 0.70 H new ATOM 0 HB3 CYS A 628 -10.322 6.535 5.468 1.00 0.70 H new ATOM 0 HG CYS A 628 -8.377 5.056 6.689 1.00 2.76 H new ATOM 1511 N ARG A 629 -8.073 9.590 5.494 1.00 0.83 N ATOM 1512 CA ARG A 629 -7.029 10.026 4.556 1.00 0.90 C ATOM 1513 C ARG A 629 -6.128 8.830 4.240 1.00 0.84 C ATOM 1514 O ARG A 629 -5.412 8.340 5.120 1.00 0.86 O ATOM 1515 CB ARG A 629 -6.220 11.152 5.241 1.00 1.16 C ATOM 1516 CG ARG A 629 -6.977 12.480 5.410 1.00 1.68 C ATOM 1517 CD ARG A 629 -6.962 13.310 4.120 1.00 1.23 C ATOM 1518 NE ARG A 629 -5.846 14.272 4.066 1.00 1.58 N ATOM 1519 CZ ARG A 629 -5.896 15.553 4.379 1.00 2.14 C ATOM 1520 NH1 ARG A 629 -6.909 16.111 4.973 1.00 2.84 N ATOM 1521 NH2 ARG A 629 -4.889 16.307 4.074 1.00 2.92 N ATOM 0 H ARG A 629 -7.831 9.804 6.461 1.00 0.83 H new ATOM 0 HA ARG A 629 -7.456 10.399 3.625 1.00 0.90 H new ATOM 0 HB2 ARG A 629 -5.901 10.805 6.224 1.00 1.16 H new ATOM 0 HB3 ARG A 629 -5.317 11.336 4.659 1.00 1.16 H new ATOM 0 HG2 ARG A 629 -8.008 12.277 5.700 1.00 1.68 H new ATOM 0 HG3 ARG A 629 -6.526 13.056 6.218 1.00 1.68 H new ATOM 0 HD2 ARG A 629 -6.897 12.639 3.264 1.00 1.23 H new ATOM 0 HD3 ARG A 629 -7.905 13.850 4.031 1.00 1.23 H new ATOM 0 HE ARG A 629 -4.944 13.911 3.755 1.00 1.58 H new ATOM 0 HH11 ARG A 629 -7.725 15.552 5.223 1.00 2.84 H new ATOM 0 HH12 ARG A 629 -6.888 17.108 5.189 1.00 2.84 H new ATOM 0 HH21 ARG A 629 -4.078 15.908 3.601 1.00 2.92 H new ATOM 0 HH22 ARG A 629 -4.906 17.300 4.307 1.00 2.92 H new ATOM 1535 N LEU A 630 -6.153 8.380 2.989 1.00 0.82 N ATOM 1536 CA LEU A 630 -5.263 7.344 2.452 1.00 0.81 C ATOM 1537 C LEU A 630 -4.226 7.945 1.491 1.00 0.96 C ATOM 1538 O LEU A 630 -4.400 9.036 0.951 1.00 1.07 O ATOM 1539 CB LEU A 630 -6.064 6.228 1.744 1.00 0.75 C ATOM 1540 CG LEU A 630 -7.130 5.471 2.563 1.00 0.71 C ATOM 1541 CD1 LEU A 630 -7.631 4.258 1.767 1.00 0.80 C ATOM 1542 CD2 LEU A 630 -6.570 4.945 3.882 1.00 0.82 C ATOM 0 H LEU A 630 -6.812 8.734 2.296 1.00 0.82 H new ATOM 0 HA LEU A 630 -4.734 6.903 3.297 1.00 0.81 H new ATOM 0 HB2 LEU A 630 -6.559 6.669 0.879 1.00 0.75 H new ATOM 0 HB3 LEU A 630 -5.352 5.495 1.364 1.00 0.75 H new ATOM 0 HG LEU A 630 -7.934 6.179 2.767 1.00 0.71 H new ATOM 0 HD11 LEU A 630 -8.384 3.726 2.349 1.00 0.80 H new ATOM 0 HD12 LEU A 630 -8.070 4.595 0.828 1.00 0.80 H new ATOM 0 HD13 LEU A 630 -6.796 3.590 1.558 1.00 0.80 H new ATOM 0 HD21 LEU A 630 -7.354 4.419 4.426 1.00 0.82 H new ATOM 0 HD22 LEU A 630 -5.746 4.260 3.680 1.00 0.82 H new ATOM 0 HD23 LEU A 630 -6.209 5.780 4.483 1.00 0.82 H new ATOM 1554 N TYR A 631 -3.164 7.193 1.233 1.00 0.97 N ATOM 1555 CA TYR A 631 -2.168 7.472 0.203 1.00 1.04 C ATOM 1556 C TYR A 631 -2.113 6.286 -0.782 1.00 1.06 C ATOM 1557 O TYR A 631 -2.209 5.130 -0.359 1.00 1.28 O ATOM 1558 CB TYR A 631 -0.825 7.787 0.885 1.00 1.21 C ATOM 1559 CG TYR A 631 -0.178 9.072 0.410 1.00 2.43 C ATOM 1560 CD1 TYR A 631 0.260 9.184 -0.919 1.00 3.44 C ATOM 1561 CD2 TYR A 631 -0.052 10.173 1.279 1.00 3.87 C ATOM 1562 CE1 TYR A 631 0.776 10.405 -1.388 1.00 5.07 C ATOM 1563 CE2 TYR A 631 0.484 11.391 0.816 1.00 5.31 C ATOM 1564 CZ TYR A 631 0.887 11.515 -0.530 1.00 5.77 C ATOM 1565 OH TYR A 631 1.344 12.697 -1.026 1.00 7.47 O ATOM 0 H TYR A 631 -2.964 6.339 1.754 1.00 0.97 H new ATOM 0 HA TYR A 631 -2.430 8.349 -0.389 1.00 1.04 H new ATOM 0 HB2 TYR A 631 -0.982 7.848 1.962 1.00 1.21 H new ATOM 0 HB3 TYR A 631 -0.137 6.960 0.709 1.00 1.21 H new ATOM 0 HD1 TYR A 631 0.201 8.333 -1.581 1.00 3.44 H new ATOM 0 HD2 TYR A 631 -0.368 10.083 2.308 1.00 3.87 H new ATOM 0 HE1 TYR A 631 1.090 10.492 -2.418 1.00 5.07 H new ATOM 0 HE2 TYR A 631 0.586 12.228 1.491 1.00 5.31 H new ATOM 0 HH TYR A 631 1.362 13.367 -0.311 1.00 7.47 H new ATOM 1575 N SER A 632 -1.989 6.556 -2.086 1.00 0.97 N ATOM 1576 CA SER A 632 -2.099 5.559 -3.165 1.00 1.01 C ATOM 1577 C SER A 632 -0.829 5.523 -4.018 1.00 0.96 C ATOM 1578 O SER A 632 -0.332 6.565 -4.455 1.00 1.17 O ATOM 1579 CB SER A 632 -3.304 5.887 -4.057 1.00 1.34 C ATOM 1580 OG SER A 632 -4.508 5.886 -3.307 1.00 2.40 O ATOM 0 H SER A 632 -1.805 7.497 -2.433 1.00 0.97 H new ATOM 0 HA SER A 632 -2.234 4.580 -2.706 1.00 1.01 H new ATOM 0 HB2 SER A 632 -3.162 6.863 -4.522 1.00 1.34 H new ATOM 0 HB3 SER A 632 -3.373 5.157 -4.863 1.00 1.34 H new ATOM 0 HG SER A 632 -5.175 6.444 -3.759 1.00 2.40 H new ATOM 1586 N LEU A 633 -0.304 4.324 -4.286 1.00 0.83 N ATOM 1587 CA LEU A 633 0.960 4.123 -5.003 1.00 0.82 C ATOM 1588 C LEU A 633 0.793 3.059 -6.097 1.00 0.85 C ATOM 1589 O LEU A 633 0.514 1.886 -5.828 1.00 0.80 O ATOM 1590 CB LEU A 633 2.057 3.801 -3.966 1.00 0.81 C ATOM 1591 CG LEU A 633 3.506 4.127 -4.370 1.00 0.93 C ATOM 1592 CD1 LEU A 633 4.411 3.922 -3.153 1.00 1.20 C ATOM 1593 CD2 LEU A 633 4.036 3.261 -5.509 1.00 1.35 C ATOM 0 H LEU A 633 -0.752 3.451 -4.007 1.00 0.83 H new ATOM 0 HA LEU A 633 1.266 5.026 -5.532 1.00 0.82 H new ATOM 0 HB2 LEU A 633 1.829 4.344 -3.049 1.00 0.81 H new ATOM 0 HB3 LEU A 633 2.000 2.739 -3.729 1.00 0.81 H new ATOM 0 HG LEU A 633 3.509 5.159 -4.722 1.00 0.93 H new ATOM 0 HD11 LEU A 633 5.442 4.149 -3.424 1.00 1.20 H new ATOM 0 HD12 LEU A 633 4.093 4.584 -2.348 1.00 1.20 H new ATOM 0 HD13 LEU A 633 4.343 2.886 -2.820 1.00 1.20 H new ATOM 0 HD21 LEU A 633 5.062 3.549 -5.738 1.00 1.35 H new ATOM 0 HD22 LEU A 633 4.011 2.213 -5.211 1.00 1.35 H new ATOM 0 HD23 LEU A 633 3.414 3.402 -6.393 1.00 1.35 H new ATOM 1605 N SER A 634 0.966 3.485 -7.349 1.00 1.06 N ATOM 1606 CA SER A 634 0.953 2.601 -8.511 1.00 1.17 C ATOM 1607 C SER A 634 2.105 1.605 -8.476 1.00 1.10 C ATOM 1608 O SER A 634 3.280 1.982 -8.512 1.00 0.96 O ATOM 1609 CB SER A 634 0.973 3.397 -9.814 1.00 1.31 C ATOM 1610 OG SER A 634 1.897 4.467 -9.802 1.00 2.78 O ATOM 0 H SER A 634 1.121 4.465 -7.585 1.00 1.06 H new ATOM 0 HA SER A 634 0.022 2.035 -8.470 1.00 1.17 H new ATOM 0 HB2 SER A 634 1.216 2.726 -10.638 1.00 1.31 H new ATOM 0 HB3 SER A 634 -0.025 3.790 -10.007 1.00 1.31 H new ATOM 0 HG SER A 634 2.399 4.475 -10.644 1.00 2.78 H new ATOM 1616 N VAL A 635 1.763 0.314 -8.444 1.00 1.30 N ATOM 1617 CA VAL A 635 2.742 -0.765 -8.290 1.00 1.43 C ATOM 1618 C VAL A 635 3.839 -0.698 -9.338 1.00 1.31 C ATOM 1619 O VAL A 635 5.020 -0.919 -9.077 1.00 1.50 O ATOM 1620 CB VAL A 635 2.060 -2.142 -8.275 1.00 1.71 C ATOM 1621 CG1 VAL A 635 2.031 -2.893 -9.597 1.00 1.71 C ATOM 1622 CG2 VAL A 635 2.979 -3.038 -7.502 1.00 2.47 C ATOM 0 H VAL A 635 0.800 -0.012 -8.524 1.00 1.30 H new ATOM 0 HA VAL A 635 3.222 -0.623 -7.322 1.00 1.43 H new ATOM 0 HB VAL A 635 1.047 -1.951 -7.921 1.00 1.71 H new ATOM 0 HG11 VAL A 635 1.525 -3.849 -9.461 1.00 1.71 H new ATOM 0 HG12 VAL A 635 1.496 -2.302 -10.340 1.00 1.71 H new ATOM 0 HG13 VAL A 635 3.051 -3.068 -9.939 1.00 1.71 H new ATOM 0 HG21 VAL A 635 2.553 -4.040 -7.452 1.00 2.47 H new ATOM 0 HG22 VAL A 635 3.948 -3.080 -7.998 1.00 2.47 H new ATOM 0 HG23 VAL A 635 3.105 -2.646 -6.493 1.00 2.47 H new ATOM 1632 N ASP A 636 3.440 -0.373 -10.555 1.00 1.10 N ATOM 1633 CA ASP A 636 4.335 -0.544 -11.677 1.00 1.21 C ATOM 1634 C ASP A 636 5.410 0.561 -11.707 1.00 1.06 C ATOM 1635 O ASP A 636 6.505 0.350 -12.229 1.00 1.27 O ATOM 1636 CB ASP A 636 3.533 -0.529 -12.982 1.00 1.35 C ATOM 1637 CG ASP A 636 2.562 -1.700 -13.106 1.00 1.79 C ATOM 1638 OD1 ASP A 636 2.979 -2.811 -13.509 1.00 2.59 O ATOM 1639 OD2 ASP A 636 1.365 -1.510 -12.803 1.00 2.13 O ATOM 0 H ASP A 636 2.520 0.003 -10.786 1.00 1.10 H new ATOM 0 HA ASP A 636 4.841 -1.503 -11.569 1.00 1.21 H new ATOM 0 HB2 ASP A 636 2.975 0.405 -13.047 1.00 1.35 H new ATOM 0 HB3 ASP A 636 4.223 -0.547 -13.825 1.00 1.35 H new ATOM 1644 N ASN A 637 5.123 1.729 -11.114 1.00 0.83 N ATOM 1645 CA ASN A 637 6.071 2.841 -10.986 1.00 0.79 C ATOM 1646 C ASN A 637 7.067 2.628 -9.833 1.00 0.79 C ATOM 1647 O ASN A 637 8.139 3.226 -9.863 1.00 0.96 O ATOM 1648 CB ASN A 637 5.314 4.171 -10.846 1.00 0.98 C ATOM 1649 CG ASN A 637 4.481 4.476 -12.076 1.00 1.45 C ATOM 1650 OD1 ASN A 637 3.272 4.297 -12.076 1.00 2.44 O ATOM 1651 ND2 ASN A 637 5.085 4.921 -13.151 1.00 1.36 N ATOM 0 H ASN A 637 4.211 1.929 -10.704 1.00 0.83 H new ATOM 0 HA ASN A 637 6.666 2.879 -11.898 1.00 0.79 H new ATOM 0 HB2 ASN A 637 4.667 4.131 -9.970 1.00 0.98 H new ATOM 0 HB3 ASN A 637 6.026 4.979 -10.680 1.00 0.98 H new ATOM 0 HD21 ASN A 637 4.546 5.120 -13.994 1.00 1.36 H new ATOM 0 HD22 ASN A 637 6.094 5.068 -13.145 1.00 1.36 H new ATOM 1658 N PHE A 638 6.755 1.751 -8.868 1.00 0.75 N ATOM 1659 CA PHE A 638 7.685 1.169 -7.891 1.00 0.80 C ATOM 1660 C PHE A 638 8.605 0.156 -8.594 1.00 0.83 C ATOM 1661 O PHE A 638 9.826 0.233 -8.480 1.00 0.78 O ATOM 1662 CB PHE A 638 6.862 0.536 -6.759 1.00 1.05 C ATOM 1663 CG PHE A 638 7.579 0.053 -5.504 1.00 1.15 C ATOM 1664 CD1 PHE A 638 8.706 -0.798 -5.552 1.00 1.65 C ATOM 1665 CD2 PHE A 638 7.023 0.370 -4.251 1.00 2.29 C ATOM 1666 CE1 PHE A 638 9.294 -1.271 -4.367 1.00 1.76 C ATOM 1667 CE2 PHE A 638 7.608 -0.111 -3.069 1.00 2.40 C ATOM 1668 CZ PHE A 638 8.759 -0.911 -3.125 1.00 1.50 C ATOM 0 H PHE A 638 5.801 1.412 -8.742 1.00 0.75 H new ATOM 0 HA PHE A 638 8.331 1.932 -7.456 1.00 0.80 H new ATOM 0 HB2 PHE A 638 6.113 1.265 -6.450 1.00 1.05 H new ATOM 0 HB3 PHE A 638 6.325 -0.315 -7.179 1.00 1.05 H new ATOM 0 HD1 PHE A 638 9.119 -1.087 -6.507 1.00 1.65 H new ATOM 0 HD2 PHE A 638 6.139 0.988 -4.198 1.00 2.29 H new ATOM 0 HE1 PHE A 638 10.161 -1.914 -4.415 1.00 1.76 H new ATOM 0 HE2 PHE A 638 7.170 0.136 -2.113 1.00 2.40 H new ATOM 0 HZ PHE A 638 9.230 -1.248 -2.213 1.00 1.50 H new ATOM 1678 N ASN A 639 8.043 -0.750 -9.400 1.00 1.00 N ATOM 1679 CA ASN A 639 8.829 -1.709 -10.185 1.00 1.14 C ATOM 1680 C ASN A 639 9.774 -1.026 -11.210 1.00 1.12 C ATOM 1681 O ASN A 639 10.827 -1.577 -11.523 1.00 1.26 O ATOM 1682 CB ASN A 639 7.856 -2.700 -10.855 1.00 1.31 C ATOM 1683 CG ASN A 639 7.340 -3.787 -9.922 1.00 1.65 C ATOM 1684 OD1 ASN A 639 8.048 -4.302 -9.069 1.00 2.33 O ATOM 1685 ND2 ASN A 639 6.116 -4.232 -10.086 1.00 1.51 N ATOM 0 H ASN A 639 7.035 -0.840 -9.527 1.00 1.00 H new ATOM 0 HA ASN A 639 9.497 -2.249 -9.514 1.00 1.14 H new ATOM 0 HB2 ASN A 639 7.007 -2.146 -11.255 1.00 1.31 H new ATOM 0 HB3 ASN A 639 8.357 -3.170 -11.701 1.00 1.31 H new ATOM 0 HD21 ASN A 639 5.769 -4.996 -9.506 1.00 1.51 H new ATOM 0 HD22 ASN A 639 5.512 -3.814 -10.793 1.00 1.51 H new ATOM 1692 N GLU A 640 9.461 0.190 -11.674 1.00 1.01 N ATOM 1693 CA GLU A 640 10.331 1.012 -12.534 1.00 1.08 C ATOM 1694 C GLU A 640 11.579 1.525 -11.794 1.00 1.09 C ATOM 1695 O GLU A 640 12.696 1.446 -12.308 1.00 1.35 O ATOM 1696 CB GLU A 640 9.530 2.227 -13.035 1.00 1.03 C ATOM 1697 CG GLU A 640 8.779 2.019 -14.362 1.00 1.81 C ATOM 1698 CD GLU A 640 9.693 1.965 -15.599 1.00 2.43 C ATOM 1699 OE1 GLU A 640 10.186 0.866 -15.962 1.00 3.52 O ATOM 1700 OE2 GLU A 640 9.915 3.030 -16.227 1.00 2.83 O ATOM 0 H GLU A 640 8.574 0.644 -11.458 1.00 1.01 H new ATOM 0 HA GLU A 640 10.665 0.382 -13.358 1.00 1.08 H new ATOM 0 HB2 GLU A 640 8.808 2.506 -12.268 1.00 1.03 H new ATOM 0 HB3 GLU A 640 10.213 3.069 -13.151 1.00 1.03 H new ATOM 0 HG2 GLU A 640 8.210 1.091 -14.303 1.00 1.81 H new ATOM 0 HG3 GLU A 640 8.059 2.827 -14.490 1.00 1.81 H new ATOM 1707 N VAL A 641 11.402 2.071 -10.587 1.00 0.89 N ATOM 1708 CA VAL A 641 12.494 2.589 -9.737 1.00 0.92 C ATOM 1709 C VAL A 641 13.327 1.463 -9.123 1.00 1.01 C ATOM 1710 O VAL A 641 14.527 1.628 -8.929 1.00 1.15 O ATOM 1711 CB VAL A 641 11.938 3.584 -8.700 1.00 0.80 C ATOM 1712 CG1 VAL A 641 10.802 3.032 -7.853 1.00 0.70 C ATOM 1713 CG2 VAL A 641 12.974 4.172 -7.742 1.00 0.84 C ATOM 0 H VAL A 641 10.481 2.170 -10.160 1.00 0.89 H new ATOM 0 HA VAL A 641 13.192 3.143 -10.364 1.00 0.92 H new ATOM 0 HB VAL A 641 11.567 4.377 -9.349 1.00 0.80 H new ATOM 0 HG11 VAL A 641 10.469 3.795 -7.149 1.00 0.70 H new ATOM 0 HG12 VAL A 641 9.972 2.747 -8.499 1.00 0.70 H new ATOM 0 HG13 VAL A 641 11.150 2.158 -7.302 1.00 0.70 H new ATOM 0 HG21 VAL A 641 12.483 4.859 -7.053 1.00 0.84 H new ATOM 0 HG22 VAL A 641 13.446 3.367 -7.178 1.00 0.84 H new ATOM 0 HG23 VAL A 641 13.733 4.709 -8.311 1.00 0.84 H new ATOM 1723 N LEU A 642 12.745 0.277 -8.948 1.00 1.01 N ATOM 1724 CA LEU A 642 13.471 -0.976 -8.690 1.00 1.20 C ATOM 1725 C LEU A 642 14.660 -1.235 -9.636 1.00 1.39 C ATOM 1726 O LEU A 642 15.681 -1.766 -9.209 1.00 1.58 O ATOM 1727 CB LEU A 642 12.495 -2.132 -8.683 1.00 1.24 C ATOM 1728 CG LEU A 642 12.902 -3.010 -7.490 1.00 1.27 C ATOM 1729 CD1 LEU A 642 12.382 -2.492 -6.151 1.00 1.95 C ATOM 1730 CD2 LEU A 642 12.299 -4.346 -7.710 1.00 3.01 C ATOM 0 H LEU A 642 11.733 0.153 -8.982 1.00 1.01 H new ATOM 0 HA LEU A 642 13.931 -0.875 -7.707 1.00 1.20 H new ATOM 0 HB2 LEU A 642 11.469 -1.778 -8.577 1.00 1.24 H new ATOM 0 HB3 LEU A 642 12.544 -2.692 -9.617 1.00 1.24 H new ATOM 0 HG LEU A 642 13.991 -3.020 -7.438 1.00 1.27 H new ATOM 0 HD11 LEU A 642 12.706 -3.159 -5.352 1.00 1.95 H new ATOM 0 HD12 LEU A 642 12.775 -1.492 -5.970 1.00 1.95 H new ATOM 0 HD13 LEU A 642 11.293 -2.455 -6.173 1.00 1.95 H new ATOM 0 HD21 LEU A 642 12.563 -5.005 -6.883 1.00 3.01 H new ATOM 0 HD22 LEU A 642 11.215 -4.251 -7.766 1.00 3.01 H new ATOM 0 HD23 LEU A 642 12.675 -4.766 -8.643 1.00 3.01 H new ATOM 1742 N GLU A 643 14.564 -0.835 -10.907 1.00 1.40 N ATOM 1743 CA GLU A 643 15.622 -1.053 -11.903 1.00 1.61 C ATOM 1744 C GLU A 643 16.750 0.006 -11.820 1.00 1.55 C ATOM 1745 O GLU A 643 17.852 -0.226 -12.329 1.00 1.65 O ATOM 1746 CB GLU A 643 14.977 -1.111 -13.300 1.00 1.89 C ATOM 1747 CG GLU A 643 13.861 -2.170 -13.440 1.00 2.51 C ATOM 1748 CD GLU A 643 14.238 -3.472 -14.168 1.00 3.31 C ATOM 1749 OE1 GLU A 643 15.435 -3.834 -14.291 1.00 3.53 O ATOM 1750 OE2 GLU A 643 13.301 -4.180 -14.624 1.00 4.39 O ATOM 0 H GLU A 643 13.748 -0.349 -11.278 1.00 1.40 H new ATOM 0 HA GLU A 643 16.114 -2.003 -11.693 1.00 1.61 H new ATOM 0 HB2 GLU A 643 14.564 -0.131 -13.538 1.00 1.89 H new ATOM 0 HB3 GLU A 643 15.753 -1.317 -14.037 1.00 1.89 H new ATOM 0 HG2 GLU A 643 13.508 -2.427 -12.442 1.00 2.51 H new ATOM 0 HG3 GLU A 643 13.023 -1.715 -13.967 1.00 2.51 H new ATOM 1757 N GLU A 644 16.533 1.150 -11.149 1.00 1.44 N ATOM 1758 CA GLU A 644 17.543 2.192 -10.930 1.00 1.48 C ATOM 1759 C GLU A 644 18.541 1.858 -9.810 1.00 1.38 C ATOM 1760 O GLU A 644 19.620 2.451 -9.753 1.00 1.47 O ATOM 1761 CB GLU A 644 16.814 3.490 -10.600 1.00 1.47 C ATOM 1762 CG GLU A 644 16.019 4.019 -11.793 1.00 1.60 C ATOM 1763 CD GLU A 644 16.847 4.998 -12.627 1.00 1.85 C ATOM 1764 OE1 GLU A 644 16.945 6.194 -12.265 1.00 1.66 O ATOM 1765 OE2 GLU A 644 17.456 4.566 -13.635 1.00 3.31 O ATOM 0 H GLU A 644 15.629 1.378 -10.736 1.00 1.44 H new ATOM 0 HA GLU A 644 18.135 2.279 -11.841 1.00 1.48 H new ATOM 0 HB2 GLU A 644 16.140 3.324 -9.760 1.00 1.47 H new ATOM 0 HB3 GLU A 644 17.537 4.242 -10.284 1.00 1.47 H new ATOM 0 HG2 GLU A 644 15.701 3.185 -12.418 1.00 1.60 H new ATOM 0 HG3 GLU A 644 15.115 4.515 -11.439 1.00 1.60 H new ATOM 1772 N TYR A 645 18.180 0.919 -8.933 1.00 1.23 N ATOM 1773 CA TYR A 645 18.939 0.523 -7.741 1.00 1.12 C ATOM 1774 C TYR A 645 19.118 -1.010 -7.716 1.00 1.14 C ATOM 1775 O TYR A 645 18.408 -1.706 -6.983 1.00 1.12 O ATOM 1776 CB TYR A 645 18.257 1.078 -6.474 1.00 0.98 C ATOM 1777 CG TYR A 645 18.114 2.592 -6.459 1.00 1.00 C ATOM 1778 CD1 TYR A 645 17.042 3.181 -7.150 1.00 2.24 C ATOM 1779 CD2 TYR A 645 19.046 3.413 -5.796 1.00 1.88 C ATOM 1780 CE1 TYR A 645 16.923 4.575 -7.245 1.00 2.30 C ATOM 1781 CE2 TYR A 645 18.911 4.817 -5.850 1.00 1.91 C ATOM 1782 CZ TYR A 645 17.864 5.402 -6.598 1.00 1.16 C ATOM 1783 OH TYR A 645 17.771 6.755 -6.705 1.00 1.28 O ATOM 0 H TYR A 645 17.314 0.390 -9.037 1.00 1.23 H new ATOM 0 HA TYR A 645 19.940 0.954 -7.771 1.00 1.12 H new ATOM 0 HB2 TYR A 645 17.268 0.629 -6.380 1.00 0.98 H new ATOM 0 HB3 TYR A 645 18.831 0.769 -5.600 1.00 0.98 H new ATOM 0 HD1 TYR A 645 16.298 2.551 -7.615 1.00 2.24 H new ATOM 0 HD2 TYR A 645 19.863 2.969 -5.247 1.00 1.88 H new ATOM 0 HE1 TYR A 645 16.114 5.013 -7.811 1.00 2.30 H new ATOM 0 HE2 TYR A 645 19.610 5.446 -5.318 1.00 1.91 H new ATOM 0 HH TYR A 645 18.497 7.174 -6.198 1.00 1.28 H new ATOM 1793 N PRO A 646 20.032 -1.578 -8.531 1.00 1.22 N ATOM 1794 CA PRO A 646 20.234 -3.028 -8.662 1.00 1.31 C ATOM 1795 C PRO A 646 20.586 -3.790 -7.370 1.00 1.23 C ATOM 1796 O PRO A 646 20.457 -5.019 -7.355 1.00 1.38 O ATOM 1797 CB PRO A 646 21.322 -3.199 -9.729 1.00 1.48 C ATOM 1798 CG PRO A 646 22.027 -1.844 -9.777 1.00 1.41 C ATOM 1799 CD PRO A 646 20.884 -0.878 -9.486 1.00 1.33 C ATOM 0 HA PRO A 646 19.282 -3.481 -8.938 1.00 1.31 H new ATOM 0 HB2 PRO A 646 22.015 -3.998 -9.465 1.00 1.48 H new ATOM 0 HB3 PRO A 646 20.892 -3.457 -10.697 1.00 1.48 H new ATOM 0 HG2 PRO A 646 22.821 -1.771 -9.034 1.00 1.41 H new ATOM 0 HG3 PRO A 646 22.482 -1.656 -10.749 1.00 1.41 H new ATOM 0 HD2 PRO A 646 21.255 0.059 -9.071 1.00 1.33 H new ATOM 0 HD3 PRO A 646 20.336 -0.629 -10.395 1.00 1.33 H new ATOM 1807 N MET A 647 20.971 -3.119 -6.276 1.00 1.12 N ATOM 1808 CA MET A 647 20.998 -3.729 -4.936 1.00 1.15 C ATOM 1809 C MET A 647 19.573 -3.963 -4.407 1.00 1.11 C ATOM 1810 O MET A 647 19.221 -5.069 -4.005 1.00 1.20 O ATOM 1811 CB MET A 647 21.784 -2.823 -3.974 1.00 1.18 C ATOM 1812 CG MET A 647 21.819 -3.393 -2.547 1.00 1.74 C ATOM 1813 SD MET A 647 22.337 -2.226 -1.265 1.00 1.65 S ATOM 1814 CE MET A 647 20.816 -1.245 -1.150 1.00 1.26 C ATOM 0 H MET A 647 21.271 -2.144 -6.292 1.00 1.12 H new ATOM 0 HA MET A 647 21.492 -4.698 -5.004 1.00 1.15 H new ATOM 0 HB2 MET A 647 22.803 -2.702 -4.341 1.00 1.18 H new ATOM 0 HB3 MET A 647 21.331 -1.832 -3.958 1.00 1.18 H new ATOM 0 HG2 MET A 647 20.826 -3.765 -2.297 1.00 1.74 H new ATOM 0 HG3 MET A 647 22.494 -4.249 -2.531 1.00 1.74 H new ATOM 0 HE1 MET A 647 20.760 -0.773 -0.169 1.00 1.26 H new ATOM 0 HE2 MET A 647 20.820 -0.476 -1.922 1.00 1.26 H new ATOM 0 HE3 MET A 647 19.952 -1.895 -1.289 1.00 1.26 H new ATOM 1824 N MET A 648 18.734 -2.927 -4.440 1.00 1.01 N ATOM 1825 CA MET A 648 17.367 -2.967 -3.906 1.00 1.00 C ATOM 1826 C MET A 648 16.470 -3.913 -4.718 1.00 1.08 C ATOM 1827 O MET A 648 15.592 -4.558 -4.153 1.00 1.18 O ATOM 1828 CB MET A 648 16.778 -1.549 -3.873 1.00 0.92 C ATOM 1829 CG MET A 648 17.505 -0.577 -2.932 1.00 1.17 C ATOM 1830 SD MET A 648 16.800 -0.365 -1.271 1.00 1.72 S ATOM 1831 CE MET A 648 16.847 -2.048 -0.591 1.00 1.68 C ATOM 0 H MET A 648 18.985 -2.024 -4.843 1.00 1.01 H new ATOM 0 HA MET A 648 17.410 -3.358 -2.889 1.00 1.00 H new ATOM 0 HB2 MET A 648 16.796 -1.139 -4.883 1.00 0.92 H new ATOM 0 HB3 MET A 648 15.732 -1.611 -3.573 1.00 0.92 H new ATOM 0 HG2 MET A 648 18.535 -0.916 -2.823 1.00 1.17 H new ATOM 0 HG3 MET A 648 17.540 0.400 -3.414 1.00 1.17 H new ATOM 0 HE1 MET A 648 16.681 -2.010 0.486 1.00 1.68 H new ATOM 0 HE2 MET A 648 16.068 -2.651 -1.058 1.00 1.68 H new ATOM 0 HE3 MET A 648 17.821 -2.495 -0.792 1.00 1.68 H new ATOM 1841 N ARG A 649 16.743 -4.079 -6.019 1.00 1.13 N ATOM 1842 CA ARG A 649 16.129 -5.108 -6.880 1.00 1.28 C ATOM 1843 C ARG A 649 16.328 -6.521 -6.322 1.00 1.44 C ATOM 1844 O ARG A 649 15.372 -7.292 -6.224 1.00 1.49 O ATOM 1845 CB ARG A 649 16.728 -4.958 -8.293 1.00 1.38 C ATOM 1846 CG ARG A 649 15.787 -5.327 -9.445 1.00 1.62 C ATOM 1847 CD ARG A 649 15.548 -6.833 -9.677 1.00 1.84 C ATOM 1848 NE ARG A 649 14.503 -7.059 -10.701 1.00 2.77 N ATOM 1849 CZ ARG A 649 14.487 -6.598 -11.938 1.00 3.27 C ATOM 1850 NH1 ARG A 649 15.541 -6.127 -12.534 1.00 3.62 N ATOM 1851 NH2 ARG A 649 13.372 -6.577 -12.598 1.00 4.56 N ATOM 0 H ARG A 649 17.411 -3.490 -6.517 1.00 1.13 H new ATOM 0 HA ARG A 649 15.050 -4.961 -6.916 1.00 1.28 H new ATOM 0 HB2 ARG A 649 17.050 -3.925 -8.425 1.00 1.38 H new ATOM 0 HB3 ARG A 649 17.620 -5.581 -8.360 1.00 1.38 H new ATOM 0 HG2 ARG A 649 14.823 -4.851 -9.265 1.00 1.62 H new ATOM 0 HG3 ARG A 649 16.187 -4.899 -10.364 1.00 1.62 H new ATOM 0 HD2 ARG A 649 16.478 -7.307 -9.992 1.00 1.84 H new ATOM 0 HD3 ARG A 649 15.251 -7.305 -8.740 1.00 1.84 H new ATOM 0 HE ARG A 649 13.709 -7.634 -10.420 1.00 2.77 H new ATOM 0 HH11 ARG A 649 16.435 -6.101 -12.044 1.00 3.62 H new ATOM 0 HH12 ARG A 649 15.474 -5.783 -13.492 1.00 3.62 H new ATOM 0 HH21 ARG A 649 12.514 -6.915 -12.161 1.00 4.56 H new ATOM 0 HH22 ARG A 649 13.352 -6.222 -13.554 1.00 4.56 H new ATOM 1865 N ARG A 650 17.557 -6.831 -5.895 1.00 1.55 N ATOM 1866 CA ARG A 650 17.971 -8.155 -5.399 1.00 1.64 C ATOM 1867 C ARG A 650 17.217 -8.547 -4.128 1.00 1.65 C ATOM 1868 O ARG A 650 16.709 -9.661 -4.028 1.00 1.74 O ATOM 1869 CB ARG A 650 19.488 -8.164 -5.182 1.00 1.83 C ATOM 1870 CG ARG A 650 20.009 -9.591 -4.992 1.00 2.36 C ATOM 1871 CD ARG A 650 21.484 -9.517 -4.610 1.00 2.18 C ATOM 1872 NE ARG A 650 22.061 -10.850 -4.388 1.00 3.34 N ATOM 1873 CZ ARG A 650 23.274 -11.106 -3.939 1.00 4.06 C ATOM 1874 NH1 ARG A 650 24.143 -10.174 -3.666 1.00 4.22 N ATOM 1875 NH2 ARG A 650 23.639 -12.335 -3.737 1.00 5.38 N ATOM 0 H ARG A 650 18.316 -6.150 -5.883 1.00 1.55 H new ATOM 0 HA ARG A 650 17.717 -8.905 -6.148 1.00 1.64 H new ATOM 0 HB2 ARG A 650 19.983 -7.703 -6.037 1.00 1.83 H new ATOM 0 HB3 ARG A 650 19.737 -7.563 -4.307 1.00 1.83 H new ATOM 0 HG2 ARG A 650 19.441 -10.102 -4.215 1.00 2.36 H new ATOM 0 HG3 ARG A 650 19.883 -10.166 -5.909 1.00 2.36 H new ATOM 0 HD2 ARG A 650 22.038 -9.009 -5.399 1.00 2.18 H new ATOM 0 HD3 ARG A 650 21.595 -8.918 -3.706 1.00 2.18 H new ATOM 0 HE ARG A 650 21.468 -11.652 -4.601 1.00 3.34 H new ATOM 0 HH11 ARG A 650 23.897 -9.193 -3.798 1.00 4.22 H new ATOM 0 HH12 ARG A 650 25.069 -10.426 -3.321 1.00 4.22 H new ATOM 0 HH21 ARG A 650 22.989 -13.098 -3.926 1.00 5.38 H new ATOM 0 HH22 ARG A 650 24.576 -12.538 -3.390 1.00 5.38 H new ATOM 1889 N ALA A 651 17.075 -7.596 -3.205 1.00 1.60 N ATOM 1890 CA ALA A 651 16.333 -7.731 -1.946 1.00 1.64 C ATOM 1891 C ALA A 651 14.888 -8.270 -2.091 1.00 1.62 C ATOM 1892 O ALA A 651 14.361 -8.858 -1.143 1.00 1.72 O ATOM 1893 CB ALA A 651 16.309 -6.350 -1.279 1.00 1.62 C ATOM 0 H ALA A 651 17.490 -6.671 -3.316 1.00 1.60 H new ATOM 0 HA ALA A 651 16.848 -8.480 -1.345 1.00 1.64 H new ATOM 0 HB1 ALA A 651 15.764 -6.410 -0.337 1.00 1.62 H new ATOM 0 HB2 ALA A 651 17.330 -6.021 -1.087 1.00 1.62 H new ATOM 0 HB3 ALA A 651 15.816 -5.636 -1.938 1.00 1.62 H new ATOM 1899 N PHE A 652 14.246 -8.080 -3.251 1.00 1.53 N ATOM 1900 CA PHE A 652 12.935 -8.653 -3.586 1.00 1.56 C ATOM 1901 C PHE A 652 12.989 -9.976 -4.377 1.00 1.69 C ATOM 1902 O PHE A 652 12.196 -10.876 -4.113 1.00 1.86 O ATOM 1903 CB PHE A 652 12.121 -7.593 -4.333 1.00 1.46 C ATOM 1904 CG PHE A 652 11.631 -6.453 -3.463 1.00 1.26 C ATOM 1905 CD1 PHE A 652 10.486 -6.612 -2.662 1.00 2.16 C ATOM 1906 CD2 PHE A 652 12.317 -5.227 -3.457 1.00 1.80 C ATOM 1907 CE1 PHE A 652 10.014 -5.542 -1.881 1.00 2.05 C ATOM 1908 CE2 PHE A 652 11.849 -4.154 -2.672 1.00 1.85 C ATOM 1909 CZ PHE A 652 10.691 -4.308 -1.888 1.00 1.14 C ATOM 0 H PHE A 652 14.634 -7.509 -4.002 1.00 1.53 H new ATOM 0 HA PHE A 652 12.454 -8.926 -2.647 1.00 1.56 H new ATOM 0 HB2 PHE A 652 12.732 -7.183 -5.138 1.00 1.46 H new ATOM 0 HB3 PHE A 652 11.261 -8.074 -4.799 1.00 1.46 H new ATOM 0 HD1 PHE A 652 9.967 -7.559 -2.647 1.00 2.16 H new ATOM 0 HD2 PHE A 652 13.207 -5.106 -4.057 1.00 1.80 H new ATOM 0 HE1 PHE A 652 9.130 -5.667 -1.274 1.00 2.05 H new ATOM 0 HE2 PHE A 652 12.380 -3.213 -2.672 1.00 1.85 H new ATOM 0 HZ PHE A 652 10.323 -3.484 -1.295 1.00 1.14 H new ATOM 1919 N GLU A 653 13.914 -10.167 -5.320 1.00 1.70 N ATOM 1920 CA GLU A 653 14.017 -11.457 -6.042 1.00 1.89 C ATOM 1921 C GLU A 653 14.620 -12.593 -5.196 1.00 1.96 C ATOM 1922 O GLU A 653 14.425 -13.773 -5.486 1.00 2.08 O ATOM 1923 CB GLU A 653 14.714 -11.304 -7.394 1.00 2.07 C ATOM 1924 CG GLU A 653 16.112 -10.710 -7.284 1.00 2.08 C ATOM 1925 CD GLU A 653 16.805 -10.566 -8.645 1.00 2.81 C ATOM 1926 OE1 GLU A 653 16.614 -11.432 -9.536 1.00 3.24 O ATOM 1927 OE2 GLU A 653 17.549 -9.581 -8.851 1.00 3.98 O ATOM 0 H GLU A 653 14.596 -9.464 -5.605 1.00 1.70 H new ATOM 0 HA GLU A 653 12.991 -11.764 -6.243 1.00 1.89 H new ATOM 0 HB2 GLU A 653 14.778 -12.280 -7.875 1.00 2.07 H new ATOM 0 HB3 GLU A 653 14.106 -10.670 -8.039 1.00 2.07 H new ATOM 0 HG2 GLU A 653 16.050 -9.732 -6.808 1.00 2.08 H new ATOM 0 HG3 GLU A 653 16.720 -11.342 -6.637 1.00 2.08 H new ATOM 1934 N THR A 654 15.298 -12.241 -4.103 1.00 1.96 N ATOM 1935 CA THR A 654 15.873 -13.190 -3.129 1.00 2.14 C ATOM 1936 C THR A 654 14.817 -13.783 -2.183 1.00 2.23 C ATOM 1937 O THR A 654 15.010 -14.863 -1.623 1.00 2.53 O ATOM 1938 CB THR A 654 17.026 -12.518 -2.369 1.00 2.13 C ATOM 1939 OG1 THR A 654 17.841 -13.471 -1.733 1.00 2.39 O ATOM 1940 CG2 THR A 654 16.545 -11.559 -1.287 1.00 1.99 C ATOM 0 H THR A 654 15.471 -11.266 -3.858 1.00 1.96 H new ATOM 0 HA THR A 654 16.272 -14.041 -3.681 1.00 2.14 H new ATOM 0 HB THR A 654 17.580 -11.965 -3.128 1.00 2.13 H new ATOM 0 HG1 THR A 654 18.567 -13.016 -1.258 1.00 2.39 H new ATOM 0 HG21 THR A 654 17.405 -11.116 -0.785 1.00 1.99 H new ATOM 0 HG22 THR A 654 15.943 -10.771 -1.740 1.00 1.99 H new ATOM 0 HG23 THR A 654 15.942 -12.103 -0.560 1.00 1.99 H new ATOM 1948 N VAL A 655 13.674 -13.096 -2.047 1.00 2.09 N ATOM 1949 CA VAL A 655 12.482 -13.512 -1.284 1.00 2.24 C ATOM 1950 C VAL A 655 11.399 -14.108 -2.186 1.00 2.33 C ATOM 1951 O VAL A 655 10.758 -15.095 -1.827 1.00 2.56 O ATOM 1952 CB VAL A 655 11.953 -12.343 -0.426 1.00 2.23 C ATOM 1953 CG1 VAL A 655 11.651 -11.075 -1.204 1.00 2.03 C ATOM 1954 CG2 VAL A 655 10.744 -12.736 0.422 1.00 2.50 C ATOM 0 H VAL A 655 13.546 -12.186 -2.489 1.00 2.09 H new ATOM 0 HA VAL A 655 12.780 -14.312 -0.606 1.00 2.24 H new ATOM 0 HB VAL A 655 12.788 -12.112 0.236 1.00 2.23 H new ATOM 0 HG11 VAL A 655 11.285 -10.308 -0.522 1.00 2.03 H new ATOM 0 HG12 VAL A 655 12.560 -10.723 -1.692 1.00 2.03 H new ATOM 0 HG13 VAL A 655 10.891 -11.283 -1.958 1.00 2.03 H new ATOM 0 HG21 VAL A 655 10.414 -11.876 1.005 1.00 2.50 H new ATOM 0 HG22 VAL A 655 9.934 -13.066 -0.229 1.00 2.50 H new ATOM 0 HG23 VAL A 655 11.020 -13.547 1.096 1.00 2.50 H new ATOM 1964 N ALA A 656 11.230 -13.561 -3.392 1.00 2.22 N ATOM 1965 CA ALA A 656 10.224 -14.010 -4.361 1.00 2.36 C ATOM 1966 C ALA A 656 10.301 -15.519 -4.671 1.00 2.62 C ATOM 1967 O ALA A 656 9.262 -16.172 -4.777 1.00 2.86 O ATOM 1968 CB ALA A 656 10.386 -13.190 -5.644 1.00 2.27 C ATOM 0 H ALA A 656 11.796 -12.782 -3.729 1.00 2.22 H new ATOM 0 HA ALA A 656 9.241 -13.850 -3.919 1.00 2.36 H new ATOM 0 HB1 ALA A 656 9.645 -13.511 -6.377 1.00 2.27 H new ATOM 0 HB2 ALA A 656 10.242 -12.133 -5.421 1.00 2.27 H new ATOM 0 HB3 ALA A 656 11.386 -13.342 -6.049 1.00 2.27 H new ATOM 1974 N ILE A 657 11.510 -16.094 -4.724 1.00 2.66 N ATOM 1975 CA ILE A 657 11.712 -17.532 -4.967 1.00 2.97 C ATOM 1976 C ILE A 657 11.052 -18.451 -3.918 1.00 3.22 C ATOM 1977 O ILE A 657 10.732 -19.599 -4.225 1.00 3.66 O ATOM 1978 CB ILE A 657 13.205 -17.861 -5.212 1.00 3.02 C ATOM 1979 CG1 ILE A 657 14.227 -17.324 -4.184 1.00 3.87 C ATOM 1980 CG2 ILE A 657 13.611 -17.330 -6.597 1.00 3.29 C ATOM 1981 CD1 ILE A 657 14.009 -17.814 -2.750 1.00 5.05 C ATOM 0 H ILE A 657 12.379 -15.575 -4.599 1.00 2.66 H new ATOM 0 HA ILE A 657 11.176 -17.758 -5.889 1.00 2.97 H new ATOM 0 HB ILE A 657 13.252 -18.946 -5.119 1.00 3.02 H new ATOM 0 HG12 ILE A 657 15.229 -17.612 -4.504 1.00 3.87 H new ATOM 0 HG13 ILE A 657 14.191 -16.235 -4.191 1.00 3.87 H new ATOM 0 HG21 ILE A 657 14.661 -17.556 -6.780 1.00 3.29 H new ATOM 0 HG22 ILE A 657 12.998 -17.806 -7.363 1.00 3.29 H new ATOM 0 HG23 ILE A 657 13.461 -16.251 -6.631 1.00 3.29 H new ATOM 0 HD11 ILE A 657 14.772 -17.387 -2.099 1.00 5.05 H new ATOM 0 HD12 ILE A 657 13.023 -17.503 -2.405 1.00 5.05 H new ATOM 0 HD13 ILE A 657 14.077 -18.902 -2.723 1.00 5.05 H new ATOM 1993 N ASP A 658 10.759 -17.939 -2.720 1.00 3.18 N ATOM 1994 CA ASP A 658 9.986 -18.611 -1.670 1.00 3.78 C ATOM 1995 C ASP A 658 8.536 -18.102 -1.595 1.00 4.04 C ATOM 1996 O ASP A 658 7.627 -18.877 -1.300 1.00 4.67 O ATOM 1997 CB ASP A 658 10.714 -18.409 -0.335 1.00 3.99 C ATOM 1998 CG ASP A 658 10.017 -19.135 0.815 1.00 4.95 C ATOM 1999 OD1 ASP A 658 9.845 -20.374 0.726 1.00 5.70 O ATOM 2000 OD2 ASP A 658 9.675 -18.473 1.823 1.00 5.48 O ATOM 0 H ASP A 658 11.066 -17.007 -2.443 1.00 3.18 H new ATOM 0 HA ASP A 658 9.918 -19.673 -1.904 1.00 3.78 H new ATOM 0 HB2 ASP A 658 11.739 -18.770 -0.423 1.00 3.99 H new ATOM 0 HB3 ASP A 658 10.769 -17.344 -0.110 1.00 3.99 H new ATOM 2005 N ARG A 659 8.296 -16.818 -1.897 1.00 3.70 N ATOM 2006 CA ARG A 659 6.978 -16.158 -1.793 1.00 4.06 C ATOM 2007 C ARG A 659 5.904 -16.774 -2.703 1.00 4.46 C ATOM 2008 O ARG A 659 4.731 -16.836 -2.323 1.00 4.84 O ATOM 2009 CB ARG A 659 7.157 -14.653 -2.079 1.00 3.81 C ATOM 2010 CG ARG A 659 6.208 -13.764 -1.262 1.00 3.78 C ATOM 2011 CD ARG A 659 6.690 -13.624 0.192 1.00 3.37 C ATOM 2012 NE ARG A 659 5.771 -12.779 0.977 1.00 3.93 N ATOM 2013 CZ ARG A 659 4.623 -13.122 1.533 1.00 4.84 C ATOM 2014 NH1 ARG A 659 4.198 -14.353 1.591 1.00 5.68 N ATOM 2015 NH2 ARG A 659 3.875 -12.187 2.040 1.00 5.49 N ATOM 0 H ARG A 659 9.028 -16.190 -2.229 1.00 3.70 H new ATOM 0 HA ARG A 659 6.609 -16.311 -0.779 1.00 4.06 H new ATOM 0 HB2 ARG A 659 8.187 -14.369 -1.863 1.00 3.81 H new ATOM 0 HB3 ARG A 659 6.992 -14.470 -3.141 1.00 3.81 H new ATOM 0 HG2 ARG A 659 6.142 -12.778 -1.723 1.00 3.78 H new ATOM 0 HG3 ARG A 659 5.205 -14.190 -1.276 1.00 3.78 H new ATOM 0 HD2 ARG A 659 6.763 -14.610 0.651 1.00 3.37 H new ATOM 0 HD3 ARG A 659 7.690 -13.190 0.207 1.00 3.37 H new ATOM 0 HE ARG A 659 6.058 -11.809 1.107 1.00 3.93 H new ATOM 0 HH11 ARG A 659 4.761 -15.106 1.195 1.00 5.68 H new ATOM 0 HH12 ARG A 659 3.303 -14.563 2.032 1.00 5.68 H new ATOM 0 HH21 ARG A 659 4.179 -11.214 2.003 1.00 5.49 H new ATOM 0 HH22 ARG A 659 2.984 -12.426 2.475 1.00 5.49 H new ATOM 2029 N LEU A 660 6.312 -17.252 -3.882 1.00 4.46 N ATOM 2030 CA LEU A 660 5.460 -17.934 -4.873 1.00 4.87 C ATOM 2031 C LEU A 660 5.166 -19.404 -4.487 1.00 5.31 C ATOM 2032 O LEU A 660 4.257 -20.024 -5.036 1.00 5.85 O ATOM 2033 CB LEU A 660 6.140 -17.827 -6.260 1.00 4.91 C ATOM 2034 CG LEU A 660 5.994 -16.487 -7.022 1.00 5.43 C ATOM 2035 CD1 LEU A 660 4.624 -16.349 -7.685 1.00 5.79 C ATOM 2036 CD2 LEU A 660 6.217 -15.242 -6.164 1.00 5.98 C ATOM 0 H LEU A 660 7.282 -17.174 -4.189 1.00 4.46 H new ATOM 0 HA LEU A 660 4.487 -17.443 -4.903 1.00 4.87 H new ATOM 0 HB2 LEU A 660 7.204 -18.027 -6.130 1.00 4.91 H new ATOM 0 HB3 LEU A 660 5.741 -18.620 -6.893 1.00 4.91 H new ATOM 0 HG LEU A 660 6.786 -16.535 -7.770 1.00 5.43 H new ATOM 0 HD11 LEU A 660 4.567 -15.394 -8.208 1.00 5.79 H new ATOM 0 HD12 LEU A 660 4.481 -17.162 -8.397 1.00 5.79 H new ATOM 0 HD13 LEU A 660 3.845 -16.393 -6.924 1.00 5.79 H new ATOM 0 HD21 LEU A 660 6.095 -14.350 -6.779 1.00 5.98 H new ATOM 0 HD22 LEU A 660 5.490 -15.225 -5.352 1.00 5.98 H new ATOM 0 HD23 LEU A 660 7.225 -15.262 -5.749 1.00 5.98 H new ATOM 2048 N ASP A 661 5.907 -19.939 -3.513 1.00 5.22 N ATOM 2049 CA ASP A 661 5.710 -21.249 -2.869 1.00 5.70 C ATOM 2050 C ASP A 661 5.451 -22.402 -3.869 1.00 7.03 C ATOM 2051 O ASP A 661 6.230 -22.573 -4.810 1.00 7.85 O ATOM 2052 CB ASP A 661 4.672 -21.090 -1.743 1.00 6.08 C ATOM 2053 CG ASP A 661 4.792 -22.210 -0.714 1.00 6.25 C ATOM 2054 OD1 ASP A 661 5.697 -22.135 0.157 1.00 6.10 O ATOM 2055 OD2 ASP A 661 3.997 -23.173 -0.797 1.00 7.02 O ATOM 0 H ASP A 661 6.710 -19.443 -3.127 1.00 5.22 H new ATOM 0 HA ASP A 661 6.641 -21.575 -2.406 1.00 5.70 H new ATOM 0 HB2 ASP A 661 4.810 -20.127 -1.252 1.00 6.08 H new ATOM 0 HB3 ASP A 661 3.668 -21.090 -2.168 1.00 6.08 H new ATOM 2060 N ARG A 662 4.400 -23.221 -3.697 1.00 7.79 N ATOM 2061 CA ARG A 662 3.913 -24.201 -4.686 1.00 9.43 C ATOM 2062 C ARG A 662 2.829 -23.678 -5.651 1.00 10.75 C ATOM 2063 O ARG A 662 2.348 -24.427 -6.506 1.00 12.16 O ATOM 2064 CB ARG A 662 3.463 -25.430 -3.888 1.00 9.83 C ATOM 2065 CG ARG A 662 2.240 -25.135 -2.999 1.00 10.00 C ATOM 2066 CD ARG A 662 2.150 -26.101 -1.822 1.00 10.21 C ATOM 2067 NE ARG A 662 3.154 -25.843 -0.771 1.00 9.75 N ATOM 2068 CZ ARG A 662 3.431 -26.637 0.250 1.00 10.04 C ATOM 2069 NH1 ARG A 662 2.842 -27.786 0.420 1.00 10.70 N ATOM 2070 NH2 ARG A 662 4.323 -26.292 1.129 1.00 10.13 N ATOM 0 H ARG A 662 3.848 -23.220 -2.839 1.00 7.79 H new ATOM 0 HA ARG A 662 4.723 -24.446 -5.373 1.00 9.43 H new ATOM 0 HB2 ARG A 662 3.222 -26.239 -4.577 1.00 9.83 H new ATOM 0 HB3 ARG A 662 4.287 -25.777 -3.265 1.00 9.83 H new ATOM 0 HG2 ARG A 662 2.300 -24.112 -2.626 1.00 10.00 H new ATOM 0 HG3 ARG A 662 1.331 -25.204 -3.596 1.00 10.00 H new ATOM 0 HD2 ARG A 662 1.153 -26.037 -1.385 1.00 10.21 H new ATOM 0 HD3 ARG A 662 2.273 -27.120 -2.188 1.00 10.21 H new ATOM 0 HE ARG A 662 3.682 -24.973 -0.838 1.00 9.75 H new ATOM 0 HH11 ARG A 662 2.139 -28.102 -0.248 1.00 10.70 H new ATOM 0 HH12 ARG A 662 3.084 -28.370 1.221 1.00 10.70 H new ATOM 0 HH21 ARG A 662 4.815 -25.404 1.035 1.00 10.13 H new ATOM 0 HH22 ARG A 662 4.531 -26.909 1.914 1.00 10.13 H new ATOM 2084 N ILE A 663 2.402 -22.422 -5.493 1.00 10.67 N ATOM 2085 CA ILE A 663 1.214 -21.809 -6.120 1.00 12.19 C ATOM 2086 C ILE A 663 1.499 -20.807 -7.245 1.00 13.64 C ATOM 2087 O ILE A 663 0.617 -20.064 -7.686 1.00 14.63 O ATOM 2088 CB ILE A 663 0.288 -21.252 -5.063 1.00 12.07 C ATOM 2089 CG1 ILE A 663 0.993 -20.293 -4.126 1.00 10.77 C ATOM 2090 CG2 ILE A 663 -0.258 -22.428 -4.235 1.00 12.53 C ATOM 2091 CD1 ILE A 663 1.142 -18.842 -4.597 1.00 11.40 C ATOM 0 H ILE A 663 2.899 -21.764 -4.892 1.00 10.67 H new ATOM 0 HA ILE A 663 0.708 -22.621 -6.642 1.00 12.19 H new ATOM 0 HB ILE A 663 -0.507 -20.702 -5.566 1.00 12.07 H new ATOM 0 HG12 ILE A 663 0.454 -20.288 -3.179 1.00 10.77 H new ATOM 0 HG13 ILE A 663 1.989 -20.687 -3.924 1.00 10.77 H new ATOM 0 HG21 ILE A 663 -0.930 -22.050 -3.465 1.00 12.53 H new ATOM 0 HG22 ILE A 663 -0.802 -23.111 -4.888 1.00 12.53 H new ATOM 0 HG23 ILE A 663 0.571 -22.958 -3.765 1.00 12.53 H new ATOM 0 HD11 ILE A 663 1.663 -18.264 -3.834 1.00 11.40 H new ATOM 0 HD12 ILE A 663 1.714 -18.817 -5.525 1.00 11.40 H new ATOM 0 HD13 ILE A 663 0.155 -18.412 -4.767 1.00 11.40 H new ATOM 2103 N GLY A 664 2.752 -20.761 -7.679 1.00 14.07 N ATOM 2104 CA GLY A 664 3.271 -19.754 -8.603 1.00 15.66 C ATOM 2105 C GLY A 664 2.583 -19.717 -9.974 1.00 17.01 C ATOM 2106 O GLY A 664 2.421 -18.620 -10.523 1.00 18.28 O ATOM 0 H GLY A 664 3.456 -21.440 -7.392 1.00 14.07 H new ATOM 0 HA2 GLY A 664 3.175 -18.773 -8.138 1.00 15.66 H new ATOM 0 HA3 GLY A 664 4.336 -19.934 -8.752 1.00 15.66 H new ATOM 2110 N LYS A 665 2.116 -20.866 -10.488 1.00 16.96 N ATOM 2111 CA LYS A 665 1.249 -21.033 -11.675 1.00 18.31 C ATOM 2112 C LYS A 665 1.709 -20.239 -12.910 1.00 19.68 C ATOM 2113 O LYS A 665 1.162 -19.178 -13.230 1.00 20.26 O ATOM 2114 CB LYS A 665 -0.210 -20.762 -11.280 1.00 18.07 C ATOM 2115 CG LYS A 665 -0.776 -21.807 -10.298 1.00 17.17 C ATOM 2116 CD LYS A 665 -2.070 -21.356 -9.606 1.00 17.11 C ATOM 2117 CE LYS A 665 -3.156 -20.929 -10.601 1.00 18.41 C ATOM 2118 NZ LYS A 665 -4.419 -20.588 -9.912 1.00 18.51 N ATOM 0 H LYS A 665 2.346 -21.763 -10.061 1.00 16.96 H new ATOM 0 HA LYS A 665 1.333 -22.068 -12.005 1.00 18.31 H new ATOM 0 HB2 LYS A 665 -0.280 -19.773 -10.828 1.00 18.07 H new ATOM 0 HB3 LYS A 665 -0.826 -20.746 -12.179 1.00 18.07 H new ATOM 0 HG2 LYS A 665 -0.965 -22.735 -10.837 1.00 17.17 H new ATOM 0 HG3 LYS A 665 -0.025 -22.026 -9.539 1.00 17.17 H new ATOM 0 HD2 LYS A 665 -2.449 -22.170 -8.988 1.00 17.11 H new ATOM 0 HD3 LYS A 665 -1.849 -20.524 -8.937 1.00 17.11 H new ATOM 0 HE2 LYS A 665 -2.809 -20.069 -11.173 1.00 18.41 H new ATOM 0 HE3 LYS A 665 -3.335 -21.734 -11.313 1.00 18.41 H new ATOM 0 HZ1 LYS A 665 -5.132 -20.304 -10.614 1.00 18.51 H new ATOM 0 HZ2 LYS A 665 -4.762 -21.417 -9.386 1.00 18.51 H new ATOM 0 HZ3 LYS A 665 -4.253 -19.803 -9.250 1.00 18.51 H new ATOM 2132 N LYS A 666 2.714 -20.743 -13.629 1.00 20.41 N ATOM 2133 CA LYS A 666 3.289 -20.137 -14.850 1.00 21.86 C ATOM 2134 C LYS A 666 2.236 -19.835 -15.932 1.00 23.12 C ATOM 2135 O LYS A 666 1.364 -20.667 -16.204 1.00 23.66 O ATOM 2136 CB LYS A 666 4.396 -21.071 -15.376 1.00 22.50 C ATOM 2137 CG LYS A 666 5.069 -20.550 -16.651 1.00 23.63 C ATOM 2138 CD LYS A 666 6.232 -21.444 -17.091 1.00 24.24 C ATOM 2139 CE LYS A 666 6.835 -20.865 -18.374 1.00 25.66 C ATOM 2140 NZ LYS A 666 7.948 -21.698 -18.874 1.00 26.31 N ATOM 0 H LYS A 666 3.173 -21.618 -13.374 1.00 20.41 H new ATOM 0 HA LYS A 666 3.709 -19.165 -14.591 1.00 21.86 H new ATOM 0 HB2 LYS A 666 5.151 -21.201 -14.601 1.00 22.50 H new ATOM 0 HB3 LYS A 666 3.969 -22.054 -15.574 1.00 22.50 H new ATOM 0 HG2 LYS A 666 4.332 -20.492 -17.452 1.00 23.63 H new ATOM 0 HG3 LYS A 666 5.434 -19.537 -16.480 1.00 23.63 H new ATOM 0 HD2 LYS A 666 6.988 -21.495 -16.307 1.00 24.24 H new ATOM 0 HD3 LYS A 666 5.883 -22.462 -17.263 1.00 24.24 H new ATOM 0 HE2 LYS A 666 6.062 -20.791 -19.139 1.00 25.66 H new ATOM 0 HE3 LYS A 666 7.193 -19.853 -18.184 1.00 25.66 H new ATOM 0 HZ1 LYS A 666 8.333 -21.277 -19.744 1.00 26.31 H new ATOM 0 HZ2 LYS A 666 8.696 -21.748 -18.153 1.00 26.31 H new ATOM 0 HZ3 LYS A 666 7.600 -22.656 -19.078 1.00 26.31 H new ATOM 2154 N ASN A 667 2.354 -18.668 -16.570 1.00 23.75 N ATOM 2155 CA ASN A 667 1.578 -18.260 -17.747 1.00 25.11 C ATOM 2156 C ASN A 667 2.432 -18.326 -19.026 1.00 26.19 C ATOM 2157 O ASN A 667 3.547 -17.794 -19.046 1.00 26.22 O ATOM 2158 CB ASN A 667 1.014 -16.845 -17.524 1.00 25.27 C ATOM 2159 CG ASN A 667 0.280 -16.355 -18.762 1.00 26.59 C ATOM 2160 OD1 ASN A 667 -0.716 -16.937 -19.164 1.00 27.04 O ATOM 2161 ND2 ASN A 667 0.767 -15.339 -19.431 1.00 27.39 N ATOM 0 H ASN A 667 3.017 -17.953 -16.271 1.00 23.75 H new ATOM 0 HA ASN A 667 0.747 -18.953 -17.881 1.00 25.11 H new ATOM 0 HB2 ASN A 667 0.335 -16.849 -16.671 1.00 25.27 H new ATOM 0 HB3 ASN A 667 1.826 -16.159 -17.282 1.00 25.27 H new ATOM 0 HD21 ASN A 667 0.314 -15.031 -20.291 1.00 27.39 H new ATOM 0 HD22 ASN A 667 1.599 -14.856 -19.091 1.00 27.39 H new ATOM 2168 N SER A 668 1.883 -18.912 -20.091 1.00 27.25 N ATOM 2169 CA SER A 668 2.576 -19.154 -21.366 1.00 28.46 C ATOM 2170 C SER A 668 1.710 -18.769 -22.582 1.00 29.58 C ATOM 2171 O SER A 668 0.634 -18.174 -22.444 1.00 29.79 O ATOM 2172 CB SER A 668 3.029 -20.623 -21.421 1.00 28.66 C ATOM 2173 OG SER A 668 3.849 -20.919 -20.304 1.00 27.71 O ATOM 0 H SER A 668 0.918 -19.242 -20.095 1.00 27.25 H new ATOM 0 HA SER A 668 3.454 -18.511 -21.416 1.00 28.46 H new ATOM 0 HB2 SER A 668 2.160 -21.280 -21.429 1.00 28.66 H new ATOM 0 HB3 SER A 668 3.577 -20.809 -22.345 1.00 28.66 H new ATOM 0 HG SER A 668 4.132 -21.856 -20.345 1.00 27.71 H new ATOM 2179 N ILE A 669 2.199 -19.067 -23.790 1.00 30.45 N ATOM 2180 CA ILE A 669 1.625 -18.647 -25.081 1.00 31.65 C ATOM 2181 C ILE A 669 0.192 -19.141 -25.350 1.00 32.00 C ATOM 2182 O ILE A 669 -0.265 -20.143 -24.791 1.00 31.57 O ATOM 2183 CB ILE A 669 2.564 -19.052 -26.242 1.00 32.76 C ATOM 2184 CG1 ILE A 669 2.758 -20.586 -26.336 1.00 32.96 C ATOM 2185 CG2 ILE A 669 3.897 -18.302 -26.090 1.00 32.77 C ATOM 2186 CD1 ILE A 669 3.577 -21.033 -27.553 1.00 34.27 C ATOM 0 H ILE A 669 3.041 -19.631 -23.904 1.00 30.45 H new ATOM 0 HA ILE A 669 1.543 -17.562 -25.019 1.00 31.65 H new ATOM 0 HB ILE A 669 2.102 -18.764 -27.186 1.00 32.76 H new ATOM 0 HG12 ILE A 669 3.251 -20.937 -25.429 1.00 32.96 H new ATOM 0 HG13 ILE A 669 1.780 -21.065 -26.372 1.00 32.96 H new ATOM 0 HG21 ILE A 669 4.566 -18.581 -26.904 1.00 32.77 H new ATOM 0 HG22 ILE A 669 3.716 -17.228 -26.121 1.00 32.77 H new ATOM 0 HG23 ILE A 669 4.356 -18.565 -25.137 1.00 32.77 H new ATOM 0 HD11 ILE A 669 3.670 -22.119 -27.550 1.00 34.27 H new ATOM 0 HD12 ILE A 669 3.075 -20.714 -28.466 1.00 34.27 H new ATOM 0 HD13 ILE A 669 4.569 -20.584 -27.509 1.00 34.27 H new ATOM 2198 N LEU A 670 -0.492 -18.455 -26.269 1.00 32.98 N ATOM 2199 CA LEU A 670 -1.832 -18.771 -26.785 1.00 33.75 C ATOM 2200 C LEU A 670 -1.762 -19.218 -28.261 1.00 35.12 C ATOM 2201 O LEU A 670 -2.529 -18.737 -29.103 1.00 36.13 O ATOM 2202 CB LEU A 670 -2.762 -17.555 -26.575 1.00 33.87 C ATOM 2203 CG LEU A 670 -2.947 -17.097 -25.116 1.00 32.95 C ATOM 2204 CD1 LEU A 670 -3.863 -15.874 -25.079 1.00 33.45 C ATOM 2205 CD2 LEU A 670 -3.573 -18.185 -24.244 1.00 32.42 C ATOM 0 H LEU A 670 -0.106 -17.615 -26.700 1.00 32.98 H new ATOM 0 HA LEU A 670 -2.251 -19.611 -26.231 1.00 33.75 H new ATOM 0 HB2 LEU A 670 -2.370 -16.718 -27.152 1.00 33.87 H new ATOM 0 HB3 LEU A 670 -3.742 -17.795 -26.988 1.00 33.87 H new ATOM 0 HG LEU A 670 -1.957 -16.864 -24.723 1.00 32.95 H new ATOM 0 HD11 LEU A 670 -3.995 -15.549 -24.047 1.00 33.45 H new ATOM 0 HD12 LEU A 670 -3.416 -15.067 -25.659 1.00 33.45 H new ATOM 0 HD13 LEU A 670 -4.833 -16.133 -25.504 1.00 33.45 H new ATOM 0 HD21 LEU A 670 -3.683 -17.815 -23.225 1.00 32.42 H new ATOM 0 HD22 LEU A 670 -4.552 -18.451 -24.642 1.00 32.42 H new ATOM 0 HD23 LEU A 670 -2.930 -19.065 -24.243 1.00 32.42 H new ATOM 2217 N LEU A 671 -0.790 -20.075 -28.600 1.00 35.27 N ATOM 2218 CA LEU A 671 -0.446 -20.443 -29.977 1.00 36.62 C ATOM 2219 C LEU A 671 0.108 -21.880 -30.095 1.00 36.79 C ATOM 2220 O LEU A 671 0.596 -22.488 -29.136 1.00 35.83 O ATOM 2221 CB LEU A 671 0.524 -19.375 -30.533 1.00 37.06 C ATOM 2222 CG LEU A 671 0.894 -19.488 -32.027 1.00 38.47 C ATOM 2223 CD1 LEU A 671 -0.318 -19.529 -32.963 1.00 39.75 C ATOM 2224 CD2 LEU A 671 1.763 -18.298 -32.435 1.00 38.85 C ATOM 0 H LEU A 671 -0.207 -20.543 -27.906 1.00 35.27 H new ATOM 0 HA LEU A 671 -1.352 -20.457 -30.583 1.00 36.62 H new ATOM 0 HB2 LEU A 671 0.082 -18.393 -30.365 1.00 37.06 H new ATOM 0 HB3 LEU A 671 1.444 -19.414 -29.950 1.00 37.06 H new ATOM 0 HG LEU A 671 1.425 -20.434 -32.131 1.00 38.47 H new ATOM 0 HD11 LEU A 671 0.022 -19.609 -33.995 1.00 39.75 H new ATOM 0 HD12 LEU A 671 -0.938 -20.391 -32.718 1.00 39.75 H new ATOM 0 HD13 LEU A 671 -0.902 -18.616 -32.843 1.00 39.75 H new ATOM 0 HD21 LEU A 671 2.022 -18.382 -33.490 1.00 38.85 H new ATOM 0 HD22 LEU A 671 1.213 -17.372 -32.269 1.00 38.85 H new ATOM 0 HD23 LEU A 671 2.674 -18.291 -31.837 1.00 38.85 H new ATOM 2236 N HIS A 672 0.001 -22.417 -31.308 1.00 38.15 N ATOM 2237 CA HIS A 672 0.370 -23.761 -31.746 1.00 38.83 C ATOM 2238 C HIS A 672 1.870 -24.073 -31.633 1.00 38.53 C ATOM 2239 O HIS A 672 2.203 -25.139 -31.065 1.00 38.05 O ATOM 2240 CB HIS A 672 -0.132 -23.889 -33.187 1.00 40.45 C ATOM 2241 CG HIS A 672 -0.030 -25.289 -33.715 1.00 41.41 C ATOM 2242 ND1 HIS A 672 1.038 -25.830 -34.392 1.00 42.09 N ATOM 2243 CD2 HIS A 672 -0.965 -26.275 -33.570 1.00 41.89 C ATOM 2244 CE1 HIS A 672 0.752 -27.116 -34.654 1.00 42.94 C ATOM 2245 NE2 HIS A 672 -0.463 -27.437 -34.169 1.00 42.86 N ATOM 0 H HIS A 672 -0.382 -21.872 -32.081 1.00 38.15 H new ATOM 0 HA HIS A 672 -0.090 -24.497 -31.086 1.00 38.83 H new ATOM 0 HB2 HIS A 672 -1.171 -23.562 -33.236 1.00 40.45 H new ATOM 0 HB3 HIS A 672 0.443 -23.221 -33.828 1.00 40.45 H new ATOM 0 HD2 HIS A 672 -1.922 -26.176 -33.080 1.00 41.89 H new ATOM 0 HE1 HIS A 672 1.405 -27.797 -35.180 1.00 42.94 H new ATOM 0 HE2 HIS A 672 -0.925 -28.345 -34.227 1.00 42.86 H new TER 2253 HIS A 672