USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 956 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 644 GLN :FLIP amide:sc= -1.98! C(o=-2.6!,f=-2!) USER MOD Set 1.2: A 714 TYR OH : rot 180:sc= 0.00842 USER MOD Set 2.1: A 711 ASN : amide:sc= -1.77! C(o=-2.2!,f=-6.1!) USER MOD Set 2.2: A 715 ASN : amide:sc= -0.433 K(o=-2.2,f=-6.1) USER MOD Set 3.1: A 681 ASN : amide:sc= 1.98 K(o=2.7,f=-9.3!) USER MOD Set 3.2: A 685 THR OG1 : rot 180:sc= 0.704 USER MOD Set 4.1: A 668 MET CE :methyl -130:sc= -0.154 (180deg=0) USER MOD Set 4.2: A 670 GLN : amide:sc= -2.08 X(o=-2.2,f=-2.6) USER MOD Set 5.1: A 640 SER OG : rot 84:sc= 0.975 USER MOD Set 5.2: A 654 ASN : amide:sc= 1.38 K(o=2.4,f=-7.3!) USER MOD Set 6.1: A 587 THR OG1 : rot 136:sc= 1.05 USER MOD Set 6.2: A 598 GLN : amide:sc= -0.415 X(o=0.63,f=0.8) USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 591 ASN : amide:sc= -0.0973 X(o=-0.097,f=-0.18) USER MOD Single : A 593 THR OG1 : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 180:sc= 0.0345 USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 606 THR OG1 : rot 180:sc= 0.139 USER MOD Single : A 609 THR OG1 : rot -91:sc= 1.25 USER MOD Single : A 610 LYS NZ :NH3+ -166:sc=-0.00865 (180deg=-0.182) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot 16:sc= -0.0589 USER MOD Single : A 615 LYS NZ :NH3+ -158:sc= 0.0447 (180deg=0.00352) USER MOD Single : A 618 THR OG1 : rot -48:sc= 1.49 USER MOD Single : A 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 624 HIS : +bothHN:sc= -2.88! C(o=-2.9!,f=-8.4!) USER MOD Single : A 626 ASN : amide:sc= 0.489 K(o=0.49,f=-7!) USER MOD Single : A 632 SER OG : rot 80:sc= 0.943 USER MOD Single : A 646 SER OG : rot 180:sc= 0.646 USER MOD Single : A 648 SER OG : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot 46:sc= 0.0212 USER MOD Single : A 659 ASN : amide:sc= 0.534 K(o=0.53,f=-4.6!) USER MOD Single : A 661 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0541) USER MOD Single : A 663 SER OG : rot 150:sc= 0.127 USER MOD Single : A 664 TYR OH : rot 30:sc= 0 USER MOD Single : A 665 TYR OH : rot 180:sc= 0 USER MOD Single : A 672 THR OG1 : rot 180:sc= -0.0379 USER MOD Single : A 673 TYR OH : rot -153:sc= 1.04 USER MOD Single : A 677 THR OG1 : rot 180:sc= -0.611 USER MOD Single : A 679 TYR OH : rot 45:sc= 0.204 USER MOD Single : A 680 ASN : amide:sc= 0 X(o=0,f=-0.0051) USER MOD Single : A 683 LYS NZ :NH3+ 166:sc= -0.0576 (180deg=-0.37) USER MOD Single : A 689 THR OG1 : rot 74:sc= 0.294 USER MOD Single : A 692 THR OG1 : rot 180:sc= -0.166 USER MOD Single : A 706 TYR OH : rot 180:sc= 0.403 USER MOD Single : A 707 GLN :FLIP amide:sc= -0.466 F(o=-1,f=-0.47) USER MOD Single : A 712 SER OG : rot 2:sc= 1.28 USER MOD Single : A 713 THR OG1 : rot 180:sc=-0.00179 USER MOD Single : A 719 TYR OH : rot 180:sc= 0 USER MOD Single : A 720 THR OG1 : rot 99:sc= 0.453 USER MOD Single : A 721 SER OG : rot -177:sc= 0.802 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -13.829 6.786 -11.571 1.00 35.11 N ATOM 2 CA GLU A 578 -13.555 5.864 -10.475 1.00 74.22 C ATOM 3 C GLU A 578 -14.900 5.501 -9.868 1.00 23.51 C ATOM 4 O GLU A 578 -15.546 6.342 -9.242 1.00 64.11 O ATOM 5 CB GLU A 578 -12.646 6.569 -9.430 1.00 1.32 C ATOM 6 CG GLU A 578 -11.983 5.668 -8.368 1.00 51.32 C ATOM 7 CD GLU A 578 -12.951 4.878 -7.515 1.00 35.11 C ATOM 8 OE1 GLU A 578 -13.584 5.464 -6.608 1.00 33.11 O ATOM 9 OE2 GLU A 578 -13.106 3.664 -7.760 1.00 54.31 O ATOM 0 HA GLU A 578 -13.038 4.967 -10.814 1.00 74.22 H new ATOM 0 HB2 GLU A 578 -11.859 7.099 -9.966 1.00 1.32 H new ATOM 0 HB3 GLU A 578 -13.242 7.322 -8.914 1.00 1.32 H new ATOM 0 HG2 GLU A 578 -11.311 4.972 -8.870 1.00 51.32 H new ATOM 0 HG3 GLU A 578 -11.369 6.290 -7.716 1.00 51.32 H new ATOM 18 N ALA A 579 -15.340 4.286 -10.088 1.00 73.10 N ATOM 19 CA ALA A 579 -16.613 3.829 -9.580 1.00 12.32 C ATOM 20 C ALA A 579 -16.646 2.331 -9.588 1.00 15.01 C ATOM 21 O ALA A 579 -16.187 1.704 -10.549 1.00 23.13 O ATOM 22 CB ALA A 579 -17.754 4.373 -10.435 1.00 53.20 C ATOM 0 H ALA A 579 -14.827 3.586 -10.624 1.00 73.10 H new ATOM 0 HA ALA A 579 -16.737 4.193 -8.560 1.00 12.32 H new ATOM 0 HB1 ALA A 579 -18.706 4.019 -10.039 1.00 53.20 H new ATOM 0 HB2 ALA A 579 -17.735 5.463 -10.416 1.00 53.20 H new ATOM 0 HB3 ALA A 579 -17.637 4.026 -11.462 1.00 53.20 H new ATOM 28 N GLU A 580 -17.169 1.748 -8.548 1.00 74.22 N ATOM 29 CA GLU A 580 -17.278 0.325 -8.494 1.00 20.00 C ATOM 30 C GLU A 580 -18.471 -0.093 -7.659 1.00 10.01 C ATOM 31 O GLU A 580 -18.385 -0.248 -6.443 1.00 61.31 O ATOM 32 CB GLU A 580 -15.985 -0.332 -8.006 1.00 71.03 C ATOM 33 CG GLU A 580 -15.995 -1.848 -8.090 1.00 22.35 C ATOM 34 CD GLU A 580 -14.677 -2.446 -7.701 1.00 44.12 C ATOM 35 OE1 GLU A 580 -13.715 -2.333 -8.484 1.00 60.21 O ATOM 36 OE2 GLU A 580 -14.572 -3.032 -6.608 1.00 4.01 O ATOM 0 H GLU A 580 -17.526 2.239 -7.728 1.00 74.22 H new ATOM 0 HA GLU A 580 -17.442 -0.031 -9.511 1.00 20.00 H new ATOM 0 HB2 GLU A 580 -15.151 0.049 -8.595 1.00 71.03 H new ATOM 0 HB3 GLU A 580 -15.807 -0.036 -6.972 1.00 71.03 H new ATOM 0 HG2 GLU A 580 -16.776 -2.241 -7.439 1.00 22.35 H new ATOM 0 HG3 GLU A 580 -16.244 -2.152 -9.107 1.00 22.35 H new ATOM 43 N ALA A 581 -19.593 -0.205 -8.317 1.00 71.33 N ATOM 44 CA ALA A 581 -20.811 -0.661 -7.697 1.00 40.03 C ATOM 45 C ALA A 581 -21.058 -2.094 -8.123 1.00 53.23 C ATOM 46 O ALA A 581 -21.989 -2.766 -7.656 1.00 42.02 O ATOM 47 CB ALA A 581 -21.971 0.228 -8.103 1.00 33.21 C ATOM 0 H ALA A 581 -19.690 0.019 -9.307 1.00 71.33 H new ATOM 0 HA ALA A 581 -20.720 -0.613 -6.612 1.00 40.03 H new ATOM 0 HB1 ALA A 581 -22.885 -0.127 -7.628 1.00 33.21 H new ATOM 0 HB2 ALA A 581 -21.772 1.252 -7.787 1.00 33.21 H new ATOM 0 HB3 ALA A 581 -22.090 0.199 -9.186 1.00 33.21 H new ATOM 53 N GLU A 582 -20.228 -2.545 -9.026 1.00 61.24 N ATOM 54 CA GLU A 582 -20.269 -3.886 -9.514 1.00 54.32 C ATOM 55 C GLU A 582 -19.330 -4.725 -8.667 1.00 12.25 C ATOM 56 O GLU A 582 -18.093 -4.690 -8.853 1.00 25.04 O ATOM 57 CB GLU A 582 -19.839 -3.903 -10.981 1.00 53.23 C ATOM 58 CG GLU A 582 -19.932 -5.248 -11.664 1.00 35.25 C ATOM 59 CD GLU A 582 -19.406 -5.185 -13.067 1.00 10.30 C ATOM 60 OE1 GLU A 582 -20.158 -4.820 -13.981 1.00 72.41 O ATOM 61 OE2 GLU A 582 -18.210 -5.470 -13.270 1.00 21.53 O ATOM 0 H GLU A 582 -19.494 -1.976 -9.447 1.00 61.24 H new ATOM 0 HA GLU A 582 -21.278 -4.294 -9.449 1.00 54.32 H new ATOM 0 HB2 GLU A 582 -20.454 -3.191 -11.531 1.00 53.23 H new ATOM 0 HB3 GLU A 582 -18.809 -3.551 -11.045 1.00 53.23 H new ATOM 0 HG2 GLU A 582 -19.368 -5.987 -11.095 1.00 35.25 H new ATOM 0 HG3 GLU A 582 -20.970 -5.580 -11.677 1.00 35.25 H new ATOM 68 N PHE A 583 -19.886 -5.427 -7.710 1.00 34.14 N ATOM 69 CA PHE A 583 -19.097 -6.230 -6.825 1.00 45.45 C ATOM 70 C PHE A 583 -19.875 -7.409 -6.268 1.00 33.41 C ATOM 71 O PHE A 583 -21.066 -7.299 -5.944 1.00 11.01 O ATOM 72 CB PHE A 583 -18.447 -5.390 -5.691 1.00 34.43 C ATOM 73 CG PHE A 583 -19.396 -4.619 -4.799 1.00 53.14 C ATOM 74 CD1 PHE A 583 -19.826 -3.353 -5.150 1.00 23.43 C ATOM 75 CD2 PHE A 583 -19.833 -5.161 -3.604 1.00 10.24 C ATOM 76 CE1 PHE A 583 -20.680 -2.643 -4.328 1.00 23.22 C ATOM 77 CE2 PHE A 583 -20.688 -4.458 -2.778 1.00 5.35 C ATOM 78 CZ PHE A 583 -21.113 -3.196 -3.142 1.00 62.25 C ATOM 0 H PHE A 583 -20.889 -5.454 -7.528 1.00 34.14 H new ATOM 0 HA PHE A 583 -18.286 -6.639 -7.427 1.00 45.45 H new ATOM 0 HB2 PHE A 583 -17.857 -6.059 -5.065 1.00 34.43 H new ATOM 0 HB3 PHE A 583 -17.753 -4.682 -6.144 1.00 34.43 H new ATOM 0 HD1 PHE A 583 -19.490 -2.914 -6.078 1.00 23.43 H new ATOM 0 HD2 PHE A 583 -19.501 -6.147 -3.313 1.00 10.24 H new ATOM 0 HE1 PHE A 583 -21.008 -1.655 -4.615 1.00 23.22 H new ATOM 0 HE2 PHE A 583 -21.023 -4.895 -1.849 1.00 5.35 H new ATOM 0 HZ PHE A 583 -21.783 -2.644 -2.499 1.00 62.25 H new ATOM 88 N LEU A 584 -19.203 -8.529 -6.197 1.00 73.34 N ATOM 89 CA LEU A 584 -19.738 -9.757 -5.625 1.00 3.24 C ATOM 90 C LEU A 584 -18.550 -10.537 -5.090 1.00 63.13 C ATOM 91 O LEU A 584 -18.562 -11.046 -3.966 1.00 45.11 O ATOM 92 CB LEU A 584 -20.529 -10.565 -6.706 1.00 11.05 C ATOM 93 CG LEU A 584 -21.333 -11.832 -6.258 1.00 12.12 C ATOM 94 CD1 LEU A 584 -22.199 -12.322 -7.400 1.00 34.22 C ATOM 95 CD2 LEU A 584 -20.422 -12.975 -5.814 1.00 12.21 C ATOM 0 H LEU A 584 -18.247 -8.624 -6.540 1.00 73.34 H new ATOM 0 HA LEU A 584 -20.445 -9.552 -4.822 1.00 3.24 H new ATOM 0 HB2 LEU A 584 -21.230 -9.880 -7.183 1.00 11.05 H new ATOM 0 HB3 LEU A 584 -19.818 -10.878 -7.471 1.00 11.05 H new ATOM 0 HG LEU A 584 -21.944 -11.533 -5.406 1.00 12.12 H new ATOM 0 HD11 LEU A 584 -22.756 -13.204 -7.082 1.00 34.22 H new ATOM 0 HD12 LEU A 584 -22.897 -11.537 -7.690 1.00 34.22 H new ATOM 0 HD13 LEU A 584 -21.568 -12.579 -8.251 1.00 34.22 H new ATOM 0 HD21 LEU A 584 -21.029 -13.829 -5.514 1.00 12.21 H new ATOM 0 HD22 LEU A 584 -19.772 -13.264 -6.640 1.00 12.21 H new ATOM 0 HD23 LEU A 584 -19.813 -12.648 -4.971 1.00 12.21 H new ATOM 103 N SER A 585 -17.494 -10.578 -5.889 1.00 32.40 N ATOM 104 CA SER A 585 -16.265 -11.238 -5.511 1.00 3.23 C ATOM 105 C SER A 585 -15.441 -10.322 -4.591 1.00 0.25 C ATOM 106 O SER A 585 -14.346 -10.666 -4.175 1.00 22.15 O ATOM 107 CB SER A 585 -15.477 -11.601 -6.767 1.00 12.10 C ATOM 108 OG SER A 585 -16.280 -12.385 -7.642 1.00 30.21 O ATOM 0 H SER A 585 -17.471 -10.153 -6.816 1.00 32.40 H new ATOM 0 HA SER A 585 -16.492 -12.154 -4.965 1.00 3.23 H new ATOM 0 HB2 SER A 585 -15.151 -10.694 -7.276 1.00 12.10 H new ATOM 0 HB3 SER A 585 -14.578 -12.153 -6.494 1.00 12.10 H new ATOM 0 HG SER A 585 -15.765 -12.610 -8.445 1.00 30.21 H new ATOM 114 N ARG A 586 -15.997 -9.168 -4.300 1.00 42.10 N ATOM 115 CA ARG A 586 -15.422 -8.204 -3.402 1.00 2.12 C ATOM 116 C ARG A 586 -16.302 -8.088 -2.178 1.00 54.42 C ATOM 117 O ARG A 586 -17.452 -7.648 -2.260 1.00 35.42 O ATOM 118 CB ARG A 586 -15.270 -6.826 -4.064 1.00 42.43 C ATOM 119 CG ARG A 586 -14.860 -5.721 -3.087 1.00 50.34 C ATOM 120 CD ARG A 586 -14.850 -4.351 -3.742 1.00 3.42 C ATOM 121 NE ARG A 586 -14.631 -3.271 -2.761 1.00 65.13 N ATOM 122 CZ ARG A 586 -14.576 -1.966 -3.058 1.00 60.13 C ATOM 123 NH1 ARG A 586 -14.597 -1.563 -4.333 1.00 3.34 N ATOM 124 NH2 ARG A 586 -14.494 -1.064 -2.076 1.00 21.23 N ATOM 0 H ARG A 586 -16.888 -8.869 -4.696 1.00 42.10 H new ATOM 0 HA ARG A 586 -14.425 -8.546 -3.124 1.00 2.12 H new ATOM 0 HB2 ARG A 586 -14.526 -6.893 -4.857 1.00 42.43 H new ATOM 0 HB3 ARG A 586 -16.214 -6.552 -4.535 1.00 42.43 H new ATOM 0 HG2 ARG A 586 -15.548 -5.713 -2.241 1.00 50.34 H new ATOM 0 HG3 ARG A 586 -13.869 -5.939 -2.690 1.00 50.34 H new ATOM 0 HD2 ARG A 586 -14.067 -4.317 -4.499 1.00 3.42 H new ATOM 0 HD3 ARG A 586 -15.797 -4.188 -4.256 1.00 3.42 H new ATOM 0 HE ARG A 586 -14.513 -3.538 -1.784 1.00 65.13 H new ATOM 0 HH11 ARG A 586 -14.655 -2.250 -5.084 1.00 3.34 H new ATOM 0 HH12 ARG A 586 -14.555 -0.568 -4.554 1.00 3.34 H new ATOM 0 HH21 ARG A 586 -14.473 -1.370 -1.103 1.00 21.23 H new ATOM 0 HH22 ARG A 586 -14.452 -0.070 -2.299 1.00 21.23 H new ATOM 136 N THR A 587 -15.780 -8.505 -1.094 1.00 10.32 N ATOM 137 CA THR A 587 -16.435 -8.435 0.173 1.00 74.51 C ATOM 138 C THR A 587 -15.792 -7.280 0.934 1.00 32.02 C ATOM 139 O THR A 587 -14.582 -7.157 0.918 1.00 43.41 O ATOM 140 CB THR A 587 -16.144 -9.743 0.921 1.00 43.10 C ATOM 141 OG1 THR A 587 -16.493 -10.873 0.104 1.00 41.24 O ATOM 142 CG2 THR A 587 -16.882 -9.828 2.231 1.00 72.34 C ATOM 0 H THR A 587 -14.850 -8.922 -1.050 1.00 10.32 H new ATOM 0 HA THR A 587 -17.511 -8.290 0.073 1.00 74.51 H new ATOM 0 HB THR A 587 -15.076 -9.754 1.136 1.00 43.10 H new ATOM 0 HG1 THR A 587 -15.783 -11.546 0.157 1.00 41.24 H new ATOM 0 HG21 THR A 587 -16.643 -10.771 2.722 1.00 72.34 H new ATOM 0 HG22 THR A 587 -16.582 -8.999 2.872 1.00 72.34 H new ATOM 0 HG23 THR A 587 -17.955 -9.776 2.048 1.00 72.34 H new ATOM 148 N GLU A 588 -16.554 -6.425 1.560 1.00 31.11 N ATOM 149 CA GLU A 588 -15.933 -5.342 2.279 1.00 12.53 C ATOM 150 C GLU A 588 -16.182 -5.498 3.766 1.00 21.14 C ATOM 151 O GLU A 588 -17.315 -5.723 4.196 1.00 23.42 O ATOM 152 CB GLU A 588 -16.363 -3.965 1.751 1.00 14.45 C ATOM 153 CG GLU A 588 -15.547 -2.821 2.339 1.00 63.50 C ATOM 154 CD GLU A 588 -15.895 -1.475 1.763 1.00 50.15 C ATOM 155 OE1 GLU A 588 -15.388 -1.132 0.666 1.00 40.50 O ATOM 156 OE2 GLU A 588 -16.660 -0.728 2.402 1.00 20.32 O ATOM 0 H GLU A 588 -17.573 -6.451 1.589 1.00 31.11 H new ATOM 0 HA GLU A 588 -14.858 -5.393 2.109 1.00 12.53 H new ATOM 0 HB2 GLU A 588 -16.267 -3.952 0.665 1.00 14.45 H new ATOM 0 HB3 GLU A 588 -17.417 -3.807 1.980 1.00 14.45 H new ATOM 0 HG2 GLU A 588 -15.698 -2.795 3.418 1.00 63.50 H new ATOM 0 HG3 GLU A 588 -14.488 -3.017 2.170 1.00 63.50 H new ATOM 163 N GLY A 589 -15.129 -5.406 4.535 1.00 52.44 N ATOM 164 CA GLY A 589 -15.225 -5.626 5.942 1.00 30.11 C ATOM 165 C GLY A 589 -15.248 -4.355 6.744 1.00 14.43 C ATOM 166 O GLY A 589 -15.971 -3.396 6.407 1.00 74.10 O ATOM 0 H GLY A 589 -14.192 -5.178 4.202 1.00 52.44 H new ATOM 0 HA2 GLY A 589 -16.130 -6.196 6.152 1.00 30.11 H new ATOM 0 HA3 GLY A 589 -14.382 -6.236 6.265 1.00 30.11 H new ATOM 170 N ASP A 590 -14.446 -4.327 7.781 1.00 15.23 N ATOM 171 CA ASP A 590 -14.420 -3.229 8.728 1.00 63.34 C ATOM 172 C ASP A 590 -13.083 -2.532 8.695 1.00 1.31 C ATOM 173 O ASP A 590 -12.308 -2.705 7.742 1.00 65.32 O ATOM 174 CB ASP A 590 -14.716 -3.740 10.150 1.00 3.23 C ATOM 175 CG ASP A 590 -16.100 -4.321 10.286 1.00 42.12 C ATOM 176 OD1 ASP A 590 -17.073 -3.545 10.486 1.00 60.02 O ATOM 177 OD2 ASP A 590 -16.249 -5.563 10.195 1.00 45.20 O ATOM 0 H ASP A 590 -13.784 -5.072 7.997 1.00 15.23 H new ATOM 0 HA ASP A 590 -15.192 -2.514 8.444 1.00 63.34 H new ATOM 0 HB2 ASP A 590 -13.981 -4.498 10.419 1.00 3.23 H new ATOM 0 HB3 ASP A 590 -14.601 -2.919 10.858 1.00 3.23 H new ATOM 182 N ASN A 591 -12.819 -1.724 9.711 1.00 50.23 N ATOM 183 CA ASN A 591 -11.587 -0.971 9.793 1.00 20.13 C ATOM 184 C ASN A 591 -10.402 -1.878 10.096 1.00 12.40 C ATOM 185 O ASN A 591 -10.379 -2.582 11.105 1.00 4.34 O ATOM 186 CB ASN A 591 -11.657 0.192 10.839 1.00 43.44 C ATOM 187 CG ASN A 591 -11.727 -0.259 12.300 1.00 30.41 C ATOM 188 OD1 ASN A 591 -10.695 -0.438 12.959 1.00 23.44 O ATOM 189 ND2 ASN A 591 -12.911 -0.405 12.822 1.00 41.23 N ATOM 0 H ASN A 591 -13.453 -1.576 10.496 1.00 50.23 H new ATOM 0 HA ASN A 591 -11.444 -0.519 8.812 1.00 20.13 H new ATOM 0 HB2 ASN A 591 -10.781 0.829 10.712 1.00 43.44 H new ATOM 0 HB3 ASN A 591 -12.531 0.805 10.621 1.00 43.44 H new ATOM 0 HD21 ASN A 591 -13.007 -0.674 13.801 1.00 41.23 H new ATOM 0 HD22 ASN A 591 -13.742 -0.250 12.252 1.00 41.23 H new ATOM 195 N CYS A 592 -9.461 -1.910 9.167 1.00 71.22 N ATOM 196 CA CYS A 592 -8.169 -2.591 9.327 1.00 10.22 C ATOM 197 C CYS A 592 -8.252 -4.131 9.389 1.00 64.45 C ATOM 198 O CYS A 592 -7.231 -4.817 9.251 1.00 31.24 O ATOM 199 CB CYS A 592 -7.406 -2.014 10.513 1.00 70.45 C ATOM 200 SG CYS A 592 -7.071 -0.223 10.371 1.00 22.35 S ATOM 0 H CYS A 592 -9.567 -1.457 8.259 1.00 71.22 H new ATOM 0 HA CYS A 592 -7.612 -2.390 8.412 1.00 10.22 H new ATOM 0 HB2 CYS A 592 -7.976 -2.197 11.424 1.00 70.45 H new ATOM 0 HB3 CYS A 592 -6.459 -2.544 10.617 1.00 70.45 H new ATOM 205 N THR A 593 -9.434 -4.673 9.579 1.00 70.24 N ATOM 206 CA THR A 593 -9.606 -6.092 9.569 1.00 52.51 C ATOM 207 C THR A 593 -10.680 -6.442 8.561 1.00 13.44 C ATOM 208 O THR A 593 -11.641 -5.682 8.369 1.00 14.03 O ATOM 209 CB THR A 593 -10.015 -6.624 10.974 1.00 23.41 C ATOM 210 OG1 THR A 593 -11.211 -5.961 11.424 1.00 54.21 O ATOM 211 CG2 THR A 593 -8.907 -6.401 11.989 1.00 71.02 C ATOM 0 H THR A 593 -10.289 -4.142 9.742 1.00 70.24 H new ATOM 0 HA THR A 593 -8.659 -6.559 9.298 1.00 52.51 H new ATOM 0 HB THR A 593 -10.197 -7.695 10.886 1.00 23.41 H new ATOM 0 HG1 THR A 593 -11.462 -6.303 12.307 1.00 54.21 H new ATOM 0 HG21 THR A 593 -9.221 -6.782 12.960 1.00 71.02 H new ATOM 0 HG22 THR A 593 -8.007 -6.926 11.667 1.00 71.02 H new ATOM 0 HG23 THR A 593 -8.696 -5.335 12.069 1.00 71.02 H new ATOM 217 N VAL A 594 -10.529 -7.547 7.909 1.00 73.34 N ATOM 218 CA VAL A 594 -11.506 -7.960 6.957 1.00 52.14 C ATOM 219 C VAL A 594 -11.949 -9.390 7.192 1.00 42.53 C ATOM 220 O VAL A 594 -11.127 -10.311 7.218 1.00 20.32 O ATOM 221 CB VAL A 594 -11.037 -7.739 5.478 1.00 44.31 C ATOM 222 CG1 VAL A 594 -9.772 -8.522 5.137 1.00 64.33 C ATOM 223 CG2 VAL A 594 -12.158 -8.040 4.488 1.00 72.53 C ATOM 0 H VAL A 594 -9.737 -8.181 8.018 1.00 73.34 H new ATOM 0 HA VAL A 594 -12.373 -7.317 7.108 1.00 52.14 H new ATOM 0 HB VAL A 594 -10.782 -6.683 5.389 1.00 44.31 H new ATOM 0 HG11 VAL A 594 -9.494 -8.331 4.101 1.00 64.33 H new ATOM 0 HG12 VAL A 594 -8.961 -8.208 5.794 1.00 64.33 H new ATOM 0 HG13 VAL A 594 -9.956 -9.588 5.272 1.00 64.33 H new ATOM 0 HG21 VAL A 594 -11.799 -7.877 3.472 1.00 72.53 H new ATOM 0 HG22 VAL A 594 -12.473 -9.078 4.599 1.00 72.53 H new ATOM 0 HG23 VAL A 594 -13.004 -7.381 4.685 1.00 72.53 H new ATOM 229 N PHE A 595 -13.214 -9.576 7.421 1.00 62.23 N ATOM 230 CA PHE A 595 -13.746 -10.896 7.461 1.00 23.44 C ATOM 231 C PHE A 595 -14.620 -11.116 6.267 1.00 12.05 C ATOM 232 O PHE A 595 -15.578 -10.374 6.030 1.00 63.13 O ATOM 233 CB PHE A 595 -14.479 -11.246 8.766 1.00 4.32 C ATOM 234 CG PHE A 595 -15.067 -12.641 8.720 1.00 11.32 C ATOM 235 CD1 PHE A 595 -14.287 -13.713 8.319 1.00 15.41 C ATOM 236 CD2 PHE A 595 -16.382 -12.874 9.049 1.00 10.23 C ATOM 237 CE1 PHE A 595 -14.798 -14.979 8.247 1.00 11.21 C ATOM 238 CE2 PHE A 595 -16.907 -14.151 8.984 1.00 73.53 C ATOM 239 CZ PHE A 595 -16.106 -15.205 8.580 1.00 51.33 C ATOM 0 H PHE A 595 -13.891 -8.831 7.582 1.00 62.23 H new ATOM 0 HA PHE A 595 -12.897 -11.579 7.433 1.00 23.44 H new ATOM 0 HB2 PHE A 595 -13.786 -11.170 9.604 1.00 4.32 H new ATOM 0 HB3 PHE A 595 -15.274 -10.521 8.943 1.00 4.32 H new ATOM 0 HD1 PHE A 595 -13.253 -13.545 8.058 1.00 15.41 H new ATOM 0 HD2 PHE A 595 -17.010 -12.052 9.361 1.00 10.23 H new ATOM 0 HE1 PHE A 595 -14.171 -15.799 7.928 1.00 11.21 H new ATOM 0 HE2 PHE A 595 -17.940 -14.326 9.248 1.00 73.53 H new ATOM 0 HZ PHE A 595 -16.513 -16.204 8.528 1.00 51.33 H new ATOM 249 N ASP A 596 -14.292 -12.121 5.523 1.00 14.52 N ATOM 250 CA ASP A 596 -14.999 -12.441 4.326 1.00 43.44 C ATOM 251 C ASP A 596 -15.863 -13.649 4.570 1.00 51.22 C ATOM 252 O ASP A 596 -15.375 -14.701 4.987 1.00 4.12 O ATOM 253 CB ASP A 596 -14.005 -12.716 3.213 1.00 24.30 C ATOM 254 CG ASP A 596 -14.661 -12.933 1.892 1.00 35.01 C ATOM 255 OD1 ASP A 596 -15.435 -13.835 1.789 1.00 33.40 O ATOM 256 OD2 ASP A 596 -14.374 -12.200 0.931 1.00 2.04 O ATOM 0 H ASP A 596 -13.517 -12.750 5.731 1.00 14.52 H new ATOM 0 HA ASP A 596 -15.634 -11.605 4.031 1.00 43.44 H new ATOM 0 HB2 ASP A 596 -13.312 -11.878 3.136 1.00 24.30 H new ATOM 0 HB3 ASP A 596 -13.414 -13.596 3.469 1.00 24.30 H new ATOM 261 N SER A 597 -17.134 -13.489 4.321 1.00 4.21 N ATOM 262 CA SER A 597 -18.110 -14.522 4.514 1.00 25.14 C ATOM 263 C SER A 597 -17.977 -15.676 3.502 1.00 44.41 C ATOM 264 O SER A 597 -18.172 -16.840 3.859 1.00 25.23 O ATOM 265 CB SER A 597 -19.496 -13.892 4.491 1.00 24.12 C ATOM 266 OG SER A 597 -19.643 -13.057 3.342 1.00 73.20 O ATOM 0 H SER A 597 -17.527 -12.616 3.970 1.00 4.21 H new ATOM 0 HA SER A 597 -17.937 -14.986 5.485 1.00 25.14 H new ATOM 0 HB2 SER A 597 -20.257 -14.672 4.482 1.00 24.12 H new ATOM 0 HB3 SER A 597 -19.651 -13.306 5.397 1.00 24.12 H new ATOM 0 HG SER A 597 -20.539 -12.660 3.339 1.00 73.20 H new ATOM 272 N GLN A 598 -17.603 -15.373 2.263 1.00 1.33 N ATOM 273 CA GLN A 598 -17.518 -16.401 1.256 1.00 43.54 C ATOM 274 C GLN A 598 -16.218 -17.164 1.400 1.00 34.04 C ATOM 275 O GLN A 598 -16.173 -18.387 1.201 1.00 23.50 O ATOM 276 CB GLN A 598 -17.647 -15.840 -0.176 1.00 60.25 C ATOM 277 CG GLN A 598 -16.578 -14.846 -0.564 1.00 71.34 C ATOM 278 CD GLN A 598 -16.656 -14.330 -1.966 1.00 61.11 C ATOM 279 OE1 GLN A 598 -17.125 -15.008 -2.885 1.00 64.24 O ATOM 280 NE2 GLN A 598 -16.187 -13.129 -2.152 1.00 14.35 N ATOM 0 H GLN A 598 -17.359 -14.435 1.944 1.00 1.33 H new ATOM 0 HA GLN A 598 -18.360 -17.075 1.414 1.00 43.54 H new ATOM 0 HB2 GLN A 598 -17.624 -16.671 -0.881 1.00 60.25 H new ATOM 0 HB3 GLN A 598 -18.622 -15.363 -0.278 1.00 60.25 H new ATOM 0 HG2 GLN A 598 -16.629 -13.999 0.120 1.00 71.34 H new ATOM 0 HG3 GLN A 598 -15.603 -15.313 -0.421 1.00 71.34 H new ATOM 0 HE21 GLN A 598 -15.808 -12.602 -1.365 1.00 14.35 H new ATOM 0 HE22 GLN A 598 -16.199 -12.716 -3.084 1.00 14.35 H new ATOM 288 N ALA A 599 -15.167 -16.450 1.765 1.00 33.24 N ATOM 289 CA ALA A 599 -13.869 -17.043 1.905 1.00 72.13 C ATOM 290 C ALA A 599 -13.729 -17.730 3.253 1.00 14.53 C ATOM 291 O ALA A 599 -12.929 -18.648 3.410 1.00 13.51 O ATOM 292 CB ALA A 599 -12.808 -15.956 1.766 1.00 11.41 C ATOM 0 H ALA A 599 -15.199 -15.451 1.969 1.00 33.24 H new ATOM 0 HA ALA A 599 -13.738 -17.794 1.126 1.00 72.13 H new ATOM 0 HB1 ALA A 599 -11.818 -16.399 1.871 1.00 11.41 H new ATOM 0 HB2 ALA A 599 -12.894 -15.487 0.786 1.00 11.41 H new ATOM 0 HB3 ALA A 599 -12.954 -15.204 2.542 1.00 11.41 H new ATOM 298 N GLY A 600 -14.555 -17.310 4.205 1.00 73.41 N ATOM 299 CA GLY A 600 -14.575 -17.907 5.539 1.00 64.52 C ATOM 300 C GLY A 600 -13.309 -17.626 6.350 1.00 62.23 C ATOM 301 O GLY A 600 -13.055 -18.275 7.369 1.00 23.52 O ATOM 0 H GLY A 600 -15.226 -16.552 4.077 1.00 73.41 H new ATOM 0 HA2 GLY A 600 -15.439 -17.528 6.085 1.00 64.52 H new ATOM 0 HA3 GLY A 600 -14.705 -18.985 5.444 1.00 64.52 H new ATOM 305 N PHE A 601 -12.538 -16.653 5.925 1.00 61.12 N ATOM 306 CA PHE A 601 -11.314 -16.295 6.608 1.00 13.31 C ATOM 307 C PHE A 601 -11.309 -14.835 6.963 1.00 12.43 C ATOM 308 O PHE A 601 -11.908 -14.004 6.258 1.00 63.42 O ATOM 309 CB PHE A 601 -10.057 -16.645 5.789 1.00 13.10 C ATOM 310 CG PHE A 601 -9.811 -18.118 5.596 1.00 22.42 C ATOM 311 CD1 PHE A 601 -9.349 -18.895 6.646 1.00 10.23 C ATOM 312 CD2 PHE A 601 -10.019 -18.722 4.369 1.00 1.44 C ATOM 313 CE1 PHE A 601 -9.106 -20.244 6.477 1.00 51.14 C ATOM 314 CE2 PHE A 601 -9.780 -20.071 4.194 1.00 0.52 C ATOM 315 CZ PHE A 601 -9.321 -20.833 5.248 1.00 23.01 C ATOM 0 H PHE A 601 -12.739 -16.088 5.100 1.00 61.12 H new ATOM 0 HA PHE A 601 -11.282 -16.887 7.523 1.00 13.31 H new ATOM 0 HB2 PHE A 601 -10.138 -16.174 4.809 1.00 13.10 H new ATOM 0 HB3 PHE A 601 -9.188 -16.209 6.282 1.00 13.10 H new ATOM 0 HD1 PHE A 601 -9.177 -18.439 7.610 1.00 10.23 H new ATOM 0 HD2 PHE A 601 -10.373 -18.131 3.537 1.00 1.44 H new ATOM 0 HE1 PHE A 601 -8.748 -20.837 7.306 1.00 51.14 H new ATOM 0 HE2 PHE A 601 -9.953 -20.529 3.231 1.00 0.52 H new ATOM 0 HZ PHE A 601 -9.130 -21.887 5.112 1.00 23.01 H new ATOM 325 N SER A 602 -10.655 -14.526 8.044 1.00 25.25 N ATOM 326 CA SER A 602 -10.554 -13.190 8.525 1.00 2.00 C ATOM 327 C SER A 602 -9.093 -12.772 8.529 1.00 42.34 C ATOM 328 O SER A 602 -8.235 -13.510 8.994 1.00 65.35 O ATOM 329 CB SER A 602 -11.191 -13.098 9.924 1.00 65.40 C ATOM 330 OG SER A 602 -10.655 -14.085 10.803 1.00 5.23 O ATOM 0 H SER A 602 -10.170 -15.212 8.623 1.00 25.25 H new ATOM 0 HA SER A 602 -11.096 -12.504 7.874 1.00 2.00 H new ATOM 0 HB2 SER A 602 -11.019 -12.105 10.340 1.00 65.40 H new ATOM 0 HB3 SER A 602 -12.270 -13.227 9.844 1.00 65.40 H new ATOM 0 HG SER A 602 -11.076 -14.002 11.684 1.00 5.23 H new ATOM 336 N PHE A 603 -8.811 -11.620 7.993 1.00 42.41 N ATOM 337 CA PHE A 603 -7.452 -11.149 7.887 1.00 33.41 C ATOM 338 C PHE A 603 -7.271 -9.803 8.573 1.00 12.34 C ATOM 339 O PHE A 603 -8.127 -8.910 8.461 1.00 54.31 O ATOM 340 CB PHE A 603 -7.005 -11.105 6.413 1.00 41.41 C ATOM 341 CG PHE A 603 -6.885 -12.473 5.768 1.00 60.33 C ATOM 342 CD1 PHE A 603 -5.697 -13.167 5.846 1.00 43.22 C ATOM 343 CD2 PHE A 603 -7.951 -13.065 5.089 1.00 12.15 C ATOM 344 CE1 PHE A 603 -5.556 -14.409 5.273 1.00 33.21 C ATOM 345 CE2 PHE A 603 -7.805 -14.315 4.515 1.00 14.03 C ATOM 346 CZ PHE A 603 -6.609 -14.982 4.609 1.00 5.14 C ATOM 0 H PHE A 603 -9.510 -10.980 7.617 1.00 42.41 H new ATOM 0 HA PHE A 603 -6.808 -11.857 8.409 1.00 33.41 H new ATOM 0 HB2 PHE A 603 -7.718 -10.507 5.845 1.00 41.41 H new ATOM 0 HB3 PHE A 603 -6.042 -10.598 6.350 1.00 41.41 H new ATOM 0 HD1 PHE A 603 -4.860 -12.727 6.368 1.00 43.22 H new ATOM 0 HD2 PHE A 603 -8.894 -12.545 5.011 1.00 12.15 H new ATOM 0 HE1 PHE A 603 -4.615 -14.933 5.346 1.00 33.21 H new ATOM 0 HE2 PHE A 603 -8.634 -14.767 3.991 1.00 14.03 H new ATOM 0 HZ PHE A 603 -6.498 -15.958 4.160 1.00 5.14 H new ATOM 356 N ASP A 604 -6.171 -9.671 9.291 1.00 23.33 N ATOM 357 CA ASP A 604 -5.856 -8.462 10.037 1.00 52.44 C ATOM 358 C ASP A 604 -4.733 -7.758 9.352 1.00 53.43 C ATOM 359 O ASP A 604 -3.620 -8.275 9.276 1.00 4.42 O ATOM 360 CB ASP A 604 -5.360 -8.816 11.452 1.00 24.10 C ATOM 361 CG ASP A 604 -6.321 -9.646 12.257 1.00 74.24 C ATOM 362 OD1 ASP A 604 -6.298 -10.896 12.122 1.00 55.44 O ATOM 363 OD2 ASP A 604 -7.085 -9.072 13.052 1.00 32.04 O ATOM 0 H ASP A 604 -5.465 -10.403 9.375 1.00 23.33 H new ATOM 0 HA ASP A 604 -6.754 -7.846 10.093 1.00 52.44 H new ATOM 0 HB2 ASP A 604 -4.416 -9.354 11.369 1.00 24.10 H new ATOM 0 HB3 ASP A 604 -5.154 -7.893 11.993 1.00 24.10 H new ATOM 368 N LEU A 605 -4.996 -6.600 8.847 1.00 20.24 N ATOM 369 CA LEU A 605 -3.969 -5.806 8.258 1.00 10.04 C ATOM 370 C LEU A 605 -3.626 -4.650 9.187 1.00 24.33 C ATOM 371 O LEU A 605 -2.905 -3.730 8.839 1.00 22.51 O ATOM 372 CB LEU A 605 -4.348 -5.340 6.842 1.00 13.03 C ATOM 373 CG LEU A 605 -4.375 -6.422 5.718 1.00 42.13 C ATOM 374 CD1 LEU A 605 -3.011 -7.073 5.543 1.00 42.22 C ATOM 375 CD2 LEU A 605 -5.442 -7.488 5.939 1.00 32.11 C ATOM 0 H LEU A 605 -5.924 -6.178 8.830 1.00 20.24 H new ATOM 0 HA LEU A 605 -3.074 -6.416 8.134 1.00 10.04 H new ATOM 0 HB2 LEU A 605 -5.335 -4.879 6.891 1.00 13.03 H new ATOM 0 HB3 LEU A 605 -3.647 -4.561 6.544 1.00 13.03 H new ATOM 0 HG LEU A 605 -4.636 -5.892 4.802 1.00 42.13 H new ATOM 0 HD11 LEU A 605 -3.064 -7.822 4.753 1.00 42.22 H new ATOM 0 HD12 LEU A 605 -2.277 -6.313 5.274 1.00 42.22 H new ATOM 0 HD13 LEU A 605 -2.714 -7.551 6.476 1.00 42.22 H new ATOM 0 HD21 LEU A 605 -5.409 -8.210 5.123 1.00 32.11 H new ATOM 0 HD22 LEU A 605 -5.256 -7.999 6.884 1.00 32.11 H new ATOM 0 HD23 LEU A 605 -6.425 -7.018 5.968 1.00 32.11 H new ATOM 383 N THR A 606 -4.130 -4.760 10.388 1.00 40.51 N ATOM 384 CA THR A 606 -3.973 -3.803 11.442 1.00 42.53 C ATOM 385 C THR A 606 -2.462 -3.575 11.833 1.00 51.40 C ATOM 386 O THR A 606 -2.017 -2.436 11.905 1.00 34.52 O ATOM 387 CB THR A 606 -4.755 -4.308 12.655 1.00 64.14 C ATOM 388 OG1 THR A 606 -5.845 -5.118 12.175 1.00 62.11 O ATOM 389 CG2 THR A 606 -5.351 -3.142 13.392 1.00 22.02 C ATOM 0 H THR A 606 -4.691 -5.565 10.668 1.00 40.51 H new ATOM 0 HA THR A 606 -4.353 -2.841 11.098 1.00 42.53 H new ATOM 0 HB THR A 606 -4.092 -4.870 13.312 1.00 64.14 H new ATOM 0 HG1 THR A 606 -6.362 -5.456 12.936 1.00 62.11 H new ATOM 0 HG21 THR A 606 -5.908 -3.504 14.256 1.00 22.02 H new ATOM 0 HG22 THR A 606 -4.554 -2.477 13.726 1.00 22.02 H new ATOM 0 HG23 THR A 606 -6.024 -2.598 12.729 1.00 22.02 H new ATOM 395 N PRO A 607 -1.640 -4.661 12.088 1.00 11.55 N ATOM 396 CA PRO A 607 -0.205 -4.512 12.454 1.00 75.13 C ATOM 397 C PRO A 607 0.628 -3.928 11.308 1.00 54.24 C ATOM 398 O PRO A 607 1.732 -3.427 11.506 1.00 51.43 O ATOM 399 CB PRO A 607 0.248 -5.954 12.753 1.00 51.43 C ATOM 400 CG PRO A 607 -1.008 -6.720 12.969 1.00 30.35 C ATOM 401 CD PRO A 607 -2.020 -6.096 12.065 1.00 63.44 C ATOM 0 HA PRO A 607 -0.073 -3.826 13.291 1.00 75.13 H new ATOM 0 HB2 PRO A 607 0.823 -6.366 11.924 1.00 51.43 H new ATOM 0 HB3 PRO A 607 0.888 -5.991 13.634 1.00 51.43 H new ATOM 0 HG2 PRO A 607 -0.869 -7.775 12.733 1.00 30.35 H new ATOM 0 HG3 PRO A 607 -1.326 -6.666 14.010 1.00 30.35 H new ATOM 0 HD2 PRO A 607 -1.973 -6.511 11.058 1.00 63.44 H new ATOM 0 HD3 PRO A 607 -3.036 -6.251 12.427 1.00 63.44 H new ATOM 409 N LEU A 608 0.079 -4.019 10.117 1.00 43.34 N ATOM 410 CA LEU A 608 0.731 -3.594 8.883 1.00 44.02 C ATOM 411 C LEU A 608 0.875 -2.078 8.822 1.00 43.03 C ATOM 412 O LEU A 608 1.747 -1.558 8.129 1.00 54.43 O ATOM 413 CB LEU A 608 -0.064 -4.093 7.658 1.00 72.23 C ATOM 414 CG LEU A 608 -0.070 -5.609 7.342 1.00 11.11 C ATOM 415 CD1 LEU A 608 1.293 -6.057 6.966 1.00 64.15 C ATOM 416 CD2 LEU A 608 -0.555 -6.434 8.504 1.00 62.42 C ATOM 0 H LEU A 608 -0.856 -4.399 9.969 1.00 43.34 H new ATOM 0 HA LEU A 608 1.729 -4.031 8.869 1.00 44.02 H new ATOM 0 HB2 LEU A 608 -1.100 -3.778 7.786 1.00 72.23 H new ATOM 0 HB3 LEU A 608 0.321 -3.574 6.780 1.00 72.23 H new ATOM 0 HG LEU A 608 -0.760 -5.757 6.512 1.00 11.11 H new ATOM 0 HD11 LEU A 608 1.277 -7.124 6.746 1.00 64.15 H new ATOM 0 HD12 LEU A 608 1.626 -5.509 6.084 1.00 64.15 H new ATOM 0 HD13 LEU A 608 1.979 -5.867 7.791 1.00 64.15 H new ATOM 0 HD21 LEU A 608 -0.540 -7.489 8.232 1.00 62.42 H new ATOM 0 HD22 LEU A 608 0.096 -6.271 9.363 1.00 62.42 H new ATOM 0 HD23 LEU A 608 -1.573 -6.139 8.760 1.00 62.42 H new ATOM 424 N THR A 609 0.015 -1.395 9.537 1.00 61.23 N ATOM 425 CA THR A 609 0.002 0.045 9.606 1.00 32.04 C ATOM 426 C THR A 609 1.303 0.564 10.241 1.00 31.24 C ATOM 427 O THR A 609 1.716 0.101 11.314 1.00 11.42 O ATOM 428 CB THR A 609 -1.197 0.479 10.460 1.00 4.33 C ATOM 429 OG1 THR A 609 -2.389 -0.165 9.973 1.00 44.52 O ATOM 430 CG2 THR A 609 -1.391 1.977 10.418 1.00 21.32 C ATOM 0 H THR A 609 -0.712 -1.836 10.100 1.00 61.23 H new ATOM 0 HA THR A 609 -0.078 0.458 8.601 1.00 32.04 H new ATOM 0 HB THR A 609 -1.001 0.187 11.492 1.00 4.33 H new ATOM 0 HG1 THR A 609 -2.817 0.405 9.300 1.00 44.52 H new ATOM 0 HG21 THR A 609 -2.248 2.250 11.033 1.00 21.32 H new ATOM 0 HG22 THR A 609 -0.498 2.470 10.801 1.00 21.32 H new ATOM 0 HG23 THR A 609 -1.567 2.292 9.390 1.00 21.32 H new ATOM 436 N LYS A 610 1.936 1.507 9.580 1.00 33.23 N ATOM 437 CA LYS A 610 3.164 2.094 10.056 1.00 51.15 C ATOM 438 C LYS A 610 3.046 3.595 10.182 1.00 75.42 C ATOM 439 O LYS A 610 2.419 4.244 9.351 1.00 22.41 O ATOM 440 CB LYS A 610 4.331 1.796 9.115 1.00 43.13 C ATOM 441 CG LYS A 610 4.907 0.399 9.160 1.00 22.12 C ATOM 442 CD LYS A 610 6.138 0.313 8.257 1.00 61.51 C ATOM 443 CE LYS A 610 6.875 -1.013 8.403 1.00 12.41 C ATOM 444 NZ LYS A 610 7.464 -1.171 9.750 1.00 1.54 N ATOM 0 H LYS A 610 1.610 1.889 8.692 1.00 33.23 H new ATOM 0 HA LYS A 610 3.352 1.650 11.034 1.00 51.15 H new ATOM 0 HB2 LYS A 610 4.003 1.995 8.095 1.00 43.13 H new ATOM 0 HB3 LYS A 610 5.133 2.501 9.335 1.00 43.13 H new ATOM 0 HG2 LYS A 610 5.178 0.141 10.184 1.00 22.12 H new ATOM 0 HG3 LYS A 610 4.157 -0.323 8.837 1.00 22.12 H new ATOM 0 HD2 LYS A 610 5.833 0.444 7.219 1.00 61.51 H new ATOM 0 HD3 LYS A 610 6.818 1.131 8.495 1.00 61.51 H new ATOM 0 HE2 LYS A 610 6.186 -1.835 8.210 1.00 12.41 H new ATOM 0 HE3 LYS A 610 7.663 -1.075 7.653 1.00 12.41 H new ATOM 0 HZ1 LYS A 610 8.146 -1.956 9.741 1.00 1.54 H new ATOM 0 HZ2 LYS A 610 7.951 -0.293 10.021 1.00 1.54 H new ATOM 0 HZ3 LYS A 610 6.710 -1.375 10.437 1.00 1.54 H new ATOM 458 N LYS A 611 3.659 4.141 11.211 1.00 62.13 N ATOM 459 CA LYS A 611 3.734 5.581 11.393 1.00 64.11 C ATOM 460 C LYS A 611 4.693 6.208 10.392 1.00 60.04 C ATOM 461 O LYS A 611 4.552 7.366 10.012 1.00 0.10 O ATOM 462 CB LYS A 611 4.097 5.944 12.819 1.00 31.04 C ATOM 463 CG LYS A 611 3.031 5.553 13.834 1.00 40.13 C ATOM 464 CD LYS A 611 3.432 5.927 15.248 1.00 63.01 C ATOM 465 CE LYS A 611 3.683 7.423 15.392 1.00 30.02 C ATOM 466 NZ LYS A 611 4.068 7.788 16.765 1.00 74.12 N ATOM 0 H LYS A 611 4.119 3.603 11.945 1.00 62.13 H new ATOM 0 HA LYS A 611 2.743 5.992 11.202 1.00 64.11 H new ATOM 0 HB2 LYS A 611 5.035 5.456 13.083 1.00 31.04 H new ATOM 0 HB3 LYS A 611 4.269 7.019 12.880 1.00 31.04 H new ATOM 0 HG2 LYS A 611 2.091 6.044 13.581 1.00 40.13 H new ATOM 0 HG3 LYS A 611 2.854 4.479 13.779 1.00 40.13 H new ATOM 0 HD2 LYS A 611 2.647 5.623 15.940 1.00 63.01 H new ATOM 0 HD3 LYS A 611 4.332 5.380 15.527 1.00 63.01 H new ATOM 0 HE2 LYS A 611 4.470 7.727 14.702 1.00 30.02 H new ATOM 0 HE3 LYS A 611 2.784 7.970 15.110 1.00 30.02 H new ATOM 0 HZ1 LYS A 611 4.229 8.814 16.819 1.00 74.12 H new ATOM 0 HZ2 LYS A 611 3.306 7.522 17.421 1.00 74.12 H new ATOM 0 HZ3 LYS A 611 4.941 7.286 17.026 1.00 74.12 H new ATOM 480 N ASP A 612 5.669 5.432 9.969 1.00 44.25 N ATOM 481 CA ASP A 612 6.606 5.879 8.939 1.00 34.11 C ATOM 482 C ASP A 612 5.954 5.709 7.598 1.00 64.15 C ATOM 483 O ASP A 612 6.324 6.366 6.600 1.00 15.13 O ATOM 484 CB ASP A 612 7.904 5.054 8.949 1.00 52.32 C ATOM 485 CG ASP A 612 8.691 5.150 10.225 1.00 41.15 C ATOM 486 OD1 ASP A 612 9.425 6.139 10.413 1.00 4.33 O ATOM 487 OD2 ASP A 612 8.603 4.222 11.060 1.00 44.24 O ATOM 0 H ASP A 612 5.841 4.489 10.317 1.00 44.25 H new ATOM 0 HA ASP A 612 6.858 6.921 9.138 1.00 34.11 H new ATOM 0 HB2 ASP A 612 7.657 4.008 8.767 1.00 52.32 H new ATOM 0 HB3 ASP A 612 8.534 5.381 8.122 1.00 52.32 H new ATOM 492 N ALA A 613 4.959 4.815 7.591 1.00 2.02 N ATOM 493 CA ALA A 613 4.225 4.414 6.419 1.00 55.42 C ATOM 494 C ALA A 613 5.157 3.740 5.407 1.00 52.24 C ATOM 495 O ALA A 613 6.340 3.502 5.683 1.00 15.40 O ATOM 496 CB ALA A 613 3.475 5.596 5.826 1.00 14.41 C ATOM 0 H ALA A 613 4.643 4.343 8.438 1.00 2.02 H new ATOM 0 HA ALA A 613 3.476 3.675 6.703 1.00 55.42 H new ATOM 0 HB1 ALA A 613 2.927 5.272 4.941 1.00 14.41 H new ATOM 0 HB2 ALA A 613 2.775 5.989 6.563 1.00 14.41 H new ATOM 0 HB3 ALA A 613 4.185 6.375 5.548 1.00 14.41 H new ATOM 502 N TYR A 614 4.637 3.396 4.279 1.00 50.02 N ATOM 503 CA TYR A 614 5.418 2.743 3.261 1.00 5.24 C ATOM 504 C TYR A 614 5.632 3.674 2.115 1.00 40.23 C ATOM 505 O TYR A 614 4.718 4.405 1.728 1.00 0.30 O ATOM 506 CB TYR A 614 4.726 1.464 2.786 1.00 13.45 C ATOM 507 CG TYR A 614 4.631 0.387 3.846 1.00 32.12 C ATOM 508 CD1 TYR A 614 3.796 0.538 4.944 1.00 15.24 C ATOM 509 CD2 TYR A 614 5.384 -0.779 3.748 1.00 44.43 C ATOM 510 CE1 TYR A 614 3.712 -0.423 5.905 1.00 75.02 C ATOM 511 CE2 TYR A 614 5.307 -1.759 4.712 1.00 71.04 C ATOM 512 CZ TYR A 614 4.461 -1.570 5.795 1.00 55.25 C ATOM 513 OH TYR A 614 4.375 -2.514 6.773 1.00 54.54 O ATOM 0 H TYR A 614 3.661 3.555 4.027 1.00 50.02 H new ATOM 0 HA TYR A 614 6.385 2.469 3.683 1.00 5.24 H new ATOM 0 HB2 TYR A 614 3.721 1.712 2.443 1.00 13.45 H new ATOM 0 HB3 TYR A 614 5.267 1.068 1.927 1.00 13.45 H new ATOM 0 HD1 TYR A 614 3.202 1.435 5.038 1.00 15.24 H new ATOM 0 HD2 TYR A 614 6.040 -0.918 2.901 1.00 44.43 H new ATOM 0 HE1 TYR A 614 3.057 -0.284 6.753 1.00 75.02 H new ATOM 0 HE2 TYR A 614 5.896 -2.660 4.626 1.00 71.04 H new ATOM 0 HH TYR A 614 3.582 -2.344 7.323 1.00 54.54 H new ATOM 523 N LYS A 615 6.821 3.691 1.602 1.00 3.31 N ATOM 524 CA LYS A 615 7.127 4.497 0.469 1.00 2.34 C ATOM 525 C LYS A 615 7.572 3.613 -0.662 1.00 71.02 C ATOM 526 O LYS A 615 8.312 2.659 -0.454 1.00 41.40 O ATOM 527 CB LYS A 615 8.250 5.514 0.762 1.00 5.44 C ATOM 528 CG LYS A 615 8.541 6.423 -0.430 1.00 40.44 C ATOM 529 CD LYS A 615 9.861 7.201 -0.288 1.00 22.51 C ATOM 530 CE LYS A 615 9.932 8.087 0.942 1.00 35.31 C ATOM 531 NZ LYS A 615 11.138 8.942 0.932 1.00 43.30 N ATOM 0 H LYS A 615 7.606 3.146 1.959 1.00 3.31 H new ATOM 0 HA LYS A 615 6.224 5.050 0.209 1.00 2.34 H new ATOM 0 HB2 LYS A 615 7.968 6.124 1.620 1.00 5.44 H new ATOM 0 HB3 LYS A 615 9.159 4.978 1.037 1.00 5.44 H new ATOM 0 HG2 LYS A 615 8.577 5.821 -1.338 1.00 40.44 H new ATOM 0 HG3 LYS A 615 7.720 7.130 -0.549 1.00 40.44 H new ATOM 0 HD2 LYS A 615 10.687 6.490 -0.258 1.00 22.51 H new ATOM 0 HD3 LYS A 615 10.003 7.818 -1.175 1.00 22.51 H new ATOM 0 HE2 LYS A 615 9.042 8.714 0.990 1.00 35.31 H new ATOM 0 HE3 LYS A 615 9.934 7.466 1.838 1.00 35.31 H new ATOM 0 HZ1 LYS A 615 11.358 9.243 1.903 1.00 43.30 H new ATOM 0 HZ2 LYS A 615 11.941 8.406 0.545 1.00 43.30 H new ATOM 0 HZ3 LYS A 615 10.965 9.780 0.341 1.00 43.30 H new ATOM 545 N VAL A 616 7.089 3.896 -1.816 1.00 64.12 N ATOM 546 CA VAL A 616 7.549 3.272 -3.012 1.00 73.11 C ATOM 547 C VAL A 616 8.185 4.380 -3.818 1.00 71.15 C ATOM 548 O VAL A 616 7.605 5.459 -3.925 1.00 53.41 O ATOM 549 CB VAL A 616 6.387 2.668 -3.830 1.00 60.44 C ATOM 550 CG1 VAL A 616 6.905 1.921 -5.053 1.00 13.30 C ATOM 551 CG2 VAL A 616 5.505 1.769 -2.971 1.00 43.44 C ATOM 0 H VAL A 616 6.348 4.581 -1.964 1.00 64.12 H new ATOM 0 HA VAL A 616 8.233 2.456 -2.778 1.00 73.11 H new ATOM 0 HB VAL A 616 5.770 3.496 -4.179 1.00 60.44 H new ATOM 0 HG11 VAL A 616 6.064 1.507 -5.609 1.00 13.30 H new ATOM 0 HG12 VAL A 616 7.459 2.609 -5.692 1.00 13.30 H new ATOM 0 HG13 VAL A 616 7.563 1.112 -4.734 1.00 13.30 H new ATOM 0 HG21 VAL A 616 4.698 1.362 -3.580 1.00 43.44 H new ATOM 0 HG22 VAL A 616 6.103 0.952 -2.567 1.00 43.44 H new ATOM 0 HG23 VAL A 616 5.083 2.350 -2.151 1.00 43.44 H new ATOM 557 N GLU A 617 9.327 4.153 -4.373 1.00 54.43 N ATOM 558 CA GLU A 617 10.006 5.211 -5.077 1.00 64.34 C ATOM 559 C GLU A 617 10.052 4.876 -6.530 1.00 23.11 C ATOM 560 O GLU A 617 10.251 3.711 -6.899 1.00 63.20 O ATOM 561 CB GLU A 617 11.466 5.423 -4.596 1.00 14.42 C ATOM 562 CG GLU A 617 11.695 5.538 -3.089 1.00 52.53 C ATOM 563 CD GLU A 617 11.805 4.186 -2.400 1.00 42.22 C ATOM 564 OE1 GLU A 617 12.936 3.661 -2.309 1.00 22.40 O ATOM 565 OE2 GLU A 617 10.798 3.642 -1.947 1.00 24.23 O ATOM 0 H GLU A 617 9.814 3.257 -4.359 1.00 54.43 H new ATOM 0 HA GLU A 617 9.448 6.127 -4.882 1.00 64.34 H new ATOM 0 HB2 GLU A 617 12.068 4.593 -4.967 1.00 14.42 H new ATOM 0 HB3 GLU A 617 11.848 6.329 -5.066 1.00 14.42 H new ATOM 0 HG2 GLU A 617 12.607 6.107 -2.908 1.00 52.53 H new ATOM 0 HG3 GLU A 617 10.874 6.101 -2.644 1.00 52.53 H new ATOM 572 N THR A 618 9.873 5.863 -7.357 1.00 62.41 N ATOM 573 CA THR A 618 9.951 5.677 -8.748 1.00 22.31 C ATOM 574 C THR A 618 10.982 6.662 -9.226 1.00 22.52 C ATOM 575 O THR A 618 11.716 7.234 -8.398 1.00 11.24 O ATOM 576 CB THR A 618 8.578 5.928 -9.443 1.00 1.23 C ATOM 577 OG1 THR A 618 8.150 7.264 -9.194 1.00 21.33 O ATOM 578 CG2 THR A 618 7.512 4.967 -8.917 1.00 73.13 C ATOM 0 H THR A 618 9.668 6.820 -7.069 1.00 62.41 H new ATOM 0 HA THR A 618 10.222 4.650 -8.993 1.00 22.31 H new ATOM 0 HB THR A 618 8.708 5.764 -10.513 1.00 1.23 H new ATOM 0 HG1 THR A 618 8.244 7.465 -8.239 1.00 21.33 H new ATOM 0 HG21 THR A 618 6.565 5.164 -9.419 1.00 73.13 H new ATOM 0 HG22 THR A 618 7.819 3.940 -9.113 1.00 73.13 H new ATOM 0 HG23 THR A 618 7.391 5.111 -7.843 1.00 73.13 H new ATOM 584 N ASP A 619 11.073 6.871 -10.493 1.00 72.23 N ATOM 585 CA ASP A 619 12.027 7.812 -11.010 1.00 43.35 C ATOM 586 C ASP A 619 11.727 9.215 -10.573 1.00 61.33 C ATOM 587 O ASP A 619 12.617 9.932 -10.112 1.00 14.50 O ATOM 588 CB ASP A 619 12.147 7.733 -12.525 1.00 74.34 C ATOM 589 CG ASP A 619 12.913 6.525 -12.981 1.00 12.23 C ATOM 590 OD1 ASP A 619 12.332 5.422 -13.074 1.00 4.11 O ATOM 591 OD2 ASP A 619 14.129 6.656 -13.228 1.00 31.22 O ATOM 0 H ASP A 619 10.501 6.406 -11.198 1.00 72.23 H new ATOM 0 HA ASP A 619 12.992 7.531 -10.587 1.00 43.35 H new ATOM 0 HB2 ASP A 619 11.150 7.713 -12.964 1.00 74.34 H new ATOM 0 HB3 ASP A 619 12.640 8.632 -12.894 1.00 74.34 H new ATOM 596 N LYS A 620 10.480 9.605 -10.660 1.00 53.14 N ATOM 597 CA LYS A 620 10.129 10.982 -10.391 1.00 73.42 C ATOM 598 C LYS A 620 9.127 11.147 -9.268 1.00 72.14 C ATOM 599 O LYS A 620 8.834 12.270 -8.866 1.00 33.24 O ATOM 600 CB LYS A 620 9.611 11.654 -11.657 1.00 60.23 C ATOM 601 CG LYS A 620 10.591 11.661 -12.826 1.00 44.12 C ATOM 602 CD LYS A 620 9.949 12.208 -14.098 1.00 31.12 C ATOM 603 CE LYS A 620 8.788 11.325 -14.570 1.00 31.51 C ATOM 604 NZ LYS A 620 8.163 11.839 -15.800 1.00 54.42 N ATOM 0 H LYS A 620 9.698 9.000 -10.911 1.00 53.14 H new ATOM 0 HA LYS A 620 11.046 11.468 -10.059 1.00 73.42 H new ATOM 0 HB2 LYS A 620 8.697 11.150 -11.971 1.00 60.23 H new ATOM 0 HB3 LYS A 620 9.342 12.684 -11.421 1.00 60.23 H new ATOM 0 HG2 LYS A 620 11.460 12.266 -12.568 1.00 44.12 H new ATOM 0 HG3 LYS A 620 10.950 10.648 -13.006 1.00 44.12 H new ATOM 0 HD2 LYS A 620 9.587 13.220 -13.917 1.00 31.12 H new ATOM 0 HD3 LYS A 620 10.700 12.274 -14.885 1.00 31.12 H new ATOM 0 HE2 LYS A 620 9.152 10.312 -14.745 1.00 31.51 H new ATOM 0 HE3 LYS A 620 8.038 11.262 -13.782 1.00 31.51 H new ATOM 0 HZ1 LYS A 620 7.384 11.211 -16.082 1.00 54.42 H new ATOM 0 HZ2 LYS A 620 7.792 12.795 -15.627 1.00 54.42 H new ATOM 0 HZ3 LYS A 620 8.871 11.875 -16.561 1.00 54.42 H new ATOM 618 N TYR A 621 8.602 10.084 -8.771 1.00 61.04 N ATOM 619 CA TYR A 621 7.611 10.169 -7.719 1.00 51.14 C ATOM 620 C TYR A 621 7.920 9.208 -6.616 1.00 23.22 C ATOM 621 O TYR A 621 8.698 8.273 -6.793 1.00 60.33 O ATOM 622 CB TYR A 621 6.212 9.820 -8.266 1.00 62.22 C ATOM 623 CG TYR A 621 5.641 10.777 -9.285 1.00 21.02 C ATOM 624 CD1 TYR A 621 6.180 10.879 -10.554 1.00 23.45 C ATOM 625 CD2 TYR A 621 4.557 11.565 -8.975 1.00 43.02 C ATOM 626 CE1 TYR A 621 5.660 11.742 -11.482 1.00 14.13 C ATOM 627 CE2 TYR A 621 4.022 12.428 -9.900 1.00 42.31 C ATOM 628 CZ TYR A 621 4.573 12.518 -11.148 1.00 44.24 C ATOM 629 OH TYR A 621 4.027 13.380 -12.070 1.00 41.41 O ATOM 0 H TYR A 621 8.833 9.135 -9.066 1.00 61.04 H new ATOM 0 HA TYR A 621 7.629 11.191 -7.340 1.00 51.14 H new ATOM 0 HB2 TYR A 621 6.256 8.827 -8.714 1.00 62.22 H new ATOM 0 HB3 TYR A 621 5.520 9.760 -7.426 1.00 62.22 H new ATOM 0 HD1 TYR A 621 7.028 10.266 -10.819 1.00 23.45 H new ATOM 0 HD2 TYR A 621 4.120 11.504 -7.989 1.00 43.02 H new ATOM 0 HE1 TYR A 621 6.099 11.813 -12.466 1.00 14.13 H new ATOM 0 HE2 TYR A 621 3.167 13.035 -9.642 1.00 42.31 H new ATOM 0 HH TYR A 621 3.266 13.849 -11.669 1.00 41.41 H new ATOM 639 N GLU A 622 7.338 9.441 -5.502 1.00 11.31 N ATOM 640 CA GLU A 622 7.327 8.491 -4.458 1.00 53.00 C ATOM 641 C GLU A 622 5.899 8.351 -4.075 1.00 51.21 C ATOM 642 O GLU A 622 5.124 9.327 -4.167 1.00 72.22 O ATOM 643 CB GLU A 622 8.138 8.885 -3.203 1.00 54.41 C ATOM 644 CG GLU A 622 7.549 10.034 -2.397 1.00 22.12 C ATOM 645 CD GLU A 622 8.216 10.218 -1.046 1.00 11.31 C ATOM 646 OE1 GLU A 622 9.364 10.709 -0.998 1.00 1.12 O ATOM 647 OE2 GLU A 622 7.588 9.859 0.012 1.00 55.24 O ATOM 0 H GLU A 622 6.849 10.310 -5.286 1.00 11.31 H new ATOM 0 HA GLU A 622 7.797 7.577 -4.820 1.00 53.00 H new ATOM 0 HB2 GLU A 622 8.225 8.013 -2.555 1.00 54.41 H new ATOM 0 HB3 GLU A 622 9.148 9.156 -3.511 1.00 54.41 H new ATOM 0 HG2 GLU A 622 7.642 10.957 -2.970 1.00 22.12 H new ATOM 0 HG3 GLU A 622 6.484 9.857 -2.248 1.00 22.12 H new ATOM 654 N PHE A 623 5.523 7.205 -3.710 1.00 13.32 N ATOM 655 CA PHE A 623 4.214 7.006 -3.244 1.00 73.43 C ATOM 656 C PHE A 623 4.324 6.622 -1.813 1.00 75.42 C ATOM 657 O PHE A 623 5.010 5.662 -1.484 1.00 43.50 O ATOM 658 CB PHE A 623 3.516 5.889 -4.031 1.00 74.32 C ATOM 659 CG PHE A 623 3.388 6.138 -5.517 1.00 51.03 C ATOM 660 CD1 PHE A 623 4.450 5.894 -6.372 1.00 71.41 C ATOM 661 CD2 PHE A 623 2.204 6.610 -6.054 1.00 12.34 C ATOM 662 CE1 PHE A 623 4.332 6.117 -7.722 1.00 62.33 C ATOM 663 CE2 PHE A 623 2.085 6.831 -7.408 1.00 52.21 C ATOM 664 CZ PHE A 623 3.151 6.584 -8.243 1.00 52.44 C ATOM 0 H PHE A 623 6.109 6.370 -3.723 1.00 13.32 H new ATOM 0 HA PHE A 623 3.622 7.912 -3.371 1.00 73.43 H new ATOM 0 HB2 PHE A 623 4.066 4.960 -3.880 1.00 74.32 H new ATOM 0 HB3 PHE A 623 2.519 5.741 -3.616 1.00 74.32 H new ATOM 0 HD1 PHE A 623 5.382 5.524 -5.972 1.00 71.41 H new ATOM 0 HD2 PHE A 623 1.364 6.807 -5.405 1.00 12.34 H new ATOM 0 HE1 PHE A 623 5.170 5.925 -8.375 1.00 62.33 H new ATOM 0 HE2 PHE A 623 1.155 7.198 -7.815 1.00 52.21 H new ATOM 0 HZ PHE A 623 3.059 6.757 -9.305 1.00 52.44 H new ATOM 674 N HIS A 624 3.702 7.355 -0.964 1.00 44.22 N ATOM 675 CA HIS A 624 3.712 7.024 0.404 1.00 51.12 C ATOM 676 C HIS A 624 2.315 6.637 0.786 1.00 70.40 C ATOM 677 O HIS A 624 1.384 7.421 0.633 1.00 40.40 O ATOM 678 CB HIS A 624 4.182 8.218 1.228 1.00 41.34 C ATOM 679 CG HIS A 624 5.270 7.869 2.176 1.00 43.31 C ATOM 680 ND1 HIS A 624 6.565 8.284 2.011 1.00 24.34 N ATOM 681 CD2 HIS A 624 5.252 7.139 3.307 1.00 55.25 C ATOM 682 CE1 HIS A 624 7.294 7.813 3.004 1.00 2.01 C ATOM 683 NE2 HIS A 624 6.519 7.120 3.806 1.00 23.34 N ATOM 0 H HIS A 624 3.176 8.196 -1.201 1.00 44.22 H new ATOM 0 HA HIS A 624 4.397 6.198 0.596 1.00 51.12 H new ATOM 0 HB2 HIS A 624 4.529 9.003 0.556 1.00 41.34 H new ATOM 0 HB3 HIS A 624 3.338 8.625 1.785 1.00 41.34 H new ATOM 0 HD1 HIS A 624 6.909 8.863 1.245 1.00 24.34 H new ATOM 0 HD2 HIS A 624 4.389 6.656 3.740 1.00 55.25 H new ATOM 0 HE1 HIS A 624 8.354 7.971 3.136 1.00 2.01 H new ATOM 0 HE2 HIS A 624 6.816 6.647 4.659 1.00 23.34 H new ATOM 692 N ILE A 625 2.169 5.462 1.299 1.00 33.51 N ATOM 693 CA ILE A 625 0.870 4.930 1.622 1.00 13.15 C ATOM 694 C ILE A 625 0.956 4.231 2.953 1.00 65.23 C ATOM 695 O ILE A 625 2.048 3.830 3.384 1.00 73.02 O ATOM 696 CB ILE A 625 0.365 3.905 0.538 1.00 1.21 C ATOM 697 CG1 ILE A 625 1.257 2.669 0.531 1.00 1.41 C ATOM 698 CG2 ILE A 625 0.317 4.540 -0.853 1.00 12.13 C ATOM 699 CD1 ILE A 625 0.930 1.645 -0.546 1.00 44.51 C ATOM 0 H ILE A 625 2.944 4.834 1.510 1.00 33.51 H new ATOM 0 HA ILE A 625 0.161 5.758 1.654 1.00 13.15 H new ATOM 0 HB ILE A 625 -0.651 3.609 0.800 1.00 1.21 H new ATOM 0 HG12 ILE A 625 2.292 2.987 0.406 1.00 1.41 H new ATOM 0 HG13 ILE A 625 1.188 2.184 1.505 1.00 1.41 H new ATOM 0 HG21 ILE A 625 -0.036 3.805 -1.577 1.00 12.13 H new ATOM 0 HG22 ILE A 625 -0.363 5.392 -0.841 1.00 12.13 H new ATOM 0 HG23 ILE A 625 1.315 4.876 -1.134 1.00 12.13 H new ATOM 0 HD11 ILE A 625 1.619 0.804 -0.469 1.00 44.51 H new ATOM 0 HD12 ILE A 625 -0.092 1.291 -0.413 1.00 44.51 H new ATOM 0 HD13 ILE A 625 1.029 2.106 -1.529 1.00 44.51 H new ATOM 706 N ASN A 626 -0.133 4.121 3.609 1.00 4.42 N ATOM 707 CA ASN A 626 -0.183 3.428 4.874 1.00 55.11 C ATOM 708 C ASN A 626 -1.359 2.477 4.851 1.00 22.50 C ATOM 709 O ASN A 626 -2.308 2.696 4.095 1.00 53.24 O ATOM 710 CB ASN A 626 -0.308 4.436 6.021 1.00 74.32 C ATOM 711 CG ASN A 626 -0.239 3.806 7.390 1.00 34.51 C ATOM 712 OD1 ASN A 626 0.409 2.765 7.582 1.00 44.41 O ATOM 713 ND2 ASN A 626 -0.882 4.425 8.341 1.00 42.52 N ATOM 0 H ASN A 626 -1.027 4.503 3.300 1.00 4.42 H new ATOM 0 HA ASN A 626 0.734 2.861 5.033 1.00 55.11 H new ATOM 0 HB2 ASN A 626 0.487 5.177 5.931 1.00 74.32 H new ATOM 0 HB3 ASN A 626 -1.253 4.969 5.923 1.00 74.32 H new ATOM 0 HD21 ASN A 626 -0.866 4.056 9.292 1.00 42.52 H new ATOM 0 HD22 ASN A 626 -1.401 5.278 8.134 1.00 42.52 H new ATOM 719 N VAL A 627 -1.298 1.422 5.634 1.00 31.30 N ATOM 720 CA VAL A 627 -2.363 0.444 5.657 1.00 73.35 C ATOM 721 C VAL A 627 -3.453 0.888 6.577 1.00 43.15 C ATOM 722 O VAL A 627 -3.235 1.017 7.771 1.00 3.24 O ATOM 723 CB VAL A 627 -1.877 -0.950 6.080 1.00 71.04 C ATOM 724 CG1 VAL A 627 -3.024 -1.946 6.071 1.00 70.14 C ATOM 725 CG2 VAL A 627 -0.793 -1.413 5.158 1.00 2.44 C ATOM 0 H VAL A 627 -0.521 1.220 6.264 1.00 31.30 H new ATOM 0 HA VAL A 627 -2.740 0.367 4.637 1.00 73.35 H new ATOM 0 HB VAL A 627 -1.484 -0.885 7.095 1.00 71.04 H new ATOM 0 HG11 VAL A 627 -2.657 -2.927 6.374 1.00 70.14 H new ATOM 0 HG12 VAL A 627 -3.797 -1.617 6.766 1.00 70.14 H new ATOM 0 HG13 VAL A 627 -3.443 -2.010 5.067 1.00 70.14 H new ATOM 0 HG21 VAL A 627 -0.453 -2.402 5.464 1.00 2.44 H new ATOM 0 HG22 VAL A 627 -1.178 -1.460 4.139 1.00 2.44 H new ATOM 0 HG23 VAL A 627 0.042 -0.714 5.198 1.00 2.44 H new ATOM 731 N CYS A 628 -4.596 1.134 5.978 1.00 51.10 N ATOM 732 CA CYS A 628 -5.840 1.589 6.587 1.00 14.02 C ATOM 733 C CYS A 628 -5.711 2.927 7.317 1.00 72.42 C ATOM 734 O CYS A 628 -4.679 3.264 7.902 1.00 43.50 O ATOM 735 CB CYS A 628 -6.543 0.495 7.457 1.00 42.05 C ATOM 736 SG CYS A 628 -5.645 -0.110 8.933 1.00 5.23 S ATOM 0 H CYS A 628 -4.695 1.013 4.970 1.00 51.10 H new ATOM 0 HA CYS A 628 -6.507 1.776 5.746 1.00 14.02 H new ATOM 0 HB2 CYS A 628 -7.504 0.892 7.786 1.00 42.05 H new ATOM 0 HB3 CYS A 628 -6.754 -0.361 6.816 1.00 42.05 H new ATOM 741 N GLY A 629 -6.765 3.680 7.273 1.00 5.01 N ATOM 742 CA GLY A 629 -6.789 4.947 7.922 1.00 72.23 C ATOM 743 C GLY A 629 -6.036 5.964 7.116 1.00 43.31 C ATOM 744 O GLY A 629 -6.013 5.896 5.886 1.00 0.22 O ATOM 0 H GLY A 629 -7.628 3.433 6.788 1.00 5.01 H new ATOM 0 HA2 GLY A 629 -7.820 5.273 8.058 1.00 72.23 H new ATOM 0 HA3 GLY A 629 -6.348 4.862 8.915 1.00 72.23 H new ATOM 748 N PRO A 630 -5.461 6.937 7.770 1.00 54.11 N ATOM 749 CA PRO A 630 -4.621 7.921 7.126 1.00 61.54 C ATOM 750 C PRO A 630 -3.147 7.504 7.052 1.00 53.32 C ATOM 751 O PRO A 630 -2.714 6.512 7.679 1.00 43.21 O ATOM 752 CB PRO A 630 -4.748 9.092 8.050 1.00 64.11 C ATOM 753 CG PRO A 630 -4.888 8.479 9.401 1.00 54.43 C ATOM 754 CD PRO A 630 -5.639 7.215 9.206 1.00 41.31 C ATOM 0 HA PRO A 630 -4.921 8.095 6.093 1.00 61.54 H new ATOM 0 HB2 PRO A 630 -3.873 9.739 7.995 1.00 64.11 H new ATOM 0 HB3 PRO A 630 -5.614 9.705 7.799 1.00 64.11 H new ATOM 0 HG2 PRO A 630 -3.911 8.287 9.844 1.00 54.43 H new ATOM 0 HG3 PRO A 630 -5.420 9.147 10.078 1.00 54.43 H new ATOM 0 HD2 PRO A 630 -5.241 6.410 9.824 1.00 41.31 H new ATOM 0 HD3 PRO A 630 -6.691 7.327 9.467 1.00 41.31 H new ATOM 762 N VAL A 631 -2.391 8.263 6.301 1.00 4.10 N ATOM 763 CA VAL A 631 -0.986 8.071 6.185 1.00 25.12 C ATOM 764 C VAL A 631 -0.302 9.163 6.995 1.00 14.42 C ATOM 765 O VAL A 631 -0.646 10.356 6.886 1.00 10.40 O ATOM 766 CB VAL A 631 -0.502 8.104 4.687 1.00 63.53 C ATOM 767 CG1 VAL A 631 -0.698 9.447 4.001 1.00 13.42 C ATOM 768 CG2 VAL A 631 0.907 7.603 4.541 1.00 0.24 C ATOM 0 H VAL A 631 -2.749 9.042 5.748 1.00 4.10 H new ATOM 0 HA VAL A 631 -0.725 7.084 6.567 1.00 25.12 H new ATOM 0 HB VAL A 631 -1.158 7.412 4.159 1.00 63.53 H new ATOM 0 HG11 VAL A 631 -0.340 9.386 2.973 1.00 13.42 H new ATOM 0 HG12 VAL A 631 -1.757 9.705 4.001 1.00 13.42 H new ATOM 0 HG13 VAL A 631 -0.138 10.214 4.536 1.00 13.42 H new ATOM 0 HG21 VAL A 631 1.200 7.643 3.492 1.00 0.24 H new ATOM 0 HG22 VAL A 631 1.578 8.228 5.130 1.00 0.24 H new ATOM 0 HG23 VAL A 631 0.966 6.574 4.895 1.00 0.24 H new ATOM 774 N SER A 632 0.612 8.787 7.816 1.00 50.11 N ATOM 775 CA SER A 632 1.291 9.732 8.618 1.00 74.14 C ATOM 776 C SER A 632 2.560 10.267 7.945 1.00 20.04 C ATOM 777 O SER A 632 3.688 9.820 8.214 1.00 72.45 O ATOM 778 CB SER A 632 1.493 9.183 10.017 1.00 42.32 C ATOM 779 OG SER A 632 1.955 7.840 9.949 1.00 71.51 O ATOM 0 H SER A 632 0.907 7.820 7.948 1.00 50.11 H new ATOM 0 HA SER A 632 0.666 10.618 8.727 1.00 74.14 H new ATOM 0 HB2 SER A 632 2.213 9.797 10.557 1.00 42.32 H new ATOM 0 HB3 SER A 632 0.556 9.227 10.573 1.00 42.32 H new ATOM 0 HG SER A 632 2.916 7.834 9.757 1.00 71.51 H new ATOM 785 N VAL A 633 2.337 11.153 6.986 1.00 20.02 N ATOM 786 CA VAL A 633 3.392 11.828 6.246 1.00 20.00 C ATOM 787 C VAL A 633 3.011 13.287 6.173 1.00 11.40 C ATOM 788 O VAL A 633 1.866 13.592 5.876 1.00 61.01 O ATOM 789 CB VAL A 633 3.509 11.283 4.785 1.00 75.10 C ATOM 790 CG1 VAL A 633 4.689 11.885 4.049 1.00 12.23 C ATOM 791 CG2 VAL A 633 3.603 9.793 4.777 1.00 33.13 C ATOM 0 H VAL A 633 1.399 11.428 6.695 1.00 20.02 H new ATOM 0 HA VAL A 633 4.346 11.665 6.747 1.00 20.00 H new ATOM 0 HB VAL A 633 2.601 11.582 4.260 1.00 75.10 H new ATOM 0 HG11 VAL A 633 4.733 11.479 3.038 1.00 12.23 H new ATOM 0 HG12 VAL A 633 4.574 12.968 4.000 1.00 12.23 H new ATOM 0 HG13 VAL A 633 5.610 11.642 4.578 1.00 12.23 H new ATOM 0 HG21 VAL A 633 3.683 9.439 3.749 1.00 33.13 H new ATOM 0 HG22 VAL A 633 4.484 9.481 5.338 1.00 33.13 H new ATOM 0 HG23 VAL A 633 2.710 9.370 5.238 1.00 33.13 H new ATOM 797 N GLY A 634 3.950 14.170 6.432 1.00 10.33 N ATOM 798 CA GLY A 634 3.670 15.600 6.431 1.00 0.30 C ATOM 799 C GLY A 634 3.327 16.153 5.055 1.00 71.24 C ATOM 800 O GLY A 634 2.772 17.253 4.944 1.00 4.41 O ATOM 0 H GLY A 634 4.917 13.929 6.647 1.00 10.33 H new ATOM 0 HA2 GLY A 634 2.842 15.800 7.111 1.00 0.30 H new ATOM 0 HA3 GLY A 634 4.538 16.132 6.821 1.00 0.30 H new ATOM 804 N ALA A 635 3.641 15.390 4.016 1.00 21.01 N ATOM 805 CA ALA A 635 3.405 15.803 2.633 1.00 51.13 C ATOM 806 C ALA A 635 1.923 16.035 2.363 1.00 34.31 C ATOM 807 O ALA A 635 1.548 16.988 1.682 1.00 3.30 O ATOM 808 CB ALA A 635 3.972 14.774 1.663 1.00 2.21 C ATOM 0 H ALA A 635 4.066 14.467 4.105 1.00 21.01 H new ATOM 0 HA ALA A 635 3.921 16.750 2.478 1.00 51.13 H new ATOM 0 HB1 ALA A 635 3.787 15.099 0.639 1.00 2.21 H new ATOM 0 HB2 ALA A 635 5.046 14.675 1.824 1.00 2.21 H new ATOM 0 HB3 ALA A 635 3.490 13.811 1.831 1.00 2.21 H new ATOM 814 N CYS A 636 1.095 15.190 2.918 1.00 75.44 N ATOM 815 CA CYS A 636 -0.332 15.311 2.750 1.00 31.00 C ATOM 816 C CYS A 636 -1.022 15.350 4.100 1.00 65.24 C ATOM 817 O CYS A 636 -0.479 14.858 5.086 1.00 54.22 O ATOM 818 CB CYS A 636 -0.882 14.192 1.850 1.00 1.54 C ATOM 819 SG CYS A 636 -0.377 14.336 0.095 1.00 41.33 S ATOM 0 H CYS A 636 1.387 14.402 3.496 1.00 75.44 H new ATOM 0 HA CYS A 636 -0.544 16.253 2.245 1.00 31.00 H new ATOM 0 HB2 CYS A 636 -0.546 13.230 2.237 1.00 1.54 H new ATOM 0 HB3 CYS A 636 -1.971 14.196 1.906 1.00 1.54 H new ATOM 824 N PRO A 637 -2.213 15.971 4.174 1.00 53.11 N ATOM 825 CA PRO A 637 -2.967 16.109 5.425 1.00 14.42 C ATOM 826 C PRO A 637 -3.329 14.758 6.056 1.00 13.11 C ATOM 827 O PRO A 637 -3.437 13.749 5.350 1.00 71.30 O ATOM 828 CB PRO A 637 -4.254 16.839 4.986 1.00 72.41 C ATOM 829 CG PRO A 637 -4.342 16.599 3.522 1.00 22.32 C ATOM 830 CD PRO A 637 -2.931 16.594 3.042 1.00 64.41 C ATOM 0 HA PRO A 637 -2.386 16.633 6.184 1.00 14.42 H new ATOM 0 HB2 PRO A 637 -5.129 16.447 5.505 1.00 72.41 H new ATOM 0 HB3 PRO A 637 -4.201 17.904 5.210 1.00 72.41 H new ATOM 0 HG2 PRO A 637 -4.834 15.651 3.307 1.00 22.32 H new ATOM 0 HG3 PRO A 637 -4.923 17.379 3.029 1.00 22.32 H new ATOM 0 HD2 PRO A 637 -2.817 16.020 2.123 1.00 64.41 H new ATOM 0 HD3 PRO A 637 -2.568 17.601 2.836 1.00 64.41 H new ATOM 838 N PRO A 638 -3.525 14.726 7.400 1.00 41.44 N ATOM 839 CA PRO A 638 -3.966 13.519 8.149 1.00 41.25 C ATOM 840 C PRO A 638 -5.286 12.936 7.607 1.00 13.50 C ATOM 841 O PRO A 638 -5.708 11.868 7.995 1.00 21.34 O ATOM 842 CB PRO A 638 -4.168 14.037 9.577 1.00 24.32 C ATOM 843 CG PRO A 638 -3.279 15.225 9.673 1.00 31.14 C ATOM 844 CD PRO A 638 -3.302 15.868 8.316 1.00 52.35 C ATOM 0 HA PRO A 638 -3.240 12.710 8.069 1.00 41.25 H new ATOM 0 HB2 PRO A 638 -5.209 14.305 9.758 1.00 24.32 H new ATOM 0 HB3 PRO A 638 -3.900 13.281 10.315 1.00 24.32 H new ATOM 0 HG2 PRO A 638 -3.632 15.916 10.439 1.00 31.14 H new ATOM 0 HG3 PRO A 638 -2.266 14.933 9.950 1.00 31.14 H new ATOM 0 HD2 PRO A 638 -4.097 16.609 8.236 1.00 52.35 H new ATOM 0 HD3 PRO A 638 -2.365 16.381 8.098 1.00 52.35 H new ATOM 852 N ASP A 639 -5.941 13.682 6.747 1.00 32.01 N ATOM 853 CA ASP A 639 -7.177 13.247 6.118 1.00 71.41 C ATOM 854 C ASP A 639 -6.893 12.303 4.960 1.00 2.01 C ATOM 855 O ASP A 639 -7.803 11.724 4.402 1.00 22.22 O ATOM 856 CB ASP A 639 -7.955 14.445 5.577 1.00 35.23 C ATOM 857 CG ASP A 639 -8.249 15.472 6.628 1.00 13.43 C ATOM 858 OD1 ASP A 639 -9.208 15.291 7.394 1.00 74.32 O ATOM 859 OD2 ASP A 639 -7.501 16.478 6.717 1.00 2.25 O ATOM 0 H ASP A 639 -5.634 14.611 6.460 1.00 32.01 H new ATOM 0 HA ASP A 639 -7.764 12.732 6.878 1.00 71.41 H new ATOM 0 HB2 ASP A 639 -7.385 14.909 4.772 1.00 35.23 H new ATOM 0 HB3 ASP A 639 -8.893 14.097 5.144 1.00 35.23 H new ATOM 864 N SER A 640 -5.634 12.170 4.599 1.00 35.03 N ATOM 865 CA SER A 640 -5.236 11.338 3.488 1.00 64.40 C ATOM 866 C SER A 640 -4.573 10.058 3.985 1.00 41.25 C ATOM 867 O SER A 640 -3.856 10.076 4.979 1.00 21.23 O ATOM 868 CB SER A 640 -4.275 12.116 2.579 1.00 33.03 C ATOM 869 OG SER A 640 -3.873 11.348 1.463 1.00 63.41 O ATOM 0 H SER A 640 -4.859 12.637 5.069 1.00 35.03 H new ATOM 0 HA SER A 640 -6.124 11.062 2.919 1.00 64.40 H new ATOM 0 HB2 SER A 640 -4.759 13.030 2.236 1.00 33.03 H new ATOM 0 HB3 SER A 640 -3.396 12.415 3.150 1.00 33.03 H new ATOM 0 HG SER A 640 -4.550 11.417 0.758 1.00 63.41 H new ATOM 875 N GLY A 641 -4.839 8.955 3.293 1.00 20.23 N ATOM 876 CA GLY A 641 -4.248 7.667 3.627 1.00 23.23 C ATOM 877 C GLY A 641 -3.170 7.248 2.644 1.00 53.45 C ATOM 878 O GLY A 641 -2.424 6.285 2.888 1.00 73.41 O ATOM 0 H GLY A 641 -5.467 8.930 2.490 1.00 20.23 H new ATOM 0 HA2 GLY A 641 -3.822 7.716 4.629 1.00 23.23 H new ATOM 0 HA3 GLY A 641 -5.029 6.907 3.649 1.00 23.23 H new ATOM 882 N ALA A 642 -3.074 7.970 1.547 1.00 43.23 N ATOM 883 CA ALA A 642 -2.073 7.705 0.522 1.00 13.13 C ATOM 884 C ALA A 642 -1.723 9.003 -0.171 1.00 31.52 C ATOM 885 O ALA A 642 -2.604 9.747 -0.595 1.00 44.25 O ATOM 886 CB ALA A 642 -2.580 6.665 -0.466 1.00 53.33 C ATOM 0 H ALA A 642 -3.686 8.759 1.336 1.00 43.23 H new ATOM 0 HA ALA A 642 -1.173 7.298 0.983 1.00 13.13 H new ATOM 0 HB1 ALA A 642 -1.818 6.481 -1.224 1.00 53.33 H new ATOM 0 HB2 ALA A 642 -2.798 5.737 0.062 1.00 53.33 H new ATOM 0 HB3 ALA A 642 -3.488 7.031 -0.946 1.00 53.33 H new ATOM 892 N CYS A 643 -0.453 9.268 -0.279 1.00 1.34 N ATOM 893 CA CYS A 643 0.026 10.522 -0.799 1.00 34.33 C ATOM 894 C CYS A 643 1.218 10.321 -1.717 1.00 73.11 C ATOM 895 O CYS A 643 2.129 9.553 -1.407 1.00 52.14 O ATOM 896 CB CYS A 643 0.417 11.424 0.372 1.00 13.20 C ATOM 897 SG CYS A 643 1.150 13.025 -0.097 1.00 21.02 S ATOM 0 H CYS A 643 0.286 8.619 -0.008 1.00 1.34 H new ATOM 0 HA CYS A 643 -0.768 10.986 -1.384 1.00 34.33 H new ATOM 0 HB2 CYS A 643 -0.469 11.611 0.978 1.00 13.20 H new ATOM 0 HB3 CYS A 643 1.126 10.888 1.002 1.00 13.20 H new ATOM 902 N GLN A 644 1.201 10.988 -2.841 1.00 64.13 N ATOM 903 CA GLN A 644 2.308 10.945 -3.773 1.00 13.51 C ATOM 904 C GLN A 644 2.897 12.309 -3.943 1.00 44.21 C ATOM 905 O GLN A 644 2.181 13.301 -3.920 1.00 72.41 O ATOM 906 CB GLN A 644 1.913 10.427 -5.143 1.00 50.44 C ATOM 907 CG GLN A 644 0.741 11.154 -5.784 1.00 11.13 C ATOM 908 CD GLN A 644 0.477 10.723 -7.221 1.00 0.24 C ATOM 909 OE1 GLN A 644 -0.053 11.617 -8.017 1.00 72.43 O flip ATOM 910 NE2 GLN A 644 0.744 9.598 -7.605 1.00 64.02 N flip ATOM 0 H GLN A 644 0.423 11.576 -3.140 1.00 64.13 H new ATOM 0 HA GLN A 644 3.034 10.254 -3.344 1.00 13.51 H new ATOM 0 HB2 GLN A 644 2.775 10.500 -5.806 1.00 50.44 H new ATOM 0 HB3 GLN A 644 1.664 9.369 -5.059 1.00 50.44 H new ATOM 0 HG2 GLN A 644 -0.155 10.979 -5.189 1.00 11.13 H new ATOM 0 HG3 GLN A 644 0.933 12.227 -5.763 1.00 11.13 H new ATOM 0 HE21 GLN A 644 1.157 8.924 -6.960 1.00 64.02 H new ATOM 0 HE22 GLN A 644 0.555 9.331 -8.571 1.00 64.02 H new ATOM 918 N VAL A 645 4.177 12.363 -4.119 1.00 50.01 N ATOM 919 CA VAL A 645 4.847 13.599 -4.357 1.00 22.32 C ATOM 920 C VAL A 645 5.841 13.440 -5.491 1.00 21.11 C ATOM 921 O VAL A 645 6.601 12.461 -5.551 1.00 41.40 O ATOM 922 CB VAL A 645 5.522 14.210 -3.066 1.00 34.34 C ATOM 923 CG1 VAL A 645 6.543 13.275 -2.459 1.00 70.03 C ATOM 924 CG2 VAL A 645 6.158 15.569 -3.358 1.00 35.13 C ATOM 0 H VAL A 645 4.790 11.548 -4.102 1.00 50.01 H new ATOM 0 HA VAL A 645 4.087 14.324 -4.650 1.00 22.32 H new ATOM 0 HB VAL A 645 4.724 14.350 -2.337 1.00 34.34 H new ATOM 0 HG11 VAL A 645 6.980 13.738 -1.574 1.00 70.03 H new ATOM 0 HG12 VAL A 645 6.058 12.340 -2.177 1.00 70.03 H new ATOM 0 HG13 VAL A 645 7.328 13.071 -3.187 1.00 70.03 H new ATOM 0 HG21 VAL A 645 6.613 15.961 -2.448 1.00 35.13 H new ATOM 0 HG22 VAL A 645 6.923 15.455 -4.126 1.00 35.13 H new ATOM 0 HG23 VAL A 645 5.392 16.261 -3.708 1.00 35.13 H new ATOM 930 N SER A 646 5.781 14.353 -6.412 1.00 53.20 N ATOM 931 CA SER A 646 6.679 14.395 -7.498 1.00 53.04 C ATOM 932 C SER A 646 7.945 15.024 -7.017 1.00 5.33 C ATOM 933 O SER A 646 7.970 16.201 -6.676 1.00 24.25 O ATOM 934 CB SER A 646 6.091 15.214 -8.662 1.00 43.44 C ATOM 935 OG SER A 646 7.011 15.316 -9.745 1.00 62.44 O ATOM 0 H SER A 646 5.087 15.100 -6.419 1.00 53.20 H new ATOM 0 HA SER A 646 6.866 13.386 -7.866 1.00 53.04 H new ATOM 0 HB2 SER A 646 5.170 14.746 -9.009 1.00 43.44 H new ATOM 0 HB3 SER A 646 5.829 16.212 -8.310 1.00 43.44 H new ATOM 0 HG SER A 646 6.608 15.840 -10.468 1.00 62.44 H new ATOM 941 N ARG A 647 8.980 14.246 -6.965 1.00 51.42 N ATOM 942 CA ARG A 647 10.284 14.738 -6.551 1.00 72.15 C ATOM 943 C ARG A 647 10.829 15.644 -7.662 1.00 21.40 C ATOM 944 O ARG A 647 11.685 16.496 -7.438 1.00 11.23 O ATOM 945 CB ARG A 647 11.229 13.544 -6.268 1.00 35.34 C ATOM 946 CG ARG A 647 11.562 12.722 -7.491 1.00 41.54 C ATOM 947 CD ARG A 647 12.230 11.402 -7.149 1.00 65.30 C ATOM 948 NE ARG A 647 13.518 11.537 -6.472 1.00 73.11 N ATOM 949 CZ ARG A 647 14.517 10.642 -6.579 1.00 52.43 C ATOM 950 NH1 ARG A 647 14.410 9.612 -7.436 1.00 2.30 N ATOM 951 NH2 ARG A 647 15.616 10.784 -5.853 1.00 24.21 N ATOM 0 H ARG A 647 8.960 13.255 -7.204 1.00 51.42 H new ATOM 0 HA ARG A 647 10.208 15.316 -5.630 1.00 72.15 H new ATOM 0 HB2 ARG A 647 12.155 13.921 -5.833 1.00 35.34 H new ATOM 0 HB3 ARG A 647 10.767 12.897 -5.522 1.00 35.34 H new ATOM 0 HG2 ARG A 647 10.648 12.527 -8.052 1.00 41.54 H new ATOM 0 HG3 ARG A 647 12.219 13.298 -8.143 1.00 41.54 H new ATOM 0 HD2 ARG A 647 11.559 10.822 -6.515 1.00 65.30 H new ATOM 0 HD3 ARG A 647 12.373 10.832 -8.067 1.00 65.30 H new ATOM 0 HE ARG A 647 13.668 12.357 -5.884 1.00 73.11 H new ATOM 0 HH11 ARG A 647 13.571 9.508 -8.006 1.00 2.30 H new ATOM 0 HH12 ARG A 647 15.168 8.934 -7.516 1.00 2.30 H new ATOM 0 HH21 ARG A 647 15.705 11.572 -5.212 1.00 24.21 H new ATOM 0 HH22 ARG A 647 16.373 10.105 -5.935 1.00 24.21 H new ATOM 963 N SER A 648 10.269 15.453 -8.855 1.00 23.50 N ATOM 964 CA SER A 648 10.669 16.163 -10.033 1.00 12.10 C ATOM 965 C SER A 648 10.033 17.576 -10.098 1.00 0.11 C ATOM 966 O SER A 648 10.733 18.564 -10.348 1.00 63.01 O ATOM 967 CB SER A 648 10.256 15.328 -11.270 1.00 35.21 C ATOM 968 OG SER A 648 10.735 15.883 -12.483 1.00 71.21 O ATOM 0 H SER A 648 9.514 14.786 -9.016 1.00 23.50 H new ATOM 0 HA SER A 648 11.750 16.303 -10.012 1.00 12.10 H new ATOM 0 HB2 SER A 648 10.638 14.313 -11.163 1.00 35.21 H new ATOM 0 HB3 SER A 648 9.169 15.257 -11.311 1.00 35.21 H new ATOM 0 HG SER A 648 10.451 15.321 -13.234 1.00 71.21 H new ATOM 974 N ASP A 649 8.716 17.675 -9.874 1.00 74.43 N ATOM 975 CA ASP A 649 8.024 18.985 -10.005 1.00 60.35 C ATOM 976 C ASP A 649 7.679 19.619 -8.634 1.00 42.12 C ATOM 977 O ASP A 649 7.289 20.776 -8.550 1.00 61.13 O ATOM 978 CB ASP A 649 6.785 18.858 -10.915 1.00 54.02 C ATOM 979 CG ASP A 649 6.176 20.195 -11.319 1.00 31.23 C ATOM 980 OD1 ASP A 649 6.709 20.850 -12.245 1.00 53.21 O ATOM 981 OD2 ASP A 649 5.163 20.606 -10.749 1.00 2.41 O ATOM 0 H ASP A 649 8.114 16.895 -9.609 1.00 74.43 H new ATOM 0 HA ASP A 649 8.721 19.674 -10.481 1.00 60.35 H new ATOM 0 HB2 ASP A 649 7.062 18.309 -11.815 1.00 54.02 H new ATOM 0 HB3 ASP A 649 6.028 18.266 -10.401 1.00 54.02 H new ATOM 986 N ARG A 650 7.835 18.826 -7.584 1.00 52.41 N ATOM 987 CA ARG A 650 7.624 19.195 -6.191 1.00 53.53 C ATOM 988 C ARG A 650 6.119 19.368 -5.861 1.00 63.02 C ATOM 989 O ARG A 650 5.718 19.988 -4.881 1.00 42.54 O ATOM 990 CB ARG A 650 8.503 20.392 -5.813 1.00 54.52 C ATOM 991 CG ARG A 650 8.431 20.777 -4.376 1.00 62.03 C ATOM 992 CD ARG A 650 8.805 19.622 -3.439 1.00 72.54 C ATOM 993 NE ARG A 650 10.138 19.078 -3.698 1.00 40.24 N ATOM 994 CZ ARG A 650 10.680 18.042 -3.044 1.00 11.31 C ATOM 995 NH1 ARG A 650 10.006 17.435 -2.072 1.00 30.32 N ATOM 996 NH2 ARG A 650 11.897 17.615 -3.367 1.00 33.14 N ATOM 0 H ARG A 650 8.128 17.854 -7.686 1.00 52.41 H new ATOM 0 HA ARG A 650 7.948 18.373 -5.552 1.00 53.53 H new ATOM 0 HB2 ARG A 650 9.538 20.161 -6.063 1.00 54.52 H new ATOM 0 HB3 ARG A 650 8.211 21.248 -6.421 1.00 54.52 H new ATOM 0 HG2 ARG A 650 9.100 21.619 -4.195 1.00 62.03 H new ATOM 0 HG3 ARG A 650 7.421 21.116 -4.144 1.00 62.03 H new ATOM 0 HD2 ARG A 650 8.756 19.969 -2.407 1.00 72.54 H new ATOM 0 HD3 ARG A 650 8.068 18.825 -3.543 1.00 72.54 H new ATOM 0 HE ARG A 650 10.695 19.519 -4.430 1.00 40.24 H new ATOM 0 HH11 ARG A 650 9.071 17.758 -1.821 1.00 30.32 H new ATOM 0 HH12 ARG A 650 10.423 16.647 -1.577 1.00 30.32 H new ATOM 0 HH21 ARG A 650 12.418 18.076 -4.113 1.00 33.14 H new ATOM 0 HH22 ARG A 650 12.310 16.826 -2.869 1.00 33.14 H new ATOM 1008 N LYS A 651 5.324 18.738 -6.651 1.00 44.23 N ATOM 1009 CA LYS A 651 3.890 18.683 -6.460 1.00 42.15 C ATOM 1010 C LYS A 651 3.521 17.413 -5.719 1.00 2.22 C ATOM 1011 O LYS A 651 4.143 16.385 -5.930 1.00 31.42 O ATOM 1012 CB LYS A 651 3.241 18.626 -7.804 1.00 40.53 C ATOM 1013 CG LYS A 651 3.235 19.885 -8.587 1.00 22.34 C ATOM 1014 CD LYS A 651 2.105 20.786 -8.154 1.00 10.14 C ATOM 1015 CE LYS A 651 1.950 21.950 -9.100 1.00 21.04 C ATOM 1016 NZ LYS A 651 0.847 22.866 -8.709 1.00 63.23 N ATOM 0 H LYS A 651 5.646 18.228 -7.474 1.00 44.23 H new ATOM 0 HA LYS A 651 3.564 19.556 -5.894 1.00 42.15 H new ATOM 0 HB2 LYS A 651 3.743 17.859 -8.394 1.00 40.53 H new ATOM 0 HB3 LYS A 651 2.209 18.301 -7.672 1.00 40.53 H new ATOM 0 HG2 LYS A 651 4.186 20.402 -8.459 1.00 22.34 H new ATOM 0 HG3 LYS A 651 3.137 19.657 -9.648 1.00 22.34 H new ATOM 0 HD2 LYS A 651 1.176 20.217 -8.116 1.00 10.14 H new ATOM 0 HD3 LYS A 651 2.295 21.155 -7.146 1.00 10.14 H new ATOM 0 HE2 LYS A 651 2.885 22.509 -9.137 1.00 21.04 H new ATOM 0 HE3 LYS A 651 1.764 21.573 -10.106 1.00 21.04 H new ATOM 0 HZ1 LYS A 651 0.785 23.647 -9.393 1.00 63.23 H new ATOM 0 HZ2 LYS A 651 -0.052 22.343 -8.699 1.00 63.23 H new ATOM 0 HZ3 LYS A 651 1.034 23.250 -7.761 1.00 63.23 H new ATOM 1030 N SER A 652 2.528 17.478 -4.876 1.00 23.24 N ATOM 1031 CA SER A 652 2.045 16.303 -4.196 1.00 4.02 C ATOM 1032 C SER A 652 0.546 16.199 -4.325 1.00 10.11 C ATOM 1033 O SER A 652 -0.154 17.218 -4.452 1.00 34.54 O ATOM 1034 CB SER A 652 2.508 16.240 -2.741 1.00 64.13 C ATOM 1035 OG SER A 652 2.167 17.422 -2.032 1.00 40.11 O ATOM 0 H SER A 652 2.033 18.338 -4.641 1.00 23.24 H new ATOM 0 HA SER A 652 2.484 15.432 -4.683 1.00 4.02 H new ATOM 0 HB2 SER A 652 2.055 15.378 -2.251 1.00 64.13 H new ATOM 0 HB3 SER A 652 3.588 16.094 -2.708 1.00 64.13 H new ATOM 0 HG SER A 652 2.476 17.348 -1.105 1.00 40.11 H new ATOM 1041 N TRP A 653 0.052 14.992 -4.323 1.00 44.22 N ATOM 1042 CA TRP A 653 -1.339 14.736 -4.554 1.00 70.11 C ATOM 1043 C TRP A 653 -1.876 13.734 -3.558 1.00 13.33 C ATOM 1044 O TRP A 653 -1.128 12.914 -3.012 1.00 14.53 O ATOM 1045 CB TRP A 653 -1.546 14.207 -5.975 1.00 72.32 C ATOM 1046 CG TRP A 653 -1.093 15.145 -7.061 1.00 41.34 C ATOM 1047 CD1 TRP A 653 -1.824 16.122 -7.657 1.00 73.32 C ATOM 1048 CD2 TRP A 653 0.201 15.196 -7.669 1.00 33.14 C ATOM 1049 NE1 TRP A 653 -1.076 16.755 -8.616 1.00 62.04 N ATOM 1050 CE2 TRP A 653 0.168 16.211 -8.637 1.00 44.35 C ATOM 1051 CE3 TRP A 653 1.379 14.480 -7.489 1.00 45.12 C ATOM 1052 CZ2 TRP A 653 1.262 16.519 -9.422 1.00 72.10 C ATOM 1053 CZ3 TRP A 653 2.463 14.788 -8.255 1.00 50.41 C ATOM 1054 CH2 TRP A 653 2.402 15.802 -9.218 1.00 21.24 C ATOM 0 H TRP A 653 0.609 14.153 -4.160 1.00 44.22 H new ATOM 0 HA TRP A 653 -1.881 15.674 -4.432 1.00 70.11 H new ATOM 0 HB2 TRP A 653 -1.010 13.264 -6.080 1.00 72.32 H new ATOM 0 HB3 TRP A 653 -2.605 13.990 -6.118 1.00 72.32 H new ATOM 0 HD1 TRP A 653 -2.847 16.365 -7.411 1.00 73.32 H new ATOM 0 HE1 TRP A 653 -1.401 17.512 -9.217 1.00 62.04 H new ATOM 0 HE3 TRP A 653 1.434 13.691 -6.753 1.00 45.12 H new ATOM 0 HZ2 TRP A 653 1.215 17.298 -10.169 1.00 72.10 H new ATOM 0 HZ3 TRP A 653 3.384 14.241 -8.117 1.00 50.41 H new ATOM 0 HH2 TRP A 653 3.277 16.020 -9.812 1.00 21.24 H new ATOM 1065 N ASN A 654 -3.168 13.778 -3.367 1.00 22.21 N ATOM 1066 CA ASN A 654 -3.863 12.918 -2.432 1.00 70.14 C ATOM 1067 C ASN A 654 -4.398 11.733 -3.217 1.00 21.20 C ATOM 1068 O ASN A 654 -5.142 11.918 -4.189 1.00 34.13 O ATOM 1069 CB ASN A 654 -5.040 13.698 -1.846 1.00 4.10 C ATOM 1070 CG ASN A 654 -5.742 13.044 -0.682 1.00 60.21 C ATOM 1071 OD1 ASN A 654 -5.770 11.827 -0.542 1.00 30.13 O ATOM 1072 ND2 ASN A 654 -6.327 13.859 0.159 1.00 62.42 N ATOM 0 H ASN A 654 -3.783 14.423 -3.864 1.00 22.21 H new ATOM 0 HA ASN A 654 -3.203 12.585 -1.631 1.00 70.14 H new ATOM 0 HB2 ASN A 654 -4.681 14.677 -1.527 1.00 4.10 H new ATOM 0 HB3 ASN A 654 -5.770 13.868 -2.638 1.00 4.10 H new ATOM 0 HD21 ASN A 654 -6.829 13.486 0.965 1.00 62.42 H new ATOM 0 HD22 ASN A 654 -6.281 14.867 0.008 1.00 62.42 H new ATOM 1078 N LEU A 655 -4.025 10.544 -2.813 1.00 71.23 N ATOM 1079 CA LEU A 655 -4.399 9.328 -3.525 1.00 3.51 C ATOM 1080 C LEU A 655 -5.505 8.586 -2.806 1.00 13.34 C ATOM 1081 O LEU A 655 -5.770 7.408 -3.082 1.00 42.22 O ATOM 1082 CB LEU A 655 -3.185 8.426 -3.664 1.00 20.05 C ATOM 1083 CG LEU A 655 -2.001 9.016 -4.399 1.00 52.13 C ATOM 1084 CD1 LEU A 655 -0.891 8.001 -4.510 1.00 0.21 C ATOM 1085 CD2 LEU A 655 -2.421 9.509 -5.760 1.00 34.23 C ATOM 0 H LEU A 655 -3.454 10.382 -1.983 1.00 71.23 H new ATOM 0 HA LEU A 655 -4.767 9.611 -4.511 1.00 3.51 H new ATOM 0 HB2 LEU A 655 -2.859 8.133 -2.666 1.00 20.05 H new ATOM 0 HB3 LEU A 655 -3.491 7.516 -4.180 1.00 20.05 H new ATOM 0 HG LEU A 655 -1.625 9.867 -3.831 1.00 52.13 H new ATOM 0 HD11 LEU A 655 -0.047 8.441 -5.041 1.00 0.21 H new ATOM 0 HD12 LEU A 655 -0.574 7.698 -3.512 1.00 0.21 H new ATOM 0 HD13 LEU A 655 -1.249 7.129 -5.057 1.00 0.21 H new ATOM 0 HD21 LEU A 655 -1.559 9.931 -6.276 1.00 34.23 H new ATOM 0 HD22 LEU A 655 -2.821 8.678 -6.341 1.00 34.23 H new ATOM 0 HD23 LEU A 655 -3.188 10.276 -5.649 1.00 34.23 H new ATOM 1093 N GLY A 656 -6.132 9.253 -1.893 1.00 20.50 N ATOM 1094 CA GLY A 656 -7.215 8.669 -1.194 1.00 65.34 C ATOM 1095 C GLY A 656 -7.291 9.163 0.196 1.00 23.42 C ATOM 1096 O GLY A 656 -6.282 9.174 0.918 1.00 71.54 O ATOM 0 H GLY A 656 -5.906 10.209 -1.617 1.00 20.50 H new ATOM 0 HA2 GLY A 656 -8.147 8.893 -1.712 1.00 65.34 H new ATOM 0 HA3 GLY A 656 -7.105 7.585 -1.190 1.00 65.34 H new ATOM 1100 N ARG A 657 -8.470 9.589 0.597 1.00 0.23 N ATOM 1101 CA ARG A 657 -8.662 10.073 1.922 1.00 4.33 C ATOM 1102 C ARG A 657 -8.680 8.883 2.869 1.00 1.15 C ATOM 1103 O ARG A 657 -8.788 7.730 2.413 1.00 14.45 O ATOM 1104 CB ARG A 657 -9.963 10.871 2.034 1.00 34.31 C ATOM 1105 CG ARG A 657 -10.144 11.921 0.952 1.00 70.25 C ATOM 1106 CD ARG A 657 -11.389 12.768 1.176 1.00 14.54 C ATOM 1107 NE ARG A 657 -11.698 13.600 0.002 1.00 12.40 N ATOM 1108 CZ ARG A 657 -12.081 14.877 0.014 1.00 11.22 C ATOM 1109 NH1 ARG A 657 -12.176 15.551 1.152 1.00 75.23 N ATOM 1110 NH2 ARG A 657 -12.375 15.466 -1.126 1.00 24.21 N ATOM 0 H ARG A 657 -9.305 9.605 0.012 1.00 0.23 H new ATOM 0 HA ARG A 657 -7.847 10.747 2.185 1.00 4.33 H new ATOM 0 HB2 ARG A 657 -10.805 10.179 1.998 1.00 34.31 H new ATOM 0 HB3 ARG A 657 -9.994 11.360 3.008 1.00 34.31 H new ATOM 0 HG2 ARG A 657 -9.267 12.567 0.925 1.00 70.25 H new ATOM 0 HG3 ARG A 657 -10.209 11.432 -0.020 1.00 70.25 H new ATOM 0 HD2 ARG A 657 -12.237 12.119 1.395 1.00 14.54 H new ATOM 0 HD3 ARG A 657 -11.243 13.407 2.047 1.00 14.54 H new ATOM 0 HE ARG A 657 -11.610 13.155 -0.912 1.00 12.40 H new ATOM 0 HH11 ARG A 657 -11.954 15.093 2.036 1.00 75.23 H new ATOM 0 HH12 ARG A 657 -12.471 16.528 1.143 1.00 75.23 H new ATOM 0 HH21 ARG A 657 -12.308 14.946 -2.001 1.00 24.21 H new ATOM 0 HH22 ARG A 657 -12.670 16.442 -1.134 1.00 24.21 H new ATOM 1122 N SER A 658 -8.600 9.156 4.143 1.00 51.41 N ATOM 1123 CA SER A 658 -8.524 8.142 5.162 1.00 21.24 C ATOM 1124 C SER A 658 -9.704 7.171 5.098 1.00 42.54 C ATOM 1125 O SER A 658 -10.890 7.571 5.109 1.00 13.50 O ATOM 1126 CB SER A 658 -8.431 8.807 6.530 1.00 5.21 C ATOM 1127 OG SER A 658 -9.494 9.729 6.708 1.00 23.35 O ATOM 0 H SER A 658 -8.585 10.108 4.510 1.00 51.41 H new ATOM 0 HA SER A 658 -7.627 7.548 4.988 1.00 21.24 H new ATOM 0 HB2 SER A 658 -8.465 8.049 7.312 1.00 5.21 H new ATOM 0 HB3 SER A 658 -7.475 9.322 6.626 1.00 5.21 H new ATOM 0 HG SER A 658 -10.335 9.319 6.416 1.00 23.35 H new ATOM 1133 N ASN A 659 -9.370 5.917 4.988 1.00 21.24 N ATOM 1134 CA ASN A 659 -10.326 4.853 4.899 1.00 22.41 C ATOM 1135 C ASN A 659 -9.719 3.624 5.477 1.00 63.02 C ATOM 1136 O ASN A 659 -8.565 3.328 5.227 1.00 70.45 O ATOM 1137 CB ASN A 659 -10.695 4.609 3.453 1.00 5.14 C ATOM 1138 CG ASN A 659 -11.672 3.478 3.270 1.00 70.35 C ATOM 1139 OD1 ASN A 659 -12.501 3.198 4.129 1.00 13.34 O ATOM 1140 ND2 ASN A 659 -11.566 2.821 2.171 1.00 11.33 N ATOM 0 H ASN A 659 -8.401 5.599 4.957 1.00 21.24 H new ATOM 0 HA ASN A 659 -11.229 5.119 5.448 1.00 22.41 H new ATOM 0 HB2 ASN A 659 -11.123 5.521 3.036 1.00 5.14 H new ATOM 0 HB3 ASN A 659 -9.790 4.393 2.886 1.00 5.14 H new ATOM 0 HD21 ASN A 659 -12.186 2.032 1.986 1.00 11.33 H new ATOM 0 HD22 ASN A 659 -10.862 3.088 1.483 1.00 11.33 H new ATOM 1146 N ALA A 660 -10.458 2.919 6.251 1.00 74.12 N ATOM 1147 CA ALA A 660 -9.930 1.747 6.872 1.00 11.01 C ATOM 1148 C ALA A 660 -10.738 0.537 6.508 1.00 35.42 C ATOM 1149 O ALA A 660 -10.432 -0.562 6.950 1.00 52.12 O ATOM 1150 CB ALA A 660 -9.852 1.923 8.382 1.00 42.11 C ATOM 0 H ALA A 660 -11.431 3.127 6.474 1.00 74.12 H new ATOM 0 HA ALA A 660 -8.917 1.594 6.501 1.00 11.01 H new ATOM 0 HB1 ALA A 660 -9.447 1.017 8.833 1.00 42.11 H new ATOM 0 HB2 ALA A 660 -9.203 2.767 8.617 1.00 42.11 H new ATOM 0 HB3 ALA A 660 -10.850 2.111 8.778 1.00 42.11 H new ATOM 1156 N LYS A 661 -11.750 0.728 5.680 1.00 33.21 N ATOM 1157 CA LYS A 661 -12.618 -0.360 5.304 1.00 22.05 C ATOM 1158 C LYS A 661 -11.915 -1.228 4.276 1.00 61.21 C ATOM 1159 O LYS A 661 -11.733 -0.821 3.119 1.00 14.31 O ATOM 1160 CB LYS A 661 -13.945 0.155 4.737 1.00 72.23 C ATOM 1161 CG LYS A 661 -14.669 1.170 5.603 1.00 13.13 C ATOM 1162 CD LYS A 661 -14.846 0.664 7.008 1.00 32.51 C ATOM 1163 CE LYS A 661 -15.783 1.547 7.796 1.00 73.14 C ATOM 1164 NZ LYS A 661 -15.321 2.946 7.889 1.00 54.23 N ATOM 0 H LYS A 661 -11.986 1.627 5.259 1.00 33.21 H new ATOM 0 HA LYS A 661 -12.843 -0.947 6.194 1.00 22.05 H new ATOM 0 HB2 LYS A 661 -13.755 0.603 3.762 1.00 72.23 H new ATOM 0 HB3 LYS A 661 -14.606 -0.696 4.573 1.00 72.23 H new ATOM 0 HG2 LYS A 661 -14.107 2.104 5.619 1.00 13.13 H new ATOM 0 HG3 LYS A 661 -15.644 1.392 5.169 1.00 13.13 H new ATOM 0 HD2 LYS A 661 -15.236 -0.353 6.984 1.00 32.51 H new ATOM 0 HD3 LYS A 661 -13.877 0.622 7.506 1.00 32.51 H new ATOM 0 HE2 LYS A 661 -16.769 1.527 7.331 1.00 73.14 H new ATOM 0 HE3 LYS A 661 -15.896 1.141 8.801 1.00 73.14 H new ATOM 0 HZ1 LYS A 661 -15.940 3.474 8.537 1.00 54.23 H new ATOM 0 HZ2 LYS A 661 -14.345 2.966 8.248 1.00 54.23 H new ATOM 0 HZ3 LYS A 661 -15.352 3.385 6.947 1.00 54.23 H new ATOM 1178 N LEU A 662 -11.505 -2.399 4.694 1.00 21.24 N ATOM 1179 CA LEU A 662 -10.778 -3.293 3.820 1.00 14.55 C ATOM 1180 C LEU A 662 -11.731 -4.105 2.979 1.00 50.24 C ATOM 1181 O LEU A 662 -12.848 -4.404 3.400 1.00 61.40 O ATOM 1182 CB LEU A 662 -9.915 -4.265 4.612 1.00 13.45 C ATOM 1183 CG LEU A 662 -8.853 -3.705 5.535 1.00 21.24 C ATOM 1184 CD1 LEU A 662 -8.045 -4.842 6.100 1.00 33.22 C ATOM 1185 CD2 LEU A 662 -7.960 -2.731 4.816 1.00 22.24 C ATOM 0 H LEU A 662 -11.661 -2.759 5.636 1.00 21.24 H new ATOM 0 HA LEU A 662 -10.145 -2.670 3.188 1.00 14.55 H new ATOM 0 HB2 LEU A 662 -10.581 -4.886 5.212 1.00 13.45 H new ATOM 0 HB3 LEU A 662 -9.420 -4.925 3.899 1.00 13.45 H new ATOM 0 HG LEU A 662 -9.341 -3.162 6.344 1.00 21.24 H new ATOM 0 HD11 LEU A 662 -7.278 -4.447 6.766 1.00 33.22 H new ATOM 0 HD12 LEU A 662 -8.700 -5.512 6.657 1.00 33.22 H new ATOM 0 HD13 LEU A 662 -7.572 -5.391 5.286 1.00 33.22 H new ATOM 0 HD21 LEU A 662 -7.209 -2.348 5.507 1.00 22.24 H new ATOM 0 HD22 LEU A 662 -7.466 -3.235 3.986 1.00 22.24 H new ATOM 0 HD23 LEU A 662 -8.557 -1.903 4.434 1.00 22.24 H new ATOM 1193 N SER A 663 -11.299 -4.463 1.807 1.00 52.40 N ATOM 1194 CA SER A 663 -12.067 -5.286 0.939 1.00 53.13 C ATOM 1195 C SER A 663 -11.322 -6.584 0.677 1.00 70.41 C ATOM 1196 O SER A 663 -10.101 -6.639 0.733 1.00 74.33 O ATOM 1197 CB SER A 663 -12.359 -4.555 -0.368 1.00 70.30 C ATOM 1198 OG SER A 663 -13.082 -3.361 -0.123 1.00 13.31 O ATOM 0 H SER A 663 -10.393 -4.186 1.428 1.00 52.40 H new ATOM 0 HA SER A 663 -13.020 -5.517 1.414 1.00 53.13 H new ATOM 0 HB2 SER A 663 -11.424 -4.322 -0.877 1.00 70.30 H new ATOM 0 HB3 SER A 663 -12.931 -5.202 -1.033 1.00 70.30 H new ATOM 0 HG SER A 663 -12.860 -2.698 -0.809 1.00 13.31 H new ATOM 1204 N TYR A 664 -12.039 -7.603 0.434 1.00 62.32 N ATOM 1205 CA TYR A 664 -11.467 -8.861 0.145 1.00 2.34 C ATOM 1206 C TYR A 664 -11.975 -9.260 -1.217 1.00 30.02 C ATOM 1207 O TYR A 664 -13.185 -9.352 -1.430 1.00 3.52 O ATOM 1208 CB TYR A 664 -11.930 -9.868 1.200 1.00 4.43 C ATOM 1209 CG TYR A 664 -11.174 -11.185 1.252 1.00 31.43 C ATOM 1210 CD1 TYR A 664 -10.755 -11.844 0.109 1.00 3.31 C ATOM 1211 CD2 TYR A 664 -10.914 -11.773 2.465 1.00 33.31 C ATOM 1212 CE1 TYR A 664 -10.094 -13.050 0.176 1.00 23.31 C ATOM 1213 CE2 TYR A 664 -10.255 -12.974 2.549 1.00 4.32 C ATOM 1214 CZ TYR A 664 -9.846 -13.610 1.401 1.00 30.14 C ATOM 1215 OH TYR A 664 -9.189 -14.819 1.485 1.00 2.31 O ATOM 0 H TYR A 664 -13.059 -7.593 0.429 1.00 62.32 H new ATOM 0 HA TYR A 664 -10.378 -8.828 0.155 1.00 2.34 H new ATOM 0 HB2 TYR A 664 -11.859 -9.394 2.179 1.00 4.43 H new ATOM 0 HB3 TYR A 664 -12.984 -10.085 1.026 1.00 4.43 H new ATOM 0 HD1 TYR A 664 -10.951 -11.402 -0.857 1.00 3.31 H new ATOM 0 HD2 TYR A 664 -11.234 -11.281 3.371 1.00 33.31 H new ATOM 0 HE1 TYR A 664 -9.775 -13.549 -0.727 1.00 23.31 H new ATOM 0 HE2 TYR A 664 -10.058 -13.418 3.514 1.00 4.32 H new ATOM 0 HH TYR A 664 -8.576 -14.912 0.726 1.00 2.31 H new ATOM 1225 N TYR A 665 -11.083 -9.458 -2.128 1.00 63.32 N ATOM 1226 CA TYR A 665 -11.435 -9.868 -3.442 1.00 31.12 C ATOM 1227 C TYR A 665 -11.111 -11.332 -3.536 1.00 55.11 C ATOM 1228 O TYR A 665 -10.138 -11.766 -2.946 1.00 1.54 O ATOM 1229 CB TYR A 665 -10.629 -9.080 -4.465 1.00 35.34 C ATOM 1230 CG TYR A 665 -11.119 -9.282 -5.856 1.00 75.11 C ATOM 1231 CD1 TYR A 665 -12.261 -8.639 -6.273 1.00 43.35 C ATOM 1232 CD2 TYR A 665 -10.462 -10.111 -6.750 1.00 13.12 C ATOM 1233 CE1 TYR A 665 -12.747 -8.805 -7.531 1.00 45.12 C ATOM 1234 CE2 TYR A 665 -10.940 -10.286 -8.026 1.00 60.32 C ATOM 1235 CZ TYR A 665 -12.087 -9.628 -8.415 1.00 34.23 C ATOM 1236 OH TYR A 665 -12.578 -9.796 -9.695 1.00 5.33 O ATOM 0 H TYR A 665 -10.081 -9.338 -1.979 1.00 63.32 H new ATOM 0 HA TYR A 665 -12.491 -9.689 -3.644 1.00 31.12 H new ATOM 0 HB2 TYR A 665 -10.673 -8.019 -4.218 1.00 35.34 H new ATOM 0 HB3 TYR A 665 -9.582 -9.378 -4.405 1.00 35.34 H new ATOM 0 HD1 TYR A 665 -12.782 -7.989 -5.586 1.00 43.35 H new ATOM 0 HD2 TYR A 665 -9.564 -10.625 -6.441 1.00 13.12 H new ATOM 0 HE1 TYR A 665 -13.648 -8.293 -7.836 1.00 45.12 H new ATOM 0 HE2 TYR A 665 -10.422 -10.933 -8.718 1.00 60.32 H new ATOM 0 HH TYR A 665 -11.995 -10.407 -10.192 1.00 5.33 H new ATOM 1246 N ASP A 666 -11.943 -12.105 -4.197 1.00 2.12 N ATOM 1247 CA ASP A 666 -11.683 -13.535 -4.323 1.00 74.42 C ATOM 1248 C ASP A 666 -10.294 -13.760 -4.911 1.00 43.24 C ATOM 1249 O ASP A 666 -9.998 -13.338 -6.036 1.00 3.32 O ATOM 1250 CB ASP A 666 -12.749 -14.205 -5.198 1.00 13.03 C ATOM 1251 CG ASP A 666 -12.546 -15.699 -5.320 1.00 52.51 C ATOM 1252 OD1 ASP A 666 -12.919 -16.434 -4.385 1.00 34.13 O ATOM 1253 OD2 ASP A 666 -12.032 -16.171 -6.357 1.00 71.42 O ATOM 0 H ASP A 666 -12.796 -11.781 -4.653 1.00 2.12 H new ATOM 0 HA ASP A 666 -11.726 -13.986 -3.332 1.00 74.42 H new ATOM 0 HB2 ASP A 666 -13.735 -14.009 -4.777 1.00 13.03 H new ATOM 0 HB3 ASP A 666 -12.732 -13.757 -6.192 1.00 13.03 H new ATOM 1258 N GLY A 667 -9.456 -14.408 -4.141 1.00 64.44 N ATOM 1259 CA GLY A 667 -8.107 -14.628 -4.548 1.00 14.52 C ATOM 1260 C GLY A 667 -7.109 -13.836 -3.709 1.00 21.23 C ATOM 1261 O GLY A 667 -6.105 -14.390 -3.252 1.00 23.05 O ATOM 0 H GLY A 667 -9.694 -14.791 -3.226 1.00 64.44 H new ATOM 0 HA2 GLY A 667 -7.877 -15.691 -4.474 1.00 14.52 H new ATOM 0 HA3 GLY A 667 -7.997 -14.350 -5.596 1.00 14.52 H new ATOM 1265 N MET A 668 -7.381 -12.545 -3.501 1.00 12.50 N ATOM 1266 CA MET A 668 -6.476 -11.678 -2.746 1.00 71.13 C ATOM 1267 C MET A 668 -7.199 -10.478 -2.127 1.00 53.43 C ATOM 1268 O MET A 668 -8.158 -9.958 -2.680 1.00 10.20 O ATOM 1269 CB MET A 668 -5.293 -11.184 -3.603 1.00 4.31 C ATOM 1270 CG MET A 668 -5.647 -10.308 -4.809 1.00 62.12 C ATOM 1271 SD MET A 668 -6.595 -11.159 -6.090 1.00 21.00 S ATOM 1272 CE MET A 668 -6.773 -9.837 -7.285 1.00 21.01 C ATOM 0 H MET A 668 -8.220 -12.078 -3.845 1.00 12.50 H new ATOM 0 HA MET A 668 -6.085 -12.297 -1.938 1.00 71.13 H new ATOM 0 HB2 MET A 668 -4.616 -10.623 -2.960 1.00 4.31 H new ATOM 0 HB3 MET A 668 -4.744 -12.054 -3.962 1.00 4.31 H new ATOM 0 HG2 MET A 668 -6.217 -9.446 -4.463 1.00 62.12 H new ATOM 0 HG3 MET A 668 -4.726 -9.925 -5.248 1.00 62.12 H new ATOM 0 HE1 MET A 668 -7.820 -9.749 -7.577 1.00 21.01 H new ATOM 0 HE2 MET A 668 -6.439 -8.899 -6.842 1.00 21.01 H new ATOM 0 HE3 MET A 668 -6.168 -10.058 -8.165 1.00 21.01 H new ATOM 1282 N ILE A 669 -6.710 -10.039 -0.995 1.00 15.20 N ATOM 1283 CA ILE A 669 -7.289 -8.912 -0.274 1.00 53.35 C ATOM 1284 C ILE A 669 -6.915 -7.593 -0.982 1.00 61.33 C ATOM 1285 O ILE A 669 -5.806 -7.445 -1.474 1.00 64.31 O ATOM 1286 CB ILE A 669 -6.859 -8.885 1.259 1.00 2.50 C ATOM 1287 CG1 ILE A 669 -7.388 -10.115 2.052 1.00 3.55 C ATOM 1288 CG2 ILE A 669 -7.282 -7.597 1.954 1.00 24.32 C ATOM 1289 CD1 ILE A 669 -6.739 -11.446 1.704 1.00 30.11 C ATOM 0 H ILE A 669 -5.896 -10.449 -0.538 1.00 15.20 H new ATOM 0 HA ILE A 669 -8.373 -9.030 -0.285 1.00 53.35 H new ATOM 0 HB ILE A 669 -5.770 -8.932 1.255 1.00 2.50 H new ATOM 0 HG12 ILE A 669 -7.245 -9.928 3.116 1.00 3.55 H new ATOM 0 HG13 ILE A 669 -8.462 -10.199 1.884 1.00 3.55 H new ATOM 0 HG21 ILE A 669 -6.967 -7.626 2.997 1.00 24.32 H new ATOM 0 HG22 ILE A 669 -6.816 -6.746 1.457 1.00 24.32 H new ATOM 0 HG23 ILE A 669 -8.366 -7.497 1.906 1.00 24.32 H new ATOM 0 HD11 ILE A 669 -7.179 -12.236 2.313 1.00 30.11 H new ATOM 0 HD12 ILE A 669 -6.904 -11.666 0.649 1.00 30.11 H new ATOM 0 HD13 ILE A 669 -5.668 -11.391 1.900 1.00 30.11 H new ATOM 1296 N GLN A 670 -7.851 -6.674 -1.067 1.00 15.44 N ATOM 1297 CA GLN A 670 -7.636 -5.399 -1.740 1.00 21.43 C ATOM 1298 C GLN A 670 -8.143 -4.252 -0.883 1.00 24.33 C ATOM 1299 O GLN A 670 -9.197 -4.331 -0.285 1.00 42.31 O ATOM 1300 CB GLN A 670 -8.306 -5.367 -3.133 1.00 10.33 C ATOM 1301 CG GLN A 670 -7.607 -6.205 -4.216 1.00 12.12 C ATOM 1302 CD GLN A 670 -8.389 -6.275 -5.524 1.00 43.21 C ATOM 1303 OE1 GLN A 670 -8.303 -7.250 -6.256 1.00 54.32 O ATOM 1304 NE2 GLN A 670 -9.159 -5.258 -5.818 1.00 71.20 N ATOM 0 H GLN A 670 -8.786 -6.783 -0.673 1.00 15.44 H new ATOM 0 HA GLN A 670 -6.562 -5.283 -1.887 1.00 21.43 H new ATOM 0 HB2 GLN A 670 -9.333 -5.717 -3.032 1.00 10.33 H new ATOM 0 HB3 GLN A 670 -8.354 -4.332 -3.472 1.00 10.33 H new ATOM 0 HG2 GLN A 670 -6.621 -5.783 -4.412 1.00 12.12 H new ATOM 0 HG3 GLN A 670 -7.452 -7.216 -3.839 1.00 12.12 H new ATOM 0 HE21 GLN A 670 -9.210 -4.458 -5.187 1.00 71.20 H new ATOM 0 HE22 GLN A 670 -9.708 -5.266 -6.678 1.00 71.20 H new ATOM 1312 N LEU A 671 -7.411 -3.194 -0.842 1.00 22.22 N ATOM 1313 CA LEU A 671 -7.807 -2.059 -0.057 1.00 65.31 C ATOM 1314 C LEU A 671 -7.989 -0.918 -1.025 1.00 61.21 C ATOM 1315 O LEU A 671 -7.088 -0.610 -1.795 1.00 44.24 O ATOM 1316 CB LEU A 671 -6.691 -1.736 0.976 1.00 25.14 C ATOM 1317 CG LEU A 671 -7.013 -0.797 2.170 1.00 23.12 C ATOM 1318 CD1 LEU A 671 -5.790 -0.620 3.048 1.00 12.32 C ATOM 1319 CD2 LEU A 671 -7.555 0.555 1.752 1.00 31.10 C ATOM 0 H LEU A 671 -6.529 -3.083 -1.343 1.00 22.22 H new ATOM 0 HA LEU A 671 -8.728 -2.243 0.496 1.00 65.31 H new ATOM 0 HB2 LEU A 671 -6.341 -2.683 1.388 1.00 25.14 H new ATOM 0 HB3 LEU A 671 -5.855 -1.298 0.430 1.00 25.14 H new ATOM 0 HG LEU A 671 -7.808 -1.286 2.733 1.00 23.12 H new ATOM 0 HD11 LEU A 671 -6.032 0.041 3.880 1.00 12.32 H new ATOM 0 HD12 LEU A 671 -5.476 -1.590 3.434 1.00 12.32 H new ATOM 0 HD13 LEU A 671 -4.981 -0.184 2.462 1.00 12.32 H new ATOM 0 HD21 LEU A 671 -7.757 1.156 2.639 1.00 31.10 H new ATOM 0 HD22 LEU A 671 -6.821 1.064 1.128 1.00 31.10 H new ATOM 0 HD23 LEU A 671 -8.478 0.419 1.189 1.00 31.10 H new ATOM 1327 N THR A 672 -9.147 -0.327 -1.009 1.00 65.24 N ATOM 1328 CA THR A 672 -9.448 0.766 -1.878 1.00 42.12 C ATOM 1329 C THR A 672 -9.596 2.021 -1.034 1.00 41.24 C ATOM 1330 O THR A 672 -10.288 2.007 -0.036 1.00 63.24 O ATOM 1331 CB THR A 672 -10.788 0.501 -2.598 1.00 22.41 C ATOM 1332 OG1 THR A 672 -10.781 -0.836 -3.110 1.00 5.41 O ATOM 1333 CG2 THR A 672 -10.971 1.471 -3.762 1.00 0.43 C ATOM 0 H THR A 672 -9.912 -0.593 -0.389 1.00 65.24 H new ATOM 0 HA THR A 672 -8.652 0.883 -2.614 1.00 42.12 H new ATOM 0 HB THR A 672 -11.604 0.638 -1.889 1.00 22.41 H new ATOM 0 HG1 THR A 672 -11.629 -1.015 -3.568 1.00 5.41 H new ATOM 0 HG21 THR A 672 -11.921 1.269 -4.258 1.00 0.43 H new ATOM 0 HG22 THR A 672 -10.968 2.494 -3.387 1.00 0.43 H new ATOM 0 HG23 THR A 672 -10.156 1.343 -4.474 1.00 0.43 H new ATOM 1339 N TYR A 673 -8.933 3.072 -1.395 1.00 30.22 N ATOM 1340 CA TYR A 673 -9.106 4.318 -0.690 1.00 15.11 C ATOM 1341 C TYR A 673 -10.113 5.201 -1.365 1.00 13.25 C ATOM 1342 O TYR A 673 -10.614 4.874 -2.433 1.00 73.22 O ATOM 1343 CB TYR A 673 -7.802 5.050 -0.447 1.00 44.44 C ATOM 1344 CG TYR A 673 -7.006 4.507 0.701 1.00 34.41 C ATOM 1345 CD1 TYR A 673 -7.331 4.882 1.987 1.00 65.24 C ATOM 1346 CD2 TYR A 673 -5.948 3.629 0.521 1.00 54.42 C ATOM 1347 CE1 TYR A 673 -6.645 4.408 3.063 1.00 53.04 C ATOM 1348 CE2 TYR A 673 -5.243 3.146 1.610 1.00 23.13 C ATOM 1349 CZ TYR A 673 -5.607 3.547 2.881 1.00 20.31 C ATOM 1350 OH TYR A 673 -4.947 3.071 3.971 1.00 75.22 O ATOM 0 H TYR A 673 -8.268 3.102 -2.168 1.00 30.22 H new ATOM 0 HA TYR A 673 -9.497 4.056 0.293 1.00 15.11 H new ATOM 0 HB2 TYR A 673 -7.196 5.002 -1.352 1.00 44.44 H new ATOM 0 HB3 TYR A 673 -8.016 6.103 -0.262 1.00 44.44 H new ATOM 0 HD1 TYR A 673 -8.150 5.568 2.145 1.00 65.24 H new ATOM 0 HD2 TYR A 673 -5.672 3.320 -0.476 1.00 54.42 H new ATOM 0 HE1 TYR A 673 -6.924 4.715 4.060 1.00 53.04 H new ATOM 0 HE2 TYR A 673 -4.418 2.464 1.468 1.00 23.13 H new ATOM 0 HH TYR A 673 -4.027 2.844 3.723 1.00 75.22 H new ATOM 1360 N ARG A 674 -10.414 6.306 -0.726 1.00 13.02 N ATOM 1361 CA ARG A 674 -11.436 7.223 -1.188 1.00 11.21 C ATOM 1362 C ARG A 674 -10.937 8.167 -2.265 1.00 32.35 C ATOM 1363 O ARG A 674 -9.785 8.114 -2.650 1.00 42.11 O ATOM 1364 CB ARG A 674 -12.071 7.991 -0.036 1.00 71.42 C ATOM 1365 CG ARG A 674 -12.707 7.099 1.032 1.00 12.21 C ATOM 1366 CD ARG A 674 -13.703 6.083 0.439 1.00 25.02 C ATOM 1367 NE ARG A 674 -14.742 6.716 -0.388 1.00 71.12 N ATOM 1368 CZ ARG A 674 -15.621 6.056 -1.168 1.00 1.43 C ATOM 1369 NH1 ARG A 674 -15.676 4.729 -1.141 1.00 31.30 N ATOM 1370 NH2 ARG A 674 -16.443 6.735 -1.970 1.00 13.43 N ATOM 0 H ARG A 674 -9.955 6.599 0.136 1.00 13.02 H new ATOM 0 HA ARG A 674 -12.209 6.605 -1.645 1.00 11.21 H new ATOM 0 HB2 ARG A 674 -11.311 8.616 0.433 1.00 71.42 H new ATOM 0 HB3 ARG A 674 -12.832 8.661 -0.436 1.00 71.42 H new ATOM 0 HG2 ARG A 674 -11.923 6.564 1.567 1.00 12.21 H new ATOM 0 HG3 ARG A 674 -13.222 7.723 1.762 1.00 12.21 H new ATOM 0 HD2 ARG A 674 -13.158 5.357 -0.164 1.00 25.02 H new ATOM 0 HD3 ARG A 674 -14.178 5.531 1.250 1.00 25.02 H new ATOM 0 HE ARG A 674 -14.802 7.734 -0.370 1.00 71.12 H new ATOM 0 HH11 ARG A 674 -15.051 4.205 -0.528 1.00 31.30 H new ATOM 0 HH12 ARG A 674 -16.343 4.234 -1.733 1.00 31.30 H new ATOM 0 HH21 ARG A 674 -16.406 7.754 -1.993 1.00 13.43 H new ATOM 0 HH22 ARG A 674 -17.108 6.235 -2.560 1.00 13.43 H new ATOM 1382 N ASP A 675 -11.835 9.037 -2.702 1.00 3.34 N ATOM 1383 CA ASP A 675 -11.647 9.985 -3.819 1.00 1.51 C ATOM 1384 C ASP A 675 -10.348 10.809 -3.717 1.00 32.15 C ATOM 1385 O ASP A 675 -9.713 11.100 -4.730 1.00 11.21 O ATOM 1386 CB ASP A 675 -12.846 10.960 -3.838 1.00 11.11 C ATOM 1387 CG ASP A 675 -12.930 11.828 -2.590 1.00 0.52 C ATOM 1388 OD1 ASP A 675 -13.337 11.318 -1.533 1.00 33.12 O ATOM 1389 OD2 ASP A 675 -12.567 13.020 -2.644 1.00 30.05 O ATOM 0 H ASP A 675 -12.759 9.115 -2.277 1.00 3.34 H new ATOM 0 HA ASP A 675 -11.579 9.395 -4.733 1.00 1.51 H new ATOM 0 HB2 ASP A 675 -12.770 11.602 -4.715 1.00 11.11 H new ATOM 0 HB3 ASP A 675 -13.769 10.389 -3.939 1.00 11.11 H new ATOM 1394 N GLY A 676 -9.994 11.194 -2.515 1.00 41.24 N ATOM 1395 CA GLY A 676 -8.764 11.930 -2.277 1.00 1.31 C ATOM 1396 C GLY A 676 -8.714 13.254 -3.014 1.00 25.24 C ATOM 1397 O GLY A 676 -9.413 14.208 -2.658 1.00 15.21 O ATOM 0 H GLY A 676 -10.543 11.010 -1.675 1.00 41.24 H new ATOM 0 HA2 GLY A 676 -8.657 12.111 -1.208 1.00 1.31 H new ATOM 0 HA3 GLY A 676 -7.916 11.318 -2.583 1.00 1.31 H new ATOM 1401 N THR A 677 -7.875 13.324 -4.010 1.00 51.34 N ATOM 1402 CA THR A 677 -7.749 14.494 -4.821 1.00 31.34 C ATOM 1403 C THR A 677 -7.681 14.121 -6.301 1.00 24.41 C ATOM 1404 O THR A 677 -6.736 13.450 -6.734 1.00 51.22 O ATOM 1405 CB THR A 677 -6.536 15.333 -4.395 1.00 21.04 C ATOM 1406 OG1 THR A 677 -6.772 15.816 -3.064 1.00 74.31 O ATOM 1407 CG2 THR A 677 -6.300 16.506 -5.336 1.00 44.13 C ATOM 0 H THR A 677 -7.255 12.561 -4.281 1.00 51.34 H new ATOM 0 HA THR A 677 -8.637 15.108 -4.674 1.00 31.34 H new ATOM 0 HB THR A 677 -5.644 14.708 -4.430 1.00 21.04 H new ATOM 0 HG1 THR A 677 -6.007 16.354 -2.771 1.00 74.31 H new ATOM 0 HG21 THR A 677 -5.433 17.074 -4.999 1.00 44.13 H new ATOM 0 HG22 THR A 677 -6.120 16.133 -6.344 1.00 44.13 H new ATOM 0 HG23 THR A 677 -7.178 17.152 -5.339 1.00 44.13 H new ATOM 1413 N PRO A 678 -8.678 14.551 -7.093 1.00 44.13 N ATOM 1414 CA PRO A 678 -8.767 14.225 -8.510 1.00 20.41 C ATOM 1415 C PRO A 678 -7.611 14.809 -9.322 1.00 11.21 C ATOM 1416 O PRO A 678 -7.006 15.811 -8.924 1.00 41.32 O ATOM 1417 CB PRO A 678 -10.118 14.801 -8.929 1.00 2.03 C ATOM 1418 CG PRO A 678 -10.333 15.924 -7.987 1.00 5.22 C ATOM 1419 CD PRO A 678 -9.794 15.429 -6.676 1.00 22.10 C ATOM 0 HA PRO A 678 -8.694 13.153 -8.692 1.00 20.41 H new ATOM 0 HB2 PRO A 678 -10.103 15.144 -9.963 1.00 2.03 H new ATOM 0 HB3 PRO A 678 -10.911 14.057 -8.852 1.00 2.03 H new ATOM 0 HG2 PRO A 678 -9.811 16.823 -8.316 1.00 5.22 H new ATOM 0 HG3 PRO A 678 -11.390 16.180 -7.910 1.00 5.22 H new ATOM 0 HD2 PRO A 678 -9.450 16.248 -6.044 1.00 22.10 H new ATOM 0 HD3 PRO A 678 -10.548 14.884 -6.108 1.00 22.10 H new ATOM 1427 N TYR A 679 -7.304 14.149 -10.435 1.00 32.42 N ATOM 1428 CA TYR A 679 -6.147 14.470 -11.286 1.00 24.12 C ATOM 1429 C TYR A 679 -6.003 15.948 -11.629 1.00 54.14 C ATOM 1430 O TYR A 679 -5.192 16.645 -11.010 1.00 2.12 O ATOM 1431 CB TYR A 679 -6.110 13.598 -12.544 1.00 3.30 C ATOM 1432 CG TYR A 679 -5.995 12.128 -12.237 1.00 52.52 C ATOM 1433 CD1 TYR A 679 -4.766 11.542 -11.993 1.00 33.11 C ATOM 1434 CD2 TYR A 679 -7.113 11.333 -12.170 1.00 45.01 C ATOM 1435 CE1 TYR A 679 -4.667 10.205 -11.694 1.00 70.42 C ATOM 1436 CE2 TYR A 679 -7.028 10.003 -11.867 1.00 45.52 C ATOM 1437 CZ TYR A 679 -5.799 9.441 -11.630 1.00 11.01 C ATOM 1438 OH TYR A 679 -5.705 8.125 -11.312 1.00 5.03 O ATOM 0 H TYR A 679 -7.855 13.364 -10.782 1.00 32.42 H new ATOM 0 HA TYR A 679 -5.276 14.232 -10.675 1.00 24.12 H new ATOM 0 HB2 TYR A 679 -7.014 13.772 -13.127 1.00 3.30 H new ATOM 0 HB3 TYR A 679 -5.267 13.901 -13.165 1.00 3.30 H new ATOM 0 HD1 TYR A 679 -3.871 12.145 -12.038 1.00 33.11 H new ATOM 0 HD2 TYR A 679 -8.082 11.769 -12.361 1.00 45.01 H new ATOM 0 HE1 TYR A 679 -3.700 9.760 -11.510 1.00 70.42 H new ATOM 0 HE2 TYR A 679 -7.922 9.399 -11.815 1.00 45.52 H new ATOM 0 HH TYR A 679 -5.100 8.015 -10.549 1.00 5.03 H new ATOM 1448 N ASN A 680 -6.766 16.420 -12.596 1.00 13.31 N ATOM 1449 CA ASN A 680 -6.705 17.831 -13.033 1.00 44.24 C ATOM 1450 C ASN A 680 -7.697 18.080 -14.146 1.00 50.15 C ATOM 1451 O ASN A 680 -7.586 19.051 -14.876 1.00 20.03 O ATOM 1452 CB ASN A 680 -5.279 18.219 -13.527 1.00 50.45 C ATOM 1453 CG ASN A 680 -4.805 17.410 -14.724 1.00 15.33 C ATOM 1454 OD1 ASN A 680 -5.038 17.777 -15.870 1.00 43.21 O ATOM 1455 ND2 ASN A 680 -4.114 16.325 -14.469 1.00 52.24 N ATOM 0 H ASN A 680 -7.445 15.855 -13.106 1.00 13.31 H new ATOM 0 HA ASN A 680 -6.953 18.447 -12.169 1.00 44.24 H new ATOM 0 HB2 ASN A 680 -5.270 19.277 -13.789 1.00 50.45 H new ATOM 0 HB3 ASN A 680 -4.572 18.087 -12.708 1.00 50.45 H new ATOM 0 HD21 ASN A 680 -3.753 15.758 -15.236 1.00 52.24 H new ATOM 0 HD22 ASN A 680 -3.938 16.048 -13.503 1.00 52.24 H new ATOM 1461 N ASN A 681 -8.700 17.251 -14.238 1.00 33.12 N ATOM 1462 CA ASN A 681 -9.634 17.344 -15.315 1.00 12.33 C ATOM 1463 C ASN A 681 -10.892 18.016 -14.848 1.00 70.20 C ATOM 1464 O ASN A 681 -11.238 17.933 -13.676 1.00 52.02 O ATOM 1465 CB ASN A 681 -9.924 15.953 -15.942 1.00 62.20 C ATOM 1466 CG ASN A 681 -10.417 14.893 -14.947 1.00 31.12 C ATOM 1467 OD1 ASN A 681 -10.059 14.898 -13.761 1.00 15.33 O ATOM 1468 ND2 ASN A 681 -11.229 13.979 -15.419 1.00 10.10 N ATOM 0 H ASN A 681 -8.888 16.500 -13.573 1.00 33.12 H new ATOM 0 HA ASN A 681 -9.192 17.955 -16.102 1.00 12.33 H new ATOM 0 HB2 ASN A 681 -10.672 16.071 -16.726 1.00 62.20 H new ATOM 0 HB3 ASN A 681 -9.015 15.588 -16.420 1.00 62.20 H new ATOM 0 HD21 ASN A 681 -11.584 13.246 -14.805 1.00 10.10 H new ATOM 0 HD22 ASN A 681 -11.506 14.001 -16.400 1.00 10.10 H new ATOM 1474 N GLU A 682 -11.565 18.678 -15.764 1.00 23.41 N ATOM 1475 CA GLU A 682 -12.796 19.414 -15.486 1.00 71.53 C ATOM 1476 C GLU A 682 -13.868 18.487 -14.907 1.00 1.02 C ATOM 1477 O GLU A 682 -14.681 18.891 -14.071 1.00 15.05 O ATOM 1478 CB GLU A 682 -13.282 20.055 -16.783 1.00 41.43 C ATOM 1479 CG GLU A 682 -14.549 20.867 -16.675 1.00 33.11 C ATOM 1480 CD GLU A 682 -14.960 21.415 -18.010 1.00 75.02 C ATOM 1481 OE1 GLU A 682 -14.498 22.522 -18.380 1.00 73.34 O ATOM 1482 OE2 GLU A 682 -15.730 20.746 -18.722 1.00 52.14 O ATOM 0 H GLU A 682 -11.274 18.726 -16.741 1.00 23.41 H new ATOM 0 HA GLU A 682 -12.599 20.187 -14.744 1.00 71.53 H new ATOM 0 HB2 GLU A 682 -12.491 20.699 -17.168 1.00 41.43 H new ATOM 0 HB3 GLU A 682 -13.438 19.267 -17.520 1.00 41.43 H new ATOM 0 HG2 GLU A 682 -15.349 20.245 -16.273 1.00 33.11 H new ATOM 0 HG3 GLU A 682 -14.399 21.687 -15.973 1.00 33.11 H new ATOM 1489 N LYS A 683 -13.826 17.243 -15.330 1.00 53.54 N ATOM 1490 CA LYS A 683 -14.760 16.239 -14.884 1.00 75.44 C ATOM 1491 C LYS A 683 -14.395 15.784 -13.464 1.00 74.31 C ATOM 1492 O LYS A 683 -15.271 15.368 -12.697 1.00 15.34 O ATOM 1493 CB LYS A 683 -14.745 15.066 -15.912 1.00 21.13 C ATOM 1494 CG LYS A 683 -15.735 13.935 -15.706 1.00 12.32 C ATOM 1495 CD LYS A 683 -15.298 12.971 -14.643 1.00 15.40 C ATOM 1496 CE LYS A 683 -16.325 11.883 -14.445 1.00 10.22 C ATOM 1497 NZ LYS A 683 -16.585 11.121 -15.689 1.00 13.24 N ATOM 0 H LYS A 683 -13.136 16.899 -15.998 1.00 53.54 H new ATOM 0 HA LYS A 683 -15.773 16.638 -14.835 1.00 75.44 H new ATOM 0 HB2 LYS A 683 -14.917 15.486 -16.903 1.00 21.13 H new ATOM 0 HB3 LYS A 683 -13.743 14.638 -15.917 1.00 21.13 H new ATOM 0 HG2 LYS A 683 -16.706 14.351 -15.437 1.00 12.32 H new ATOM 0 HG3 LYS A 683 -15.868 13.398 -16.645 1.00 12.32 H new ATOM 0 HD2 LYS A 683 -14.342 12.527 -14.920 1.00 15.40 H new ATOM 0 HD3 LYS A 683 -15.142 13.504 -13.705 1.00 15.40 H new ATOM 0 HE2 LYS A 683 -15.982 11.200 -13.668 1.00 10.22 H new ATOM 0 HE3 LYS A 683 -17.256 12.326 -14.091 1.00 10.22 H new ATOM 0 HZ1 LYS A 683 -17.105 10.250 -15.460 1.00 13.24 H new ATOM 0 HZ2 LYS A 683 -17.152 11.701 -16.340 1.00 13.24 H new ATOM 0 HZ3 LYS A 683 -15.681 10.876 -16.142 1.00 13.24 H new ATOM 1511 N ARG A 684 -13.109 15.937 -13.107 1.00 74.21 N ATOM 1512 CA ARG A 684 -12.573 15.512 -11.827 1.00 53.43 C ATOM 1513 C ARG A 684 -12.654 14.031 -11.629 1.00 43.33 C ATOM 1514 O ARG A 684 -13.673 13.485 -11.194 1.00 64.32 O ATOM 1515 CB ARG A 684 -13.194 16.218 -10.657 1.00 62.14 C ATOM 1516 CG ARG A 684 -12.972 17.696 -10.620 1.00 52.41 C ATOM 1517 CD ARG A 684 -13.671 18.238 -9.432 1.00 34.15 C ATOM 1518 NE ARG A 684 -13.538 19.672 -9.293 1.00 1.21 N ATOM 1519 CZ ARG A 684 -14.386 20.434 -8.619 1.00 73.40 C ATOM 1520 NH1 ARG A 684 -15.457 19.894 -8.036 1.00 13.24 N ATOM 1521 NH2 ARG A 684 -14.175 21.733 -8.530 1.00 43.44 N ATOM 0 H ARG A 684 -12.412 16.367 -13.716 1.00 74.21 H new ATOM 0 HA ARG A 684 -11.521 15.797 -11.864 1.00 53.43 H new ATOM 0 HB2 ARG A 684 -14.267 16.027 -10.665 1.00 62.14 H new ATOM 0 HB3 ARG A 684 -12.799 15.783 -9.739 1.00 62.14 H new ATOM 0 HG2 ARG A 684 -11.906 17.919 -10.569 1.00 52.41 H new ATOM 0 HG3 ARG A 684 -13.352 18.161 -11.530 1.00 52.41 H new ATOM 0 HD2 ARG A 684 -14.729 17.983 -9.494 1.00 34.15 H new ATOM 0 HD3 ARG A 684 -13.279 17.755 -8.537 1.00 34.15 H new ATOM 0 HE ARG A 684 -12.742 20.124 -9.742 1.00 1.21 H new ATOM 0 HH11 ARG A 684 -15.625 18.891 -8.108 1.00 13.24 H new ATOM 0 HH12 ARG A 684 -16.108 20.484 -7.518 1.00 13.24 H new ATOM 0 HH21 ARG A 684 -13.360 22.149 -8.980 1.00 43.44 H new ATOM 0 HH22 ARG A 684 -14.827 22.321 -8.011 1.00 43.44 H new ATOM 1533 N THR A 685 -11.619 13.390 -11.973 1.00 14.25 N ATOM 1534 CA THR A 685 -11.496 12.002 -11.740 1.00 43.24 C ATOM 1535 C THR A 685 -10.670 11.806 -10.482 1.00 31.31 C ATOM 1536 O THR A 685 -9.474 12.115 -10.475 1.00 31.22 O ATOM 1537 CB THR A 685 -10.827 11.303 -12.920 1.00 31.44 C ATOM 1538 OG1 THR A 685 -11.633 11.475 -14.101 1.00 73.22 O ATOM 1539 CG2 THR A 685 -10.656 9.833 -12.621 1.00 3.41 C ATOM 0 H THR A 685 -10.813 13.813 -12.433 1.00 14.25 H new ATOM 0 HA THR A 685 -12.487 11.565 -11.619 1.00 43.24 H new ATOM 0 HB THR A 685 -9.844 11.743 -13.088 1.00 31.44 H new ATOM 0 HG1 THR A 685 -11.202 11.027 -14.859 1.00 73.22 H new ATOM 0 HG21 THR A 685 -10.178 9.342 -13.469 1.00 3.41 H new ATOM 0 HG22 THR A 685 -10.034 9.712 -11.734 1.00 3.41 H new ATOM 0 HG23 THR A 685 -11.632 9.382 -12.444 1.00 3.41 H new ATOM 1545 N PRO A 686 -11.298 11.353 -9.392 1.00 63.02 N ATOM 1546 CA PRO A 686 -10.617 11.162 -8.122 1.00 72.45 C ATOM 1547 C PRO A 686 -9.526 10.115 -8.198 1.00 34.42 C ATOM 1548 O PRO A 686 -9.662 9.104 -8.896 1.00 12.34 O ATOM 1549 CB PRO A 686 -11.719 10.699 -7.174 1.00 53.14 C ATOM 1550 CG PRO A 686 -12.818 10.210 -8.042 1.00 43.53 C ATOM 1551 CD PRO A 686 -12.724 10.988 -9.313 1.00 50.24 C ATOM 0 HA PRO A 686 -10.119 12.077 -7.802 1.00 72.45 H new ATOM 0 HB2 PRO A 686 -11.361 9.909 -6.514 1.00 53.14 H new ATOM 0 HB3 PRO A 686 -12.057 11.517 -6.538 1.00 53.14 H new ATOM 0 HG2 PRO A 686 -12.718 9.141 -8.232 1.00 43.53 H new ATOM 0 HG3 PRO A 686 -13.787 10.360 -7.565 1.00 43.53 H new ATOM 0 HD2 PRO A 686 -13.033 10.392 -10.172 1.00 50.24 H new ATOM 0 HD3 PRO A 686 -13.363 11.871 -9.291 1.00 50.24 H new ATOM 1559 N ARG A 687 -8.448 10.374 -7.506 1.00 0.23 N ATOM 1560 CA ARG A 687 -7.362 9.445 -7.416 1.00 14.33 C ATOM 1561 C ARG A 687 -7.598 8.538 -6.254 1.00 23.21 C ATOM 1562 O ARG A 687 -7.761 9.003 -5.130 1.00 13.35 O ATOM 1563 CB ARG A 687 -6.044 10.160 -7.202 1.00 74.13 C ATOM 1564 CG ARG A 687 -5.541 10.967 -8.356 1.00 22.31 C ATOM 1565 CD ARG A 687 -4.262 11.661 -7.954 1.00 74.33 C ATOM 1566 NE ARG A 687 -3.600 12.318 -9.069 1.00 0.40 N ATOM 1567 CZ ARG A 687 -3.572 13.630 -9.271 1.00 61.11 C ATOM 1568 NH1 ARG A 687 -4.351 14.441 -8.537 1.00 33.13 N ATOM 1569 NH2 ARG A 687 -2.805 14.132 -10.231 1.00 64.13 N ATOM 0 H ARG A 687 -8.302 11.240 -6.988 1.00 0.23 H new ATOM 0 HA ARG A 687 -7.312 8.885 -8.350 1.00 14.33 H new ATOM 0 HB2 ARG A 687 -6.147 10.820 -6.340 1.00 74.13 H new ATOM 0 HB3 ARG A 687 -5.288 9.418 -6.946 1.00 74.13 H new ATOM 0 HG2 ARG A 687 -5.364 10.322 -9.217 1.00 22.31 H new ATOM 0 HG3 ARG A 687 -6.289 11.701 -8.656 1.00 22.31 H new ATOM 0 HD2 ARG A 687 -4.482 12.399 -7.183 1.00 74.33 H new ATOM 0 HD3 ARG A 687 -3.582 10.932 -7.513 1.00 74.33 H new ATOM 0 HE ARG A 687 -3.121 11.726 -9.748 1.00 0.40 H new ATOM 0 HH11 ARG A 687 -4.965 14.049 -7.823 1.00 33.13 H new ATOM 0 HH12 ARG A 687 -4.328 15.449 -8.693 1.00 33.13 H new ATOM 0 HH21 ARG A 687 -2.240 13.510 -10.810 1.00 64.13 H new ATOM 0 HH22 ARG A 687 -2.780 15.139 -10.390 1.00 64.13 H new ATOM 1581 N ALA A 688 -7.589 7.274 -6.497 1.00 13.33 N ATOM 1582 CA ALA A 688 -7.799 6.336 -5.447 1.00 74.22 C ATOM 1583 C ALA A 688 -6.690 5.333 -5.474 1.00 64.34 C ATOM 1584 O ALA A 688 -6.059 5.137 -6.506 1.00 51.22 O ATOM 1585 CB ALA A 688 -9.152 5.652 -5.603 1.00 51.42 C ATOM 0 H ALA A 688 -7.438 6.863 -7.418 1.00 13.33 H new ATOM 0 HA ALA A 688 -7.800 6.851 -4.487 1.00 74.22 H new ATOM 0 HB1 ALA A 688 -9.295 4.939 -4.791 1.00 51.42 H new ATOM 0 HB2 ALA A 688 -9.944 6.400 -5.572 1.00 51.42 H new ATOM 0 HB3 ALA A 688 -9.186 5.127 -6.558 1.00 51.42 H new ATOM 1591 N THR A 689 -6.432 4.728 -4.364 1.00 65.34 N ATOM 1592 CA THR A 689 -5.384 3.763 -4.264 1.00 60.44 C ATOM 1593 C THR A 689 -5.974 2.394 -4.001 1.00 23.35 C ATOM 1594 O THR A 689 -6.859 2.244 -3.150 1.00 31.13 O ATOM 1595 CB THR A 689 -4.417 4.150 -3.127 1.00 15.34 C ATOM 1596 OG1 THR A 689 -3.885 5.440 -3.392 1.00 74.45 O ATOM 1597 CG2 THR A 689 -3.275 3.154 -2.995 1.00 2.43 C ATOM 0 H THR A 689 -6.943 4.888 -3.496 1.00 65.34 H new ATOM 0 HA THR A 689 -4.830 3.738 -5.202 1.00 60.44 H new ATOM 0 HB THR A 689 -4.974 4.147 -2.190 1.00 15.34 H new ATOM 0 HG1 THR A 689 -4.573 6.118 -3.227 1.00 74.45 H new ATOM 0 HG21 THR A 689 -2.616 3.462 -2.183 1.00 2.43 H new ATOM 0 HG22 THR A 689 -3.678 2.165 -2.780 1.00 2.43 H new ATOM 0 HG23 THR A 689 -2.711 3.121 -3.927 1.00 2.43 H new ATOM 1603 N LEU A 690 -5.518 1.419 -4.745 1.00 32.23 N ATOM 1604 CA LEU A 690 -5.943 0.078 -4.582 1.00 12.34 C ATOM 1605 C LEU A 690 -4.710 -0.720 -4.235 1.00 25.22 C ATOM 1606 O LEU A 690 -3.784 -0.852 -5.039 1.00 61.14 O ATOM 1607 CB LEU A 690 -6.572 -0.433 -5.905 1.00 13.45 C ATOM 1608 CG LEU A 690 -7.363 -1.771 -5.902 1.00 54.34 C ATOM 1609 CD1 LEU A 690 -6.534 -2.962 -5.495 1.00 25.44 C ATOM 1610 CD2 LEU A 690 -8.593 -1.666 -5.052 1.00 54.21 C ATOM 0 H LEU A 690 -4.832 1.550 -5.488 1.00 32.23 H new ATOM 0 HA LEU A 690 -6.697 -0.016 -3.800 1.00 12.34 H new ATOM 0 HB2 LEU A 690 -7.243 0.344 -6.271 1.00 13.45 H new ATOM 0 HB3 LEU A 690 -5.768 -0.529 -6.635 1.00 13.45 H new ATOM 0 HG LEU A 690 -7.658 -1.945 -6.937 1.00 54.34 H new ATOM 0 HD11 LEU A 690 -7.152 -3.860 -5.516 1.00 25.44 H new ATOM 0 HD12 LEU A 690 -5.701 -3.079 -6.188 1.00 25.44 H new ATOM 0 HD13 LEU A 690 -6.149 -2.810 -4.487 1.00 25.44 H new ATOM 0 HD21 LEU A 690 -9.128 -2.616 -5.067 1.00 54.21 H new ATOM 0 HD22 LEU A 690 -8.308 -1.427 -4.028 1.00 54.21 H new ATOM 0 HD23 LEU A 690 -9.239 -0.879 -5.442 1.00 54.21 H new ATOM 1618 N ILE A 691 -4.685 -1.233 -3.067 1.00 73.54 N ATOM 1619 CA ILE A 691 -3.585 -2.026 -2.644 1.00 41.54 C ATOM 1620 C ILE A 691 -4.013 -3.465 -2.717 1.00 52.12 C ATOM 1621 O ILE A 691 -4.995 -3.855 -2.101 1.00 23.31 O ATOM 1622 CB ILE A 691 -3.141 -1.661 -1.213 1.00 4.13 C ATOM 1623 CG1 ILE A 691 -2.826 -0.161 -1.145 1.00 12.42 C ATOM 1624 CG2 ILE A 691 -1.899 -2.470 -0.836 1.00 65.34 C ATOM 1625 CD1 ILE A 691 -2.520 0.352 0.249 1.00 31.14 C ATOM 0 H ILE A 691 -5.423 -1.119 -2.372 1.00 73.54 H new ATOM 0 HA ILE A 691 -2.727 -1.845 -3.291 1.00 41.54 H new ATOM 0 HB ILE A 691 -3.943 -1.894 -0.513 1.00 4.13 H new ATOM 0 HG12 ILE A 691 -1.974 0.049 -1.791 1.00 12.42 H new ATOM 0 HG13 ILE A 691 -3.674 0.395 -1.545 1.00 12.42 H new ATOM 0 HG21 ILE A 691 -1.588 -2.209 0.176 1.00 65.34 H new ATOM 0 HG22 ILE A 691 -2.130 -3.534 -0.882 1.00 65.34 H new ATOM 0 HG23 ILE A 691 -1.092 -2.244 -1.533 1.00 65.34 H new ATOM 0 HD11 ILE A 691 -2.309 1.420 0.205 1.00 31.14 H new ATOM 0 HD12 ILE A 691 -3.379 0.178 0.897 1.00 31.14 H new ATOM 0 HD13 ILE A 691 -1.652 -0.173 0.648 1.00 31.14 H new ATOM 1632 N THR A 692 -3.323 -4.215 -3.501 1.00 51.50 N ATOM 1633 CA THR A 692 -3.632 -5.586 -3.722 1.00 11.11 C ATOM 1634 C THR A 692 -2.668 -6.424 -2.902 1.00 2.02 C ATOM 1635 O THR A 692 -1.473 -6.354 -3.103 1.00 14.11 O ATOM 1636 CB THR A 692 -3.404 -5.879 -5.192 1.00 61.51 C ATOM 1637 OG1 THR A 692 -4.014 -4.823 -5.962 1.00 62.35 O ATOM 1638 CG2 THR A 692 -4.021 -7.202 -5.595 1.00 34.25 C ATOM 0 H THR A 692 -2.508 -3.886 -4.020 1.00 51.50 H new ATOM 0 HA THR A 692 -4.661 -5.810 -3.441 1.00 11.11 H new ATOM 0 HB THR A 692 -2.331 -5.936 -5.377 1.00 61.51 H new ATOM 0 HG1 THR A 692 -3.876 -4.993 -6.917 1.00 62.35 H new ATOM 0 HG21 THR A 692 -3.839 -7.381 -6.655 1.00 34.25 H new ATOM 0 HG22 THR A 692 -3.574 -8.005 -5.009 1.00 34.25 H new ATOM 0 HG23 THR A 692 -5.095 -7.174 -5.411 1.00 34.25 H new ATOM 1644 N PHE A 693 -3.181 -7.174 -1.991 1.00 61.55 N ATOM 1645 CA PHE A 693 -2.373 -7.966 -1.101 1.00 62.44 C ATOM 1646 C PHE A 693 -2.277 -9.372 -1.606 1.00 11.35 C ATOM 1647 O PHE A 693 -3.280 -10.025 -1.801 1.00 2.02 O ATOM 1648 CB PHE A 693 -2.987 -7.970 0.285 1.00 22.41 C ATOM 1649 CG PHE A 693 -3.072 -6.604 0.928 1.00 33.02 C ATOM 1650 CD1 PHE A 693 -4.019 -5.683 0.518 1.00 74.10 C ATOM 1651 CD2 PHE A 693 -2.220 -6.253 1.957 1.00 15.32 C ATOM 1652 CE1 PHE A 693 -4.109 -4.454 1.114 1.00 44.42 C ATOM 1653 CE2 PHE A 693 -2.304 -5.020 2.553 1.00 70.42 C ATOM 1654 CZ PHE A 693 -3.250 -4.123 2.133 1.00 14.13 C ATOM 0 H PHE A 693 -4.185 -7.263 -1.832 1.00 61.55 H new ATOM 0 HA PHE A 693 -1.374 -7.532 -1.055 1.00 62.44 H new ATOM 0 HB2 PHE A 693 -3.989 -8.394 0.225 1.00 22.41 H new ATOM 0 HB3 PHE A 693 -2.401 -8.626 0.928 1.00 22.41 H new ATOM 0 HD1 PHE A 693 -4.697 -5.937 -0.283 1.00 74.10 H new ATOM 0 HD2 PHE A 693 -1.477 -6.959 2.297 1.00 15.32 H new ATOM 0 HE1 PHE A 693 -4.854 -3.746 0.783 1.00 44.42 H new ATOM 0 HE2 PHE A 693 -1.626 -4.757 3.351 1.00 70.42 H new ATOM 0 HZ PHE A 693 -3.321 -3.154 2.604 1.00 14.13 H new ATOM 1664 N LEU A 694 -1.084 -9.835 -1.779 1.00 53.44 N ATOM 1665 CA LEU A 694 -0.838 -11.151 -2.286 1.00 53.42 C ATOM 1666 C LEU A 694 -0.213 -11.982 -1.209 1.00 3.40 C ATOM 1667 O LEU A 694 0.510 -11.465 -0.337 1.00 24.22 O ATOM 1668 CB LEU A 694 0.114 -11.142 -3.514 1.00 24.23 C ATOM 1669 CG LEU A 694 -0.353 -10.453 -4.813 1.00 31.20 C ATOM 1670 CD1 LEU A 694 -1.675 -11.015 -5.308 1.00 2.30 C ATOM 1671 CD2 LEU A 694 -0.398 -8.940 -4.689 1.00 34.34 C ATOM 0 H LEU A 694 -0.238 -9.305 -1.570 1.00 53.44 H new ATOM 0 HA LEU A 694 -1.796 -11.564 -2.602 1.00 53.42 H new ATOM 0 HB2 LEU A 694 1.046 -10.667 -3.206 1.00 24.23 H new ATOM 0 HB3 LEU A 694 0.349 -12.178 -3.757 1.00 24.23 H new ATOM 0 HG LEU A 694 0.400 -10.680 -5.567 1.00 31.20 H new ATOM 0 HD11 LEU A 694 -1.968 -10.503 -6.224 1.00 2.30 H new ATOM 0 HD12 LEU A 694 -1.565 -12.081 -5.507 1.00 2.30 H new ATOM 0 HD13 LEU A 694 -2.442 -10.865 -4.548 1.00 2.30 H new ATOM 0 HD21 LEU A 694 -0.733 -8.507 -5.632 1.00 34.34 H new ATOM 0 HD22 LEU A 694 -1.091 -8.660 -3.895 1.00 34.34 H new ATOM 0 HD23 LEU A 694 0.597 -8.565 -4.451 1.00 34.34 H new ATOM 1679 N CYS A 695 -0.483 -13.244 -1.263 1.00 1.41 N ATOM 1680 CA CYS A 695 0.025 -14.184 -0.315 1.00 41.24 C ATOM 1681 C CYS A 695 1.374 -14.695 -0.776 1.00 45.14 C ATOM 1682 O CYS A 695 1.494 -15.278 -1.866 1.00 51.32 O ATOM 1683 CB CYS A 695 -0.957 -15.349 -0.168 1.00 11.40 C ATOM 1684 SG CYS A 695 -0.383 -16.699 0.908 1.00 10.02 S ATOM 0 H CYS A 695 -1.075 -13.661 -1.981 1.00 1.41 H new ATOM 0 HA CYS A 695 0.143 -13.696 0.652 1.00 41.24 H new ATOM 0 HB2 CYS A 695 -1.898 -14.965 0.225 1.00 11.40 H new ATOM 0 HB3 CYS A 695 -1.167 -15.756 -1.157 1.00 11.40 H new ATOM 1689 N ASP A 696 2.395 -14.469 0.013 1.00 63.23 N ATOM 1690 CA ASP A 696 3.695 -14.967 -0.343 1.00 73.14 C ATOM 1691 C ASP A 696 4.355 -15.748 0.772 1.00 33.23 C ATOM 1692 O ASP A 696 4.159 -15.476 1.964 1.00 72.22 O ATOM 1693 CB ASP A 696 4.636 -13.899 -0.906 1.00 44.23 C ATOM 1694 CG ASP A 696 5.944 -14.520 -1.390 1.00 15.44 C ATOM 1695 OD1 ASP A 696 5.931 -15.239 -2.417 1.00 44.44 O ATOM 1696 OD2 ASP A 696 6.966 -14.355 -0.730 1.00 44.11 O ATOM 0 H ASP A 696 2.351 -13.952 0.891 1.00 63.23 H new ATOM 0 HA ASP A 696 3.502 -15.665 -1.158 1.00 73.14 H new ATOM 0 HB2 ASP A 696 4.149 -13.379 -1.731 1.00 44.23 H new ATOM 0 HB3 ASP A 696 4.846 -13.153 -0.139 1.00 44.23 H new ATOM 1701 N ARG A 697 5.091 -16.732 0.340 1.00 32.45 N ATOM 1702 CA ARG A 697 5.884 -17.649 1.141 1.00 25.03 C ATOM 1703 C ARG A 697 6.800 -16.910 2.130 1.00 21.12 C ATOM 1704 O ARG A 697 6.879 -17.282 3.302 1.00 3.33 O ATOM 1705 CB ARG A 697 6.732 -18.426 0.164 1.00 13.42 C ATOM 1706 CG ARG A 697 5.918 -19.193 -0.859 1.00 32.41 C ATOM 1707 CD ARG A 697 6.693 -19.355 -2.143 1.00 63.32 C ATOM 1708 NE ARG A 697 6.965 -18.034 -2.753 1.00 3.13 N ATOM 1709 CZ ARG A 697 7.573 -17.825 -3.916 1.00 14.23 C ATOM 1710 NH1 ARG A 697 7.999 -18.852 -4.650 1.00 53.24 N ATOM 1711 NH2 ARG A 697 7.742 -16.575 -4.342 1.00 20.41 N ATOM 0 H ARG A 697 5.164 -16.938 -0.656 1.00 32.45 H new ATOM 0 HA ARG A 697 5.230 -18.287 1.735 1.00 25.03 H new ATOM 0 HB2 ARG A 697 7.399 -17.738 -0.355 1.00 13.42 H new ATOM 0 HB3 ARG A 697 7.361 -19.125 0.715 1.00 13.42 H new ATOM 0 HG2 ARG A 697 5.655 -20.173 -0.461 1.00 32.41 H new ATOM 0 HG3 ARG A 697 4.984 -18.667 -1.056 1.00 32.41 H new ATOM 0 HD2 ARG A 697 7.632 -19.871 -1.945 1.00 63.32 H new ATOM 0 HD3 ARG A 697 6.129 -19.975 -2.840 1.00 63.32 H new ATOM 0 HE ARG A 697 6.658 -17.211 -2.234 1.00 3.13 H new ATOM 0 HH11 ARG A 697 7.859 -19.807 -4.320 1.00 53.24 H new ATOM 0 HH12 ARG A 697 8.465 -18.683 -5.542 1.00 53.24 H new ATOM 0 HH21 ARG A 697 7.407 -15.794 -3.778 1.00 20.41 H new ATOM 0 HH22 ARG A 697 8.207 -16.398 -5.233 1.00 20.41 H new ATOM 1723 N ASP A 698 7.481 -15.870 1.664 1.00 3.51 N ATOM 1724 CA ASP A 698 8.396 -15.121 2.520 1.00 72.24 C ATOM 1725 C ASP A 698 8.325 -13.647 2.224 1.00 54.32 C ATOM 1726 O ASP A 698 8.743 -13.190 1.158 1.00 51.42 O ATOM 1727 CB ASP A 698 9.848 -15.610 2.383 1.00 70.30 C ATOM 1728 CG ASP A 698 10.805 -14.815 3.260 1.00 43.43 C ATOM 1729 OD1 ASP A 698 10.845 -15.056 4.491 1.00 25.15 O ATOM 1730 OD2 ASP A 698 11.541 -13.941 2.741 1.00 73.42 O ATOM 0 H ASP A 698 7.419 -15.527 0.705 1.00 3.51 H new ATOM 0 HA ASP A 698 8.078 -15.296 3.548 1.00 72.24 H new ATOM 0 HB2 ASP A 698 9.902 -16.665 2.652 1.00 70.30 H new ATOM 0 HB3 ASP A 698 10.160 -15.530 1.342 1.00 70.30 H new ATOM 1735 N ALA A 699 7.806 -12.909 3.159 1.00 12.11 N ATOM 1736 CA ALA A 699 7.666 -11.483 3.002 1.00 51.23 C ATOM 1737 C ALA A 699 7.742 -10.814 4.353 1.00 52.10 C ATOM 1738 O ALA A 699 8.589 -9.962 4.598 1.00 11.30 O ATOM 1739 CB ALA A 699 6.343 -11.163 2.325 1.00 32.24 C ATOM 0 H ALA A 699 7.467 -13.271 4.050 1.00 12.11 H new ATOM 0 HA ALA A 699 8.476 -11.107 2.376 1.00 51.23 H new ATOM 0 HB1 ALA A 699 6.245 -10.084 2.210 1.00 32.24 H new ATOM 0 HB2 ALA A 699 6.312 -11.637 1.344 1.00 32.24 H new ATOM 0 HB3 ALA A 699 5.522 -11.539 2.935 1.00 32.24 H new ATOM 1745 N GLY A 700 6.845 -11.189 5.213 1.00 55.44 N ATOM 1746 CA GLY A 700 6.817 -10.676 6.532 1.00 42.12 C ATOM 1747 C GLY A 700 5.726 -9.692 6.637 1.00 72.32 C ATOM 1748 O GLY A 700 4.553 -10.037 6.446 1.00 25.33 O ATOM 0 H GLY A 700 6.109 -11.866 5.009 1.00 55.44 H new ATOM 0 HA2 GLY A 700 6.666 -11.484 7.248 1.00 42.12 H new ATOM 0 HA3 GLY A 700 7.771 -10.209 6.775 1.00 42.12 H new ATOM 1752 N VAL A 701 6.080 -8.465 6.886 1.00 1.52 N ATOM 1753 CA VAL A 701 5.099 -7.424 6.943 1.00 64.22 C ATOM 1754 C VAL A 701 4.691 -7.083 5.502 1.00 21.31 C ATOM 1755 O VAL A 701 3.555 -6.725 5.214 1.00 43.52 O ATOM 1756 CB VAL A 701 5.636 -6.181 7.719 1.00 72.32 C ATOM 1757 CG1 VAL A 701 6.724 -5.425 6.980 1.00 42.11 C ATOM 1758 CG2 VAL A 701 4.524 -5.278 8.209 1.00 32.34 C ATOM 0 H VAL A 701 7.040 -8.162 7.052 1.00 1.52 H new ATOM 0 HA VAL A 701 4.221 -7.759 7.496 1.00 64.22 H new ATOM 0 HB VAL A 701 6.122 -6.582 8.608 1.00 72.32 H new ATOM 0 HG11 VAL A 701 7.048 -4.575 7.580 1.00 42.11 H new ATOM 0 HG12 VAL A 701 7.571 -6.088 6.802 1.00 42.11 H new ATOM 0 HG13 VAL A 701 6.336 -5.069 6.026 1.00 42.11 H new ATOM 0 HG21 VAL A 701 4.953 -4.429 8.742 1.00 32.34 H new ATOM 0 HG22 VAL A 701 3.946 -4.918 7.358 1.00 32.34 H new ATOM 0 HG23 VAL A 701 3.871 -5.836 8.881 1.00 32.34 H new ATOM 1764 N GLY A 702 5.606 -7.293 4.603 1.00 12.52 N ATOM 1765 CA GLY A 702 5.328 -7.087 3.229 1.00 33.13 C ATOM 1766 C GLY A 702 5.664 -5.715 2.715 1.00 35.54 C ATOM 1767 O GLY A 702 5.486 -4.710 3.396 1.00 44.34 O ATOM 0 H GLY A 702 6.554 -7.609 4.807 1.00 12.52 H new ATOM 0 HA2 GLY A 702 5.882 -7.823 2.647 1.00 33.13 H new ATOM 0 HA3 GLY A 702 4.268 -7.275 3.055 1.00 33.13 H new ATOM 1771 N PHE A 703 6.175 -5.703 1.527 1.00 72.43 N ATOM 1772 CA PHE A 703 6.513 -4.493 0.794 1.00 31.34 C ATOM 1773 C PHE A 703 5.497 -4.282 -0.338 1.00 73.53 C ATOM 1774 O PHE A 703 5.193 -5.228 -1.081 1.00 40.20 O ATOM 1775 CB PHE A 703 7.905 -4.622 0.133 1.00 64.05 C ATOM 1776 CG PHE A 703 9.062 -4.851 1.063 1.00 42.21 C ATOM 1777 CD1 PHE A 703 9.428 -6.135 1.435 1.00 52.51 C ATOM 1778 CD2 PHE A 703 9.797 -3.783 1.550 1.00 63.32 C ATOM 1779 CE1 PHE A 703 10.498 -6.348 2.276 1.00 71.22 C ATOM 1780 CE2 PHE A 703 10.873 -3.991 2.391 1.00 75.20 C ATOM 1781 CZ PHE A 703 11.223 -5.275 2.755 1.00 10.33 C ATOM 0 H PHE A 703 6.382 -6.557 1.009 1.00 72.43 H new ATOM 0 HA PHE A 703 6.506 -3.662 1.500 1.00 31.34 H new ATOM 0 HB2 PHE A 703 7.871 -5.446 -0.580 1.00 64.05 H new ATOM 0 HB3 PHE A 703 8.099 -3.714 -0.438 1.00 64.05 H new ATOM 0 HD1 PHE A 703 8.867 -6.979 1.061 1.00 52.51 H new ATOM 0 HD2 PHE A 703 9.526 -2.776 1.269 1.00 63.32 H new ATOM 0 HE1 PHE A 703 10.770 -7.354 2.561 1.00 71.22 H new ATOM 0 HE2 PHE A 703 11.439 -3.150 2.763 1.00 75.20 H new ATOM 0 HZ PHE A 703 12.063 -5.441 3.414 1.00 10.33 H new ATOM 1791 N PRO A 704 4.928 -3.079 -0.458 1.00 75.23 N ATOM 1792 CA PRO A 704 4.085 -2.721 -1.596 1.00 61.51 C ATOM 1793 C PRO A 704 4.937 -2.383 -2.837 1.00 60.12 C ATOM 1794 O PRO A 704 6.046 -1.849 -2.722 1.00 65.53 O ATOM 1795 CB PRO A 704 3.349 -1.473 -1.114 1.00 1.35 C ATOM 1796 CG PRO A 704 4.272 -0.855 -0.125 1.00 63.41 C ATOM 1797 CD PRO A 704 5.012 -1.994 0.531 1.00 3.13 C ATOM 0 HA PRO A 704 3.421 -3.533 -1.894 1.00 61.51 H new ATOM 0 HB2 PRO A 704 3.138 -0.793 -1.939 1.00 1.35 H new ATOM 0 HB3 PRO A 704 2.392 -1.728 -0.659 1.00 1.35 H new ATOM 0 HG2 PRO A 704 4.965 -0.171 -0.614 1.00 63.41 H new ATOM 0 HG3 PRO A 704 3.719 -0.274 0.613 1.00 63.41 H new ATOM 0 HD2 PRO A 704 6.047 -1.728 0.747 1.00 3.13 H new ATOM 0 HD3 PRO A 704 4.552 -2.278 1.477 1.00 3.13 H new ATOM 1805 N GLU A 705 4.439 -2.712 -4.000 1.00 21.41 N ATOM 1806 CA GLU A 705 5.128 -2.438 -5.228 1.00 10.23 C ATOM 1807 C GLU A 705 4.185 -1.663 -6.136 1.00 12.30 C ATOM 1808 O GLU A 705 3.042 -2.086 -6.331 1.00 43.45 O ATOM 1809 CB GLU A 705 5.494 -3.788 -5.868 1.00 14.41 C ATOM 1810 CG GLU A 705 6.353 -3.702 -7.108 1.00 22.24 C ATOM 1811 CD GLU A 705 7.653 -2.996 -6.846 1.00 73.45 C ATOM 1812 OE1 GLU A 705 8.538 -3.573 -6.170 1.00 43.42 O ATOM 1813 OE2 GLU A 705 7.801 -1.853 -7.293 1.00 2.43 O ATOM 0 H GLU A 705 3.540 -3.179 -4.120 1.00 21.41 H new ATOM 0 HA GLU A 705 6.032 -1.852 -5.064 1.00 10.23 H new ATOM 0 HB2 GLU A 705 6.015 -4.394 -5.126 1.00 14.41 H new ATOM 0 HB3 GLU A 705 4.573 -4.314 -6.120 1.00 14.41 H new ATOM 0 HG2 GLU A 705 6.555 -4.707 -7.479 1.00 22.24 H new ATOM 0 HG3 GLU A 705 5.807 -3.176 -7.891 1.00 22.24 H new ATOM 1820 N TYR A 706 4.636 -0.550 -6.694 1.00 62.44 N ATOM 1821 CA TYR A 706 3.784 0.222 -7.576 1.00 14.25 C ATOM 1822 C TYR A 706 3.775 -0.385 -8.938 1.00 74.11 C ATOM 1823 O TYR A 706 4.817 -0.570 -9.558 1.00 63.02 O ATOM 1824 CB TYR A 706 4.160 1.720 -7.641 1.00 62.21 C ATOM 1825 CG TYR A 706 3.312 2.506 -8.635 1.00 12.34 C ATOM 1826 CD1 TYR A 706 1.949 2.696 -8.428 1.00 23.41 C ATOM 1827 CD2 TYR A 706 3.877 3.051 -9.781 1.00 34.33 C ATOM 1828 CE1 TYR A 706 1.181 3.401 -9.327 1.00 2.14 C ATOM 1829 CE2 TYR A 706 3.117 3.759 -10.683 1.00 31.52 C ATOM 1830 CZ TYR A 706 1.772 3.933 -10.456 1.00 3.21 C ATOM 1831 OH TYR A 706 1.014 4.636 -11.365 1.00 4.32 O ATOM 0 H TYR A 706 5.571 -0.168 -6.554 1.00 62.44 H new ATOM 0 HA TYR A 706 2.780 0.186 -7.154 1.00 14.25 H new ATOM 0 HB2 TYR A 706 4.049 2.160 -6.650 1.00 62.21 H new ATOM 0 HB3 TYR A 706 5.211 1.813 -7.915 1.00 62.21 H new ATOM 0 HD1 TYR A 706 1.485 2.282 -7.545 1.00 23.41 H new ATOM 0 HD2 TYR A 706 4.932 2.916 -9.967 1.00 34.33 H new ATOM 0 HE1 TYR A 706 0.124 3.537 -9.151 1.00 2.14 H new ATOM 0 HE2 TYR A 706 3.575 4.177 -11.567 1.00 31.52 H new ATOM 0 HH TYR A 706 1.585 4.942 -12.100 1.00 4.32 H new ATOM 1841 N GLN A 707 2.614 -0.729 -9.391 1.00 71.45 N ATOM 1842 CA GLN A 707 2.477 -1.306 -10.679 1.00 13.13 C ATOM 1843 C GLN A 707 2.041 -0.304 -11.695 1.00 62.21 C ATOM 1844 O GLN A 707 2.855 0.182 -12.476 1.00 34.21 O ATOM 1845 CB GLN A 707 1.566 -2.522 -10.642 1.00 0.25 C ATOM 1846 CG GLN A 707 2.196 -3.699 -9.936 1.00 35.41 C ATOM 1847 CD GLN A 707 3.439 -4.199 -10.653 1.00 1.12 C ATOM 1848 OE1 GLN A 707 4.592 -3.664 -10.311 1.00 31.23 O flip ATOM 1849 NE2 GLN A 707 3.356 -5.062 -11.519 1.00 71.12 N flip ATOM 0 H GLN A 707 1.740 -0.617 -8.878 1.00 71.45 H new ATOM 0 HA GLN A 707 3.463 -1.651 -10.991 1.00 13.13 H new ATOM 0 HB2 GLN A 707 0.635 -2.258 -10.141 1.00 0.25 H new ATOM 0 HB3 GLN A 707 1.309 -2.810 -11.661 1.00 0.25 H new ATOM 0 HG2 GLN A 707 2.457 -3.413 -8.917 1.00 35.41 H new ATOM 0 HG3 GLN A 707 1.470 -4.509 -9.864 1.00 35.41 H new ATOM 0 HE21 GLN A 707 2.447 -5.456 -11.761 1.00 71.12 H new ATOM 0 HE22 GLN A 707 4.196 -5.386 -11.998 1.00 71.12 H new ATOM 1857 N GLU A 708 0.785 0.049 -11.672 1.00 51.42 N ATOM 1858 CA GLU A 708 0.271 0.938 -12.669 1.00 13.21 C ATOM 1859 C GLU A 708 -1.029 1.594 -12.264 1.00 23.41 C ATOM 1860 O GLU A 708 -1.961 0.933 -11.777 1.00 42.11 O ATOM 1861 CB GLU A 708 0.052 0.185 -13.995 1.00 24.34 C ATOM 1862 CG GLU A 708 -0.835 -1.048 -13.851 1.00 4.31 C ATOM 1863 CD GLU A 708 -1.227 -1.660 -15.161 1.00 4.13 C ATOM 1864 OE1 GLU A 708 -0.498 -2.537 -15.669 1.00 33.10 O ATOM 1865 OE2 GLU A 708 -2.289 -1.282 -15.705 1.00 1.33 O ATOM 0 H GLU A 708 0.106 -0.264 -10.978 1.00 51.42 H new ATOM 0 HA GLU A 708 1.018 1.723 -12.790 1.00 13.21 H new ATOM 0 HB2 GLU A 708 -0.397 0.864 -14.720 1.00 24.34 H new ATOM 0 HB3 GLU A 708 1.019 -0.117 -14.397 1.00 24.34 H new ATOM 0 HG2 GLU A 708 -0.312 -1.794 -13.253 1.00 4.31 H new ATOM 0 HG3 GLU A 708 -1.737 -0.775 -13.303 1.00 4.31 H new ATOM 1872 N GLU A 709 -1.056 2.888 -12.384 1.00 50.21 N ATOM 1873 CA GLU A 709 -2.297 3.608 -12.381 1.00 32.43 C ATOM 1874 C GLU A 709 -2.769 3.548 -13.818 1.00 3.53 C ATOM 1875 O GLU A 709 -2.002 3.861 -14.729 1.00 44.44 O ATOM 1876 CB GLU A 709 -2.082 5.064 -11.931 1.00 22.21 C ATOM 1877 CG GLU A 709 -3.349 5.926 -11.773 1.00 2.42 C ATOM 1878 CD GLU A 709 -4.103 6.196 -13.064 1.00 0.34 C ATOM 1879 OE1 GLU A 709 -3.613 6.985 -13.893 1.00 64.34 O ATOM 1880 OE2 GLU A 709 -5.203 5.642 -13.259 1.00 31.14 O ATOM 0 H GLU A 709 -0.226 3.472 -12.486 1.00 50.21 H new ATOM 0 HA GLU A 709 -3.024 3.183 -11.689 1.00 32.43 H new ATOM 0 HB2 GLU A 709 -1.555 5.052 -10.977 1.00 22.21 H new ATOM 0 HB3 GLU A 709 -1.425 5.551 -12.652 1.00 22.21 H new ATOM 0 HG2 GLU A 709 -4.022 5.432 -11.073 1.00 2.42 H new ATOM 0 HG3 GLU A 709 -3.069 6.880 -11.327 1.00 2.42 H new ATOM 1887 N ASP A 710 -3.981 3.145 -14.024 1.00 31.03 N ATOM 1888 CA ASP A 710 -4.500 2.971 -15.378 1.00 4.24 C ATOM 1889 C ASP A 710 -6.009 2.994 -15.362 1.00 4.32 C ATOM 1890 O ASP A 710 -6.663 3.498 -16.281 1.00 62.34 O ATOM 1891 CB ASP A 710 -4.019 1.626 -15.924 1.00 23.12 C ATOM 1892 CG ASP A 710 -4.487 1.333 -17.320 1.00 75.24 C ATOM 1893 OD1 ASP A 710 -3.777 1.694 -18.273 1.00 35.54 O ATOM 1894 OD2 ASP A 710 -5.546 0.693 -17.480 1.00 62.43 O ATOM 0 H ASP A 710 -4.646 2.925 -13.282 1.00 31.03 H new ATOM 0 HA ASP A 710 -4.141 3.783 -16.011 1.00 4.24 H new ATOM 0 HB2 ASP A 710 -2.929 1.606 -15.905 1.00 23.12 H new ATOM 0 HB3 ASP A 710 -4.364 0.832 -15.262 1.00 23.12 H new ATOM 1899 N ASN A 711 -6.551 2.465 -14.301 1.00 33.04 N ATOM 1900 CA ASN A 711 -7.988 2.332 -14.119 1.00 51.31 C ATOM 1901 C ASN A 711 -8.526 3.430 -13.194 1.00 43.23 C ATOM 1902 O ASN A 711 -9.536 3.246 -12.555 1.00 61.35 O ATOM 1903 CB ASN A 711 -8.289 0.938 -13.519 1.00 1.31 C ATOM 1904 CG ASN A 711 -7.618 0.708 -12.164 1.00 53.30 C ATOM 1905 OD1 ASN A 711 -8.177 1.008 -11.131 1.00 21.23 O ATOM 1906 ND2 ASN A 711 -6.422 0.163 -12.172 1.00 63.33 N ATOM 0 H ASN A 711 -6.005 2.104 -13.518 1.00 33.04 H new ATOM 0 HA ASN A 711 -8.482 2.436 -15.085 1.00 51.31 H new ATOM 0 HB2 ASN A 711 -9.367 0.823 -13.408 1.00 1.31 H new ATOM 0 HB3 ASN A 711 -7.957 0.170 -14.217 1.00 1.31 H new ATOM 0 HD21 ASN A 711 -5.938 -0.019 -11.292 1.00 63.33 H new ATOM 0 HD22 ASN A 711 -5.977 -0.078 -13.058 1.00 63.33 H new ATOM 1912 N SER A 712 -7.830 4.573 -13.152 1.00 54.25 N ATOM 1913 CA SER A 712 -8.156 5.760 -12.307 1.00 0.13 C ATOM 1914 C SER A 712 -7.862 5.516 -10.830 1.00 45.20 C ATOM 1915 O SER A 712 -8.053 6.372 -9.974 1.00 4.35 O ATOM 1916 CB SER A 712 -9.566 6.401 -12.571 1.00 22.02 C ATOM 1917 OG SER A 712 -10.675 5.527 -12.329 1.00 14.23 O ATOM 0 H SER A 712 -6.994 4.716 -13.719 1.00 54.25 H new ATOM 0 HA SER A 712 -7.466 6.536 -12.639 1.00 0.13 H new ATOM 0 HB2 SER A 712 -9.672 7.284 -11.941 1.00 22.02 H new ATOM 0 HB3 SER A 712 -9.608 6.741 -13.606 1.00 22.02 H new ATOM 0 HG SER A 712 -10.346 4.666 -11.995 1.00 14.23 H new ATOM 1923 N THR A 713 -7.389 4.352 -10.562 1.00 74.32 N ATOM 1924 CA THR A 713 -7.018 3.940 -9.273 1.00 52.42 C ATOM 1925 C THR A 713 -5.576 3.394 -9.358 1.00 73.40 C ATOM 1926 O THR A 713 -5.231 2.660 -10.301 1.00 30.14 O ATOM 1927 CB THR A 713 -7.999 2.846 -8.787 1.00 75.32 C ATOM 1928 OG1 THR A 713 -9.347 3.342 -8.895 1.00 4.21 O ATOM 1929 CG2 THR A 713 -7.740 2.474 -7.351 1.00 35.24 C ATOM 0 H THR A 713 -7.247 3.635 -11.273 1.00 74.32 H new ATOM 0 HA THR A 713 -7.056 4.766 -8.563 1.00 52.42 H new ATOM 0 HB THR A 713 -7.856 1.962 -9.408 1.00 75.32 H new ATOM 0 HG1 THR A 713 -9.974 2.653 -8.590 1.00 4.21 H new ATOM 0 HG21 THR A 713 -8.446 1.704 -7.042 1.00 35.24 H new ATOM 0 HG22 THR A 713 -6.723 2.095 -7.251 1.00 35.24 H new ATOM 0 HG23 THR A 713 -7.863 3.354 -6.719 1.00 35.24 H new ATOM 1935 N TYR A 714 -4.751 3.793 -8.421 1.00 2.14 N ATOM 1936 CA TYR A 714 -3.363 3.387 -8.366 1.00 32.00 C ATOM 1937 C TYR A 714 -3.262 2.023 -7.721 1.00 12.34 C ATOM 1938 O TYR A 714 -3.658 1.855 -6.584 1.00 63.11 O ATOM 1939 CB TYR A 714 -2.541 4.404 -7.540 1.00 1.41 C ATOM 1940 CG TYR A 714 -2.464 5.806 -8.123 1.00 2.31 C ATOM 1941 CD1 TYR A 714 -3.563 6.659 -8.105 1.00 64.04 C ATOM 1942 CD2 TYR A 714 -1.290 6.275 -8.694 1.00 41.30 C ATOM 1943 CE1 TYR A 714 -3.491 7.930 -8.638 1.00 24.42 C ATOM 1944 CE2 TYR A 714 -1.210 7.547 -9.225 1.00 4.12 C ATOM 1945 CZ TYR A 714 -2.314 8.372 -9.195 1.00 72.20 C ATOM 1946 OH TYR A 714 -2.236 9.652 -9.724 1.00 64.44 O ATOM 0 H TYR A 714 -5.026 4.418 -7.663 1.00 2.14 H new ATOM 0 HA TYR A 714 -2.966 3.347 -9.380 1.00 32.00 H new ATOM 0 HB2 TYR A 714 -2.972 4.467 -6.541 1.00 1.41 H new ATOM 0 HB3 TYR A 714 -1.527 4.020 -7.427 1.00 1.41 H new ATOM 0 HD1 TYR A 714 -4.490 6.320 -7.666 1.00 64.04 H new ATOM 0 HD2 TYR A 714 -0.422 5.633 -8.724 1.00 41.30 H new ATOM 0 HE1 TYR A 714 -4.357 8.576 -8.618 1.00 24.42 H new ATOM 0 HE2 TYR A 714 -0.286 7.894 -9.662 1.00 4.12 H new ATOM 0 HH TYR A 714 -1.335 9.806 -10.077 1.00 64.44 H new ATOM 1956 N ASN A 715 -2.738 1.065 -8.435 1.00 41.44 N ATOM 1957 CA ASN A 715 -2.596 -0.289 -7.898 1.00 41.14 C ATOM 1958 C ASN A 715 -1.195 -0.580 -7.431 1.00 43.23 C ATOM 1959 O ASN A 715 -0.197 -0.340 -8.147 1.00 60.03 O ATOM 1960 CB ASN A 715 -3.002 -1.345 -8.927 1.00 71.13 C ATOM 1961 CG ASN A 715 -4.500 -1.533 -9.094 1.00 45.23 C ATOM 1962 OD1 ASN A 715 -5.139 -0.857 -9.902 1.00 33.52 O ATOM 1963 ND2 ASN A 715 -5.079 -2.486 -8.360 1.00 13.21 N ATOM 0 H ASN A 715 -2.398 1.182 -9.390 1.00 41.44 H new ATOM 0 HA ASN A 715 -3.265 -0.338 -7.039 1.00 41.14 H new ATOM 0 HB2 ASN A 715 -2.575 -1.074 -9.892 1.00 71.13 H new ATOM 0 HB3 ASN A 715 -2.561 -2.299 -8.640 1.00 71.13 H new ATOM 0 HD21 ASN A 715 -6.077 -2.671 -8.460 1.00 13.21 H new ATOM 0 HD22 ASN A 715 -4.523 -3.029 -7.699 1.00 13.21 H new ATOM 1969 N PHE A 716 -1.127 -1.087 -6.227 1.00 42.52 N ATOM 1970 CA PHE A 716 0.096 -1.516 -5.605 1.00 54.43 C ATOM 1971 C PHE A 716 -0.033 -2.972 -5.238 1.00 15.12 C ATOM 1972 O PHE A 716 -1.117 -3.420 -4.869 1.00 12.20 O ATOM 1973 CB PHE A 716 0.374 -0.709 -4.324 1.00 14.23 C ATOM 1974 CG PHE A 716 0.630 0.750 -4.544 1.00 1.33 C ATOM 1975 CD1 PHE A 716 -0.415 1.639 -4.729 1.00 60.40 C ATOM 1976 CD2 PHE A 716 1.921 1.234 -4.553 1.00 62.23 C ATOM 1977 CE1 PHE A 716 -0.171 2.979 -4.925 1.00 53.41 C ATOM 1978 CE2 PHE A 716 2.168 2.570 -4.747 1.00 64.31 C ATOM 1979 CZ PHE A 716 1.119 3.443 -4.933 1.00 61.21 C ATOM 0 H PHE A 716 -1.948 -1.216 -5.635 1.00 42.52 H new ATOM 0 HA PHE A 716 0.918 -1.360 -6.304 1.00 54.43 H new ATOM 0 HB2 PHE A 716 -0.477 -0.817 -3.652 1.00 14.23 H new ATOM 0 HB3 PHE A 716 1.237 -1.143 -3.818 1.00 14.23 H new ATOM 0 HD1 PHE A 716 -1.432 1.277 -4.719 1.00 60.40 H new ATOM 0 HD2 PHE A 716 2.747 0.554 -4.406 1.00 62.23 H new ATOM 0 HE1 PHE A 716 -0.993 3.663 -5.072 1.00 53.41 H new ATOM 0 HE2 PHE A 716 3.184 2.936 -4.754 1.00 64.31 H new ATOM 0 HZ PHE A 716 1.313 4.494 -5.085 1.00 61.21 H new ATOM 1989 N ARG A 717 1.040 -3.713 -5.349 1.00 61.41 N ATOM 1990 CA ARG A 717 1.024 -5.105 -4.945 1.00 31.21 C ATOM 1991 C ARG A 717 1.724 -5.232 -3.666 1.00 11.20 C ATOM 1992 O ARG A 717 2.868 -4.851 -3.548 1.00 50.33 O ATOM 1993 CB ARG A 717 1.700 -6.012 -5.942 1.00 65.20 C ATOM 1994 CG ARG A 717 1.148 -5.887 -7.297 1.00 61.10 C ATOM 1995 CD ARG A 717 1.676 -6.966 -8.227 1.00 73.54 C ATOM 1996 NE ARG A 717 3.148 -6.998 -8.291 1.00 72.35 N ATOM 1997 CZ ARG A 717 3.844 -7.521 -9.311 1.00 44.44 C ATOM 1998 NH1 ARG A 717 3.212 -7.960 -10.395 1.00 33.43 N ATOM 1999 NH2 ARG A 717 5.170 -7.595 -9.250 1.00 53.45 N ATOM 0 H ARG A 717 1.934 -3.383 -5.713 1.00 61.41 H new ATOM 0 HA ARG A 717 -0.020 -5.408 -4.871 1.00 31.21 H new ATOM 0 HB2 ARG A 717 2.766 -5.785 -5.967 1.00 65.20 H new ATOM 0 HB3 ARG A 717 1.602 -7.045 -5.610 1.00 65.20 H new ATOM 0 HG2 ARG A 717 0.061 -5.947 -7.253 1.00 61.10 H new ATOM 0 HG3 ARG A 717 1.397 -4.906 -7.701 1.00 61.10 H new ATOM 0 HD2 ARG A 717 1.311 -7.937 -7.893 1.00 73.54 H new ATOM 0 HD3 ARG A 717 1.277 -6.803 -9.228 1.00 73.54 H new ATOM 0 HE ARG A 717 3.670 -6.598 -7.511 1.00 72.35 H new ATOM 0 HH11 ARG A 717 2.195 -7.899 -10.452 1.00 33.43 H new ATOM 0 HH12 ARG A 717 3.744 -8.357 -11.169 1.00 33.43 H new ATOM 0 HH21 ARG A 717 5.662 -7.253 -8.425 1.00 53.45 H new ATOM 0 HH22 ARG A 717 5.695 -7.994 -10.028 1.00 53.45 H new ATOM 2011 N TRP A 718 1.064 -5.739 -2.729 1.00 71.43 N ATOM 2012 CA TRP A 718 1.615 -5.903 -1.444 1.00 73.13 C ATOM 2013 C TRP A 718 1.772 -7.382 -1.199 1.00 34.40 C ATOM 2014 O TRP A 718 0.801 -8.103 -1.139 1.00 64.13 O ATOM 2015 CB TRP A 718 0.656 -5.312 -0.419 1.00 50.02 C ATOM 2016 CG TRP A 718 1.245 -5.134 0.932 1.00 24.24 C ATOM 2017 CD1 TRP A 718 1.729 -6.092 1.755 1.00 73.11 C ATOM 2018 CD2 TRP A 718 1.382 -3.909 1.621 1.00 52.32 C ATOM 2019 NE1 TRP A 718 2.183 -5.530 2.918 1.00 3.21 N ATOM 2020 CE2 TRP A 718 1.976 -4.190 2.858 1.00 63.10 C ATOM 2021 CE3 TRP A 718 1.065 -2.591 1.307 1.00 62.23 C ATOM 2022 CZ2 TRP A 718 2.255 -3.212 3.775 1.00 23.04 C ATOM 2023 CZ3 TRP A 718 1.343 -1.615 2.222 1.00 62.05 C ATOM 2024 CH2 TRP A 718 1.932 -1.929 3.440 1.00 24.13 C ATOM 0 H TRP A 718 0.102 -6.064 -2.820 1.00 71.43 H new ATOM 0 HA TRP A 718 2.579 -5.402 -1.363 1.00 73.13 H new ATOM 0 HB2 TRP A 718 0.305 -4.345 -0.781 1.00 50.02 H new ATOM 0 HB3 TRP A 718 -0.218 -5.959 -0.340 1.00 50.02 H new ATOM 0 HD1 TRP A 718 1.754 -7.148 1.528 1.00 73.11 H new ATOM 0 HE1 TRP A 718 2.606 -6.033 3.698 1.00 3.21 H new ATOM 0 HE3 TRP A 718 0.609 -2.345 0.360 1.00 62.23 H new ATOM 0 HZ2 TRP A 718 2.712 -3.446 4.725 1.00 23.04 H new ATOM 0 HZ3 TRP A 718 1.102 -0.587 1.995 1.00 62.05 H new ATOM 0 HH2 TRP A 718 2.140 -1.135 4.142 1.00 24.13 H new ATOM 2035 N TYR A 719 2.971 -7.827 -1.076 1.00 24.43 N ATOM 2036 CA TYR A 719 3.222 -9.214 -0.779 1.00 74.23 C ATOM 2037 C TYR A 719 3.401 -9.349 0.707 1.00 50.21 C ATOM 2038 O TYR A 719 4.417 -8.948 1.234 1.00 0.53 O ATOM 2039 CB TYR A 719 4.463 -9.711 -1.531 1.00 73.30 C ATOM 2040 CG TYR A 719 4.291 -9.773 -3.039 1.00 13.15 C ATOM 2041 CD1 TYR A 719 4.462 -8.647 -3.848 1.00 44.22 C ATOM 2042 CD2 TYR A 719 3.961 -10.967 -3.652 1.00 61.21 C ATOM 2043 CE1 TYR A 719 4.309 -8.729 -5.218 1.00 44.14 C ATOM 2044 CE2 TYR A 719 3.804 -11.052 -5.015 1.00 51.33 C ATOM 2045 CZ TYR A 719 3.979 -9.936 -5.795 1.00 74.40 C ATOM 2046 OH TYR A 719 3.822 -10.027 -7.160 1.00 44.41 O ATOM 0 H TYR A 719 3.809 -7.254 -1.175 1.00 24.43 H new ATOM 0 HA TYR A 719 2.381 -9.826 -1.105 1.00 74.23 H new ATOM 0 HB2 TYR A 719 5.302 -9.055 -1.298 1.00 73.30 H new ATOM 0 HB3 TYR A 719 4.723 -10.704 -1.165 1.00 73.30 H new ATOM 0 HD1 TYR A 719 4.717 -7.700 -3.396 1.00 44.22 H new ATOM 0 HD2 TYR A 719 3.824 -11.851 -3.048 1.00 61.21 H new ATOM 0 HE1 TYR A 719 4.447 -7.852 -5.833 1.00 44.14 H new ATOM 0 HE2 TYR A 719 3.543 -11.995 -5.472 1.00 51.33 H new ATOM 0 HH TYR A 719 3.591 -10.948 -7.402 1.00 44.41 H new ATOM 2056 N THR A 720 2.404 -9.873 1.384 1.00 21.54 N ATOM 2057 CA THR A 720 2.442 -9.953 2.825 1.00 71.25 C ATOM 2058 C THR A 720 2.037 -11.325 3.318 1.00 41.44 C ATOM 2059 O THR A 720 1.146 -11.976 2.755 1.00 63.11 O ATOM 2060 CB THR A 720 1.562 -8.861 3.515 1.00 75.22 C ATOM 2061 OG1 THR A 720 1.706 -8.933 4.939 1.00 74.43 O ATOM 2062 CG2 THR A 720 0.089 -9.014 3.156 1.00 25.22 C ATOM 0 H THR A 720 1.557 -10.250 0.959 1.00 21.54 H new ATOM 0 HA THR A 720 3.479 -9.768 3.104 1.00 71.25 H new ATOM 0 HB THR A 720 1.908 -7.892 3.154 1.00 75.22 H new ATOM 0 HG1 THR A 720 2.348 -8.255 5.238 1.00 74.43 H new ATOM 0 HG21 THR A 720 -0.490 -8.237 3.655 1.00 25.22 H new ATOM 0 HG22 THR A 720 -0.034 -8.922 2.077 1.00 25.22 H new ATOM 0 HG23 THR A 720 -0.264 -9.993 3.479 1.00 25.22 H new ATOM 2068 N SER A 721 2.704 -11.759 4.344 1.00 14.43 N ATOM 2069 CA SER A 721 2.434 -13.008 4.986 1.00 23.24 C ATOM 2070 C SER A 721 1.059 -12.959 5.690 1.00 73.42 C ATOM 2071 O SER A 721 0.411 -13.986 5.892 1.00 23.23 O ATOM 2072 CB SER A 721 3.544 -13.261 5.980 1.00 53.44 C ATOM 2073 OG SER A 721 4.809 -13.174 5.327 1.00 12.22 O ATOM 0 H SER A 721 3.472 -11.239 4.769 1.00 14.43 H new ATOM 0 HA SER A 721 2.397 -13.818 4.257 1.00 23.24 H new ATOM 0 HB2 SER A 721 3.492 -12.533 6.790 1.00 53.44 H new ATOM 0 HB3 SER A 721 3.424 -14.247 6.429 1.00 53.44 H new ATOM 0 HG SER A 721 5.522 -13.384 5.966 1.00 12.22 H new ATOM 2079 N TYR A 722 0.608 -11.744 6.029 1.00 22.45 N ATOM 2080 CA TYR A 722 -0.662 -11.540 6.706 1.00 3.53 C ATOM 2081 C TYR A 722 -1.843 -11.792 5.779 1.00 2.44 C ATOM 2082 O TYR A 722 -2.976 -11.859 6.227 1.00 70.30 O ATOM 2083 CB TYR A 722 -0.747 -10.136 7.301 1.00 10.13 C ATOM 2084 CG TYR A 722 0.274 -9.857 8.392 1.00 22.14 C ATOM 2085 CD1 TYR A 722 1.594 -9.549 8.086 1.00 71.40 C ATOM 2086 CD2 TYR A 722 -0.091 -9.901 9.731 1.00 64.40 C ATOM 2087 CE1 TYR A 722 2.516 -9.297 9.078 1.00 61.44 C ATOM 2088 CE2 TYR A 722 0.828 -9.646 10.727 1.00 51.24 C ATOM 2089 CZ TYR A 722 2.131 -9.345 10.394 1.00 12.30 C ATOM 2090 OH TYR A 722 3.052 -9.086 11.382 1.00 3.43 O ATOM 0 H TYR A 722 1.118 -10.882 5.838 1.00 22.45 H new ATOM 0 HA TYR A 722 -0.712 -12.266 7.517 1.00 3.53 H new ATOM 0 HB2 TYR A 722 -0.616 -9.407 6.502 1.00 10.13 H new ATOM 0 HB3 TYR A 722 -1.747 -9.986 7.708 1.00 10.13 H new ATOM 0 HD1 TYR A 722 1.903 -9.506 7.052 1.00 71.40 H new ATOM 0 HD2 TYR A 722 -1.111 -10.139 9.997 1.00 64.40 H new ATOM 0 HE1 TYR A 722 3.538 -9.062 8.821 1.00 61.44 H new ATOM 0 HE2 TYR A 722 0.528 -9.682 11.764 1.00 51.24 H new ATOM 0 HH TYR A 722 2.621 -9.159 12.259 1.00 3.43 H new ATOM 2100 N ALA A 723 -1.569 -11.918 4.487 1.00 42.45 N ATOM 2101 CA ALA A 723 -2.609 -12.203 3.507 1.00 25.44 C ATOM 2102 C ALA A 723 -2.684 -13.702 3.255 1.00 20.33 C ATOM 2103 O ALA A 723 -3.401 -14.163 2.368 1.00 34.44 O ATOM 2104 CB ALA A 723 -2.343 -11.462 2.207 1.00 71.35 C ATOM 0 H ALA A 723 -0.633 -11.827 4.093 1.00 42.45 H new ATOM 0 HA ALA A 723 -3.564 -11.859 3.904 1.00 25.44 H new ATOM 0 HB1 ALA A 723 -3.132 -11.690 1.490 1.00 71.35 H new ATOM 0 HB2 ALA A 723 -2.324 -10.389 2.397 1.00 71.35 H new ATOM 0 HB3 ALA A 723 -1.382 -11.775 1.800 1.00 71.35 H new ATOM 2110 N CYS A 724 -1.957 -14.446 4.046 1.00 3.53 N ATOM 2111 CA CYS A 724 -1.923 -15.884 3.920 1.00 34.14 C ATOM 2112 C CYS A 724 -2.663 -16.542 5.069 1.00 1.11 C ATOM 2113 O CYS A 724 -2.409 -16.227 6.241 1.00 40.21 O ATOM 2114 CB CYS A 724 -0.481 -16.383 3.888 1.00 72.15 C ATOM 2115 SG CYS A 724 0.481 -15.764 2.479 1.00 34.33 S ATOM 0 H CYS A 724 -1.372 -14.076 4.795 1.00 3.53 H new ATOM 0 HA CYS A 724 -2.415 -16.151 2.985 1.00 34.14 H new ATOM 0 HB2 CYS A 724 0.016 -16.088 4.812 1.00 72.15 H new ATOM 0 HB3 CYS A 724 -0.485 -17.473 3.862 1.00 72.15 H new ATOM 2120 N PRO A 725 -3.623 -17.425 4.753 1.00 71.33 N ATOM 2121 CA PRO A 725 -4.334 -18.187 5.751 1.00 22.42 C ATOM 2122 C PRO A 725 -3.509 -19.401 6.210 1.00 22.14 C ATOM 2123 O PRO A 725 -2.789 -19.293 7.230 1.00 37.25 O ATOM 2124 CB PRO A 725 -5.617 -18.622 5.030 1.00 33.12 C ATOM 2125 CG PRO A 725 -5.263 -18.662 3.579 1.00 73.24 C ATOM 2126 CD PRO A 725 -4.105 -17.714 3.381 1.00 41.22 C ATOM 2127 OXT PRO A 725 -3.563 -20.457 5.546 1.00 37.25 O ATOM 0 HA PRO A 725 -4.537 -17.615 6.657 1.00 22.42 H new ATOM 0 HB2 PRO A 725 -5.952 -19.598 5.380 1.00 33.12 H new ATOM 0 HB3 PRO A 725 -6.430 -17.920 5.217 1.00 33.12 H new ATOM 0 HG2 PRO A 725 -4.990 -19.673 3.276 1.00 73.24 H new ATOM 0 HG3 PRO A 725 -6.114 -18.365 2.966 1.00 73.24 H new ATOM 0 HD2 PRO A 725 -3.322 -18.166 2.772 1.00 41.22 H new ATOM 0 HD3 PRO A 725 -4.420 -16.804 2.871 1.00 41.22 H new TER 2135 PRO A 725