USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1122 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 30 LYS NZ :NH3+ 169:sc= 0.636 (180deg=0.139) USER MOD Set 1.2: A 127 SER OG : rot -170:sc= -0.718 USER MOD Set 2.1: A 27 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 59 ASN : amide:sc= -2.21 K(o=-2.2,f=-4.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 159:sc= -0.014 (180deg=-0.275) USER MOD Single : A 4 HIS :FLIP no HD1:sc= -2.64! C(o=-4.8!,f=-2.6!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 42:sc= 0.402 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -47:sc= 1.06 USER MOD Single : A 14 ASN : amide:sc= -0.72 X(o=-0.72,f=-1) USER MOD Single : A 18 SER OG : rot 180:sc= -0.133 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -174:sc= 0.829 (180deg=0.802) USER MOD Single : A 34 SER OG : rot -69:sc= 1.75 USER MOD Single : A 41 SER OG : rot 89:sc= 0.684 USER MOD Single : A 45 GLN : amide:sc=-0.00584 X(o=-0.0058,f=-0.0058) USER MOD Single : A 46 THR OG1 : rot 118:sc= 0.361 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0485 K(o=-0.048,f=-0.63) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 89:sc= 0.257 USER MOD Single : A 62 THR OG1 : rot -68:sc= -2.55! USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.296 K(o=0.3,f=-1) USER MOD Single : A 72 LYS NZ :NH3+ -146:sc= 1.53 (180deg=-0.0485) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -1.1 K(o=-1.1,f=-4.3!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 137:sc= -0.501 USER MOD Single : A 85 ASN :FLIP amide:sc= 0.977 F(o=-0.039,f=0.98) USER MOD Single : A 86 TYR OH : rot 180:sc=-0.00127 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0526 USER MOD Single : A 95 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.18) USER MOD Single : A 98 THR OG1 : rot 90:sc= 1.41 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0384 K(o=-0.038,f=-0.98) USER MOD Single : A 106 SER OG : rot 180:sc= 0.00051 USER MOD Single : A 108 TYR OH : rot 90:sc= 0.821 USER MOD Single : A 110 SER OG : rot 80:sc= 1.02 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0.25) USER MOD Single : A 125 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.218) USER MOD Single : A 129 ASN : amide:sc=-0.00343 K(o=-0.0034,f=-1.5) USER MOD Single : A 132 GLN : amide:sc= -0.0745 K(o=-0.074,f=-3.7!) USER MOD Single : A 141 ASN : amide:sc= 0 K(o=0,f=-0.95) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.285 2.918 5.776 1.00 12.33 N ATOM 2 CA MET A 1 -2.670 1.597 5.724 1.00 44.33 C ATOM 3 C MET A 1 -1.573 1.550 4.665 1.00 41.54 C ATOM 4 O MET A 1 -1.602 0.713 3.763 1.00 54.03 O ATOM 5 CB MET A 1 -3.726 0.530 5.429 1.00 44.43 C ATOM 6 CG MET A 1 -4.493 0.775 4.140 1.00 51.14 C ATOM 7 SD MET A 1 -6.244 1.096 4.424 1.00 14.43 S ATOM 8 CE MET A 1 -6.980 -0.360 3.685 1.00 12.15 C ATOM 0 H1 MET A 1 -4.225 2.846 6.216 1.00 12.33 H new ATOM 0 H2 MET A 1 -2.687 3.557 6.338 1.00 12.33 H new ATOM 0 H3 MET A 1 -3.382 3.294 4.811 1.00 12.33 H new ATOM 0 HA MET A 1 -2.221 1.394 6.696 1.00 44.33 H new ATOM 0 HB2 MET A 1 -3.241 -0.444 5.374 1.00 44.43 H new ATOM 0 HB3 MET A 1 -4.431 0.489 6.259 1.00 44.43 H new ATOM 0 HG2 MET A 1 -4.053 1.623 3.615 1.00 51.14 H new ATOM 0 HG3 MET A 1 -4.388 -0.093 3.489 1.00 51.14 H new ATOM 0 HE1 MET A 1 -8.064 -0.308 3.782 1.00 12.15 H new ATOM 0 HE2 MET A 1 -6.711 -0.408 2.630 1.00 12.15 H new ATOM 0 HE3 MET A 1 -6.613 -1.251 4.193 1.00 12.15 H new ATOM 18 N VAL A 2 -0.606 2.455 4.780 1.00 41.32 N ATOM 19 CA VAL A 2 0.501 2.516 3.833 1.00 52.45 C ATOM 20 C VAL A 2 1.774 3.014 4.507 1.00 44.24 C ATOM 21 O VAL A 2 1.740 3.669 5.549 1.00 54.24 O ATOM 22 CB VAL A 2 0.170 3.436 2.642 1.00 63.32 C ATOM 23 CG1 VAL A 2 -0.592 2.670 1.571 1.00 13.03 C ATOM 24 CG2 VAL A 2 -0.622 4.648 3.109 1.00 60.53 C ATOM 0 H VAL A 2 -0.567 3.156 5.520 1.00 41.32 H new ATOM 0 HA VAL A 2 0.661 1.502 3.466 1.00 52.45 H new ATOM 0 HB VAL A 2 1.105 3.788 2.206 1.00 63.32 H new ATOM 0 HG11 VAL A 2 -0.817 3.336 0.738 1.00 13.03 H new ATOM 0 HG12 VAL A 2 0.016 1.838 1.216 1.00 13.03 H new ATOM 0 HG13 VAL A 2 -1.522 2.286 1.990 1.00 13.03 H new ATOM 0 HG21 VAL A 2 -0.847 5.287 2.255 1.00 60.53 H new ATOM 0 HG22 VAL A 2 -1.553 4.319 3.571 1.00 60.53 H new ATOM 0 HG23 VAL A 2 -0.035 5.208 3.836 1.00 60.53 H new ATOM 34 N PRO A 3 2.928 2.698 3.899 1.00 33.24 N ATOM 35 CA PRO A 3 4.235 3.104 4.423 1.00 63.11 C ATOM 36 C PRO A 3 4.469 4.606 4.299 1.00 75.32 C ATOM 37 O PRO A 3 5.478 5.129 4.772 1.00 62.52 O ATOM 38 CB PRO A 3 5.224 2.335 3.543 1.00 21.32 C ATOM 39 CG PRO A 3 4.488 2.090 2.271 1.00 21.53 C ATOM 40 CD PRO A 3 3.044 1.920 2.655 1.00 60.33 C ATOM 0 HA PRO A 3 4.332 2.888 5.487 1.00 63.11 H new ATOM 0 HB2 PRO A 3 6.132 2.913 3.370 1.00 21.32 H new ATOM 0 HB3 PRO A 3 5.526 1.399 4.012 1.00 21.32 H new ATOM 0 HG2 PRO A 3 4.613 2.924 1.581 1.00 21.53 H new ATOM 0 HG3 PRO A 3 4.865 1.200 1.767 1.00 21.53 H new ATOM 0 HD2 PRO A 3 2.375 2.297 1.881 1.00 60.33 H new ATOM 0 HD3 PRO A 3 2.791 0.872 2.812 1.00 60.33 H new ATOM 48 N HIS A 4 3.528 5.295 3.660 1.00 4.12 N ATOM 49 CA HIS A 4 3.632 6.738 3.475 1.00 54.20 C ATOM 50 C HIS A 4 3.903 7.438 4.803 1.00 13.41 C ATOM 51 O HIS A 4 4.463 8.535 4.837 1.00 72.32 O ATOM 52 CB HIS A 4 2.349 7.286 2.849 1.00 51.34 C ATOM 53 CG HIS A 4 1.319 7.697 3.855 1.00 32.33 C ATOM 54 ND1 HIS A 4 0.704 6.989 4.832 1.00 30.43 N flip ATOM 55 CD2 HIS A 4 0.806 8.975 3.929 1.00 42.20 C flip ATOM 56 CE1 HIS A 4 -0.159 7.844 5.472 1.00 71.10 C flip ATOM 57 NE2 HIS A 4 -0.078 9.036 4.909 1.00 21.05 N flip ATOM 0 H HIS A 4 2.686 4.878 3.262 1.00 4.12 H new ATOM 0 HA HIS A 4 4.468 6.934 2.804 1.00 54.20 H new ATOM 0 HB2 HIS A 4 2.597 8.144 2.224 1.00 51.34 H new ATOM 0 HB3 HIS A 4 1.922 6.527 2.193 1.00 51.34 H new ATOM 0 HD2 HIS A 4 1.083 9.797 3.286 1.00 42.20 H new ATOM 0 HE1 HIS A 4 -0.800 7.584 6.301 1.00 71.10 H new ATOM 0 HE2 HIS A 4 -0.608 9.863 5.184 1.00 21.05 H new ATOM 65 N THR A 5 3.501 6.798 5.897 1.00 11.40 N ATOM 66 CA THR A 5 3.699 7.360 7.227 1.00 15.12 C ATOM 67 C THR A 5 5.044 6.939 7.808 1.00 74.23 C ATOM 68 O THR A 5 5.665 7.684 8.566 1.00 1.40 O ATOM 69 CB THR A 5 2.578 6.928 8.192 1.00 51.04 C ATOM 70 OG1 THR A 5 2.673 7.666 9.415 1.00 53.20 O ATOM 71 CG2 THR A 5 2.661 5.438 8.485 1.00 23.30 C ATOM 0 H THR A 5 3.036 5.890 5.888 1.00 11.40 H new ATOM 0 HA THR A 5 3.677 8.444 7.118 1.00 15.12 H new ATOM 0 HB THR A 5 1.619 7.136 7.717 1.00 51.04 H new ATOM 0 HG1 THR A 5 1.956 7.387 10.022 1.00 53.20 H new ATOM 0 HG21 THR A 5 1.860 5.156 9.168 1.00 23.30 H new ATOM 0 HG22 THR A 5 2.559 4.878 7.555 1.00 23.30 H new ATOM 0 HG23 THR A 5 3.624 5.210 8.942 1.00 23.30 H new ATOM 79 N LEU A 6 5.489 5.740 7.447 1.00 12.31 N ATOM 80 CA LEU A 6 6.762 5.220 7.932 1.00 23.51 C ATOM 81 C LEU A 6 7.909 6.157 7.567 1.00 73.03 C ATOM 82 O LEU A 6 8.859 6.320 8.332 1.00 32.32 O ATOM 83 CB LEU A 6 7.021 3.828 7.351 1.00 2.33 C ATOM 84 CG LEU A 6 7.695 2.825 8.288 1.00 61.32 C ATOM 85 CD1 LEU A 6 8.963 3.417 8.882 1.00 43.40 C ATOM 86 CD2 LEU A 6 6.737 2.397 9.390 1.00 52.21 C ATOM 0 H LEU A 6 4.987 5.111 6.821 1.00 12.31 H new ATOM 0 HA LEU A 6 6.707 5.150 9.018 1.00 23.51 H new ATOM 0 HB2 LEU A 6 6.069 3.409 7.027 1.00 2.33 H new ATOM 0 HB3 LEU A 6 7.641 3.937 6.461 1.00 2.33 H new ATOM 0 HG LEU A 6 7.968 1.943 7.708 1.00 61.32 H new ATOM 0 HD11 LEU A 6 9.428 2.688 9.546 1.00 43.40 H new ATOM 0 HD12 LEU A 6 9.656 3.672 8.080 1.00 43.40 H new ATOM 0 HD13 LEU A 6 8.715 4.316 9.446 1.00 43.40 H new ATOM 0 HD21 LEU A 6 7.234 1.683 10.047 1.00 52.21 H new ATOM 0 HD22 LEU A 6 6.433 3.270 9.967 1.00 52.21 H new ATOM 0 HD23 LEU A 6 5.857 1.930 8.947 1.00 52.21 H new ATOM 98 N SER A 7 7.811 6.773 6.393 1.00 64.12 N ATOM 99 CA SER A 7 8.841 7.694 5.925 1.00 71.50 C ATOM 100 C SER A 7 8.585 9.105 6.446 1.00 61.34 C ATOM 101 O SER A 7 9.506 9.914 6.560 1.00 41.22 O ATOM 102 CB SER A 7 8.890 7.703 4.396 1.00 71.11 C ATOM 103 OG SER A 7 7.613 7.979 3.846 1.00 22.54 O ATOM 0 H SER A 7 7.030 6.651 5.749 1.00 64.12 H new ATOM 0 HA SER A 7 9.802 7.352 6.310 1.00 71.50 H new ATOM 0 HB2 SER A 7 9.605 8.452 4.056 1.00 71.11 H new ATOM 0 HB3 SER A 7 9.244 6.737 4.035 1.00 71.11 H new ATOM 0 HG SER A 7 7.672 7.981 2.868 1.00 22.54 H new ATOM 109 N THR A 8 7.326 9.393 6.760 1.00 1.44 N ATOM 110 CA THR A 8 6.947 10.706 7.268 1.00 71.03 C ATOM 111 C THR A 8 7.820 11.112 8.449 1.00 3.21 C ATOM 112 O THR A 8 8.063 12.298 8.676 1.00 14.35 O ATOM 113 CB THR A 8 5.469 10.735 7.702 1.00 24.12 C ATOM 114 OG1 THR A 8 4.623 10.454 6.582 1.00 45.05 O ATOM 115 CG2 THR A 8 5.105 12.089 8.292 1.00 3.01 C ATOM 0 H THR A 8 6.552 8.735 6.672 1.00 1.44 H new ATOM 0 HA THR A 8 7.093 11.414 6.452 1.00 71.03 H new ATOM 0 HB THR A 8 5.323 9.972 8.467 1.00 24.12 H new ATOM 0 HG1 THR A 8 5.006 9.720 6.058 1.00 45.05 H new ATOM 0 HG21 THR A 8 4.057 12.086 8.591 1.00 3.01 H new ATOM 0 HG22 THR A 8 5.730 12.286 9.163 1.00 3.01 H new ATOM 0 HG23 THR A 8 5.267 12.867 7.545 1.00 3.01 H new ATOM 123 N LEU A 9 8.292 10.122 9.198 1.00 34.34 N ATOM 124 CA LEU A 9 9.140 10.376 10.358 1.00 41.25 C ATOM 125 C LEU A 9 10.616 10.326 9.974 1.00 75.30 C ATOM 126 O LEU A 9 10.979 9.782 8.931 1.00 30.51 O ATOM 127 CB LEU A 9 8.852 9.355 11.459 1.00 24.50 C ATOM 128 CG LEU A 9 7.604 9.612 12.304 1.00 4.11 C ATOM 129 CD1 LEU A 9 7.685 10.975 12.973 1.00 11.34 C ATOM 130 CD2 LEU A 9 6.350 9.509 11.448 1.00 3.34 C ATOM 0 H LEU A 9 8.102 9.135 9.023 1.00 34.34 H new ATOM 0 HA LEU A 9 8.914 11.375 10.731 1.00 41.25 H new ATOM 0 HB2 LEU A 9 8.758 8.371 10.999 1.00 24.50 H new ATOM 0 HB3 LEU A 9 9.715 9.315 12.124 1.00 24.50 H new ATOM 0 HG LEU A 9 7.552 8.851 13.082 1.00 4.11 H new ATOM 0 HD11 LEU A 9 6.788 11.141 13.570 1.00 11.34 H new ATOM 0 HD12 LEU A 9 8.563 11.012 13.618 1.00 11.34 H new ATOM 0 HD13 LEU A 9 7.762 11.750 12.211 1.00 11.34 H new ATOM 0 HD21 LEU A 9 5.471 9.695 12.066 1.00 3.34 H new ATOM 0 HD22 LEU A 9 6.394 10.248 10.648 1.00 3.34 H new ATOM 0 HD23 LEU A 9 6.285 8.510 11.016 1.00 3.34 H new ATOM 142 N LYS A 10 11.463 10.895 10.825 1.00 75.30 N ATOM 143 CA LYS A 10 12.899 10.912 10.578 1.00 5.24 C ATOM 144 C LYS A 10 13.641 10.086 11.624 1.00 21.32 C ATOM 145 O LYS A 10 13.027 9.364 12.411 1.00 51.12 O ATOM 146 CB LYS A 10 13.422 12.351 10.586 1.00 75.31 C ATOM 147 CG LYS A 10 13.457 12.978 11.969 1.00 74.12 C ATOM 148 CD LYS A 10 13.936 14.419 11.916 1.00 72.14 C ATOM 149 CE LYS A 10 14.428 14.893 13.275 1.00 54.25 C ATOM 150 NZ LYS A 10 15.406 16.009 13.152 1.00 52.33 N ATOM 0 H LYS A 10 11.179 11.351 11.692 1.00 75.30 H new ATOM 0 HA LYS A 10 13.078 10.471 9.597 1.00 5.24 H new ATOM 0 HB2 LYS A 10 14.427 12.366 10.164 1.00 75.31 H new ATOM 0 HB3 LYS A 10 12.794 12.960 9.936 1.00 75.31 H new ATOM 0 HG2 LYS A 10 12.462 12.941 12.412 1.00 74.12 H new ATOM 0 HG3 LYS A 10 14.116 12.398 12.616 1.00 74.12 H new ATOM 0 HD2 LYS A 10 14.739 14.510 11.185 1.00 72.14 H new ATOM 0 HD3 LYS A 10 13.123 15.062 11.578 1.00 72.14 H new ATOM 0 HE2 LYS A 10 13.579 15.219 13.875 1.00 54.25 H new ATOM 0 HE3 LYS A 10 14.892 14.060 13.804 1.00 54.25 H new ATOM 0 HZ1 LYS A 10 15.717 16.304 14.100 1.00 52.33 H new ATOM 0 HZ2 LYS A 10 16.228 15.691 12.601 1.00 52.33 H new ATOM 0 HZ3 LYS A 10 14.956 16.813 12.670 1.00 52.33 H new ATOM 164 N THR A 11 14.966 10.196 11.629 1.00 51.30 N ATOM 165 CA THR A 11 15.791 9.460 12.578 1.00 30.20 C ATOM 166 C THR A 11 16.350 10.384 13.653 1.00 3.14 C ATOM 167 O THR A 11 16.645 11.550 13.391 1.00 22.33 O ATOM 168 CB THR A 11 16.959 8.747 11.872 1.00 64.34 C ATOM 169 OG1 THR A 11 17.909 9.710 11.402 1.00 70.04 O ATOM 170 CG2 THR A 11 16.457 7.911 10.704 1.00 52.11 C ATOM 0 H THR A 11 15.491 10.789 10.986 1.00 51.30 H new ATOM 0 HA THR A 11 15.147 8.714 13.043 1.00 30.20 H new ATOM 0 HB THR A 11 17.439 8.085 12.592 1.00 64.34 H new ATOM 0 HG1 THR A 11 17.439 10.432 10.935 1.00 70.04 H new ATOM 0 HG21 THR A 11 17.300 7.417 10.221 1.00 52.11 H new ATOM 0 HG22 THR A 11 15.757 7.160 11.069 1.00 52.11 H new ATOM 0 HG23 THR A 11 15.954 8.557 9.984 1.00 52.11 H new ATOM 178 N ALA A 12 16.495 9.856 14.864 1.00 14.05 N ATOM 179 CA ALA A 12 17.021 10.634 15.979 1.00 25.41 C ATOM 180 C ALA A 12 18.269 11.407 15.567 1.00 3.53 C ATOM 181 O ALA A 12 18.581 12.452 16.140 1.00 73.11 O ATOM 182 CB ALA A 12 17.328 9.724 17.159 1.00 21.52 C ATOM 0 H ALA A 12 16.256 8.892 15.098 1.00 14.05 H new ATOM 0 HA ALA A 12 16.260 11.355 16.278 1.00 25.41 H new ATOM 0 HB1 ALA A 12 17.720 10.318 17.984 1.00 21.52 H new ATOM 0 HB2 ALA A 12 16.415 9.219 17.476 1.00 21.52 H new ATOM 0 HB3 ALA A 12 18.069 8.981 16.863 1.00 21.52 H new ATOM 188 N ASP A 13 18.980 10.888 14.572 1.00 11.42 N ATOM 189 CA ASP A 13 20.194 11.531 14.083 1.00 2.34 C ATOM 190 C ASP A 13 19.860 12.789 13.288 1.00 45.35 C ATOM 191 O ASP A 13 20.212 13.899 13.686 1.00 61.22 O ATOM 192 CB ASP A 13 20.996 10.561 13.215 1.00 42.04 C ATOM 193 CG ASP A 13 21.511 9.371 14.000 1.00 4.01 C ATOM 194 OD1 ASP A 13 22.498 9.536 14.747 1.00 0.03 O ATOM 195 OD2 ASP A 13 20.928 8.274 13.867 1.00 44.41 O ATOM 0 H ASP A 13 18.737 10.024 14.088 1.00 11.42 H new ATOM 0 HA ASP A 13 20.797 11.818 14.945 1.00 2.34 H new ATOM 0 HB2 ASP A 13 20.370 10.208 12.396 1.00 42.04 H new ATOM 0 HB3 ASP A 13 21.838 11.089 12.768 1.00 42.04 H new ATOM 200 N ASN A 14 19.180 12.607 12.160 1.00 5.12 N ATOM 201 CA ASN A 14 18.801 13.727 11.307 1.00 15.53 C ATOM 202 C ASN A 14 18.302 13.235 9.952 1.00 35.13 C ATOM 203 O ASN A 14 17.588 13.947 9.246 1.00 51.12 O ATOM 204 CB ASN A 14 19.987 14.673 11.113 1.00 5.22 C ATOM 205 CG ASN A 14 19.789 16.002 11.816 1.00 54.43 C ATOM 206 OD1 ASN A 14 20.571 16.379 12.688 1.00 43.41 O ATOM 207 ND2 ASN A 14 18.737 16.720 11.438 1.00 71.43 N ATOM 0 H ASN A 14 18.881 11.695 11.816 1.00 5.12 H new ATOM 0 HA ASN A 14 17.991 14.267 11.798 1.00 15.53 H new ATOM 0 HB2 ASN A 14 20.893 14.197 11.490 1.00 5.22 H new ATOM 0 HB3 ASN A 14 20.138 14.848 10.048 1.00 5.22 H new ATOM 0 HD21 ASN A 14 18.552 17.623 11.875 1.00 71.43 H new ATOM 0 HD22 ASN A 14 18.114 16.369 10.710 1.00 71.43 H new ATOM 214 N ARG A 15 18.682 12.012 9.597 1.00 53.02 N ATOM 215 CA ARG A 15 18.274 11.424 8.327 1.00 54.14 C ATOM 216 C ARG A 15 16.878 10.816 8.433 1.00 63.44 C ATOM 217 O ARG A 15 16.378 10.535 9.522 1.00 53.12 O ATOM 218 CB ARG A 15 19.276 10.355 7.890 1.00 63.52 C ATOM 219 CG ARG A 15 20.277 10.844 6.856 1.00 71.24 C ATOM 220 CD ARG A 15 20.888 9.687 6.081 1.00 73.15 C ATOM 221 NE ARG A 15 21.930 10.134 5.160 1.00 12.22 N ATOM 222 CZ ARG A 15 22.485 9.351 4.242 1.00 1.01 C ATOM 223 NH1 ARG A 15 22.100 8.088 4.122 1.00 14.13 N ATOM 224 NH2 ARG A 15 23.428 9.831 3.441 1.00 13.11 N ATOM 0 H ARG A 15 19.272 11.409 10.171 1.00 53.02 H new ATOM 0 HA ARG A 15 18.250 12.217 7.579 1.00 54.14 H new ATOM 0 HB2 ARG A 15 19.817 9.997 8.766 1.00 63.52 H new ATOM 0 HB3 ARG A 15 18.731 9.504 7.482 1.00 63.52 H new ATOM 0 HG2 ARG A 15 19.783 11.526 6.164 1.00 71.24 H new ATOM 0 HG3 ARG A 15 21.067 11.409 7.351 1.00 71.24 H new ATOM 0 HD2 ARG A 15 21.308 8.964 6.780 1.00 73.15 H new ATOM 0 HD3 ARG A 15 20.106 9.172 5.522 1.00 73.15 H new ATOM 0 HE ARG A 15 22.249 11.101 5.226 1.00 12.22 H new ATOM 0 HH11 ARG A 15 21.376 7.715 4.736 1.00 14.13 H new ATOM 0 HH12 ARG A 15 22.528 7.489 3.416 1.00 14.13 H new ATOM 0 HH21 ARG A 15 23.727 10.802 3.530 1.00 13.11 H new ATOM 0 HH22 ARG A 15 23.854 9.229 2.736 1.00 13.11 H new ATOM 238 N PRO A 16 16.234 10.607 7.275 1.00 61.42 N ATOM 239 CA PRO A 16 14.888 10.030 7.211 1.00 61.52 C ATOM 240 C PRO A 16 14.870 8.555 7.600 1.00 43.31 C ATOM 241 O PRO A 16 15.859 7.845 7.423 1.00 65.01 O ATOM 242 CB PRO A 16 14.499 10.199 5.740 1.00 0.11 C ATOM 243 CG PRO A 16 15.796 10.249 5.009 1.00 52.55 C ATOM 244 CD PRO A 16 16.770 10.917 5.939 1.00 65.00 C ATOM 0 HA PRO A 16 14.203 10.516 7.906 1.00 61.52 H new ATOM 0 HB2 PRO A 16 13.882 9.369 5.396 1.00 0.11 H new ATOM 0 HB3 PRO A 16 13.922 11.111 5.585 1.00 0.11 H new ATOM 0 HG2 PRO A 16 16.134 9.247 4.744 1.00 52.55 H new ATOM 0 HG3 PRO A 16 15.698 10.809 4.079 1.00 52.55 H new ATOM 0 HD2 PRO A 16 17.780 10.527 5.811 1.00 65.00 H new ATOM 0 HD3 PRO A 16 16.819 11.992 5.765 1.00 65.00 H new ATOM 252 N ALA A 17 13.739 8.102 8.130 1.00 23.43 N ATOM 253 CA ALA A 17 13.592 6.711 8.542 1.00 45.10 C ATOM 254 C ALA A 17 13.326 5.809 7.342 1.00 34.42 C ATOM 255 O ALA A 17 13.486 4.591 7.422 1.00 62.34 O ATOM 256 CB ALA A 17 12.473 6.579 9.564 1.00 60.41 C ATOM 0 H ALA A 17 12.911 8.678 8.284 1.00 23.43 H new ATOM 0 HA ALA A 17 14.528 6.392 9.002 1.00 45.10 H new ATOM 0 HB1 ALA A 17 12.374 5.535 9.863 1.00 60.41 H new ATOM 0 HB2 ALA A 17 12.706 7.186 10.439 1.00 60.41 H new ATOM 0 HB3 ALA A 17 11.536 6.921 9.124 1.00 60.41 H new ATOM 262 N SER A 18 12.917 6.414 6.232 1.00 72.34 N ATOM 263 CA SER A 18 12.623 5.664 5.016 1.00 23.40 C ATOM 264 C SER A 18 13.878 4.976 4.486 1.00 52.45 C ATOM 265 O SER A 18 13.839 3.814 4.081 1.00 3.14 O ATOM 266 CB SER A 18 12.045 6.592 3.946 1.00 61.41 C ATOM 267 OG SER A 18 13.048 7.006 3.035 1.00 50.24 O ATOM 0 H SER A 18 12.782 7.422 6.149 1.00 72.34 H new ATOM 0 HA SER A 18 11.886 4.899 5.259 1.00 23.40 H new ATOM 0 HB2 SER A 18 11.249 6.079 3.407 1.00 61.41 H new ATOM 0 HB3 SER A 18 11.597 7.465 4.421 1.00 61.41 H new ATOM 0 HG SER A 18 12.653 7.597 2.360 1.00 50.24 H new ATOM 273 N VAL A 19 14.990 5.704 4.490 1.00 63.10 N ATOM 274 CA VAL A 19 16.258 5.166 4.011 1.00 73.33 C ATOM 275 C VAL A 19 16.658 3.921 4.795 1.00 72.02 C ATOM 276 O VAL A 19 17.408 3.078 4.302 1.00 41.43 O ATOM 277 CB VAL A 19 17.386 6.209 4.115 1.00 51.24 C ATOM 278 CG1 VAL A 19 18.723 5.590 3.737 1.00 32.31 C ATOM 279 CG2 VAL A 19 17.080 7.413 3.237 1.00 51.23 C ATOM 0 H VAL A 19 15.039 6.668 4.820 1.00 63.10 H new ATOM 0 HA VAL A 19 16.114 4.902 2.963 1.00 73.33 H new ATOM 0 HB VAL A 19 17.449 6.548 5.149 1.00 51.24 H new ATOM 0 HG11 VAL A 19 19.508 6.342 3.817 1.00 32.31 H new ATOM 0 HG12 VAL A 19 18.944 4.762 4.411 1.00 32.31 H new ATOM 0 HG13 VAL A 19 18.676 5.221 2.712 1.00 32.31 H new ATOM 0 HG21 VAL A 19 17.887 8.140 3.323 1.00 51.23 H new ATOM 0 HG22 VAL A 19 16.989 7.093 2.199 1.00 51.23 H new ATOM 0 HG23 VAL A 19 16.144 7.870 3.559 1.00 51.23 H new ATOM 289 N TYR A 20 16.152 3.811 6.018 1.00 11.31 N ATOM 290 CA TYR A 20 16.458 2.670 6.872 1.00 32.12 C ATOM 291 C TYR A 20 15.530 1.497 6.567 1.00 4.44 C ATOM 292 O TYR A 20 15.587 0.458 7.226 1.00 64.34 O ATOM 293 CB TYR A 20 16.336 3.062 8.346 1.00 74.43 C ATOM 294 CG TYR A 20 17.607 3.639 8.926 1.00 31.53 C ATOM 295 CD1 TYR A 20 18.766 2.877 9.005 1.00 3.11 C ATOM 296 CD2 TYR A 20 17.649 4.946 9.395 1.00 34.13 C ATOM 297 CE1 TYR A 20 19.930 3.400 9.536 1.00 54.14 C ATOM 298 CE2 TYR A 20 18.808 5.478 9.926 1.00 60.31 C ATOM 299 CZ TYR A 20 19.946 4.701 9.994 1.00 34.24 C ATOM 300 OH TYR A 20 21.103 5.226 10.522 1.00 31.22 O ATOM 0 H TYR A 20 15.528 4.498 6.440 1.00 11.31 H new ATOM 0 HA TYR A 20 17.483 2.361 6.669 1.00 32.12 H new ATOM 0 HB2 TYR A 20 15.533 3.792 8.454 1.00 74.43 H new ATOM 0 HB3 TYR A 20 16.049 2.184 8.924 1.00 74.43 H new ATOM 0 HD1 TYR A 20 18.757 1.859 8.645 1.00 3.11 H new ATOM 0 HD2 TYR A 20 16.760 5.557 9.344 1.00 34.13 H new ATOM 0 HE1 TYR A 20 20.822 2.794 9.592 1.00 54.14 H new ATOM 0 HE2 TYR A 20 18.823 6.496 10.286 1.00 60.31 H new ATOM 0 HH TYR A 20 20.946 6.153 10.797 1.00 31.22 H new ATOM 310 N LEU A 21 14.677 1.672 5.565 1.00 52.22 N ATOM 311 CA LEU A 21 13.736 0.629 5.170 1.00 1.31 C ATOM 312 C LEU A 21 14.105 0.050 3.808 1.00 22.02 C ATOM 313 O LEU A 21 14.968 0.581 3.108 1.00 14.32 O ATOM 314 CB LEU A 21 12.312 1.187 5.131 1.00 44.42 C ATOM 315 CG LEU A 21 11.996 2.291 6.141 1.00 31.31 C ATOM 316 CD1 LEU A 21 10.528 2.682 6.062 1.00 45.23 C ATOM 317 CD2 LEU A 21 12.355 1.842 7.550 1.00 14.33 C ATOM 0 H LEU A 21 14.617 2.526 5.011 1.00 52.22 H new ATOM 0 HA LEU A 21 13.786 -0.170 5.910 1.00 1.31 H new ATOM 0 HB2 LEU A 21 12.122 1.573 4.130 1.00 44.42 H new ATOM 0 HB3 LEU A 21 11.616 0.364 5.293 1.00 44.42 H new ATOM 0 HG LEU A 21 12.598 3.166 5.895 1.00 31.31 H new ATOM 0 HD11 LEU A 21 10.321 3.469 6.788 1.00 45.23 H new ATOM 0 HD12 LEU A 21 10.302 3.045 5.059 1.00 45.23 H new ATOM 0 HD13 LEU A 21 9.908 1.813 6.282 1.00 45.23 H new ATOM 0 HD21 LEU A 21 12.124 2.640 8.256 1.00 14.33 H new ATOM 0 HD22 LEU A 21 11.779 0.952 7.806 1.00 14.33 H new ATOM 0 HD23 LEU A 21 13.419 1.612 7.598 1.00 14.33 H new ATOM 329 N LYS A 22 13.445 -1.042 3.437 1.00 42.21 N ATOM 330 CA LYS A 22 13.700 -1.693 2.157 1.00 2.53 C ATOM 331 C LYS A 22 12.393 -2.070 1.469 1.00 54.35 C ATOM 332 O LYS A 22 11.594 -2.837 2.006 1.00 23.44 O ATOM 333 CB LYS A 22 14.561 -2.941 2.359 1.00 22.55 C ATOM 334 CG LYS A 22 15.809 -2.967 1.494 1.00 52.14 C ATOM 335 CD LYS A 22 16.309 -4.385 1.277 1.00 34.43 C ATOM 336 CE LYS A 22 15.774 -4.973 -0.020 1.00 45.21 C ATOM 337 NZ LYS A 22 16.733 -4.794 -1.146 1.00 33.01 N ATOM 0 H LYS A 22 12.729 -1.495 4.005 1.00 42.21 H new ATOM 0 HA LYS A 22 14.236 -0.989 1.520 1.00 2.53 H new ATOM 0 HB2 LYS A 22 14.854 -3.004 3.407 1.00 22.55 H new ATOM 0 HB3 LYS A 22 13.961 -3.825 2.143 1.00 22.55 H new ATOM 0 HG2 LYS A 22 15.594 -2.505 0.530 1.00 52.14 H new ATOM 0 HG3 LYS A 22 16.592 -2.373 1.965 1.00 52.14 H new ATOM 0 HD2 LYS A 22 17.399 -4.388 1.257 1.00 34.43 H new ATOM 0 HD3 LYS A 22 16.004 -5.012 2.115 1.00 34.43 H new ATOM 0 HE2 LYS A 22 15.571 -6.035 0.119 1.00 45.21 H new ATOM 0 HE3 LYS A 22 14.826 -4.497 -0.271 1.00 45.21 H new ATOM 0 HZ1 LYS A 22 16.333 -5.208 -2.012 1.00 33.01 H new ATOM 0 HZ2 LYS A 22 16.908 -3.780 -1.295 1.00 33.01 H new ATOM 0 HZ3 LYS A 22 17.629 -5.270 -0.918 1.00 33.01 H new ATOM 351 N LYS A 23 12.180 -1.526 0.275 1.00 72.42 N ATOM 352 CA LYS A 23 10.970 -1.807 -0.490 1.00 25.53 C ATOM 353 C LYS A 23 11.023 -3.206 -1.096 1.00 70.11 C ATOM 354 O LYS A 23 11.012 -3.364 -2.317 1.00 71.40 O ATOM 355 CB LYS A 23 10.789 -0.767 -1.597 1.00 12.42 C ATOM 356 CG LYS A 23 11.989 -0.644 -2.519 1.00 42.13 C ATOM 357 CD LYS A 23 11.564 -0.500 -3.971 1.00 44.40 C ATOM 358 CE LYS A 23 12.675 -0.921 -4.921 1.00 73.22 C ATOM 359 NZ LYS A 23 12.203 -1.926 -5.914 1.00 43.33 N ATOM 0 H LYS A 23 12.830 -0.888 -0.184 1.00 72.42 H new ATOM 0 HA LYS A 23 10.120 -1.756 0.190 1.00 25.53 H new ATOM 0 HB2 LYS A 23 9.912 -1.028 -2.189 1.00 12.42 H new ATOM 0 HB3 LYS A 23 10.590 0.204 -1.143 1.00 12.42 H new ATOM 0 HG2 LYS A 23 12.587 0.219 -2.227 1.00 42.13 H new ATOM 0 HG3 LYS A 23 12.624 -1.523 -2.410 1.00 42.13 H new ATOM 0 HD2 LYS A 23 10.678 -1.108 -4.154 1.00 44.40 H new ATOM 0 HD3 LYS A 23 11.287 0.535 -4.169 1.00 44.40 H new ATOM 0 HE2 LYS A 23 13.057 -0.045 -5.444 1.00 73.22 H new ATOM 0 HE3 LYS A 23 13.504 -1.337 -4.349 1.00 73.22 H new ATOM 0 HZ1 LYS A 23 12.989 -2.188 -6.543 1.00 43.33 H new ATOM 0 HZ2 LYS A 23 11.862 -2.773 -5.416 1.00 43.33 H new ATOM 0 HZ3 LYS A 23 11.429 -1.520 -6.477 1.00 43.33 H new ATOM 373 N ASP A 24 11.079 -4.217 -0.236 1.00 73.01 N ATOM 374 CA ASP A 24 11.130 -5.603 -0.687 1.00 41.23 C ATOM 375 C ASP A 24 11.101 -6.562 0.499 1.00 54.14 C ATOM 376 O ASP A 24 10.550 -7.659 0.410 1.00 31.50 O ATOM 377 CB ASP A 24 12.389 -5.843 -1.523 1.00 34.35 C ATOM 378 CG ASP A 24 12.166 -6.858 -2.627 1.00 14.32 C ATOM 379 OD1 ASP A 24 11.237 -7.682 -2.496 1.00 31.01 O ATOM 380 OD2 ASP A 24 12.920 -6.828 -3.622 1.00 2.03 O ATOM 0 H ASP A 24 11.090 -4.103 0.778 1.00 73.01 H new ATOM 0 HA ASP A 24 10.252 -5.791 -1.304 1.00 41.23 H new ATOM 0 HB2 ASP A 24 12.716 -4.900 -1.961 1.00 34.35 H new ATOM 0 HB3 ASP A 24 13.193 -6.188 -0.873 1.00 34.35 H new ATOM 385 N LYS A 25 11.698 -6.141 1.608 1.00 11.13 N ATOM 386 CA LYS A 25 11.741 -6.961 2.813 1.00 32.21 C ATOM 387 C LYS A 25 10.953 -6.308 3.944 1.00 32.22 C ATOM 388 O LYS A 25 10.819 -5.086 4.015 1.00 23.32 O ATOM 389 CB LYS A 25 13.190 -7.186 3.250 1.00 30.14 C ATOM 390 CG LYS A 25 14.164 -7.302 2.091 1.00 62.01 C ATOM 391 CD LYS A 25 15.392 -8.111 2.473 1.00 22.21 C ATOM 392 CE LYS A 25 15.276 -9.554 2.006 1.00 23.23 C ATOM 393 NZ LYS A 25 14.069 -10.223 2.566 1.00 41.12 N ATOM 0 H LYS A 25 12.159 -5.236 1.698 1.00 11.13 H new ATOM 0 HA LYS A 25 11.284 -7.923 2.584 1.00 32.21 H new ATOM 0 HB2 LYS A 25 13.499 -6.361 3.892 1.00 30.14 H new ATOM 0 HB3 LYS A 25 13.243 -8.094 3.850 1.00 30.14 H new ATOM 0 HG2 LYS A 25 13.667 -7.772 1.243 1.00 62.01 H new ATOM 0 HG3 LYS A 25 14.469 -6.306 1.770 1.00 62.01 H new ATOM 0 HD2 LYS A 25 16.280 -7.656 2.034 1.00 22.21 H new ATOM 0 HD3 LYS A 25 15.523 -8.087 3.555 1.00 22.21 H new ATOM 0 HE2 LYS A 25 15.234 -9.581 0.917 1.00 23.23 H new ATOM 0 HE3 LYS A 25 16.168 -10.105 2.304 1.00 23.23 H new ATOM 0 HZ1 LYS A 25 14.079 -11.230 2.308 1.00 41.12 H new ATOM 0 HZ2 LYS A 25 14.070 -10.131 3.602 1.00 41.12 H new ATOM 0 HZ3 LYS A 25 13.213 -9.776 2.180 1.00 41.12 H new ATOM 407 N PRO A 26 10.419 -7.139 4.851 1.00 20.54 N ATOM 408 CA PRO A 26 9.637 -6.665 5.997 1.00 41.42 C ATOM 409 C PRO A 26 10.498 -5.938 7.025 1.00 55.22 C ATOM 410 O PRO A 26 11.590 -6.391 7.367 1.00 4.33 O ATOM 411 CB PRO A 26 9.064 -7.952 6.594 1.00 62.53 C ATOM 412 CG PRO A 26 10.018 -9.019 6.178 1.00 34.33 C ATOM 413 CD PRO A 26 10.538 -8.607 4.829 1.00 21.02 C ATOM 0 HA PRO A 26 8.877 -5.942 5.700 1.00 41.42 H new ATOM 0 HB2 PRO A 26 8.991 -7.887 7.680 1.00 62.53 H new ATOM 0 HB3 PRO A 26 8.060 -8.150 6.219 1.00 62.53 H new ATOM 0 HG2 PRO A 26 10.832 -9.117 6.897 1.00 34.33 H new ATOM 0 HG3 PRO A 26 9.521 -9.988 6.125 1.00 34.33 H new ATOM 0 HD2 PRO A 26 11.570 -8.924 4.682 1.00 21.02 H new ATOM 0 HD3 PRO A 26 9.952 -9.046 4.021 1.00 21.02 H new ATOM 421 N THR A 27 9.998 -4.807 7.515 1.00 20.50 N ATOM 422 CA THR A 27 10.721 -4.018 8.504 1.00 42.45 C ATOM 423 C THR A 27 10.165 -4.247 9.904 1.00 10.32 C ATOM 424 O THR A 27 9.004 -4.624 10.068 1.00 20.32 O ATOM 425 CB THR A 27 10.656 -2.514 8.177 1.00 4.44 C ATOM 426 OG1 THR A 27 10.800 -2.311 6.767 1.00 21.51 O ATOM 427 CG2 THR A 27 11.746 -1.752 8.918 1.00 54.05 C ATOM 0 H THR A 27 9.095 -4.418 7.243 1.00 20.50 H new ATOM 0 HA THR A 27 11.760 -4.345 8.472 1.00 42.45 H new ATOM 0 HB THR A 27 9.686 -2.137 8.500 1.00 4.44 H new ATOM 0 HG1 THR A 27 10.756 -1.352 6.568 1.00 21.51 H new ATOM 0 HG21 THR A 27 11.681 -0.692 8.672 1.00 54.05 H new ATOM 0 HG22 THR A 27 11.616 -1.884 9.992 1.00 54.05 H new ATOM 0 HG23 THR A 27 12.723 -2.134 8.621 1.00 54.05 H new ATOM 435 N LEU A 28 10.999 -4.016 10.912 1.00 41.31 N ATOM 436 CA LEU A 28 10.590 -4.196 12.300 1.00 20.25 C ATOM 437 C LEU A 28 10.797 -2.914 13.100 1.00 12.12 C ATOM 438 O LEU A 28 11.908 -2.388 13.171 1.00 13.52 O ATOM 439 CB LEU A 28 11.377 -5.342 12.940 1.00 54.13 C ATOM 440 CG LEU A 28 10.738 -6.728 12.848 1.00 73.01 C ATOM 441 CD1 LEU A 28 11.577 -7.646 11.972 1.00 13.33 C ATOM 442 CD2 LEU A 28 10.561 -7.327 14.236 1.00 50.23 C ATOM 0 H LEU A 28 11.963 -3.704 10.794 1.00 41.31 H new ATOM 0 HA LEU A 28 9.528 -4.442 12.311 1.00 20.25 H new ATOM 0 HB2 LEU A 28 12.361 -5.386 12.473 1.00 54.13 H new ATOM 0 HB3 LEU A 28 11.534 -5.105 13.992 1.00 54.13 H new ATOM 0 HG LEU A 28 9.754 -6.624 12.391 1.00 73.01 H new ATOM 0 HD11 LEU A 28 11.107 -8.628 11.918 1.00 13.33 H new ATOM 0 HD12 LEU A 28 11.652 -7.224 10.970 1.00 13.33 H new ATOM 0 HD13 LEU A 28 12.575 -7.745 12.399 1.00 13.33 H new ATOM 0 HD21 LEU A 28 10.105 -8.313 14.151 1.00 50.23 H new ATOM 0 HD22 LEU A 28 11.533 -7.417 14.720 1.00 50.23 H new ATOM 0 HD23 LEU A 28 9.918 -6.680 14.832 1.00 50.23 H new ATOM 454 N ILE A 29 9.721 -2.418 13.702 1.00 71.02 N ATOM 455 CA ILE A 29 9.786 -1.200 14.499 1.00 14.42 C ATOM 456 C ILE A 29 9.644 -1.507 15.986 1.00 24.40 C ATOM 457 O ILE A 29 8.700 -2.177 16.406 1.00 25.01 O ATOM 458 CB ILE A 29 8.690 -0.199 14.087 1.00 10.54 C ATOM 459 CG1 ILE A 29 8.827 0.161 12.606 1.00 23.45 C ATOM 460 CG2 ILE A 29 8.764 1.052 14.950 1.00 11.24 C ATOM 461 CD1 ILE A 29 7.570 0.754 12.010 1.00 44.14 C ATOM 0 H ILE A 29 8.794 -2.841 13.653 1.00 71.02 H new ATOM 0 HA ILE A 29 10.763 -0.754 14.314 1.00 14.42 H new ATOM 0 HB ILE A 29 7.717 -0.666 14.240 1.00 10.54 H new ATOM 0 HG12 ILE A 29 9.646 0.871 12.487 1.00 23.45 H new ATOM 0 HG13 ILE A 29 9.098 -0.734 12.046 1.00 23.45 H new ATOM 0 HG21 ILE A 29 7.983 1.750 14.647 1.00 11.24 H new ATOM 0 HG22 ILE A 29 8.622 0.781 15.996 1.00 11.24 H new ATOM 0 HG23 ILE A 29 9.739 1.522 14.826 1.00 11.24 H new ATOM 0 HD11 ILE A 29 7.740 0.985 10.958 1.00 44.14 H new ATOM 0 HD12 ILE A 29 6.753 0.038 12.097 1.00 44.14 H new ATOM 0 HD13 ILE A 29 7.310 1.668 12.545 1.00 44.14 H new ATOM 473 N LYS A 30 10.589 -1.013 16.779 1.00 15.52 N ATOM 474 CA LYS A 30 10.569 -1.231 18.221 1.00 44.13 C ATOM 475 C LYS A 30 10.448 0.092 18.970 1.00 53.11 C ATOM 476 O LYS A 30 11.269 0.993 18.797 1.00 71.14 O ATOM 477 CB LYS A 30 11.837 -1.965 18.663 1.00 43.11 C ATOM 478 CG LYS A 30 12.057 -1.948 20.166 1.00 72.42 C ATOM 479 CD LYS A 30 13.299 -2.732 20.557 1.00 74.14 C ATOM 480 CE LYS A 30 13.077 -3.528 21.834 1.00 54.51 C ATOM 481 NZ LYS A 30 13.238 -2.682 23.049 1.00 2.10 N ATOM 0 H LYS A 30 11.379 -0.459 16.447 1.00 15.52 H new ATOM 0 HA LYS A 30 9.699 -1.843 18.459 1.00 44.13 H new ATOM 0 HB2 LYS A 30 11.785 -2.999 18.324 1.00 43.11 H new ATOM 0 HB3 LYS A 30 12.699 -1.512 18.173 1.00 43.11 H new ATOM 0 HG2 LYS A 30 12.153 -0.918 20.509 1.00 72.42 H new ATOM 0 HG3 LYS A 30 11.186 -2.371 20.667 1.00 72.42 H new ATOM 0 HD2 LYS A 30 13.573 -3.409 19.748 1.00 74.14 H new ATOM 0 HD3 LYS A 30 14.135 -2.046 20.695 1.00 74.14 H new ATOM 0 HE2 LYS A 30 12.077 -3.961 21.823 1.00 54.51 H new ATOM 0 HE3 LYS A 30 13.783 -4.357 21.873 1.00 54.51 H new ATOM 0 HZ1 LYS A 30 12.900 -3.204 23.883 1.00 2.10 H new ATOM 0 HZ2 LYS A 30 14.242 -2.442 23.174 1.00 2.10 H new ATOM 0 HZ3 LYS A 30 12.684 -1.809 22.940 1.00 2.10 H new ATOM 495 N PHE A 31 9.419 0.202 19.804 1.00 1.11 N ATOM 496 CA PHE A 31 9.191 1.415 20.580 1.00 14.34 C ATOM 497 C PHE A 31 9.825 1.303 21.964 1.00 40.44 C ATOM 498 O PHE A 31 9.450 0.445 22.763 1.00 53.35 O ATOM 499 CB PHE A 31 7.691 1.685 20.715 1.00 34.02 C ATOM 500 CG PHE A 31 6.992 1.859 19.397 1.00 40.40 C ATOM 501 CD1 PHE A 31 6.687 0.761 18.609 1.00 13.31 C ATOM 502 CD2 PHE A 31 6.641 3.122 18.946 1.00 62.55 C ATOM 503 CE1 PHE A 31 6.044 0.918 17.396 1.00 54.23 C ATOM 504 CE2 PHE A 31 5.998 3.285 17.733 1.00 33.53 C ATOM 505 CZ PHE A 31 5.700 2.182 16.957 1.00 74.31 C ATOM 0 H PHE A 31 8.730 -0.534 19.960 1.00 1.11 H new ATOM 0 HA PHE A 31 9.657 2.247 20.052 1.00 14.34 H new ATOM 0 HB2 PHE A 31 7.229 0.859 21.256 1.00 34.02 H new ATOM 0 HB3 PHE A 31 7.544 2.582 21.316 1.00 34.02 H new ATOM 0 HD1 PHE A 31 6.955 -0.229 18.947 1.00 13.31 H new ATOM 0 HD2 PHE A 31 6.872 3.988 19.549 1.00 62.55 H new ATOM 0 HE1 PHE A 31 5.811 0.054 16.792 1.00 54.23 H new ATOM 0 HE2 PHE A 31 5.729 4.274 17.393 1.00 33.53 H new ATOM 0 HZ PHE A 31 5.199 2.307 16.009 1.00 74.31 H new ATOM 515 N TRP A 32 10.788 2.176 22.238 1.00 20.42 N ATOM 516 CA TRP A 32 11.476 2.175 23.524 1.00 34.15 C ATOM 517 C TRP A 32 11.461 3.565 24.150 1.00 1.23 C ATOM 518 O TRP A 32 10.812 4.478 23.641 1.00 12.11 O ATOM 519 CB TRP A 32 12.918 1.693 23.355 1.00 55.51 C ATOM 520 CG TRP A 32 13.702 2.503 22.367 1.00 74.45 C ATOM 521 CD1 TRP A 32 13.515 2.550 21.014 1.00 20.25 C ATOM 522 CD2 TRP A 32 14.797 3.379 22.653 1.00 21.42 C ATOM 523 NE1 TRP A 32 14.429 3.402 20.443 1.00 13.53 N ATOM 524 CE2 TRP A 32 15.226 3.924 21.427 1.00 10.34 C ATOM 525 CE3 TRP A 32 15.456 3.757 23.826 1.00 61.20 C ATOM 526 CZ2 TRP A 32 16.284 4.826 21.344 1.00 72.32 C ATOM 527 CZ3 TRP A 32 16.506 4.651 23.741 1.00 10.32 C ATOM 528 CH2 TRP A 32 16.911 5.178 22.508 1.00 40.43 C ATOM 0 H TRP A 32 11.110 2.893 21.588 1.00 20.42 H new ATOM 0 HA TRP A 32 10.949 1.492 24.189 1.00 34.15 H new ATOM 0 HB2 TRP A 32 13.420 1.726 24.322 1.00 55.51 H new ATOM 0 HB3 TRP A 32 12.910 0.651 23.035 1.00 55.51 H new ATOM 0 HD1 TRP A 32 12.760 1.999 20.473 1.00 20.25 H new ATOM 0 HE1 TRP A 32 14.502 3.612 19.448 1.00 13.53 H new ATOM 0 HE3 TRP A 32 15.150 3.358 24.782 1.00 61.20 H new ATOM 0 HZ2 TRP A 32 16.598 5.233 20.394 1.00 72.32 H new ATOM 0 HZ3 TRP A 32 17.024 4.949 24.641 1.00 10.32 H new ATOM 0 HH2 TRP A 32 17.734 5.876 22.476 1.00 40.43 H new ATOM 539 N ALA A 33 12.181 3.719 25.257 1.00 70.12 N ATOM 540 CA ALA A 33 12.252 4.999 25.950 1.00 1.11 C ATOM 541 C ALA A 33 13.506 5.087 26.814 1.00 71.15 C ATOM 542 O ALA A 33 14.013 4.073 27.293 1.00 45.03 O ATOM 543 CB ALA A 33 11.008 5.209 26.800 1.00 33.32 C ATOM 0 H ALA A 33 12.723 2.973 25.693 1.00 70.12 H new ATOM 0 HA ALA A 33 12.303 5.788 25.199 1.00 1.11 H new ATOM 0 HB1 ALA A 33 11.075 6.169 27.312 1.00 33.32 H new ATOM 0 HB2 ALA A 33 10.125 5.199 26.161 1.00 33.32 H new ATOM 0 HB3 ALA A 33 10.932 4.410 27.537 1.00 33.32 H new ATOM 549 N SER A 34 14.001 6.305 27.007 1.00 2.15 N ATOM 550 CA SER A 34 15.199 6.524 27.810 1.00 51.52 C ATOM 551 C SER A 34 14.929 6.228 29.282 1.00 73.13 C ATOM 552 O SER A 34 15.854 5.996 30.059 1.00 3.45 O ATOM 553 CB SER A 34 15.689 7.965 27.650 1.00 71.13 C ATOM 554 OG SER A 34 15.657 8.366 26.291 1.00 11.50 O ATOM 0 H SER A 34 13.592 7.155 26.619 1.00 2.15 H new ATOM 0 HA SER A 34 15.973 5.842 27.456 1.00 51.52 H new ATOM 0 HB2 SER A 34 15.065 8.633 28.244 1.00 71.13 H new ATOM 0 HB3 SER A 34 16.705 8.052 28.034 1.00 71.13 H new ATOM 0 HG SER A 34 16.339 7.873 25.788 1.00 11.50 H new ATOM 560 N TRP A 35 13.654 6.237 29.656 1.00 65.21 N ATOM 561 CA TRP A 35 13.261 5.969 31.035 1.00 61.14 C ATOM 562 C TRP A 35 12.918 4.496 31.226 1.00 30.23 C ATOM 563 O TRP A 35 12.144 4.139 32.115 1.00 75.03 O ATOM 564 CB TRP A 35 12.065 6.839 31.423 1.00 35.24 C ATOM 565 CG TRP A 35 10.885 6.666 30.515 1.00 14.14 C ATOM 566 CD1 TRP A 35 10.668 7.298 29.324 1.00 31.51 C ATOM 567 CD2 TRP A 35 9.759 5.807 30.727 1.00 62.41 C ATOM 568 NE1 TRP A 35 9.475 6.882 28.782 1.00 4.41 N ATOM 569 CE2 TRP A 35 8.899 5.967 29.623 1.00 42.31 C ATOM 570 CE3 TRP A 35 9.395 4.916 31.740 1.00 63.40 C ATOM 571 CZ2 TRP A 35 7.699 5.271 29.507 1.00 63.51 C ATOM 572 CZ3 TRP A 35 8.204 4.225 31.623 1.00 0.15 C ATOM 573 CH2 TRP A 35 7.368 4.405 30.514 1.00 71.25 C ATOM 0 H TRP A 35 12.876 6.427 29.024 1.00 65.21 H new ATOM 0 HA TRP A 35 14.104 6.213 31.682 1.00 61.14 H new ATOM 0 HB2 TRP A 35 11.767 6.600 32.444 1.00 35.24 H new ATOM 0 HB3 TRP A 35 12.369 7.886 31.417 1.00 35.24 H new ATOM 0 HD1 TRP A 35 11.335 8.018 28.874 1.00 31.51 H new ATOM 0 HE1 TRP A 35 9.082 7.203 27.897 1.00 4.41 H new ATOM 0 HE3 TRP A 35 10.033 4.770 32.599 1.00 63.40 H new ATOM 0 HZ2 TRP A 35 7.052 5.409 28.653 1.00 63.51 H new ATOM 0 HZ3 TRP A 35 7.913 3.534 32.400 1.00 0.15 H new ATOM 0 HH2 TRP A 35 6.444 3.850 30.452 1.00 71.25 H new ATOM 584 N CYS A 36 13.499 3.644 30.388 1.00 32.54 N ATOM 585 CA CYS A 36 13.255 2.208 30.465 1.00 15.34 C ATOM 586 C CYS A 36 14.566 1.439 30.592 1.00 5.34 C ATOM 587 O CYS A 36 15.449 1.522 29.737 1.00 35.24 O ATOM 588 CB CYS A 36 12.490 1.733 29.229 1.00 74.13 C ATOM 589 SG CYS A 36 12.229 -0.069 29.163 1.00 40.24 S ATOM 0 H CYS A 36 14.142 3.923 29.647 1.00 32.54 H new ATOM 0 HA CYS A 36 12.654 2.014 31.353 1.00 15.34 H new ATOM 0 HB2 CYS A 36 11.521 2.231 29.201 1.00 74.13 H new ATOM 0 HB3 CYS A 36 13.034 2.044 28.337 1.00 74.13 H new ATOM 594 N PRO A 37 14.699 0.673 31.685 1.00 65.31 N ATOM 595 CA PRO A 37 15.899 -0.127 31.950 1.00 44.42 C ATOM 596 C PRO A 37 16.037 -1.302 30.988 1.00 32.23 C ATOM 597 O PRO A 37 17.108 -1.537 30.427 1.00 0.33 O ATOM 598 CB PRO A 37 15.683 -0.628 33.380 1.00 41.11 C ATOM 599 CG PRO A 37 14.205 -0.625 33.563 1.00 74.33 C ATOM 600 CD PRO A 37 13.688 0.527 32.745 1.00 24.45 C ATOM 0 HA PRO A 37 16.812 0.454 31.821 1.00 44.42 H new ATOM 0 HB2 PRO A 37 16.097 -1.627 33.516 1.00 41.11 H new ATOM 0 HB3 PRO A 37 16.173 0.021 34.105 1.00 41.11 H new ATOM 0 HG2 PRO A 37 13.769 -1.567 33.230 1.00 74.33 H new ATOM 0 HG3 PRO A 37 13.942 -0.506 34.614 1.00 74.33 H new ATOM 0 HD2 PRO A 37 12.701 0.316 32.333 1.00 24.45 H new ATOM 0 HD3 PRO A 37 13.597 1.435 33.342 1.00 24.45 H new ATOM 608 N LEU A 38 14.947 -2.038 30.802 1.00 72.23 N ATOM 609 CA LEU A 38 14.946 -3.190 29.907 1.00 75.32 C ATOM 610 C LEU A 38 15.121 -2.753 28.456 1.00 10.00 C ATOM 611 O LEU A 38 15.355 -3.577 27.572 1.00 72.42 O ATOM 612 CB LEU A 38 13.644 -3.978 30.060 1.00 75.41 C ATOM 613 CG LEU A 38 13.609 -5.354 29.393 1.00 23.12 C ATOM 614 CD1 LEU A 38 13.823 -6.452 30.423 1.00 24.14 C ATOM 615 CD2 LEU A 38 12.292 -5.558 28.659 1.00 30.42 C ATOM 0 H LEU A 38 14.053 -1.858 31.259 1.00 72.23 H new ATOM 0 HA LEU A 38 15.786 -3.830 30.178 1.00 75.32 H new ATOM 0 HB2 LEU A 38 13.444 -4.107 31.124 1.00 75.41 H new ATOM 0 HB3 LEU A 38 12.830 -3.378 29.653 1.00 75.41 H new ATOM 0 HG LEU A 38 14.419 -5.404 28.665 1.00 23.12 H new ATOM 0 HD11 LEU A 38 13.795 -7.424 29.930 1.00 24.14 H new ATOM 0 HD12 LEU A 38 14.792 -6.317 30.903 1.00 24.14 H new ATOM 0 HD13 LEU A 38 13.036 -6.404 31.175 1.00 24.14 H new ATOM 0 HD21 LEU A 38 12.285 -6.542 28.191 1.00 30.42 H new ATOM 0 HD22 LEU A 38 11.466 -5.487 29.367 1.00 30.42 H new ATOM 0 HD23 LEU A 38 12.180 -4.791 27.893 1.00 30.42 H new ATOM 627 N CYS A 39 15.009 -1.450 28.218 1.00 33.44 N ATOM 628 CA CYS A 39 15.156 -0.902 26.876 1.00 64.03 C ATOM 629 C CYS A 39 16.530 -0.262 26.698 1.00 63.35 C ATOM 630 O CYS A 39 17.223 -0.518 25.712 1.00 42.44 O ATOM 631 CB CYS A 39 14.061 0.130 26.601 1.00 44.53 C ATOM 632 SG CYS A 39 12.389 -0.414 27.076 1.00 63.52 S ATOM 0 H CYS A 39 14.817 -0.754 28.938 1.00 33.44 H new ATOM 0 HA CYS A 39 15.061 -1.721 26.163 1.00 64.03 H new ATOM 0 HB2 CYS A 39 14.299 1.048 27.138 1.00 44.53 H new ATOM 0 HB3 CYS A 39 14.064 0.373 25.538 1.00 44.53 H new ATOM 637 N LEU A 40 16.918 0.570 27.658 1.00 62.33 N ATOM 638 CA LEU A 40 18.210 1.246 27.608 1.00 14.41 C ATOM 639 C LEU A 40 19.353 0.252 27.782 1.00 72.54 C ATOM 640 O LEU A 40 20.420 0.408 27.189 1.00 23.10 O ATOM 641 CB LEU A 40 18.286 2.322 28.693 1.00 52.32 C ATOM 642 CG LEU A 40 19.059 3.590 28.328 1.00 52.14 C ATOM 643 CD1 LEU A 40 18.393 4.304 27.162 1.00 53.23 C ATOM 644 CD2 LEU A 40 19.166 4.515 29.531 1.00 34.02 C ATOM 0 H LEU A 40 16.357 0.793 28.480 1.00 62.33 H new ATOM 0 HA LEU A 40 18.308 1.716 26.629 1.00 14.41 H new ATOM 0 HB2 LEU A 40 17.270 2.606 28.967 1.00 52.32 H new ATOM 0 HB3 LEU A 40 18.744 1.884 29.580 1.00 52.32 H new ATOM 0 HG LEU A 40 20.066 3.304 28.025 1.00 52.14 H new ATOM 0 HD11 LEU A 40 18.957 5.204 26.916 1.00 53.23 H new ATOM 0 HD12 LEU A 40 18.370 3.643 26.296 1.00 53.23 H new ATOM 0 HD13 LEU A 40 17.374 4.578 27.437 1.00 53.23 H new ATOM 0 HD21 LEU A 40 19.719 5.412 29.252 1.00 34.02 H new ATOM 0 HD22 LEU A 40 18.167 4.794 29.865 1.00 34.02 H new ATOM 0 HD23 LEU A 40 19.689 4.003 30.339 1.00 34.02 H new ATOM 656 N SER A 41 19.120 -0.773 28.596 1.00 5.21 N ATOM 657 CA SER A 41 20.131 -1.793 28.849 1.00 43.11 C ATOM 658 C SER A 41 20.234 -2.759 27.673 1.00 73.42 C ATOM 659 O SER A 41 21.226 -3.473 27.527 1.00 14.23 O ATOM 660 CB SER A 41 19.800 -2.563 30.129 1.00 45.31 C ATOM 661 OG SER A 41 19.729 -1.691 31.244 1.00 33.20 O ATOM 0 H SER A 41 18.240 -0.919 29.091 1.00 5.21 H new ATOM 0 HA SER A 41 21.092 -1.294 28.972 1.00 43.11 H new ATOM 0 HB2 SER A 41 18.850 -3.083 30.009 1.00 45.31 H new ATOM 0 HB3 SER A 41 20.560 -3.324 30.306 1.00 45.31 H new ATOM 0 HG SER A 41 18.815 -1.349 31.334 1.00 33.20 H new ATOM 667 N GLU A 42 19.200 -2.776 26.837 1.00 44.33 N ATOM 668 CA GLU A 42 19.173 -3.655 25.674 1.00 64.03 C ATOM 669 C GLU A 42 19.491 -2.880 24.398 1.00 11.11 C ATOM 670 O GLU A 42 19.399 -3.416 23.293 1.00 22.20 O ATOM 671 CB GLU A 42 17.805 -4.328 25.547 1.00 23.32 C ATOM 672 CG GLU A 42 16.805 -3.525 24.733 1.00 34.24 C ATOM 673 CD GLU A 42 16.679 -4.024 23.307 1.00 55.00 C ATOM 674 OE1 GLU A 42 17.379 -4.996 22.955 1.00 32.52 O ATOM 675 OE2 GLU A 42 15.881 -3.442 22.543 1.00 74.32 O ATOM 0 H GLU A 42 18.371 -2.191 26.944 1.00 44.33 H new ATOM 0 HA GLU A 42 19.936 -4.421 25.813 1.00 64.03 H new ATOM 0 HB2 GLU A 42 17.933 -5.307 25.086 1.00 23.32 H new ATOM 0 HB3 GLU A 42 17.398 -4.496 26.544 1.00 23.32 H new ATOM 0 HG2 GLU A 42 15.829 -3.569 25.217 1.00 34.24 H new ATOM 0 HG3 GLU A 42 17.108 -2.478 24.722 1.00 34.24 H new ATOM 682 N LEU A 43 19.864 -1.615 24.559 1.00 30.20 N ATOM 683 CA LEU A 43 20.195 -0.764 23.421 1.00 32.40 C ATOM 684 C LEU A 43 21.204 -1.449 22.505 1.00 42.32 C ATOM 685 O LEU A 43 21.019 -1.502 21.290 1.00 51.52 O ATOM 686 CB LEU A 43 20.754 0.574 23.906 1.00 43.34 C ATOM 687 CG LEU A 43 19.721 1.628 24.306 1.00 2.02 C ATOM 688 CD1 LEU A 43 20.351 2.676 25.210 1.00 11.24 C ATOM 689 CD2 LEU A 43 19.118 2.280 23.071 1.00 74.13 C ATOM 0 H LEU A 43 19.945 -1.156 25.466 1.00 30.20 H new ATOM 0 HA LEU A 43 19.281 -0.584 22.854 1.00 32.40 H new ATOM 0 HB2 LEU A 43 21.401 0.385 24.762 1.00 43.34 H new ATOM 0 HB3 LEU A 43 21.381 0.990 23.118 1.00 43.34 H new ATOM 0 HG LEU A 43 18.922 1.134 24.858 1.00 2.02 H new ATOM 0 HD11 LEU A 43 19.601 3.418 25.485 1.00 11.24 H new ATOM 0 HD12 LEU A 43 20.734 2.197 26.111 1.00 11.24 H new ATOM 0 HD13 LEU A 43 21.170 3.166 24.683 1.00 11.24 H new ATOM 0 HD21 LEU A 43 18.385 3.027 23.375 1.00 74.13 H new ATOM 0 HD22 LEU A 43 19.906 2.760 22.491 1.00 74.13 H new ATOM 0 HD23 LEU A 43 18.630 1.521 22.460 1.00 74.13 H new ATOM 701 N GLY A 44 22.273 -1.974 23.097 1.00 14.11 N ATOM 702 CA GLY A 44 23.294 -2.650 22.320 1.00 65.05 C ATOM 703 C GLY A 44 22.749 -3.841 21.556 1.00 2.23 C ATOM 704 O GLY A 44 23.089 -4.047 20.392 1.00 62.33 O ATOM 0 H GLY A 44 22.449 -1.943 24.101 1.00 14.11 H new ATOM 0 HA2 GLY A 44 23.738 -1.944 21.618 1.00 65.05 H new ATOM 0 HA3 GLY A 44 24.091 -2.983 22.985 1.00 65.05 H new ATOM 708 N GLN A 45 21.903 -4.626 22.214 1.00 32.33 N ATOM 709 CA GLN A 45 21.312 -5.804 21.590 1.00 30.21 C ATOM 710 C GLN A 45 20.677 -5.449 20.250 1.00 61.24 C ATOM 711 O GLN A 45 20.998 -6.045 19.221 1.00 43.14 O ATOM 712 CB GLN A 45 20.264 -6.426 22.515 1.00 25.31 C ATOM 713 CG GLN A 45 19.468 -7.547 21.866 1.00 43.10 C ATOM 714 CD GLN A 45 18.951 -8.555 22.873 1.00 0.44 C ATOM 715 OE1 GLN A 45 17.837 -8.426 23.382 1.00 40.41 O ATOM 716 NE2 GLN A 45 19.759 -9.566 23.167 1.00 21.54 N ATOM 0 H GLN A 45 21.611 -4.468 23.179 1.00 32.33 H new ATOM 0 HA GLN A 45 22.107 -6.528 21.414 1.00 30.21 H new ATOM 0 HB2 GLN A 45 20.761 -6.812 23.405 1.00 25.31 H new ATOM 0 HB3 GLN A 45 19.576 -5.648 22.846 1.00 25.31 H new ATOM 0 HG2 GLN A 45 18.627 -7.121 21.320 1.00 43.10 H new ATOM 0 HG3 GLN A 45 20.096 -8.058 21.136 1.00 43.10 H new ATOM 0 HE21 GLN A 45 20.674 -9.634 22.721 1.00 21.54 H new ATOM 0 HE22 GLN A 45 19.465 -10.275 23.839 1.00 21.54 H new ATOM 725 N THR A 46 19.773 -4.475 20.268 1.00 40.41 N ATOM 726 CA THR A 46 19.092 -4.041 19.055 1.00 72.13 C ATOM 727 C THR A 46 20.087 -3.537 18.016 1.00 53.42 C ATOM 728 O THR A 46 19.906 -3.747 16.817 1.00 32.21 O ATOM 729 CB THR A 46 18.069 -2.929 19.352 1.00 53.42 C ATOM 730 OG1 THR A 46 17.048 -3.422 20.226 1.00 21.45 O ATOM 731 CG2 THR A 46 17.438 -2.416 18.066 1.00 34.30 C ATOM 0 H THR A 46 19.495 -3.971 21.110 1.00 40.41 H new ATOM 0 HA THR A 46 18.567 -4.910 18.659 1.00 72.13 H new ATOM 0 HB THR A 46 18.593 -2.104 19.835 1.00 53.42 H new ATOM 0 HG1 THR A 46 17.061 -2.914 21.064 1.00 21.45 H new ATOM 0 HG21 THR A 46 16.719 -1.631 18.301 1.00 34.30 H new ATOM 0 HG22 THR A 46 18.214 -2.014 17.415 1.00 34.30 H new ATOM 0 HG23 THR A 46 16.928 -3.235 17.559 1.00 34.30 H new ATOM 739 N GLU A 47 21.138 -2.870 18.484 1.00 34.50 N ATOM 740 CA GLU A 47 22.161 -2.336 17.593 1.00 22.35 C ATOM 741 C GLU A 47 22.849 -3.458 16.821 1.00 43.13 C ATOM 742 O GLU A 47 23.258 -3.277 15.673 1.00 32.43 O ATOM 743 CB GLU A 47 23.197 -1.541 18.390 1.00 5.13 C ATOM 744 CG GLU A 47 24.405 -1.121 17.569 1.00 22.15 C ATOM 745 CD GLU A 47 24.064 -0.083 16.519 1.00 51.35 C ATOM 746 OE1 GLU A 47 23.226 -0.380 15.642 1.00 75.11 O ATOM 747 OE2 GLU A 47 24.635 1.027 16.572 1.00 32.52 O ATOM 0 H GLU A 47 21.303 -2.687 19.474 1.00 34.50 H new ATOM 0 HA GLU A 47 21.674 -1.672 16.879 1.00 22.35 H new ATOM 0 HB2 GLU A 47 22.721 -0.651 18.802 1.00 5.13 H new ATOM 0 HB3 GLU A 47 23.533 -2.143 19.234 1.00 5.13 H new ATOM 0 HG2 GLU A 47 25.171 -0.722 18.234 1.00 22.15 H new ATOM 0 HG3 GLU A 47 24.832 -1.998 17.082 1.00 22.15 H new ATOM 754 N LYS A 48 22.975 -4.617 17.458 1.00 14.01 N ATOM 755 CA LYS A 48 23.612 -5.770 16.833 1.00 41.44 C ATOM 756 C LYS A 48 22.641 -6.490 15.903 1.00 20.50 C ATOM 757 O LYS A 48 23.045 -7.059 14.888 1.00 11.34 O ATOM 758 CB LYS A 48 24.125 -6.737 17.902 1.00 73.23 C ATOM 759 CG LYS A 48 24.896 -6.056 19.019 1.00 33.21 C ATOM 760 CD LYS A 48 26.199 -6.778 19.317 1.00 4.53 C ATOM 761 CE LYS A 48 27.319 -6.306 18.403 1.00 43.32 C ATOM 762 NZ LYS A 48 28.360 -5.544 19.148 1.00 61.44 N ATOM 0 H LYS A 48 22.644 -4.783 18.408 1.00 14.01 H new ATOM 0 HA LYS A 48 24.455 -5.412 16.242 1.00 41.44 H new ATOM 0 HB2 LYS A 48 23.279 -7.273 18.331 1.00 73.23 H new ATOM 0 HB3 LYS A 48 24.767 -7.480 17.429 1.00 73.23 H new ATOM 0 HG2 LYS A 48 25.107 -5.024 18.740 1.00 33.21 H new ATOM 0 HG3 LYS A 48 24.282 -6.024 19.919 1.00 33.21 H new ATOM 0 HD2 LYS A 48 26.480 -6.609 20.356 1.00 4.53 H new ATOM 0 HD3 LYS A 48 26.057 -7.852 19.196 1.00 4.53 H new ATOM 0 HE2 LYS A 48 27.778 -7.167 17.917 1.00 43.32 H new ATOM 0 HE3 LYS A 48 26.904 -5.678 17.615 1.00 43.32 H new ATOM 0 HZ1 LYS A 48 29.105 -5.240 18.490 1.00 61.44 H new ATOM 0 HZ2 LYS A 48 27.928 -4.708 19.591 1.00 61.44 H new ATOM 0 HZ3 LYS A 48 28.774 -6.151 19.884 1.00 61.44 H new ATOM 776 N TRP A 49 21.361 -6.462 16.255 1.00 11.22 N ATOM 777 CA TRP A 49 20.332 -7.112 15.451 1.00 44.33 C ATOM 778 C TRP A 49 20.222 -6.459 14.077 1.00 0.34 C ATOM 779 O TRP A 49 20.220 -7.142 13.054 1.00 43.33 O ATOM 780 CB TRP A 49 18.982 -7.052 16.167 1.00 23.52 C ATOM 781 CG TRP A 49 18.919 -7.921 17.387 1.00 14.00 C ATOM 782 CD1 TRP A 49 19.968 -8.522 18.021 1.00 5.31 C ATOM 783 CD2 TRP A 49 17.743 -8.287 18.118 1.00 62.11 C ATOM 784 NE1 TRP A 49 19.516 -9.239 19.102 1.00 24.23 N ATOM 785 CE2 TRP A 49 18.155 -9.111 19.184 1.00 41.31 C ATOM 786 CE3 TRP A 49 16.383 -7.998 17.977 1.00 4.31 C ATOM 787 CZ2 TRP A 49 17.255 -9.647 20.101 1.00 71.25 C ATOM 788 CZ3 TRP A 49 15.491 -8.531 18.888 1.00 61.25 C ATOM 789 CH2 TRP A 49 15.930 -9.348 19.939 1.00 55.44 C ATOM 0 H TRP A 49 21.010 -5.996 17.092 1.00 11.22 H new ATOM 0 HA TRP A 49 20.617 -8.155 15.316 1.00 44.33 H new ATOM 0 HB2 TRP A 49 18.776 -6.021 16.453 1.00 23.52 H new ATOM 0 HB3 TRP A 49 18.197 -7.354 15.474 1.00 23.52 H new ATOM 0 HD1 TRP A 49 21.002 -8.445 17.717 1.00 5.31 H new ATOM 0 HE1 TRP A 49 20.100 -9.779 19.740 1.00 24.23 H new ATOM 0 HE3 TRP A 49 16.035 -7.369 17.171 1.00 4.31 H new ATOM 0 HZ2 TRP A 49 17.591 -10.277 20.912 1.00 71.25 H new ATOM 0 HZ3 TRP A 49 14.438 -8.314 18.788 1.00 61.25 H new ATOM 0 HH2 TRP A 49 15.208 -9.749 20.635 1.00 55.44 H new ATOM 800 N ALA A 50 20.130 -5.133 14.063 1.00 43.02 N ATOM 801 CA ALA A 50 20.022 -4.388 12.814 1.00 20.44 C ATOM 802 C ALA A 50 21.255 -4.598 11.942 1.00 52.24 C ATOM 803 O ALA A 50 21.253 -4.259 10.759 1.00 50.34 O ATOM 804 CB ALA A 50 19.820 -2.907 13.099 1.00 32.50 C ATOM 0 H ALA A 50 20.128 -4.553 14.902 1.00 43.02 H new ATOM 0 HA ALA A 50 19.156 -4.763 12.269 1.00 20.44 H new ATOM 0 HB1 ALA A 50 19.741 -2.363 12.158 1.00 32.50 H new ATOM 0 HB2 ALA A 50 18.906 -2.769 13.676 1.00 32.50 H new ATOM 0 HB3 ALA A 50 20.669 -2.527 13.668 1.00 32.50 H new ATOM 810 N GLN A 51 22.305 -5.157 12.533 1.00 21.35 N ATOM 811 CA GLN A 51 23.545 -5.410 11.809 1.00 51.12 C ATOM 812 C GLN A 51 23.783 -6.907 11.643 1.00 72.24 C ATOM 813 O GLN A 51 24.725 -7.325 10.969 1.00 10.11 O ATOM 814 CB GLN A 51 24.727 -4.772 12.540 1.00 0.24 C ATOM 815 CG GLN A 51 24.667 -3.253 12.585 1.00 61.51 C ATOM 816 CD GLN A 51 25.303 -2.608 11.370 1.00 64.44 C ATOM 817 OE1 GLN A 51 26.366 -3.032 10.912 1.00 14.54 O ATOM 818 NE2 GLN A 51 24.656 -1.578 10.839 1.00 53.13 N ATOM 0 H GLN A 51 22.322 -5.444 13.512 1.00 21.35 H new ATOM 0 HA GLN A 51 23.455 -4.963 10.819 1.00 51.12 H new ATOM 0 HB2 GLN A 51 24.763 -5.156 13.559 1.00 0.24 H new ATOM 0 HB3 GLN A 51 25.653 -5.076 12.052 1.00 0.24 H new ATOM 0 HG2 GLN A 51 23.627 -2.936 12.657 1.00 61.51 H new ATOM 0 HG3 GLN A 51 25.171 -2.900 13.485 1.00 61.51 H new ATOM 0 HE21 GLN A 51 23.779 -1.260 11.250 1.00 53.13 H new ATOM 0 HE22 GLN A 51 25.036 -1.105 10.019 1.00 53.13 H new ATOM 827 N ASP A 52 22.924 -7.710 12.261 1.00 55.24 N ATOM 828 CA ASP A 52 23.040 -9.161 12.181 1.00 73.34 C ATOM 829 C ASP A 52 22.735 -9.654 10.769 1.00 3.22 C ATOM 830 O ASP A 52 21.628 -9.474 10.264 1.00 73.10 O ATOM 831 CB ASP A 52 22.093 -9.826 13.181 1.00 22.03 C ATOM 832 CG ASP A 52 22.667 -11.104 13.760 1.00 24.14 C ATOM 833 OD1 ASP A 52 23.583 -11.680 13.136 1.00 72.14 O ATOM 834 OD2 ASP A 52 22.202 -11.528 14.839 1.00 42.22 O ATOM 0 H ASP A 52 22.139 -7.380 12.823 1.00 55.24 H new ATOM 0 HA ASP A 52 24.066 -9.432 12.428 1.00 73.34 H new ATOM 0 HB2 ASP A 52 21.876 -9.129 13.991 1.00 22.03 H new ATOM 0 HB3 ASP A 52 21.146 -10.047 12.689 1.00 22.03 H new ATOM 839 N ALA A 53 23.726 -10.275 10.138 1.00 4.30 N ATOM 840 CA ALA A 53 23.564 -10.794 8.786 1.00 43.34 C ATOM 841 C ALA A 53 22.329 -11.682 8.683 1.00 63.40 C ATOM 842 O ALA A 53 21.647 -11.700 7.658 1.00 45.10 O ATOM 843 CB ALA A 53 24.807 -11.563 8.363 1.00 21.11 C ATOM 0 H ALA A 53 24.650 -10.431 10.542 1.00 4.30 H new ATOM 0 HA ALA A 53 23.428 -9.948 8.113 1.00 43.34 H new ATOM 0 HB1 ALA A 53 24.672 -11.945 7.351 1.00 21.11 H new ATOM 0 HB2 ALA A 53 25.671 -10.899 8.388 1.00 21.11 H new ATOM 0 HB3 ALA A 53 24.969 -12.396 9.047 1.00 21.11 H new ATOM 849 N LYS A 54 22.047 -12.420 9.751 1.00 33.23 N ATOM 850 CA LYS A 54 20.893 -13.312 9.783 1.00 43.44 C ATOM 851 C LYS A 54 19.591 -12.518 9.759 1.00 41.52 C ATOM 852 O LYS A 54 18.585 -12.973 9.215 1.00 53.30 O ATOM 853 CB LYS A 54 20.941 -14.197 11.030 1.00 14.43 C ATOM 854 CG LYS A 54 21.601 -15.544 10.795 1.00 31.14 C ATOM 855 CD LYS A 54 21.469 -16.449 12.009 1.00 12.10 C ATOM 856 CE LYS A 54 22.803 -17.073 12.387 1.00 4.31 C ATOM 857 NZ LYS A 54 22.681 -17.970 13.569 1.00 62.40 N ATOM 0 H LYS A 54 22.602 -12.418 10.607 1.00 33.23 H new ATOM 0 HA LYS A 54 20.929 -13.944 8.896 1.00 43.44 H new ATOM 0 HB2 LYS A 54 21.479 -13.671 11.818 1.00 14.43 H new ATOM 0 HB3 LYS A 54 19.925 -14.358 11.390 1.00 14.43 H new ATOM 0 HG2 LYS A 54 21.147 -16.026 9.929 1.00 31.14 H new ATOM 0 HG3 LYS A 54 22.656 -15.398 10.562 1.00 31.14 H new ATOM 0 HD2 LYS A 54 21.083 -15.875 12.851 1.00 12.10 H new ATOM 0 HD3 LYS A 54 20.744 -17.236 11.800 1.00 12.10 H new ATOM 0 HE2 LYS A 54 23.192 -17.639 11.540 1.00 4.31 H new ATOM 0 HE3 LYS A 54 23.525 -16.285 12.602 1.00 4.31 H new ATOM 0 HZ1 LYS A 54 23.612 -18.375 13.795 1.00 62.40 H new ATOM 0 HZ2 LYS A 54 22.334 -17.425 14.384 1.00 62.40 H new ATOM 0 HZ3 LYS A 54 22.012 -18.737 13.355 1.00 62.40 H new ATOM 871 N PHE A 55 19.618 -11.328 10.350 1.00 11.14 N ATOM 872 CA PHE A 55 18.439 -10.470 10.396 1.00 25.24 C ATOM 873 C PHE A 55 18.234 -9.757 9.063 1.00 11.55 C ATOM 874 O PHE A 55 17.215 -9.100 8.849 1.00 0.34 O ATOM 875 CB PHE A 55 18.574 -9.443 11.522 1.00 12.04 C ATOM 876 CG PHE A 55 17.944 -9.882 12.813 1.00 33.50 C ATOM 877 CD1 PHE A 55 18.621 -10.728 13.677 1.00 11.44 C ATOM 878 CD2 PHE A 55 16.675 -9.450 13.162 1.00 35.13 C ATOM 879 CE1 PHE A 55 18.043 -11.134 14.865 1.00 31.12 C ATOM 880 CE2 PHE A 55 16.092 -9.853 14.349 1.00 14.11 C ATOM 881 CZ PHE A 55 16.777 -10.695 15.202 1.00 23.20 C ATOM 0 H PHE A 55 20.443 -10.936 10.804 1.00 11.14 H new ATOM 0 HA PHE A 55 17.569 -11.098 10.589 1.00 25.24 H new ATOM 0 HB2 PHE A 55 19.631 -9.241 11.693 1.00 12.04 H new ATOM 0 HB3 PHE A 55 18.117 -8.506 11.205 1.00 12.04 H new ATOM 0 HD1 PHE A 55 19.611 -11.074 13.419 1.00 11.44 H new ATOM 0 HD2 PHE A 55 16.135 -8.791 12.499 1.00 35.13 H new ATOM 0 HE1 PHE A 55 18.581 -11.794 15.530 1.00 31.12 H new ATOM 0 HE2 PHE A 55 15.102 -9.509 14.609 1.00 14.11 H new ATOM 0 HZ PHE A 55 16.324 -11.010 16.131 1.00 23.20 H new ATOM 891 N SER A 56 19.210 -9.890 8.171 1.00 74.22 N ATOM 892 CA SER A 56 19.139 -9.255 6.860 1.00 32.11 C ATOM 893 C SER A 56 17.862 -9.659 6.129 1.00 41.10 C ATOM 894 O SER A 56 17.402 -8.959 5.227 1.00 43.02 O ATOM 895 CB SER A 56 20.361 -9.631 6.021 1.00 64.41 C ATOM 896 OG SER A 56 20.492 -8.777 4.898 1.00 54.02 O ATOM 0 H SER A 56 20.059 -10.432 8.332 1.00 74.22 H new ATOM 0 HA SER A 56 19.127 -8.175 7.007 1.00 32.11 H new ATOM 0 HB2 SER A 56 21.260 -9.570 6.635 1.00 64.41 H new ATOM 0 HB3 SER A 56 20.272 -10.665 5.687 1.00 64.41 H new ATOM 0 HG SER A 56 21.282 -9.038 4.379 1.00 54.02 H new ATOM 902 N SER A 57 17.294 -10.794 6.525 1.00 3.54 N ATOM 903 CA SER A 57 16.073 -11.294 5.906 1.00 33.12 C ATOM 904 C SER A 57 14.916 -10.324 6.125 1.00 13.12 C ATOM 905 O SER A 57 13.894 -10.396 5.444 1.00 55.11 O ATOM 906 CB SER A 57 15.715 -12.669 6.474 1.00 54.04 C ATOM 907 OG SER A 57 16.879 -13.437 6.723 1.00 2.34 O ATOM 0 H SER A 57 17.660 -11.384 7.272 1.00 3.54 H new ATOM 0 HA SER A 57 16.249 -11.386 4.834 1.00 33.12 H new ATOM 0 HB2 SER A 57 15.151 -12.548 7.399 1.00 54.04 H new ATOM 0 HB3 SER A 57 15.069 -13.198 5.773 1.00 54.04 H new ATOM 0 HG SER A 57 17.200 -13.259 7.631 1.00 2.34 H new ATOM 913 N ALA A 58 15.086 -9.417 7.081 1.00 15.35 N ATOM 914 CA ALA A 58 14.058 -8.431 7.390 1.00 15.51 C ATOM 915 C ALA A 58 14.658 -7.207 8.073 1.00 3.41 C ATOM 916 O ALA A 58 15.420 -7.330 9.031 1.00 21.30 O ATOM 917 CB ALA A 58 12.978 -9.050 8.266 1.00 43.40 C ATOM 0 H ALA A 58 15.926 -9.345 7.655 1.00 15.35 H new ATOM 0 HA ALA A 58 13.608 -8.107 6.452 1.00 15.51 H new ATOM 0 HB1 ALA A 58 12.217 -8.302 8.489 1.00 43.40 H new ATOM 0 HB2 ALA A 58 12.520 -9.888 7.741 1.00 43.40 H new ATOM 0 HB3 ALA A 58 13.422 -9.404 9.196 1.00 43.40 H new ATOM 923 N ASN A 59 14.311 -6.025 7.573 1.00 35.31 N ATOM 924 CA ASN A 59 14.817 -4.778 8.135 1.00 30.40 C ATOM 925 C ASN A 59 14.423 -4.644 9.603 1.00 50.43 C ATOM 926 O ASN A 59 13.326 -5.038 10.001 1.00 1.23 O ATOM 927 CB ASN A 59 14.285 -3.584 7.341 1.00 41.32 C ATOM 928 CG ASN A 59 14.363 -3.805 5.842 1.00 14.15 C ATOM 929 OD1 ASN A 59 13.418 -3.509 5.110 1.00 20.05 O ATOM 930 ND2 ASN A 59 15.492 -4.328 5.379 1.00 10.14 N ATOM 0 H ASN A 59 13.681 -5.905 6.780 1.00 35.31 H new ATOM 0 HA ASN A 59 15.905 -4.793 8.069 1.00 30.40 H new ATOM 0 HB2 ASN A 59 13.250 -3.395 7.624 1.00 41.32 H new ATOM 0 HB3 ASN A 59 14.855 -2.693 7.604 1.00 41.32 H new ATOM 0 HD21 ASN A 59 15.602 -4.500 4.380 1.00 10.14 H new ATOM 0 HD22 ASN A 59 16.249 -4.558 6.023 1.00 10.14 H new ATOM 937 N LEU A 60 15.324 -4.084 10.402 1.00 1.13 N ATOM 938 CA LEU A 60 15.071 -3.896 11.827 1.00 42.23 C ATOM 939 C LEU A 60 15.500 -2.503 12.276 1.00 14.35 C ATOM 940 O LEU A 60 16.657 -2.115 12.113 1.00 71.54 O ATOM 941 CB LEU A 60 15.813 -4.957 12.641 1.00 73.50 C ATOM 942 CG LEU A 60 15.216 -5.293 14.008 1.00 12.23 C ATOM 943 CD1 LEU A 60 15.933 -6.482 14.627 1.00 63.53 C ATOM 944 CD2 LEU A 60 15.287 -4.085 14.932 1.00 61.51 C ATOM 0 H LEU A 60 16.236 -3.752 10.088 1.00 1.13 H new ATOM 0 HA LEU A 60 13.999 -3.999 11.998 1.00 42.23 H new ATOM 0 HB2 LEU A 60 15.858 -5.873 12.051 1.00 73.50 H new ATOM 0 HB3 LEU A 60 16.840 -4.621 12.788 1.00 73.50 H new ATOM 0 HG LEU A 60 14.168 -5.559 13.870 1.00 12.23 H new ATOM 0 HD11 LEU A 60 15.494 -6.706 15.599 1.00 63.53 H new ATOM 0 HD12 LEU A 60 15.830 -7.349 13.974 1.00 63.53 H new ATOM 0 HD13 LEU A 60 16.990 -6.245 14.752 1.00 63.53 H new ATOM 0 HD21 LEU A 60 14.858 -4.342 15.900 1.00 61.51 H new ATOM 0 HD22 LEU A 60 16.328 -3.788 15.063 1.00 61.51 H new ATOM 0 HD23 LEU A 60 14.727 -3.259 14.494 1.00 61.51 H new ATOM 956 N ILE A 61 14.560 -1.755 12.845 1.00 32.34 N ATOM 957 CA ILE A 61 14.841 -0.407 13.322 1.00 43.10 C ATOM 958 C ILE A 61 14.013 -0.077 14.559 1.00 22.13 C ATOM 959 O ILE A 61 12.978 -0.694 14.810 1.00 34.43 O ATOM 960 CB ILE A 61 14.559 0.645 12.234 1.00 53.45 C ATOM 961 CG1 ILE A 61 13.054 0.751 11.974 1.00 5.53 C ATOM 962 CG2 ILE A 61 15.299 0.294 10.952 1.00 61.42 C ATOM 963 CD1 ILE A 61 12.693 1.778 10.924 1.00 43.32 C ATOM 0 H ILE A 61 13.597 -2.060 12.987 1.00 32.34 H new ATOM 0 HA ILE A 61 15.900 -0.378 13.579 1.00 43.10 H new ATOM 0 HB ILE A 61 14.918 1.613 12.584 1.00 53.45 H new ATOM 0 HG12 ILE A 61 12.678 -0.223 11.662 1.00 5.53 H new ATOM 0 HG13 ILE A 61 12.549 1.004 12.906 1.00 5.53 H new ATOM 0 HG21 ILE A 61 15.089 1.047 10.193 1.00 61.42 H new ATOM 0 HG22 ILE A 61 16.371 0.264 11.147 1.00 61.42 H new ATOM 0 HG23 ILE A 61 14.968 -0.682 10.596 1.00 61.42 H new ATOM 0 HD11 ILE A 61 11.611 1.799 10.792 1.00 43.32 H new ATOM 0 HD12 ILE A 61 13.038 2.761 11.243 1.00 43.32 H new ATOM 0 HD13 ILE A 61 13.169 1.515 9.979 1.00 43.32 H new ATOM 975 N THR A 62 14.475 0.902 15.330 1.00 4.53 N ATOM 976 CA THR A 62 13.778 1.316 16.541 1.00 31.33 C ATOM 977 C THR A 62 13.059 2.644 16.336 1.00 52.04 C ATOM 978 O THR A 62 13.171 3.265 15.278 1.00 34.23 O ATOM 979 CB THR A 62 14.748 1.449 17.731 1.00 73.24 C ATOM 980 OG1 THR A 62 15.551 2.625 17.579 1.00 75.22 O ATOM 981 CG2 THR A 62 15.646 0.226 17.836 1.00 71.41 C ATOM 0 H THR A 62 15.330 1.424 15.137 1.00 4.53 H new ATOM 0 HA THR A 62 13.045 0.540 16.764 1.00 31.33 H new ATOM 0 HB THR A 62 14.159 1.527 18.645 1.00 73.24 H new ATOM 0 HG1 THR A 62 16.164 2.507 16.824 1.00 75.22 H new ATOM 0 HG21 THR A 62 16.322 0.343 18.683 1.00 71.41 H new ATOM 0 HG22 THR A 62 15.033 -0.664 17.981 1.00 71.41 H new ATOM 0 HG23 THR A 62 16.227 0.122 16.920 1.00 71.41 H new ATOM 989 N VAL A 63 12.321 3.076 17.353 1.00 34.01 N ATOM 990 CA VAL A 63 11.584 4.333 17.284 1.00 24.43 C ATOM 991 C VAL A 63 11.342 4.904 18.677 1.00 53.24 C ATOM 992 O VAL A 63 10.914 4.193 19.585 1.00 72.31 O ATOM 993 CB VAL A 63 10.231 4.152 16.572 1.00 34.35 C ATOM 994 CG1 VAL A 63 9.374 3.131 17.306 1.00 72.15 C ATOM 995 CG2 VAL A 63 9.506 5.485 16.459 1.00 24.31 C ATOM 0 H VAL A 63 12.217 2.574 18.235 1.00 34.01 H new ATOM 0 HA VAL A 63 12.196 5.029 16.711 1.00 24.43 H new ATOM 0 HB VAL A 63 10.417 3.779 15.565 1.00 34.35 H new ATOM 0 HG11 VAL A 63 8.422 3.016 16.788 1.00 72.15 H new ATOM 0 HG12 VAL A 63 9.892 2.172 17.331 1.00 72.15 H new ATOM 0 HG13 VAL A 63 9.194 3.473 18.325 1.00 72.15 H new ATOM 0 HG21 VAL A 63 8.552 5.338 15.953 1.00 24.31 H new ATOM 0 HG22 VAL A 63 9.330 5.889 17.456 1.00 24.31 H new ATOM 0 HG23 VAL A 63 10.116 6.184 15.887 1.00 24.31 H new ATOM 1005 N ALA A 64 11.618 6.194 18.837 1.00 54.41 N ATOM 1006 CA ALA A 64 11.427 6.863 20.118 1.00 31.11 C ATOM 1007 C ALA A 64 10.316 7.905 20.034 1.00 64.51 C ATOM 1008 O ALA A 64 9.896 8.290 18.943 1.00 13.53 O ATOM 1009 CB ALA A 64 12.726 7.510 20.574 1.00 23.45 C ATOM 0 H ALA A 64 11.975 6.797 18.095 1.00 54.41 H new ATOM 0 HA ALA A 64 11.130 6.112 20.851 1.00 31.11 H new ATOM 0 HB1 ALA A 64 12.569 8.006 21.532 1.00 23.45 H new ATOM 0 HB2 ALA A 64 13.495 6.745 20.683 1.00 23.45 H new ATOM 0 HB3 ALA A 64 13.047 8.243 19.834 1.00 23.45 H new ATOM 1015 N SER A 65 9.845 8.355 21.192 1.00 2.41 N ATOM 1016 CA SER A 65 8.780 9.349 21.249 1.00 52.41 C ATOM 1017 C SER A 65 9.153 10.493 22.188 1.00 60.34 C ATOM 1018 O SER A 65 8.772 10.519 23.358 1.00 30.51 O ATOM 1019 CB SER A 65 7.473 8.701 21.710 1.00 10.54 C ATOM 1020 OG SER A 65 7.512 7.296 21.537 1.00 31.54 O ATOM 0 H SER A 65 10.184 8.047 22.103 1.00 2.41 H new ATOM 0 HA SER A 65 8.642 9.755 20.247 1.00 52.41 H new ATOM 0 HB2 SER A 65 7.297 8.937 22.760 1.00 10.54 H new ATOM 0 HB3 SER A 65 6.638 9.117 21.146 1.00 10.54 H new ATOM 0 HG SER A 65 6.666 6.905 21.841 1.00 31.54 H new ATOM 1026 N PRO A 66 9.917 11.462 21.663 1.00 2.31 N ATOM 1027 CA PRO A 66 10.359 12.627 22.436 1.00 41.13 C ATOM 1028 C PRO A 66 9.210 13.575 22.764 1.00 64.22 C ATOM 1029 O PRO A 66 8.541 14.087 21.868 1.00 13.41 O ATOM 1030 CB PRO A 66 11.366 13.309 21.506 1.00 74.45 C ATOM 1031 CG PRO A 66 10.960 12.888 20.135 1.00 11.21 C ATOM 1032 CD PRO A 66 10.408 11.496 20.275 1.00 2.43 C ATOM 0 HA PRO A 66 10.776 12.341 23.402 1.00 41.13 H new ATOM 0 HB2 PRO A 66 11.333 14.393 21.613 1.00 74.45 H new ATOM 0 HB3 PRO A 66 12.386 12.997 21.730 1.00 74.45 H new ATOM 0 HG2 PRO A 66 10.211 13.565 19.725 1.00 11.21 H new ATOM 0 HG3 PRO A 66 11.811 12.904 19.454 1.00 11.21 H new ATOM 0 HD2 PRO A 66 9.607 11.308 19.561 1.00 2.43 H new ATOM 0 HD3 PRO A 66 11.174 10.740 20.101 1.00 2.43 H new ATOM 1040 N GLY A 67 8.988 13.804 24.055 1.00 61.24 N ATOM 1041 CA GLY A 67 7.920 14.690 24.477 1.00 13.25 C ATOM 1042 C GLY A 67 6.603 13.963 24.664 1.00 11.02 C ATOM 1043 O GLY A 67 5.551 14.591 24.788 1.00 71.40 O ATOM 0 H GLY A 67 9.529 13.392 24.815 1.00 61.24 H new ATOM 0 HA2 GLY A 67 8.201 15.173 25.413 1.00 13.25 H new ATOM 0 HA3 GLY A 67 7.793 15.480 23.737 1.00 13.25 H new ATOM 1047 N PHE A 68 6.659 12.635 24.683 1.00 4.41 N ATOM 1048 CA PHE A 68 5.461 11.822 24.853 1.00 23.43 C ATOM 1049 C PHE A 68 5.629 10.843 26.012 1.00 73.11 C ATOM 1050 O PHE A 68 6.724 10.338 26.260 1.00 64.44 O ATOM 1051 CB PHE A 68 5.152 11.056 23.565 1.00 12.31 C ATOM 1052 CG PHE A 68 3.829 10.345 23.593 1.00 10.43 C ATOM 1053 CD1 PHE A 68 2.704 10.967 24.112 1.00 65.00 C ATOM 1054 CD2 PHE A 68 3.710 9.056 23.101 1.00 72.14 C ATOM 1055 CE1 PHE A 68 1.486 10.315 24.140 1.00 64.32 C ATOM 1056 CE2 PHE A 68 2.494 8.399 23.125 1.00 21.34 C ATOM 1057 CZ PHE A 68 1.381 9.030 23.645 1.00 73.52 C ATOM 0 H PHE A 68 7.521 12.100 24.583 1.00 4.41 H new ATOM 0 HA PHE A 68 4.629 12.488 25.080 1.00 23.43 H new ATOM 0 HB2 PHE A 68 5.164 11.752 22.726 1.00 12.31 H new ATOM 0 HB3 PHE A 68 5.943 10.328 23.386 1.00 12.31 H new ATOM 0 HD1 PHE A 68 2.780 11.972 24.499 1.00 65.00 H new ATOM 0 HD2 PHE A 68 4.578 8.558 22.694 1.00 72.14 H new ATOM 0 HE1 PHE A 68 0.617 10.810 24.548 1.00 64.32 H new ATOM 0 HE2 PHE A 68 2.414 7.394 22.738 1.00 21.34 H new ATOM 0 HZ PHE A 68 0.430 8.519 23.665 1.00 73.52 H new ATOM 1067 N LEU A 69 4.535 10.580 26.719 1.00 3.52 N ATOM 1068 CA LEU A 69 4.559 9.663 27.853 1.00 64.31 C ATOM 1069 C LEU A 69 5.462 10.192 28.963 1.00 63.44 C ATOM 1070 O LEU A 69 4.995 10.833 29.905 1.00 64.33 O ATOM 1071 CB LEU A 69 5.038 8.281 27.405 1.00 23.43 C ATOM 1072 CG LEU A 69 3.944 7.260 27.091 1.00 52.34 C ATOM 1073 CD1 LEU A 69 3.375 6.674 28.374 1.00 44.33 C ATOM 1074 CD2 LEU A 69 2.841 7.900 26.260 1.00 11.31 C ATOM 0 H LEU A 69 3.621 10.989 26.527 1.00 3.52 H new ATOM 0 HA LEU A 69 3.545 9.581 28.244 1.00 64.31 H new ATOM 0 HB2 LEU A 69 5.658 8.404 26.517 1.00 23.43 H new ATOM 0 HB3 LEU A 69 5.678 7.870 28.186 1.00 23.43 H new ATOM 0 HG LEU A 69 4.386 6.450 26.511 1.00 52.34 H new ATOM 0 HD11 LEU A 69 2.598 5.950 28.130 1.00 44.33 H new ATOM 0 HD12 LEU A 69 4.170 6.179 28.932 1.00 44.33 H new ATOM 0 HD13 LEU A 69 2.949 7.473 28.981 1.00 44.33 H new ATOM 0 HD21 LEU A 69 2.071 7.159 26.046 1.00 11.31 H new ATOM 0 HD22 LEU A 69 2.402 8.730 26.815 1.00 11.31 H new ATOM 0 HD23 LEU A 69 3.259 8.270 25.324 1.00 11.31 H new ATOM 1086 N HIS A 70 6.758 9.921 28.844 1.00 62.42 N ATOM 1087 CA HIS A 70 7.728 10.372 29.836 1.00 73.23 C ATOM 1088 C HIS A 70 9.127 10.446 29.233 1.00 64.01 C ATOM 1089 O HIS A 70 10.125 10.394 29.951 1.00 64.22 O ATOM 1090 CB HIS A 70 7.729 9.433 31.043 1.00 53.14 C ATOM 1091 CG HIS A 70 7.388 10.115 32.332 1.00 61.10 C ATOM 1092 ND1 HIS A 70 6.140 10.637 32.601 1.00 63.33 N ATOM 1093 CD2 HIS A 70 8.140 10.358 33.431 1.00 64.42 C ATOM 1094 CE1 HIS A 70 6.140 11.172 33.808 1.00 3.43 C ATOM 1095 NE2 HIS A 70 7.342 11.016 34.334 1.00 60.14 N ATOM 0 H HIS A 70 7.161 9.392 28.071 1.00 62.42 H new ATOM 0 HA HIS A 70 7.439 11.371 30.163 1.00 73.23 H new ATOM 0 HB2 HIS A 70 7.015 8.628 30.867 1.00 53.14 H new ATOM 0 HB3 HIS A 70 8.713 8.973 31.134 1.00 53.14 H new ATOM 0 HD1 HIS A 70 5.342 10.613 31.967 1.00 63.33 H new ATOM 0 HD2 HIS A 70 9.175 10.085 33.571 1.00 64.42 H new ATOM 0 HE1 HIS A 70 5.300 11.655 34.285 1.00 3.43 H new ATOM 1103 N GLU A 71 9.191 10.567 27.911 1.00 44.04 N ATOM 1104 CA GLU A 71 10.469 10.646 27.212 1.00 2.35 C ATOM 1105 C GLU A 71 10.972 12.086 27.159 1.00 13.23 C ATOM 1106 O GLU A 71 10.192 13.033 27.268 1.00 72.22 O ATOM 1107 CB GLU A 71 10.336 10.088 25.794 1.00 40.30 C ATOM 1108 CG GLU A 71 10.922 8.696 25.630 1.00 34.22 C ATOM 1109 CD GLU A 71 12.389 8.721 25.250 1.00 4.23 C ATOM 1110 OE1 GLU A 71 13.122 9.588 25.770 1.00 44.44 O ATOM 1111 OE2 GLU A 71 12.805 7.873 24.433 1.00 33.22 O ATOM 0 H GLU A 71 8.374 10.612 27.302 1.00 44.04 H new ATOM 0 HA GLU A 71 11.193 10.046 27.764 1.00 2.35 H new ATOM 0 HB2 GLU A 71 9.281 10.064 25.520 1.00 40.30 H new ATOM 0 HB3 GLU A 71 10.831 10.766 25.098 1.00 40.30 H new ATOM 0 HG2 GLU A 71 10.801 8.143 26.562 1.00 34.22 H new ATOM 0 HG3 GLU A 71 10.362 8.158 24.865 1.00 34.22 H new ATOM 1118 N LYS A 72 12.280 12.244 26.992 1.00 3.02 N ATOM 1119 CA LYS A 72 12.889 13.567 26.924 1.00 44.13 C ATOM 1120 C LYS A 72 12.234 14.412 25.836 1.00 51.10 C ATOM 1121 O LYS A 72 11.517 13.894 24.980 1.00 72.41 O ATOM 1122 CB LYS A 72 14.391 13.447 26.655 1.00 21.51 C ATOM 1123 CG LYS A 72 15.121 12.575 27.662 1.00 20.41 C ATOM 1124 CD LYS A 72 16.493 12.165 27.154 1.00 3.10 C ATOM 1125 CE LYS A 72 17.604 12.771 27.999 1.00 71.34 C ATOM 1126 NZ LYS A 72 18.066 11.835 29.061 1.00 63.35 N ATOM 0 H LYS A 72 12.940 11.471 26.901 1.00 3.02 H new ATOM 0 HA LYS A 72 12.736 14.059 27.884 1.00 44.13 H new ATOM 0 HB2 LYS A 72 14.541 13.038 25.656 1.00 21.51 H new ATOM 0 HB3 LYS A 72 14.834 14.443 26.661 1.00 21.51 H new ATOM 0 HG2 LYS A 72 15.227 13.115 28.603 1.00 20.41 H new ATOM 0 HG3 LYS A 72 14.528 11.684 27.871 1.00 20.41 H new ATOM 0 HD2 LYS A 72 16.577 11.078 27.166 1.00 3.10 H new ATOM 0 HD3 LYS A 72 16.608 12.482 26.118 1.00 3.10 H new ATOM 0 HE2 LYS A 72 18.445 13.036 27.358 1.00 71.34 H new ATOM 0 HE3 LYS A 72 17.249 13.694 28.458 1.00 71.34 H new ATOM 0 HZ1 LYS A 72 18.338 12.376 29.906 1.00 63.35 H new ATOM 0 HZ2 LYS A 72 17.297 11.178 29.303 1.00 63.35 H new ATOM 0 HZ3 LYS A 72 18.886 11.296 28.716 1.00 63.35 H new ATOM 1140 N LYS A 73 12.486 15.716 25.874 1.00 15.22 N ATOM 1141 CA LYS A 73 11.923 16.634 24.891 1.00 74.43 C ATOM 1142 C LYS A 73 12.745 16.626 23.606 1.00 3.22 C ATOM 1143 O LYS A 73 13.932 16.297 23.620 1.00 55.23 O ATOM 1144 CB LYS A 73 11.862 18.052 25.462 1.00 41.10 C ATOM 1145 CG LYS A 73 13.203 18.567 25.956 1.00 62.51 C ATOM 1146 CD LYS A 73 13.121 19.044 27.396 1.00 1.20 C ATOM 1147 CE LYS A 73 13.403 17.915 28.375 1.00 63.31 C ATOM 1148 NZ LYS A 73 13.476 18.404 29.780 1.00 65.54 N ATOM 0 H LYS A 73 13.077 16.161 26.576 1.00 15.22 H new ATOM 0 HA LYS A 73 10.912 16.300 24.657 1.00 74.43 H new ATOM 0 HB2 LYS A 73 11.483 18.727 24.695 1.00 41.10 H new ATOM 0 HB3 LYS A 73 11.149 18.073 26.286 1.00 41.10 H new ATOM 0 HG2 LYS A 73 13.949 17.777 25.876 1.00 62.51 H new ATOM 0 HG3 LYS A 73 13.536 19.386 25.319 1.00 62.51 H new ATOM 0 HD2 LYS A 73 13.836 19.851 27.554 1.00 1.20 H new ATOM 0 HD3 LYS A 73 12.130 19.454 27.588 1.00 1.20 H new ATOM 0 HE2 LYS A 73 12.621 17.160 28.293 1.00 63.31 H new ATOM 0 HE3 LYS A 73 14.343 17.431 28.110 1.00 63.31 H new ATOM 0 HZ1 LYS A 73 13.670 17.604 30.416 1.00 65.54 H new ATOM 0 HZ2 LYS A 73 14.239 19.106 29.864 1.00 65.54 H new ATOM 0 HZ3 LYS A 73 12.571 18.844 30.042 1.00 65.54 H new ATOM 1162 N ASP A 74 12.109 16.992 22.499 1.00 14.13 N ATOM 1163 CA ASP A 74 12.783 17.030 21.207 1.00 54.14 C ATOM 1164 C ASP A 74 14.083 17.822 21.295 1.00 41.50 C ATOM 1165 O ASP A 74 14.160 18.833 21.993 1.00 23.51 O ATOM 1166 CB ASP A 74 11.867 17.646 20.148 1.00 74.12 C ATOM 1167 CG ASP A 74 11.048 18.801 20.691 1.00 20.51 C ATOM 1168 OD1 ASP A 74 11.616 19.899 20.869 1.00 74.13 O ATOM 1169 OD2 ASP A 74 9.840 18.606 20.938 1.00 54.10 O ATOM 0 H ASP A 74 11.127 17.267 22.471 1.00 14.13 H new ATOM 0 HA ASP A 74 13.021 16.006 20.919 1.00 54.14 H new ATOM 0 HB2 ASP A 74 12.469 17.995 19.309 1.00 74.12 H new ATOM 0 HB3 ASP A 74 11.196 16.879 19.762 1.00 74.12 H new ATOM 1174 N GLY A 75 15.104 17.356 20.582 1.00 23.15 N ATOM 1175 CA GLY A 75 16.388 18.032 20.595 1.00 2.33 C ATOM 1176 C GLY A 75 17.323 17.482 21.654 1.00 71.30 C ATOM 1177 O GLY A 75 18.494 17.217 21.381 1.00 10.40 O ATOM 0 H GLY A 75 15.065 16.522 19.996 1.00 23.15 H new ATOM 0 HA2 GLY A 75 16.856 17.935 19.616 1.00 2.33 H new ATOM 0 HA3 GLY A 75 16.233 19.097 20.770 1.00 2.33 H new ATOM 1181 N ASP A 76 16.806 17.310 22.866 1.00 61.14 N ATOM 1182 CA ASP A 76 17.603 16.788 23.970 1.00 71.22 C ATOM 1183 C ASP A 76 17.835 15.288 23.811 1.00 14.33 C ATOM 1184 O ASP A 76 18.949 14.799 23.996 1.00 62.13 O ATOM 1185 CB ASP A 76 16.912 17.071 25.304 1.00 13.53 C ATOM 1186 CG ASP A 76 17.753 17.940 26.219 1.00 51.01 C ATOM 1187 OD1 ASP A 76 17.821 19.163 25.977 1.00 12.25 O ATOM 1188 OD2 ASP A 76 18.344 17.396 27.176 1.00 41.55 O ATOM 0 H ASP A 76 15.839 17.524 23.109 1.00 61.14 H new ATOM 0 HA ASP A 76 18.570 17.290 23.957 1.00 71.22 H new ATOM 0 HB2 ASP A 76 15.957 17.562 25.118 1.00 13.53 H new ATOM 0 HB3 ASP A 76 16.693 16.127 25.804 1.00 13.53 H new ATOM 1193 N PHE A 77 16.774 14.564 23.470 1.00 62.24 N ATOM 1194 CA PHE A 77 16.861 13.119 23.289 1.00 43.55 C ATOM 1195 C PHE A 77 17.880 12.767 22.209 1.00 42.24 C ATOM 1196 O PHE A 77 18.623 11.794 22.336 1.00 53.10 O ATOM 1197 CB PHE A 77 15.491 12.547 22.919 1.00 23.12 C ATOM 1198 CG PHE A 77 15.521 11.079 22.602 1.00 13.04 C ATOM 1199 CD1 PHE A 77 15.793 10.640 21.317 1.00 60.41 C ATOM 1200 CD2 PHE A 77 15.277 10.139 23.590 1.00 34.42 C ATOM 1201 CE1 PHE A 77 15.820 9.289 21.023 1.00 52.53 C ATOM 1202 CE2 PHE A 77 15.302 8.787 23.302 1.00 64.00 C ATOM 1203 CZ PHE A 77 15.576 8.362 22.017 1.00 55.04 C ATOM 0 H PHE A 77 15.844 14.954 23.313 1.00 62.24 H new ATOM 0 HA PHE A 77 17.189 12.679 24.231 1.00 43.55 H new ATOM 0 HB2 PHE A 77 14.800 12.719 23.744 1.00 23.12 H new ATOM 0 HB3 PHE A 77 15.100 13.089 22.058 1.00 23.12 H new ATOM 0 HD1 PHE A 77 15.986 11.361 20.536 1.00 60.41 H new ATOM 0 HD2 PHE A 77 15.065 10.466 24.597 1.00 34.42 H new ATOM 0 HE1 PHE A 77 16.032 8.959 20.017 1.00 52.53 H new ATOM 0 HE2 PHE A 77 15.108 8.064 24.081 1.00 64.00 H new ATOM 0 HZ PHE A 77 15.599 7.306 21.790 1.00 55.04 H new ATOM 1213 N GLN A 78 17.908 13.566 21.147 1.00 72.35 N ATOM 1214 CA GLN A 78 18.834 13.338 20.044 1.00 62.42 C ATOM 1215 C GLN A 78 20.279 13.493 20.506 1.00 43.02 C ATOM 1216 O GLN A 78 21.113 12.616 20.279 1.00 72.30 O ATOM 1217 CB GLN A 78 18.545 14.309 18.898 1.00 3.10 C ATOM 1218 CG GLN A 78 17.243 14.020 18.169 1.00 11.22 C ATOM 1219 CD GLN A 78 16.062 14.755 18.772 1.00 34.40 C ATOM 1220 OE1 GLN A 78 15.727 15.864 18.356 1.00 43.15 O ATOM 1221 NE2 GLN A 78 15.422 14.138 19.759 1.00 73.24 N ATOM 0 H GLN A 78 17.300 14.376 21.027 1.00 72.35 H new ATOM 0 HA GLN A 78 18.693 12.317 19.689 1.00 62.42 H new ATOM 0 HB2 GLN A 78 18.513 15.324 19.293 1.00 3.10 H new ATOM 0 HB3 GLN A 78 19.368 14.270 18.184 1.00 3.10 H new ATOM 0 HG2 GLN A 78 17.347 14.304 17.122 1.00 11.22 H new ATOM 0 HG3 GLN A 78 17.049 12.948 18.191 1.00 11.22 H new ATOM 0 HE21 GLN A 78 15.734 13.219 20.073 1.00 73.24 H new ATOM 0 HE22 GLN A 78 14.619 14.583 20.203 1.00 73.24 H new ATOM 1230 N LYS A 79 20.570 14.615 21.155 1.00 2.20 N ATOM 1231 CA LYS A 79 21.914 14.887 21.650 1.00 24.44 C ATOM 1232 C LYS A 79 22.284 13.925 22.776 1.00 50.44 C ATOM 1233 O LYS A 79 23.450 13.568 22.941 1.00 63.33 O ATOM 1234 CB LYS A 79 22.016 16.331 22.146 1.00 53.15 C ATOM 1235 CG LYS A 79 21.018 16.671 23.239 1.00 22.45 C ATOM 1236 CD LYS A 79 21.095 18.137 23.629 1.00 51.44 C ATOM 1237 CE LYS A 79 21.109 18.313 25.139 1.00 4.33 C ATOM 1238 NZ LYS A 79 22.497 18.376 25.677 1.00 34.12 N ATOM 0 H LYS A 79 19.892 15.352 21.351 1.00 2.20 H new ATOM 0 HA LYS A 79 22.613 14.742 20.826 1.00 24.44 H new ATOM 0 HB2 LYS A 79 23.025 16.508 22.519 1.00 53.15 H new ATOM 0 HB3 LYS A 79 21.865 17.007 21.304 1.00 53.15 H new ATOM 0 HG2 LYS A 79 20.010 16.437 22.898 1.00 22.45 H new ATOM 0 HG3 LYS A 79 21.210 16.050 24.114 1.00 22.45 H new ATOM 0 HD2 LYS A 79 21.994 18.581 23.202 1.00 51.44 H new ATOM 0 HD3 LYS A 79 20.244 18.672 23.207 1.00 51.44 H new ATOM 0 HE2 LYS A 79 20.575 19.226 25.403 1.00 4.33 H new ATOM 0 HE3 LYS A 79 20.576 17.485 25.606 1.00 4.33 H new ATOM 0 HZ1 LYS A 79 22.464 18.496 26.709 1.00 34.12 H new ATOM 0 HZ2 LYS A 79 22.999 17.495 25.447 1.00 34.12 H new ATOM 0 HZ3 LYS A 79 22.998 19.181 25.251 1.00 34.12 H new ATOM 1252 N TRP A 80 21.284 13.510 23.545 1.00 42.41 N ATOM 1253 CA TRP A 80 21.505 12.589 24.654 1.00 60.12 C ATOM 1254 C TRP A 80 21.785 11.180 24.143 1.00 22.12 C ATOM 1255 O TRP A 80 22.694 10.504 24.626 1.00 33.33 O ATOM 1256 CB TRP A 80 20.290 12.576 25.583 1.00 72.14 C ATOM 1257 CG TRP A 80 20.194 11.336 26.419 1.00 65.44 C ATOM 1258 CD1 TRP A 80 20.739 11.137 27.655 1.00 65.30 C ATOM 1259 CD2 TRP A 80 19.515 10.123 26.078 1.00 73.53 C ATOM 1260 NE1 TRP A 80 20.439 9.873 28.103 1.00 25.12 N ATOM 1261 CE2 TRP A 80 19.688 9.231 27.154 1.00 24.04 C ATOM 1262 CE3 TRP A 80 18.775 9.703 24.969 1.00 53.30 C ATOM 1263 CZ2 TRP A 80 19.150 7.947 27.152 1.00 53.14 C ATOM 1264 CZ3 TRP A 80 18.241 8.429 24.968 1.00 70.34 C ATOM 1265 CH2 TRP A 80 18.430 7.563 26.053 1.00 33.01 C ATOM 0 H TRP A 80 20.313 13.796 23.421 1.00 42.41 H new ATOM 0 HA TRP A 80 22.376 12.933 25.212 1.00 60.12 H new ATOM 0 HB2 TRP A 80 20.334 13.445 26.239 1.00 72.14 H new ATOM 0 HB3 TRP A 80 19.384 12.674 24.985 1.00 72.14 H new ATOM 0 HD1 TRP A 80 21.320 11.866 28.200 1.00 65.30 H new ATOM 0 HE1 TRP A 80 20.729 9.477 28.997 1.00 25.12 H new ATOM 0 HE3 TRP A 80 18.623 10.363 24.128 1.00 53.30 H new ATOM 0 HZ2 TRP A 80 19.295 7.278 27.987 1.00 53.14 H new ATOM 0 HZ3 TRP A 80 17.668 8.095 24.116 1.00 70.34 H new ATOM 0 HH2 TRP A 80 17.999 6.573 26.022 1.00 33.01 H new ATOM 1276 N TYR A 81 21.000 10.743 23.165 1.00 44.14 N ATOM 1277 CA TYR A 81 21.163 9.413 22.590 1.00 24.12 C ATOM 1278 C TYR A 81 22.385 9.360 21.677 1.00 35.52 C ATOM 1279 O TYR A 81 22.985 8.303 21.487 1.00 64.41 O ATOM 1280 CB TYR A 81 19.910 9.015 21.808 1.00 24.04 C ATOM 1281 CG TYR A 81 20.183 8.045 20.681 1.00 34.43 C ATOM 1282 CD1 TYR A 81 20.349 6.688 20.931 1.00 75.02 C ATOM 1283 CD2 TYR A 81 20.273 8.485 19.366 1.00 32.43 C ATOM 1284 CE1 TYR A 81 20.598 5.798 19.904 1.00 2.11 C ATOM 1285 CE2 TYR A 81 20.521 7.602 18.333 1.00 33.31 C ATOM 1286 CZ TYR A 81 20.683 6.260 18.607 1.00 21.31 C ATOM 1287 OH TYR A 81 20.930 5.376 17.581 1.00 2.24 O ATOM 0 H TYR A 81 20.244 11.290 22.754 1.00 44.14 H new ATOM 0 HA TYR A 81 21.312 8.707 23.407 1.00 24.12 H new ATOM 0 HB2 TYR A 81 19.190 8.569 22.494 1.00 24.04 H new ATOM 0 HB3 TYR A 81 19.446 9.913 21.399 1.00 24.04 H new ATOM 0 HD1 TYR A 81 20.282 6.323 21.945 1.00 75.02 H new ATOM 0 HD2 TYR A 81 20.147 9.535 19.148 1.00 32.43 H new ATOM 0 HE1 TYR A 81 20.725 4.747 20.115 1.00 2.11 H new ATOM 0 HE2 TYR A 81 20.588 7.961 17.316 1.00 33.31 H new ATOM 0 HH TYR A 81 20.344 5.583 16.823 1.00 2.24 H new ATOM 1297 N ALA A 82 22.746 10.508 21.115 1.00 15.52 N ATOM 1298 CA ALA A 82 23.896 10.595 20.224 1.00 31.22 C ATOM 1299 C ALA A 82 25.202 10.454 20.999 1.00 51.43 C ATOM 1300 O ALA A 82 26.277 10.353 20.409 1.00 51.30 O ATOM 1301 CB ALA A 82 23.873 11.909 19.459 1.00 52.45 C ATOM 0 H ALA A 82 22.258 11.392 21.261 1.00 15.52 H new ATOM 0 HA ALA A 82 23.836 9.772 19.512 1.00 31.22 H new ATOM 0 HB1 ALA A 82 24.738 11.960 18.798 1.00 52.45 H new ATOM 0 HB2 ALA A 82 22.960 11.970 18.867 1.00 52.45 H new ATOM 0 HB3 ALA A 82 23.905 12.741 20.163 1.00 52.45 H new ATOM 1307 N GLY A 83 25.101 10.449 22.325 1.00 40.54 N ATOM 1308 CA GLY A 83 26.282 10.322 23.158 1.00 62.21 C ATOM 1309 C GLY A 83 26.267 9.059 23.996 1.00 71.22 C ATOM 1310 O GLY A 83 26.883 9.004 25.061 1.00 32.11 O ATOM 0 H GLY A 83 24.222 10.531 22.837 1.00 40.54 H new ATOM 0 HA2 GLY A 83 27.170 10.325 22.526 1.00 62.21 H new ATOM 0 HA3 GLY A 83 26.355 11.189 23.814 1.00 62.21 H new ATOM 1314 N LEU A 84 25.560 8.041 23.516 1.00 5.21 N ATOM 1315 CA LEU A 84 25.466 6.772 24.229 1.00 14.12 C ATOM 1316 C LEU A 84 26.591 5.829 23.815 1.00 10.42 C ATOM 1317 O LEU A 84 27.641 5.782 24.454 1.00 10.14 O ATOM 1318 CB LEU A 84 24.110 6.115 23.963 1.00 63.23 C ATOM 1319 CG LEU A 84 23.030 6.353 25.018 1.00 32.42 C ATOM 1320 CD1 LEU A 84 23.105 7.776 25.548 1.00 51.35 C ATOM 1321 CD2 LEU A 84 21.650 6.068 24.443 1.00 62.42 C ATOM 0 H LEU A 84 25.044 8.070 22.637 1.00 5.21 H new ATOM 0 HA LEU A 84 25.562 6.975 25.296 1.00 14.12 H new ATOM 0 HB2 LEU A 84 23.737 6.473 23.003 1.00 63.23 H new ATOM 0 HB3 LEU A 84 24.263 5.040 23.864 1.00 63.23 H new ATOM 0 HG LEU A 84 23.204 5.669 25.848 1.00 32.42 H new ATOM 0 HD11 LEU A 84 22.328 7.926 26.298 1.00 51.35 H new ATOM 0 HD12 LEU A 84 24.083 7.945 25.999 1.00 51.35 H new ATOM 0 HD13 LEU A 84 22.958 8.478 24.727 1.00 51.35 H new ATOM 0 HD21 LEU A 84 20.894 6.243 25.208 1.00 62.42 H new ATOM 0 HD22 LEU A 84 21.466 6.727 23.594 1.00 62.42 H new ATOM 0 HD23 LEU A 84 21.600 5.030 24.114 1.00 62.42 H new ATOM 1333 N ASN A 85 26.364 5.082 22.740 1.00 62.21 N ATOM 1334 CA ASN A 85 27.360 4.141 22.239 1.00 10.30 C ATOM 1335 C ASN A 85 26.794 3.309 21.093 1.00 73.51 C ATOM 1336 O ASN A 85 27.135 2.136 20.936 1.00 33.13 O ATOM 1337 CB ASN A 85 27.836 3.222 23.366 1.00 74.12 C ATOM 1338 CG ASN A 85 29.339 3.276 23.560 1.00 33.32 C ATOM 1339 OD1 ASN A 85 30.004 2.148 23.341 1.00 4.35 O flip ATOM 1340 ND2 ASN A 85 29.894 4.319 23.903 1.00 62.23 N flip ATOM 0 H ASN A 85 25.500 5.110 22.199 1.00 62.21 H new ATOM 0 HA ASN A 85 28.208 4.713 21.864 1.00 10.30 H new ATOM 0 HB2 ASN A 85 27.342 3.505 24.295 1.00 74.12 H new ATOM 0 HB3 ASN A 85 27.537 2.197 23.146 1.00 74.12 H new ATOM 0 HD21 ASN A 85 29.342 5.162 24.060 1.00 62.23 H new ATOM 0 HD22 ASN A 85 30.906 4.340 24.030 1.00 62.23 H new ATOM 1347 N TYR A 86 25.928 3.923 20.294 1.00 20.24 N ATOM 1348 CA TYR A 86 25.313 3.238 19.164 1.00 52.25 C ATOM 1349 C TYR A 86 25.092 4.199 17.999 1.00 1.34 C ATOM 1350 O TYR A 86 23.963 4.544 17.651 1.00 53.21 O ATOM 1351 CB TYR A 86 23.981 2.612 19.582 1.00 3.52 C ATOM 1352 CG TYR A 86 23.968 2.117 21.011 1.00 72.24 C ATOM 1353 CD1 TYR A 86 24.429 0.846 21.330 1.00 21.22 C ATOM 1354 CD2 TYR A 86 23.495 2.920 22.041 1.00 55.22 C ATOM 1355 CE1 TYR A 86 24.418 0.389 22.634 1.00 72.22 C ATOM 1356 CE2 TYR A 86 23.481 2.472 23.348 1.00 72.15 C ATOM 1357 CZ TYR A 86 23.943 1.205 23.639 1.00 50.42 C ATOM 1358 OH TYR A 86 23.931 0.754 24.939 1.00 44.32 O ATOM 0 H TYR A 86 25.636 4.894 20.408 1.00 20.24 H new ATOM 0 HA TYR A 86 25.991 2.449 18.838 1.00 52.25 H new ATOM 0 HB2 TYR A 86 23.187 3.348 19.454 1.00 3.52 H new ATOM 0 HB3 TYR A 86 23.755 1.780 18.916 1.00 3.52 H new ATOM 0 HD1 TYR A 86 24.802 0.204 20.546 1.00 21.22 H new ATOM 0 HD2 TYR A 86 23.132 3.912 21.816 1.00 55.22 H new ATOM 0 HE1 TYR A 86 24.780 -0.602 22.865 1.00 72.22 H new ATOM 0 HE2 TYR A 86 23.111 3.110 24.137 1.00 72.15 H new ATOM 0 HH TYR A 86 23.567 1.451 25.524 1.00 44.32 H new ATOM 1368 N PRO A 87 26.197 4.643 17.382 1.00 62.51 N ATOM 1369 CA PRO A 87 26.152 5.569 16.247 1.00 62.13 C ATOM 1370 C PRO A 87 25.592 4.916 14.988 1.00 50.24 C ATOM 1371 O PRO A 87 25.338 5.588 13.988 1.00 51.03 O ATOM 1372 CB PRO A 87 27.620 5.952 16.043 1.00 62.33 C ATOM 1373 CG PRO A 87 28.391 4.804 16.598 1.00 44.42 C ATOM 1374 CD PRO A 87 27.576 4.273 17.744 1.00 71.00 C ATOM 0 HA PRO A 87 25.498 6.420 16.441 1.00 62.13 H new ATOM 0 HB2 PRO A 87 27.846 6.108 14.988 1.00 62.33 H new ATOM 0 HB3 PRO A 87 27.863 6.880 16.561 1.00 62.33 H new ATOM 0 HG2 PRO A 87 28.546 4.036 15.841 1.00 44.42 H new ATOM 0 HG3 PRO A 87 29.377 5.123 16.935 1.00 44.42 H new ATOM 0 HD2 PRO A 87 27.688 3.194 17.851 1.00 71.00 H new ATOM 0 HD3 PRO A 87 27.876 4.720 18.692 1.00 71.00 H new ATOM 1382 N LYS A 88 25.401 3.602 15.043 1.00 51.42 N ATOM 1383 CA LYS A 88 24.869 2.858 13.908 1.00 72.22 C ATOM 1384 C LYS A 88 23.539 2.200 14.263 1.00 1.54 C ATOM 1385 O LYS A 88 23.115 1.243 13.615 1.00 25.52 O ATOM 1386 CB LYS A 88 25.871 1.794 13.455 1.00 71.52 C ATOM 1387 CG LYS A 88 26.380 2.001 12.039 1.00 73.23 C ATOM 1388 CD LYS A 88 27.393 3.131 11.970 1.00 24.32 C ATOM 1389 CE LYS A 88 26.890 4.279 11.110 1.00 41.53 C ATOM 1390 NZ LYS A 88 27.505 4.267 9.753 1.00 13.13 N ATOM 0 H LYS A 88 25.607 3.030 15.862 1.00 51.42 H new ATOM 0 HA LYS A 88 24.700 3.561 13.092 1.00 72.22 H new ATOM 0 HB2 LYS A 88 26.719 1.791 14.140 1.00 71.52 H new ATOM 0 HB3 LYS A 88 25.402 0.813 13.524 1.00 71.52 H new ATOM 0 HG2 LYS A 88 26.836 1.080 11.677 1.00 73.23 H new ATOM 0 HG3 LYS A 88 25.541 2.222 11.379 1.00 73.23 H new ATOM 0 HD2 LYS A 88 27.604 3.494 12.976 1.00 24.32 H new ATOM 0 HD3 LYS A 88 28.332 2.755 11.564 1.00 24.32 H new ATOM 0 HE2 LYS A 88 25.806 4.216 11.018 1.00 41.53 H new ATOM 0 HE3 LYS A 88 27.113 5.226 11.602 1.00 41.53 H new ATOM 0 HZ1 LYS A 88 27.136 5.065 9.198 1.00 13.13 H new ATOM 0 HZ2 LYS A 88 28.538 4.353 9.839 1.00 13.13 H new ATOM 0 HZ3 LYS A 88 27.271 3.374 9.274 1.00 13.13 H new ATOM 1404 N LEU A 89 22.884 2.721 15.295 1.00 3.22 N ATOM 1405 CA LEU A 89 21.601 2.186 15.736 1.00 31.20 C ATOM 1406 C LEU A 89 20.445 2.974 15.129 1.00 74.32 C ATOM 1407 O LEU A 89 20.293 4.175 15.355 1.00 61.53 O ATOM 1408 CB LEU A 89 21.510 2.219 17.263 1.00 75.34 C ATOM 1409 CG LEU A 89 20.179 1.766 17.865 1.00 1.13 C ATOM 1410 CD1 LEU A 89 19.897 0.315 17.508 1.00 64.01 C ATOM 1411 CD2 LEU A 89 20.186 1.954 19.375 1.00 24.34 C ATOM 0 H LEU A 89 23.221 3.513 15.842 1.00 3.22 H new ATOM 0 HA LEU A 89 21.530 1.153 15.396 1.00 31.20 H new ATOM 0 HB2 LEU A 89 22.302 1.590 17.668 1.00 75.34 H new ATOM 0 HB3 LEU A 89 21.709 3.237 17.597 1.00 75.34 H new ATOM 0 HG LEU A 89 19.384 2.382 17.445 1.00 1.13 H new ATOM 0 HD11 LEU A 89 18.946 0.011 17.945 1.00 64.01 H new ATOM 0 HD12 LEU A 89 19.848 0.210 16.424 1.00 64.01 H new ATOM 0 HD13 LEU A 89 20.694 -0.317 17.898 1.00 64.01 H new ATOM 0 HD21 LEU A 89 19.231 1.627 19.787 1.00 24.34 H new ATOM 0 HD22 LEU A 89 20.991 1.363 19.811 1.00 24.34 H new ATOM 0 HD23 LEU A 89 20.340 3.007 19.610 1.00 24.34 H new ATOM 1423 N PRO A 90 19.607 2.283 14.341 1.00 41.42 N ATOM 1424 CA PRO A 90 18.448 2.898 13.687 1.00 12.01 C ATOM 1425 C PRO A 90 17.356 3.278 14.681 1.00 33.01 C ATOM 1426 O PRO A 90 16.767 2.415 15.332 1.00 21.42 O ATOM 1427 CB PRO A 90 17.952 1.802 12.741 1.00 72.13 C ATOM 1428 CG PRO A 90 18.420 0.529 13.357 1.00 32.11 C ATOM 1429 CD PRO A 90 19.727 0.850 14.028 1.00 70.54 C ATOM 0 HA PRO A 90 18.710 3.828 13.183 1.00 12.01 H new ATOM 0 HB2 PRO A 90 16.866 1.821 12.648 1.00 72.13 H new ATOM 0 HB3 PRO A 90 18.360 1.930 11.738 1.00 72.13 H new ATOM 0 HG2 PRO A 90 17.693 0.154 14.077 1.00 32.11 H new ATOM 0 HG3 PRO A 90 18.549 -0.246 12.601 1.00 32.11 H new ATOM 0 HD2 PRO A 90 19.874 0.253 14.928 1.00 70.54 H new ATOM 0 HD3 PRO A 90 20.575 0.652 13.372 1.00 70.54 H new ATOM 1437 N VAL A 91 17.089 4.575 14.793 1.00 0.41 N ATOM 1438 CA VAL A 91 16.066 5.070 15.707 1.00 60.51 C ATOM 1439 C VAL A 91 15.235 6.171 15.058 1.00 5.23 C ATOM 1440 O VAL A 91 15.767 7.202 14.644 1.00 75.31 O ATOM 1441 CB VAL A 91 16.689 5.610 17.008 1.00 61.12 C ATOM 1442 CG1 VAL A 91 15.608 5.904 18.036 1.00 35.01 C ATOM 1443 CG2 VAL A 91 17.707 4.624 17.560 1.00 63.20 C ATOM 0 H VAL A 91 17.567 5.303 14.262 1.00 0.41 H new ATOM 0 HA VAL A 91 15.420 4.225 15.946 1.00 60.51 H new ATOM 0 HB VAL A 91 17.206 6.543 16.783 1.00 61.12 H new ATOM 0 HG11 VAL A 91 16.067 6.285 18.948 1.00 35.01 H new ATOM 0 HG12 VAL A 91 14.920 6.650 17.638 1.00 35.01 H new ATOM 0 HG13 VAL A 91 15.060 4.989 18.260 1.00 35.01 H new ATOM 0 HG21 VAL A 91 18.137 5.022 18.479 1.00 63.20 H new ATOM 0 HG22 VAL A 91 17.216 3.674 17.770 1.00 63.20 H new ATOM 0 HG23 VAL A 91 18.498 4.469 16.826 1.00 63.20 H new ATOM 1453 N VAL A 92 13.928 5.947 14.974 1.00 50.13 N ATOM 1454 CA VAL A 92 13.022 6.921 14.377 1.00 44.52 C ATOM 1455 C VAL A 92 12.377 7.798 15.444 1.00 2.12 C ATOM 1456 O VAL A 92 11.757 7.298 16.383 1.00 12.13 O ATOM 1457 CB VAL A 92 11.916 6.231 13.558 1.00 72.05 C ATOM 1458 CG1 VAL A 92 11.073 7.262 12.823 1.00 15.22 C ATOM 1459 CG2 VAL A 92 12.520 5.232 12.582 1.00 2.22 C ATOM 0 H VAL A 92 13.472 5.099 15.312 1.00 50.13 H new ATOM 0 HA VAL A 92 13.621 7.544 13.712 1.00 44.52 H new ATOM 0 HB VAL A 92 11.266 5.688 14.244 1.00 72.05 H new ATOM 0 HG11 VAL A 92 10.297 6.755 12.250 1.00 15.22 H new ATOM 0 HG12 VAL A 92 10.610 7.935 13.545 1.00 15.22 H new ATOM 0 HG13 VAL A 92 11.707 7.836 12.147 1.00 15.22 H new ATOM 0 HG21 VAL A 92 11.724 4.754 12.012 1.00 2.22 H new ATOM 0 HG22 VAL A 92 13.193 5.751 11.900 1.00 2.22 H new ATOM 0 HG23 VAL A 92 13.076 4.474 13.134 1.00 2.22 H new ATOM 1469 N THR A 93 12.527 9.111 15.294 1.00 31.44 N ATOM 1470 CA THR A 93 11.960 10.058 16.245 1.00 13.15 C ATOM 1471 C THR A 93 10.477 10.288 15.975 1.00 44.23 C ATOM 1472 O THR A 93 10.041 10.297 14.824 1.00 71.15 O ATOM 1473 CB THR A 93 12.695 11.411 16.197 1.00 31.21 C ATOM 1474 OG1 THR A 93 13.283 11.603 14.906 1.00 62.22 O ATOM 1475 CG2 THR A 93 13.774 11.479 17.267 1.00 62.31 C ATOM 0 H THR A 93 13.037 9.542 14.523 1.00 31.44 H new ATOM 0 HA THR A 93 12.082 9.621 17.236 1.00 13.15 H new ATOM 0 HB THR A 93 11.969 12.201 16.386 1.00 31.21 H new ATOM 0 HG1 THR A 93 13.747 12.466 14.883 1.00 62.22 H new ATOM 0 HG21 THR A 93 14.279 12.443 17.214 1.00 62.31 H new ATOM 0 HG22 THR A 93 13.319 11.362 18.251 1.00 62.31 H new ATOM 0 HG23 THR A 93 14.498 10.681 17.105 1.00 62.31 H new ATOM 1483 N ASP A 94 9.708 10.475 17.041 1.00 0.04 N ATOM 1484 CA ASP A 94 8.274 10.707 16.918 1.00 14.44 C ATOM 1485 C ASP A 94 7.827 11.844 17.833 1.00 72.14 C ATOM 1486 O ASP A 94 7.467 11.620 18.987 1.00 33.42 O ATOM 1487 CB ASP A 94 7.498 9.432 17.253 1.00 2.21 C ATOM 1488 CG ASP A 94 6.589 8.994 16.122 1.00 62.41 C ATOM 1489 OD1 ASP A 94 5.833 9.843 15.605 1.00 70.33 O ATOM 1490 OD2 ASP A 94 6.634 7.802 15.753 1.00 24.42 O ATOM 0 H ASP A 94 10.054 10.471 18.001 1.00 0.04 H new ATOM 0 HA ASP A 94 8.064 10.990 15.886 1.00 14.44 H new ATOM 0 HB2 ASP A 94 8.202 8.631 17.481 1.00 2.21 H new ATOM 0 HB3 ASP A 94 6.902 9.598 18.151 1.00 2.21 H new ATOM 1495 N ASN A 95 7.854 13.065 17.307 1.00 23.44 N ATOM 1496 CA ASN A 95 7.454 14.237 18.077 1.00 73.10 C ATOM 1497 C ASN A 95 6.005 14.115 18.540 1.00 22.43 C ATOM 1498 O ASN A 95 5.082 14.536 17.845 1.00 43.23 O ATOM 1499 CB ASN A 95 7.628 15.506 17.240 1.00 32.12 C ATOM 1500 CG ASN A 95 8.949 15.531 16.495 1.00 35.42 C ATOM 1501 OD1 ASN A 95 10.003 15.765 17.086 1.00 52.41 O ATOM 1502 ND2 ASN A 95 8.896 15.288 15.191 1.00 63.23 N ATOM 0 H ASN A 95 8.148 13.268 16.352 1.00 23.44 H new ATOM 0 HA ASN A 95 8.094 14.299 18.957 1.00 73.10 H new ATOM 0 HB2 ASN A 95 6.809 15.581 16.525 1.00 32.12 H new ATOM 0 HB3 ASN A 95 7.564 16.378 17.890 1.00 32.12 H new ATOM 0 HD21 ASN A 95 9.752 15.290 14.637 1.00 63.23 H new ATOM 0 HD22 ASN A 95 7.999 15.099 14.744 1.00 63.23 H new ATOM 1509 N GLY A 96 5.814 13.534 19.721 1.00 2.34 N ATOM 1510 CA GLY A 96 4.476 13.367 20.258 1.00 42.20 C ATOM 1511 C GLY A 96 3.978 11.941 20.138 1.00 33.35 C ATOM 1512 O GLY A 96 2.814 11.657 20.421 1.00 65.52 O ATOM 0 H GLY A 96 6.562 13.176 20.315 1.00 2.34 H new ATOM 0 HA2 GLY A 96 4.469 13.664 21.307 1.00 42.20 H new ATOM 0 HA3 GLY A 96 3.791 14.033 19.733 1.00 42.20 H new ATOM 1516 N GLY A 97 4.860 11.040 19.717 1.00 43.14 N ATOM 1517 CA GLY A 97 4.484 9.647 19.566 1.00 71.33 C ATOM 1518 C GLY A 97 3.391 9.450 18.534 1.00 35.14 C ATOM 1519 O GLY A 97 2.445 8.694 18.757 1.00 35.51 O ATOM 0 H GLY A 97 5.829 11.250 19.478 1.00 43.14 H new ATOM 0 HA2 GLY A 97 5.360 9.067 19.278 1.00 71.33 H new ATOM 0 HA3 GLY A 97 4.146 9.259 20.527 1.00 71.33 H new ATOM 1523 N THR A 98 3.518 10.134 17.401 1.00 33.43 N ATOM 1524 CA THR A 98 2.531 10.033 16.333 1.00 25.11 C ATOM 1525 C THR A 98 2.269 8.578 15.963 1.00 74.32 C ATOM 1526 O THR A 98 1.119 8.143 15.896 1.00 34.44 O ATOM 1527 CB THR A 98 2.986 10.797 15.075 1.00 30.20 C ATOM 1528 OG1 THR A 98 4.055 11.691 15.404 1.00 31.13 O ATOM 1529 CG2 THR A 98 1.831 11.580 14.471 1.00 55.42 C ATOM 0 H THR A 98 4.295 10.764 17.199 1.00 33.43 H new ATOM 0 HA THR A 98 1.611 10.481 16.709 1.00 25.11 H new ATOM 0 HB THR A 98 3.334 10.070 14.341 1.00 30.20 H new ATOM 0 HG1 THR A 98 4.912 11.228 15.301 1.00 31.13 H new ATOM 0 HG21 THR A 98 2.176 12.111 13.584 1.00 55.42 H new ATOM 0 HG22 THR A 98 1.031 10.893 14.194 1.00 55.42 H new ATOM 0 HG23 THR A 98 1.457 12.298 15.201 1.00 55.42 H new ATOM 1537 N ILE A 99 3.341 7.830 15.723 1.00 14.14 N ATOM 1538 CA ILE A 99 3.225 6.423 15.362 1.00 74.14 C ATOM 1539 C ILE A 99 2.765 5.586 16.550 1.00 34.23 C ATOM 1540 O ILE A 99 1.837 4.785 16.437 1.00 63.14 O ATOM 1541 CB ILE A 99 4.562 5.863 14.841 1.00 53.41 C ATOM 1542 CG1 ILE A 99 5.039 6.667 13.630 1.00 53.35 C ATOM 1543 CG2 ILE A 99 4.417 4.392 14.483 1.00 33.22 C ATOM 1544 CD1 ILE A 99 6.359 6.188 13.069 1.00 44.44 C ATOM 0 H ILE A 99 4.300 8.175 15.772 1.00 14.14 H new ATOM 0 HA ILE A 99 2.481 6.362 14.568 1.00 74.14 H new ATOM 0 HB ILE A 99 5.309 5.953 15.630 1.00 53.41 H new ATOM 0 HG12 ILE A 99 4.281 6.615 12.848 1.00 53.35 H new ATOM 0 HG13 ILE A 99 5.133 7.715 13.914 1.00 53.35 H new ATOM 0 HG21 ILE A 99 5.370 4.011 14.116 1.00 33.22 H new ATOM 0 HG22 ILE A 99 4.118 3.830 15.368 1.00 33.22 H new ATOM 0 HG23 ILE A 99 3.659 4.279 13.708 1.00 33.22 H new ATOM 0 HD11 ILE A 99 6.635 6.804 12.213 1.00 44.44 H new ATOM 0 HD12 ILE A 99 7.130 6.266 13.836 1.00 44.44 H new ATOM 0 HD13 ILE A 99 6.265 5.149 12.753 1.00 44.44 H new ATOM 1556 N ALA A 100 3.419 5.778 17.691 1.00 14.41 N ATOM 1557 CA ALA A 100 3.074 5.044 18.902 1.00 3.23 C ATOM 1558 C ALA A 100 1.579 5.130 19.190 1.00 62.42 C ATOM 1559 O ALA A 100 0.930 4.117 19.450 1.00 11.11 O ATOM 1560 CB ALA A 100 3.872 5.573 20.085 1.00 42.31 C ATOM 0 H ALA A 100 4.191 6.436 17.802 1.00 14.41 H new ATOM 0 HA ALA A 100 3.327 3.995 18.746 1.00 3.23 H new ATOM 0 HB1 ALA A 100 3.604 5.016 20.983 1.00 42.31 H new ATOM 0 HB2 ALA A 100 4.937 5.453 19.888 1.00 42.31 H new ATOM 0 HB3 ALA A 100 3.647 6.629 20.233 1.00 42.31 H new ATOM 1566 N GLN A 101 1.040 6.344 19.142 1.00 64.45 N ATOM 1567 CA GLN A 101 -0.379 6.560 19.399 1.00 65.15 C ATOM 1568 C GLN A 101 -1.235 5.841 18.362 1.00 73.32 C ATOM 1569 O GLN A 101 -2.296 5.306 18.682 1.00 35.45 O ATOM 1570 CB GLN A 101 -0.697 8.056 19.392 1.00 74.11 C ATOM 1571 CG GLN A 101 -1.273 8.561 20.705 1.00 1.11 C ATOM 1572 CD GLN A 101 -2.783 8.685 20.671 1.00 14.11 C ATOM 1573 OE1 GLN A 101 -3.324 9.777 20.492 1.00 73.33 O ATOM 1574 NE2 GLN A 101 -3.474 7.564 20.843 1.00 23.13 N ATOM 0 H GLN A 101 1.564 7.192 18.928 1.00 64.45 H new ATOM 0 HA GLN A 101 -0.612 6.151 20.382 1.00 65.15 H new ATOM 0 HB2 GLN A 101 0.213 8.612 19.166 1.00 74.11 H new ATOM 0 HB3 GLN A 101 -1.405 8.265 18.590 1.00 74.11 H new ATOM 0 HG2 GLN A 101 -0.986 7.882 21.508 1.00 1.11 H new ATOM 0 HG3 GLN A 101 -0.838 9.533 20.938 1.00 1.11 H new ATOM 0 HE21 GLN A 101 -2.985 6.681 20.988 1.00 23.13 H new ATOM 0 HE22 GLN A 101 -4.494 7.586 20.830 1.00 23.13 H new ATOM 1583 N SER A 102 -0.768 5.833 17.118 1.00 64.54 N ATOM 1584 CA SER A 102 -1.493 5.183 16.033 1.00 72.45 C ATOM 1585 C SER A 102 -1.421 3.664 16.163 1.00 3.35 C ATOM 1586 O SER A 102 -2.301 2.946 15.688 1.00 62.50 O ATOM 1587 CB SER A 102 -0.926 5.617 14.680 1.00 72.24 C ATOM 1588 OG SER A 102 -1.588 6.773 14.196 1.00 32.15 O ATOM 0 H SER A 102 0.110 6.270 16.836 1.00 64.54 H new ATOM 0 HA SER A 102 -2.538 5.486 16.096 1.00 72.45 H new ATOM 0 HB2 SER A 102 0.141 5.819 14.777 1.00 72.24 H new ATOM 0 HB3 SER A 102 -1.032 4.805 13.960 1.00 72.24 H new ATOM 0 HG SER A 102 -1.206 7.031 13.331 1.00 32.15 H new ATOM 1594 N LEU A 103 -0.366 3.183 16.811 1.00 22.44 N ATOM 1595 CA LEU A 103 -0.176 1.749 17.006 1.00 15.22 C ATOM 1596 C LEU A 103 -0.688 1.314 18.376 1.00 62.44 C ATOM 1597 O LEU A 103 -0.669 0.129 18.708 1.00 4.42 O ATOM 1598 CB LEU A 103 1.302 1.386 16.862 1.00 24.01 C ATOM 1599 CG LEU A 103 1.724 0.812 15.509 1.00 51.22 C ATOM 1600 CD1 LEU A 103 1.023 -0.512 15.249 1.00 23.41 C ATOM 1601 CD2 LEU A 103 1.426 1.803 14.393 1.00 15.11 C ATOM 0 H LEU A 103 0.371 3.764 17.210 1.00 22.44 H new ATOM 0 HA LEU A 103 -0.748 1.224 16.241 1.00 15.22 H new ATOM 0 HB2 LEU A 103 1.895 2.280 17.056 1.00 24.01 H new ATOM 0 HB3 LEU A 103 1.555 0.661 17.636 1.00 24.01 H new ATOM 0 HG LEU A 103 2.799 0.633 15.531 1.00 51.22 H new ATOM 0 HD11 LEU A 103 1.336 -0.905 14.282 1.00 23.41 H new ATOM 0 HD12 LEU A 103 1.286 -1.223 16.032 1.00 23.41 H new ATOM 0 HD13 LEU A 103 -0.056 -0.358 15.246 1.00 23.41 H new ATOM 0 HD21 LEU A 103 1.733 1.378 13.437 1.00 15.11 H new ATOM 0 HD22 LEU A 103 0.357 2.014 14.370 1.00 15.11 H new ATOM 0 HD23 LEU A 103 1.975 2.728 14.572 1.00 15.11 H new ATOM 1613 N ASN A 104 -1.147 2.279 19.165 1.00 5.50 N ATOM 1614 CA ASN A 104 -1.665 1.995 20.498 1.00 1.42 C ATOM 1615 C ASN A 104 -0.569 1.435 21.400 1.00 52.10 C ATOM 1616 O ASN A 104 -0.810 0.527 22.196 1.00 15.20 O ATOM 1617 CB ASN A 104 -2.829 1.005 20.415 1.00 4.44 C ATOM 1618 CG ASN A 104 -3.868 1.243 21.494 1.00 42.11 C ATOM 1619 OD1 ASN A 104 -3.604 1.922 22.486 1.00 15.33 O ATOM 1620 ND2 ASN A 104 -5.057 0.683 21.304 1.00 64.24 N ATOM 0 H ASN A 104 -1.171 3.265 18.905 1.00 5.50 H new ATOM 0 HA ASN A 104 -2.022 2.930 20.929 1.00 1.42 H new ATOM 0 HB2 ASN A 104 -3.301 1.085 19.436 1.00 4.44 H new ATOM 0 HB3 ASN A 104 -2.445 -0.011 20.502 1.00 4.44 H new ATOM 0 HD21 ASN A 104 -5.796 0.808 21.996 1.00 64.24 H new ATOM 0 HD22 ASN A 104 -5.231 0.128 20.466 1.00 64.24 H new ATOM 1627 N ILE A 105 0.634 1.983 21.269 1.00 23.25 N ATOM 1628 CA ILE A 105 1.766 1.539 22.073 1.00 3.05 C ATOM 1629 C ILE A 105 1.824 2.287 23.401 1.00 22.22 C ATOM 1630 O ILE A 105 2.453 3.340 23.506 1.00 65.45 O ATOM 1631 CB ILE A 105 3.099 1.737 21.327 1.00 31.11 C ATOM 1632 CG1 ILE A 105 3.069 1.007 19.983 1.00 54.45 C ATOM 1633 CG2 ILE A 105 4.260 1.244 22.177 1.00 3.13 C ATOM 1634 CD1 ILE A 105 2.935 -0.494 20.112 1.00 14.34 C ATOM 0 H ILE A 105 0.850 2.735 20.614 1.00 23.25 H new ATOM 0 HA ILE A 105 1.620 0.476 22.263 1.00 3.05 H new ATOM 0 HB ILE A 105 3.238 2.802 21.139 1.00 31.11 H new ATOM 0 HG12 ILE A 105 2.237 1.388 19.391 1.00 54.45 H new ATOM 0 HG13 ILE A 105 3.982 1.236 19.434 1.00 54.45 H new ATOM 0 HG21 ILE A 105 5.195 1.391 21.636 1.00 3.13 H new ATOM 0 HG22 ILE A 105 4.290 1.804 23.112 1.00 3.13 H new ATOM 0 HG23 ILE A 105 4.128 0.184 22.393 1.00 3.13 H new ATOM 0 HD11 ILE A 105 2.921 -0.945 19.120 1.00 14.34 H new ATOM 0 HD12 ILE A 105 3.780 -0.888 20.677 1.00 14.34 H new ATOM 0 HD13 ILE A 105 2.008 -0.733 20.633 1.00 14.34 H new ATOM 1646 N SER A 106 1.165 1.734 24.415 1.00 51.35 N ATOM 1647 CA SER A 106 1.139 2.350 25.736 1.00 24.22 C ATOM 1648 C SER A 106 2.151 1.684 26.665 1.00 54.41 C ATOM 1649 O SER A 106 2.606 2.285 27.638 1.00 1.02 O ATOM 1650 CB SER A 106 -0.263 2.255 26.339 1.00 34.13 C ATOM 1651 OG SER A 106 -0.763 0.931 26.262 1.00 54.23 O ATOM 0 H SER A 106 0.642 0.861 24.346 1.00 51.35 H new ATOM 0 HA SER A 106 1.408 3.400 25.626 1.00 24.22 H new ATOM 0 HB2 SER A 106 -0.237 2.577 27.380 1.00 34.13 H new ATOM 0 HB3 SER A 106 -0.935 2.932 25.812 1.00 34.13 H new ATOM 0 HG SER A 106 -1.660 0.897 26.656 1.00 54.23 H new ATOM 1657 N VAL A 107 2.497 0.439 26.357 1.00 65.34 N ATOM 1658 CA VAL A 107 3.455 -0.310 27.162 1.00 44.43 C ATOM 1659 C VAL A 107 4.767 -0.509 26.411 1.00 3.41 C ATOM 1660 O VAL A 107 4.773 -0.888 25.240 1.00 41.44 O ATOM 1661 CB VAL A 107 2.894 -1.686 27.566 1.00 4.24 C ATOM 1662 CG1 VAL A 107 1.847 -1.535 28.659 1.00 72.31 C ATOM 1663 CG2 VAL A 107 2.315 -2.401 26.356 1.00 71.54 C ATOM 0 H VAL A 107 2.128 -0.073 25.556 1.00 65.34 H new ATOM 0 HA VAL A 107 3.640 0.277 28.062 1.00 44.43 H new ATOM 0 HB VAL A 107 3.711 -2.291 27.960 1.00 4.24 H new ATOM 0 HG11 VAL A 107 1.462 -2.517 28.932 1.00 72.31 H new ATOM 0 HG12 VAL A 107 2.299 -1.067 29.533 1.00 72.31 H new ATOM 0 HG13 VAL A 107 1.029 -0.912 28.296 1.00 72.31 H new ATOM 0 HG21 VAL A 107 1.923 -3.372 26.660 1.00 71.54 H new ATOM 0 HG22 VAL A 107 1.510 -1.802 25.930 1.00 71.54 H new ATOM 0 HG23 VAL A 107 3.096 -2.543 25.609 1.00 71.54 H new ATOM 1673 N TYR A 108 5.878 -0.251 27.093 1.00 14.13 N ATOM 1674 CA TYR A 108 7.197 -0.400 26.491 1.00 51.35 C ATOM 1675 C TYR A 108 8.055 -1.373 27.292 1.00 24.30 C ATOM 1676 O TYR A 108 7.880 -1.548 28.498 1.00 30.30 O ATOM 1677 CB TYR A 108 7.895 0.958 26.400 1.00 43.10 C ATOM 1678 CG TYR A 108 7.052 2.031 25.748 1.00 61.52 C ATOM 1679 CD1 TYR A 108 7.070 2.215 24.371 1.00 60.31 C ATOM 1680 CD2 TYR A 108 6.237 2.859 26.509 1.00 14.00 C ATOM 1681 CE1 TYR A 108 6.302 3.194 23.771 1.00 31.32 C ATOM 1682 CE2 TYR A 108 5.464 3.840 25.918 1.00 71.34 C ATOM 1683 CZ TYR A 108 5.500 4.003 24.549 1.00 44.54 C ATOM 1684 OH TYR A 108 4.733 4.979 23.955 1.00 74.12 O ATOM 0 H TYR A 108 5.891 0.062 28.064 1.00 14.13 H new ATOM 0 HA TYR A 108 7.067 -0.802 25.486 1.00 51.35 H new ATOM 0 HB2 TYR A 108 8.170 1.284 27.403 1.00 43.10 H new ATOM 0 HB3 TYR A 108 8.821 0.844 25.837 1.00 43.10 H new ATOM 0 HD1 TYR A 108 7.695 1.582 23.759 1.00 60.31 H new ATOM 0 HD2 TYR A 108 6.207 2.734 27.581 1.00 14.00 H new ATOM 0 HE1 TYR A 108 6.329 3.325 22.699 1.00 31.32 H new ATOM 0 HE2 TYR A 108 4.835 4.475 26.524 1.00 71.34 H new ATOM 0 HH TYR A 108 3.855 4.610 23.723 1.00 74.12 H new ATOM 1694 N PRO A 109 9.008 -2.023 26.607 1.00 51.04 N ATOM 1695 CA PRO A 109 9.226 -1.823 25.171 1.00 74.32 C ATOM 1696 C PRO A 109 8.091 -2.395 24.327 1.00 23.34 C ATOM 1697 O PRO A 109 7.127 -2.946 24.859 1.00 62.55 O ATOM 1698 CB PRO A 109 10.528 -2.582 24.901 1.00 54.44 C ATOM 1699 CG PRO A 109 10.592 -3.617 25.970 1.00 73.23 C ATOM 1700 CD PRO A 109 9.945 -3.003 27.181 1.00 44.15 C ATOM 0 HA PRO A 109 9.270 -0.766 24.909 1.00 74.32 H new ATOM 0 HB2 PRO A 109 10.523 -3.036 23.910 1.00 54.44 H new ATOM 0 HB3 PRO A 109 11.390 -1.916 24.942 1.00 54.44 H new ATOM 0 HG2 PRO A 109 10.070 -4.524 25.666 1.00 73.23 H new ATOM 0 HG3 PRO A 109 11.624 -3.898 26.179 1.00 73.23 H new ATOM 0 HD2 PRO A 109 9.427 -3.750 27.782 1.00 44.15 H new ATOM 0 HD3 PRO A 109 10.679 -2.525 27.830 1.00 44.15 H new ATOM 1708 N SER A 110 8.213 -2.261 23.011 1.00 41.13 N ATOM 1709 CA SER A 110 7.196 -2.762 22.094 1.00 52.22 C ATOM 1710 C SER A 110 7.798 -3.056 20.723 1.00 35.21 C ATOM 1711 O SER A 110 8.919 -2.646 20.425 1.00 63.33 O ATOM 1712 CB SER A 110 6.059 -1.748 21.957 1.00 54.40 C ATOM 1713 OG SER A 110 5.039 -1.993 22.910 1.00 20.01 O ATOM 0 H SER A 110 9.006 -1.810 22.555 1.00 41.13 H new ATOM 0 HA SER A 110 6.798 -3.690 22.504 1.00 52.22 H new ATOM 0 HB2 SER A 110 6.450 -0.739 22.089 1.00 54.40 H new ATOM 0 HB3 SER A 110 5.641 -1.799 20.951 1.00 54.40 H new ATOM 0 HG SER A 110 5.309 -1.630 23.779 1.00 20.01 H new ATOM 1719 N TRP A 111 7.044 -3.769 19.894 1.00 34.12 N ATOM 1720 CA TRP A 111 7.502 -4.119 18.554 1.00 33.04 C ATOM 1721 C TRP A 111 6.370 -3.990 17.541 1.00 12.11 C ATOM 1722 O TRP A 111 5.208 -3.827 17.912 1.00 31.13 O ATOM 1723 CB TRP A 111 8.056 -5.544 18.539 1.00 65.31 C ATOM 1724 CG TRP A 111 9.441 -5.649 19.103 1.00 41.11 C ATOM 1725 CD1 TRP A 111 9.784 -5.741 20.422 1.00 41.43 C ATOM 1726 CD2 TRP A 111 10.668 -5.671 18.365 1.00 53.52 C ATOM 1727 NE1 TRP A 111 11.150 -5.818 20.548 1.00 42.22 N ATOM 1728 CE2 TRP A 111 11.715 -5.778 19.301 1.00 42.24 C ATOM 1729 CE3 TRP A 111 10.983 -5.612 17.005 1.00 42.12 C ATOM 1730 CZ2 TRP A 111 13.053 -5.826 18.918 1.00 71.02 C ATOM 1731 CZ3 TRP A 111 12.311 -5.660 16.626 1.00 4.44 C ATOM 1732 CH2 TRP A 111 13.333 -5.767 17.580 1.00 51.44 C ATOM 0 H TRP A 111 6.113 -4.116 20.126 1.00 34.12 H new ATOM 0 HA TRP A 111 8.295 -3.425 18.275 1.00 33.04 H new ATOM 0 HB2 TRP A 111 7.389 -6.191 19.109 1.00 65.31 H new ATOM 0 HB3 TRP A 111 8.060 -5.914 17.514 1.00 65.31 H new ATOM 0 HD1 TRP A 111 9.084 -5.752 21.245 1.00 41.43 H new ATOM 0 HE1 TRP A 111 11.661 -5.893 21.428 1.00 42.22 H new ATOM 0 HE3 TRP A 111 10.202 -5.530 16.263 1.00 42.12 H new ATOM 0 HZ2 TRP A 111 13.842 -5.907 19.651 1.00 71.02 H new ATOM 0 HZ3 TRP A 111 12.566 -5.614 15.578 1.00 4.44 H new ATOM 0 HH2 TRP A 111 14.361 -5.804 17.252 1.00 51.44 H new ATOM 1743 N ALA A 112 6.717 -4.064 16.260 1.00 14.23 N ATOM 1744 CA ALA A 112 5.729 -3.957 15.194 1.00 75.31 C ATOM 1745 C ALA A 112 6.372 -4.162 13.827 1.00 60.32 C ATOM 1746 O ALA A 112 7.135 -3.318 13.355 1.00 11.03 O ATOM 1747 CB ALA A 112 5.031 -2.606 15.254 1.00 71.52 C ATOM 0 H ALA A 112 7.675 -4.198 15.936 1.00 14.23 H new ATOM 0 HA ALA A 112 4.988 -4.743 15.339 1.00 75.31 H new ATOM 0 HB1 ALA A 112 4.296 -2.540 14.452 1.00 71.52 H new ATOM 0 HB2 ALA A 112 4.529 -2.498 16.216 1.00 71.52 H new ATOM 0 HB3 ALA A 112 5.767 -1.811 15.137 1.00 71.52 H new ATOM 1753 N LEU A 113 6.061 -5.288 13.195 1.00 72.54 N ATOM 1754 CA LEU A 113 6.610 -5.605 11.881 1.00 74.14 C ATOM 1755 C LEU A 113 5.703 -5.081 10.771 1.00 22.32 C ATOM 1756 O LEU A 113 4.487 -4.990 10.941 1.00 30.32 O ATOM 1757 CB LEU A 113 6.793 -7.117 11.734 1.00 44.55 C ATOM 1758 CG LEU A 113 7.367 -7.596 10.400 1.00 75.34 C ATOM 1759 CD1 LEU A 113 8.559 -8.512 10.629 1.00 33.23 C ATOM 1760 CD2 LEU A 113 6.296 -8.306 9.584 1.00 51.05 C ATOM 0 H LEU A 113 5.431 -5.997 13.571 1.00 72.54 H new ATOM 0 HA LEU A 113 7.581 -5.117 11.793 1.00 74.14 H new ATOM 0 HB2 LEU A 113 7.448 -7.463 12.534 1.00 44.55 H new ATOM 0 HB3 LEU A 113 5.826 -7.596 11.884 1.00 44.55 H new ATOM 0 HG LEU A 113 7.707 -6.725 9.839 1.00 75.34 H new ATOM 0 HD11 LEU A 113 8.954 -8.843 9.668 1.00 33.23 H new ATOM 0 HD12 LEU A 113 9.334 -7.972 11.173 1.00 33.23 H new ATOM 0 HD13 LEU A 113 8.245 -9.379 11.210 1.00 33.23 H new ATOM 0 HD21 LEU A 113 6.721 -8.640 8.638 1.00 51.05 H new ATOM 0 HD22 LEU A 113 5.926 -9.167 10.140 1.00 51.05 H new ATOM 0 HD23 LEU A 113 5.472 -7.619 9.389 1.00 51.05 H new ATOM 1772 N ILE A 114 6.303 -4.740 9.636 1.00 60.33 N ATOM 1773 CA ILE A 114 5.549 -4.229 8.498 1.00 62.13 C ATOM 1774 C ILE A 114 5.912 -4.975 7.218 1.00 32.32 C ATOM 1775 O ILE A 114 7.040 -4.888 6.735 1.00 74.04 O ATOM 1776 CB ILE A 114 5.797 -2.724 8.289 1.00 44.44 C ATOM 1777 CG1 ILE A 114 5.417 -1.942 9.548 1.00 63.02 C ATOM 1778 CG2 ILE A 114 5.011 -2.219 7.088 1.00 42.02 C ATOM 1779 CD1 ILE A 114 3.945 -2.018 9.885 1.00 74.23 C ATOM 0 H ILE A 114 7.309 -4.808 9.480 1.00 60.33 H new ATOM 0 HA ILE A 114 4.494 -4.388 8.722 1.00 62.13 H new ATOM 0 HB ILE A 114 6.858 -2.570 8.095 1.00 44.44 H new ATOM 0 HG12 ILE A 114 5.994 -2.323 10.390 1.00 63.02 H new ATOM 0 HG13 ILE A 114 5.698 -0.897 9.415 1.00 63.02 H new ATOM 0 HG21 ILE A 114 5.197 -1.153 6.953 1.00 42.02 H new ATOM 0 HG22 ILE A 114 5.326 -2.758 6.194 1.00 42.02 H new ATOM 0 HG23 ILE A 114 3.946 -2.383 7.255 1.00 42.02 H new ATOM 0 HD11 ILE A 114 3.748 -1.441 10.789 1.00 74.23 H new ATOM 0 HD12 ILE A 114 3.361 -1.610 9.060 1.00 74.23 H new ATOM 0 HD13 ILE A 114 3.663 -3.058 10.050 1.00 74.23 H new ATOM 1791 N GLY A 115 4.946 -5.709 6.673 1.00 12.51 N ATOM 1792 CA GLY A 115 5.182 -6.458 5.453 1.00 22.32 C ATOM 1793 C GLY A 115 5.818 -5.613 4.367 1.00 23.24 C ATOM 1794 O GLY A 115 5.736 -4.385 4.397 1.00 33.11 O ATOM 0 H GLY A 115 4.004 -5.798 7.055 1.00 12.51 H new ATOM 0 HA2 GLY A 115 5.827 -7.309 5.672 1.00 22.32 H new ATOM 0 HA3 GLY A 115 4.237 -6.860 5.089 1.00 22.32 H new ATOM 1798 N LYS A 116 6.457 -6.271 3.406 1.00 72.23 N ATOM 1799 CA LYS A 116 7.111 -5.574 2.305 1.00 53.41 C ATOM 1800 C LYS A 116 6.122 -4.680 1.563 1.00 11.22 C ATOM 1801 O LYS A 116 6.506 -3.673 0.968 1.00 4.13 O ATOM 1802 CB LYS A 116 7.733 -6.580 1.334 1.00 55.11 C ATOM 1803 CG LYS A 116 6.714 -7.289 0.458 1.00 42.44 C ATOM 1804 CD LYS A 116 7.198 -8.669 0.045 1.00 12.23 C ATOM 1805 CE LYS A 116 7.528 -8.723 -1.439 1.00 33.55 C ATOM 1806 NZ LYS A 116 7.569 -10.123 -1.946 1.00 51.23 N ATOM 0 H LYS A 116 6.536 -7.287 3.367 1.00 72.23 H new ATOM 0 HA LYS A 116 7.899 -4.947 2.722 1.00 53.41 H new ATOM 0 HB2 LYS A 116 8.450 -6.062 0.697 1.00 55.11 H new ATOM 0 HB3 LYS A 116 8.291 -7.324 1.903 1.00 55.11 H new ATOM 0 HG2 LYS A 116 5.770 -7.379 0.996 1.00 42.44 H new ATOM 0 HG3 LYS A 116 6.518 -6.690 -0.431 1.00 42.44 H new ATOM 0 HD2 LYS A 116 8.082 -8.934 0.625 1.00 12.23 H new ATOM 0 HD3 LYS A 116 6.431 -9.409 0.275 1.00 12.23 H new ATOM 0 HE2 LYS A 116 6.784 -8.156 -1.998 1.00 33.55 H new ATOM 0 HE3 LYS A 116 8.491 -8.244 -1.615 1.00 33.55 H new ATOM 0 HZ1 LYS A 116 7.797 -10.118 -2.961 1.00 51.23 H new ATOM 0 HZ2 LYS A 116 8.297 -10.658 -1.430 1.00 51.23 H new ATOM 0 HZ3 LYS A 116 6.642 -10.572 -1.801 1.00 51.23 H new ATOM 1820 N ASP A 117 4.848 -5.054 1.604 1.00 11.31 N ATOM 1821 CA ASP A 117 3.803 -4.284 0.938 1.00 65.21 C ATOM 1822 C ASP A 117 3.578 -2.950 1.643 1.00 71.21 C ATOM 1823 O ASP A 117 2.898 -2.068 1.121 1.00 34.01 O ATOM 1824 CB ASP A 117 2.499 -5.082 0.899 1.00 11.40 C ATOM 1825 CG ASP A 117 1.569 -4.616 -0.204 1.00 73.40 C ATOM 1826 OD1 ASP A 117 0.929 -3.557 -0.034 1.00 45.11 O ATOM 1827 OD2 ASP A 117 1.481 -5.311 -1.238 1.00 34.44 O ATOM 0 H ASP A 117 4.514 -5.885 2.091 1.00 11.31 H new ATOM 0 HA ASP A 117 4.128 -4.084 -0.083 1.00 65.21 H new ATOM 0 HB2 ASP A 117 2.727 -6.138 0.756 1.00 11.40 H new ATOM 0 HB3 ASP A 117 1.992 -4.992 1.860 1.00 11.40 H new ATOM 1832 N GLY A 118 4.153 -2.811 2.833 1.00 5.24 N ATOM 1833 CA GLY A 118 4.002 -1.582 3.591 1.00 24.41 C ATOM 1834 C GLY A 118 2.757 -1.584 4.456 1.00 65.11 C ATOM 1835 O GLY A 118 2.047 -0.582 4.534 1.00 14.03 O ATOM 0 H GLY A 118 4.721 -3.527 3.286 1.00 5.24 H new ATOM 0 HA2 GLY A 118 4.879 -1.438 4.222 1.00 24.41 H new ATOM 0 HA3 GLY A 118 3.962 -0.737 2.903 1.00 24.41 H new ATOM 1839 N ASP A 119 2.492 -2.712 5.105 1.00 32.03 N ATOM 1840 CA ASP A 119 1.323 -2.840 5.968 1.00 23.43 C ATOM 1841 C ASP A 119 1.657 -3.651 7.217 1.00 14.53 C ATOM 1842 O ASP A 119 2.559 -4.488 7.204 1.00 1.35 O ATOM 1843 CB ASP A 119 0.172 -3.501 5.209 1.00 71.32 C ATOM 1844 CG ASP A 119 -1.131 -3.460 5.983 1.00 72.15 C ATOM 1845 OD1 ASP A 119 -1.767 -2.386 6.016 1.00 20.02 O ATOM 1846 OD2 ASP A 119 -1.515 -4.502 6.555 1.00 2.22 O ATOM 0 H ASP A 119 3.070 -3.551 5.050 1.00 32.03 H new ATOM 0 HA ASP A 119 1.018 -1.840 6.276 1.00 23.43 H new ATOM 0 HB2 ASP A 119 0.038 -3.000 4.250 1.00 71.32 H new ATOM 0 HB3 ASP A 119 0.431 -4.538 4.993 1.00 71.32 H new ATOM 1851 N VAL A 120 0.923 -3.395 8.296 1.00 55.04 N ATOM 1852 CA VAL A 120 1.140 -4.100 9.553 1.00 32.21 C ATOM 1853 C VAL A 120 0.968 -5.605 9.376 1.00 3.31 C ATOM 1854 O VAL A 120 0.083 -6.057 8.651 1.00 41.45 O ATOM 1855 CB VAL A 120 0.172 -3.609 10.646 1.00 23.34 C ATOM 1856 CG1 VAL A 120 -1.262 -3.967 10.290 1.00 75.12 C ATOM 1857 CG2 VAL A 120 0.556 -4.193 11.998 1.00 52.02 C ATOM 0 H VAL A 120 0.173 -2.704 8.324 1.00 55.04 H new ATOM 0 HA VAL A 120 2.163 -3.888 9.862 1.00 32.21 H new ATOM 0 HB VAL A 120 0.244 -2.523 10.710 1.00 23.34 H new ATOM 0 HG11 VAL A 120 -1.931 -3.612 11.074 1.00 75.12 H new ATOM 0 HG12 VAL A 120 -1.530 -3.497 9.344 1.00 75.12 H new ATOM 0 HG13 VAL A 120 -1.354 -5.049 10.197 1.00 75.12 H new ATOM 0 HG21 VAL A 120 -0.138 -3.836 12.759 1.00 52.02 H new ATOM 0 HG22 VAL A 120 0.513 -5.281 11.950 1.00 52.02 H new ATOM 0 HG23 VAL A 120 1.568 -3.881 12.255 1.00 52.02 H new ATOM 1867 N GLN A 121 1.821 -6.375 10.045 1.00 52.43 N ATOM 1868 CA GLN A 121 1.763 -7.829 9.961 1.00 62.23 C ATOM 1869 C GLN A 121 1.869 -8.459 11.346 1.00 61.04 C ATOM 1870 O GLN A 121 1.183 -9.436 11.648 1.00 2.40 O ATOM 1871 CB GLN A 121 2.884 -8.354 9.062 1.00 41.13 C ATOM 1872 CG GLN A 121 2.382 -9.080 7.824 1.00 51.30 C ATOM 1873 CD GLN A 121 2.094 -10.545 8.083 1.00 22.44 C ATOM 1874 OE1 GLN A 121 2.982 -11.305 8.473 1.00 12.42 O ATOM 1875 NE2 GLN A 121 0.848 -10.952 7.868 1.00 5.40 N ATOM 0 H GLN A 121 2.559 -6.016 10.650 1.00 52.43 H new ATOM 0 HA GLN A 121 0.801 -8.105 9.529 1.00 62.23 H new ATOM 0 HB2 GLN A 121 3.512 -7.518 8.753 1.00 41.13 H new ATOM 0 HB3 GLN A 121 3.514 -9.031 9.639 1.00 41.13 H new ATOM 0 HG2 GLN A 121 1.475 -8.593 7.465 1.00 51.30 H new ATOM 0 HG3 GLN A 121 3.125 -8.994 7.031 1.00 51.30 H new ATOM 0 HE21 GLN A 121 0.143 -10.289 7.545 1.00 5.40 H new ATOM 0 HE22 GLN A 121 0.596 -11.928 8.026 1.00 5.40 H new ATOM 1884 N ARG A 122 2.733 -7.894 12.183 1.00 51.03 N ATOM 1885 CA ARG A 122 2.930 -8.402 13.535 1.00 13.52 C ATOM 1886 C ARG A 122 3.112 -7.255 14.525 1.00 1.31 C ATOM 1887 O ARG A 122 3.692 -6.221 14.192 1.00 2.11 O ATOM 1888 CB ARG A 122 4.145 -9.329 13.583 1.00 44.10 C ATOM 1889 CG ARG A 122 4.088 -10.460 12.570 1.00 64.52 C ATOM 1890 CD ARG A 122 3.130 -11.556 13.011 1.00 1.41 C ATOM 1891 NE ARG A 122 2.225 -11.956 11.937 1.00 32.24 N ATOM 1892 CZ ARG A 122 1.067 -12.574 12.144 1.00 23.13 C ATOM 1893 NH1 ARG A 122 0.676 -12.860 13.378 1.00 21.34 N ATOM 1894 NH2 ARG A 122 0.298 -12.907 11.115 1.00 1.45 N ATOM 0 H ARG A 122 3.308 -7.084 11.949 1.00 51.03 H new ATOM 0 HA ARG A 122 2.041 -8.966 13.817 1.00 13.52 H new ATOM 0 HB2 ARG A 122 5.047 -8.742 13.409 1.00 44.10 H new ATOM 0 HB3 ARG A 122 4.229 -9.753 14.584 1.00 44.10 H new ATOM 0 HG2 ARG A 122 3.773 -10.068 11.603 1.00 64.52 H new ATOM 0 HG3 ARG A 122 5.085 -10.879 12.435 1.00 64.52 H new ATOM 0 HD2 ARG A 122 3.700 -12.422 13.346 1.00 1.41 H new ATOM 0 HD3 ARG A 122 2.548 -11.207 13.864 1.00 1.41 H new ATOM 0 HE ARG A 122 2.497 -11.750 10.976 1.00 32.24 H new ATOM 0 HH11 ARG A 122 1.264 -12.606 14.171 1.00 21.34 H new ATOM 0 HH12 ARG A 122 -0.213 -13.334 13.534 1.00 21.34 H new ATOM 0 HH21 ARG A 122 0.596 -12.689 10.164 1.00 1.45 H new ATOM 0 HH22 ARG A 122 -0.591 -13.381 11.275 1.00 1.45 H new ATOM 1908 N ILE A 123 2.613 -7.445 15.742 1.00 72.14 N ATOM 1909 CA ILE A 123 2.721 -6.427 16.779 1.00 24.23 C ATOM 1910 C ILE A 123 2.829 -7.061 18.162 1.00 34.01 C ATOM 1911 O ILE A 123 1.994 -7.879 18.548 1.00 34.04 O ATOM 1912 CB ILE A 123 1.515 -5.470 16.758 1.00 71.34 C ATOM 1913 CG1 ILE A 123 1.570 -4.573 15.519 1.00 31.14 C ATOM 1914 CG2 ILE A 123 1.482 -4.631 18.026 1.00 41.52 C ATOM 1915 CD1 ILE A 123 0.323 -3.740 15.321 1.00 2.32 C ATOM 0 H ILE A 123 2.130 -8.295 16.034 1.00 72.14 H new ATOM 0 HA ILE A 123 3.628 -5.859 16.570 1.00 24.23 H new ATOM 0 HB ILE A 123 0.601 -6.062 16.715 1.00 71.34 H new ATOM 0 HG12 ILE A 123 2.431 -3.910 15.598 1.00 31.14 H new ATOM 0 HG13 ILE A 123 1.726 -5.194 14.637 1.00 31.14 H new ATOM 0 HG21 ILE A 123 0.624 -3.960 17.996 1.00 41.52 H new ATOM 0 HG22 ILE A 123 1.400 -5.286 18.894 1.00 41.52 H new ATOM 0 HG23 ILE A 123 2.398 -4.045 18.099 1.00 41.52 H new ATOM 0 HD11 ILE A 123 0.432 -3.129 14.425 1.00 2.32 H new ATOM 0 HD12 ILE A 123 -0.540 -4.397 15.210 1.00 2.32 H new ATOM 0 HD13 ILE A 123 0.177 -3.093 16.186 1.00 2.32 H new ATOM 1927 N VAL A 124 3.862 -6.676 18.905 1.00 74.40 N ATOM 1928 CA VAL A 124 4.077 -7.205 20.247 1.00 40.52 C ATOM 1929 C VAL A 124 4.260 -6.078 21.258 1.00 62.32 C ATOM 1930 O VAL A 124 4.848 -5.042 20.950 1.00 45.54 O ATOM 1931 CB VAL A 124 5.308 -8.128 20.295 1.00 24.53 C ATOM 1932 CG1 VAL A 124 5.610 -8.542 21.728 1.00 51.13 C ATOM 1933 CG2 VAL A 124 5.093 -9.349 19.413 1.00 21.24 C ATOM 0 H VAL A 124 4.563 -6.000 18.601 1.00 74.40 H new ATOM 0 HA VAL A 124 3.190 -7.782 20.507 1.00 40.52 H new ATOM 0 HB VAL A 124 6.168 -7.578 19.912 1.00 24.53 H new ATOM 0 HG11 VAL A 124 6.483 -9.194 21.742 1.00 51.13 H new ATOM 0 HG12 VAL A 124 5.810 -7.655 22.329 1.00 51.13 H new ATOM 0 HG13 VAL A 124 4.753 -9.074 22.141 1.00 51.13 H new ATOM 0 HG21 VAL A 124 5.973 -9.990 19.459 1.00 21.24 H new ATOM 0 HG22 VAL A 124 4.222 -9.902 19.764 1.00 21.24 H new ATOM 0 HG23 VAL A 124 4.930 -9.030 18.384 1.00 21.24 H new ATOM 1943 N LYS A 125 3.753 -6.289 22.468 1.00 51.53 N ATOM 1944 CA LYS A 125 3.861 -5.292 23.527 1.00 63.40 C ATOM 1945 C LYS A 125 4.926 -5.692 24.543 1.00 23.41 C ATOM 1946 O LYS A 125 4.616 -6.000 25.693 1.00 4.53 O ATOM 1947 CB LYS A 125 2.513 -5.115 24.229 1.00 72.44 C ATOM 1948 CG LYS A 125 1.623 -4.068 23.581 1.00 23.04 C ATOM 1949 CD LYS A 125 0.807 -4.656 22.443 1.00 35.42 C ATOM 1950 CE LYS A 125 -0.247 -3.677 21.949 1.00 41.03 C ATOM 1951 NZ LYS A 125 -0.880 -4.137 20.682 1.00 53.52 N ATOM 0 H LYS A 125 3.263 -7.141 22.740 1.00 51.53 H new ATOM 0 HA LYS A 125 4.154 -4.346 23.072 1.00 63.40 H new ATOM 0 HB2 LYS A 125 1.989 -6.071 24.237 1.00 72.44 H new ATOM 0 HB3 LYS A 125 2.688 -4.838 25.269 1.00 72.44 H new ATOM 0 HG2 LYS A 125 0.953 -3.645 24.330 1.00 23.04 H new ATOM 0 HG3 LYS A 125 2.237 -3.250 23.205 1.00 23.04 H new ATOM 0 HD2 LYS A 125 1.469 -4.925 21.620 1.00 35.42 H new ATOM 0 HD3 LYS A 125 0.324 -5.574 22.777 1.00 35.42 H new ATOM 0 HE2 LYS A 125 -1.014 -3.552 22.714 1.00 41.03 H new ATOM 0 HE3 LYS A 125 0.210 -2.700 21.793 1.00 41.03 H new ATOM 0 HZ1 LYS A 125 -1.051 -3.319 20.063 1.00 53.52 H new ATOM 0 HZ2 LYS A 125 -0.248 -4.809 20.202 1.00 53.52 H new ATOM 0 HZ3 LYS A 125 -1.784 -4.605 20.895 1.00 53.52 H new ATOM 1965 N GLY A 126 6.184 -5.685 24.110 1.00 15.12 N ATOM 1966 CA GLY A 126 7.275 -6.047 24.995 1.00 30.34 C ATOM 1967 C GLY A 126 8.623 -6.000 24.303 1.00 12.34 C ATOM 1968 O GLY A 126 8.850 -5.165 23.428 1.00 54.31 O ATOM 0 H GLY A 126 6.466 -5.435 23.162 1.00 15.12 H new ATOM 0 HA2 GLY A 126 7.285 -5.371 25.850 1.00 30.34 H new ATOM 0 HA3 GLY A 126 7.105 -7.051 25.385 1.00 30.34 H new ATOM 1972 N SER A 127 9.521 -6.897 24.698 1.00 74.14 N ATOM 1973 CA SER A 127 10.855 -6.951 24.113 1.00 45.40 C ATOM 1974 C SER A 127 11.234 -8.384 23.755 1.00 64.44 C ATOM 1975 O SER A 127 11.800 -9.111 24.572 1.00 31.21 O ATOM 1976 CB SER A 127 11.884 -6.367 25.083 1.00 0.43 C ATOM 1977 OG SER A 127 12.515 -5.224 24.531 1.00 70.21 O ATOM 0 H SER A 127 9.349 -7.596 25.421 1.00 74.14 H new ATOM 0 HA SER A 127 10.848 -6.356 23.199 1.00 45.40 H new ATOM 0 HB2 SER A 127 11.395 -6.099 26.019 1.00 0.43 H new ATOM 0 HB3 SER A 127 12.634 -7.122 25.320 1.00 0.43 H new ATOM 0 HG SER A 127 13.273 -4.964 25.096 1.00 70.21 H new ATOM 1983 N ILE A 128 10.919 -8.784 22.527 1.00 13.23 N ATOM 1984 CA ILE A 128 11.227 -10.130 22.060 1.00 55.44 C ATOM 1985 C ILE A 128 12.726 -10.402 22.117 1.00 32.11 C ATOM 1986 O ILE A 128 13.533 -9.476 22.188 1.00 72.32 O ATOM 1987 CB ILE A 128 10.731 -10.352 20.619 1.00 74.04 C ATOM 1988 CG1 ILE A 128 11.139 -9.176 19.728 1.00 33.44 C ATOM 1989 CG2 ILE A 128 9.221 -10.538 20.601 1.00 53.22 C ATOM 1990 CD1 ILE A 128 11.707 -9.599 18.392 1.00 70.31 C ATOM 0 H ILE A 128 10.451 -8.195 21.838 1.00 13.23 H new ATOM 0 HA ILE A 128 10.709 -10.821 22.725 1.00 55.44 H new ATOM 0 HB ILE A 128 11.194 -11.258 20.227 1.00 74.04 H new ATOM 0 HG12 ILE A 128 10.270 -8.540 19.559 1.00 33.44 H new ATOM 0 HG13 ILE A 128 11.879 -8.572 20.253 1.00 33.44 H new ATOM 0 HG21 ILE A 128 8.886 -10.694 19.576 1.00 53.22 H new ATOM 0 HG22 ILE A 128 8.954 -11.405 21.206 1.00 53.22 H new ATOM 0 HG23 ILE A 128 8.740 -9.649 21.009 1.00 53.22 H new ATOM 0 HD11 ILE A 128 11.974 -8.715 17.814 1.00 70.31 H new ATOM 0 HD12 ILE A 128 12.595 -10.210 18.551 1.00 70.31 H new ATOM 0 HD13 ILE A 128 10.962 -10.178 17.846 1.00 70.31 H new ATOM 2002 N ASN A 129 13.091 -11.680 22.085 1.00 42.44 N ATOM 2003 CA ASN A 129 14.494 -12.075 22.132 1.00 43.43 C ATOM 2004 C ASN A 129 15.022 -12.377 20.732 1.00 35.03 C ATOM 2005 O ASN A 129 14.251 -12.485 19.779 1.00 64.42 O ATOM 2006 CB ASN A 129 14.671 -13.300 23.031 1.00 12.31 C ATOM 2007 CG ASN A 129 14.745 -12.932 24.501 1.00 63.25 C ATOM 2008 OD1 ASN A 129 14.594 -11.767 24.869 1.00 62.31 O ATOM 2009 ND2 ASN A 129 14.980 -13.927 25.348 1.00 73.41 N ATOM 0 H ASN A 129 12.435 -12.459 22.027 1.00 42.44 H new ATOM 0 HA ASN A 129 15.066 -11.244 22.545 1.00 43.43 H new ATOM 0 HB2 ASN A 129 13.840 -13.987 22.873 1.00 12.31 H new ATOM 0 HB3 ASN A 129 15.580 -13.829 22.745 1.00 12.31 H new ATOM 0 HD21 ASN A 129 15.042 -13.741 26.349 1.00 73.41 H new ATOM 0 HD22 ASN A 129 15.099 -14.878 24.998 1.00 73.41 H new ATOM 2016 N GLU A 130 16.339 -12.512 20.619 1.00 61.44 N ATOM 2017 CA GLU A 130 16.969 -12.802 19.336 1.00 73.33 C ATOM 2018 C GLU A 130 16.331 -14.024 18.681 1.00 63.33 C ATOM 2019 O GLU A 130 16.166 -14.073 17.462 1.00 14.13 O ATOM 2020 CB GLU A 130 18.470 -13.033 19.520 1.00 70.51 C ATOM 2021 CG GLU A 130 18.807 -14.383 20.132 1.00 4.41 C ATOM 2022 CD GLU A 130 20.130 -14.372 20.874 1.00 32.12 C ATOM 2023 OE1 GLU A 130 20.843 -13.349 20.800 1.00 33.32 O ATOM 2024 OE2 GLU A 130 20.452 -15.386 21.528 1.00 12.11 O ATOM 0 H GLU A 130 16.990 -12.425 21.399 1.00 61.44 H new ATOM 0 HA GLU A 130 16.819 -11.942 18.684 1.00 73.33 H new ATOM 0 HB2 GLU A 130 18.964 -12.949 18.552 1.00 70.51 H new ATOM 0 HB3 GLU A 130 18.876 -12.245 20.154 1.00 70.51 H new ATOM 0 HG2 GLU A 130 18.012 -14.676 20.818 1.00 4.41 H new ATOM 0 HG3 GLU A 130 18.842 -15.136 19.345 1.00 4.41 H new ATOM 2031 N ALA A 131 15.977 -15.010 19.499 1.00 13.51 N ATOM 2032 CA ALA A 131 15.356 -16.231 19.001 1.00 45.24 C ATOM 2033 C ALA A 131 13.900 -15.990 18.618 1.00 31.35 C ATOM 2034 O ALA A 131 13.430 -16.481 17.592 1.00 14.44 O ATOM 2035 CB ALA A 131 15.456 -17.336 20.042 1.00 55.14 C ATOM 0 H ALA A 131 16.110 -14.987 20.510 1.00 13.51 H new ATOM 0 HA ALA A 131 15.892 -16.543 18.105 1.00 45.24 H new ATOM 0 HB1 ALA A 131 14.988 -18.242 19.657 1.00 55.14 H new ATOM 0 HB2 ALA A 131 16.505 -17.535 20.262 1.00 55.14 H new ATOM 0 HB3 ALA A 131 14.947 -17.024 20.954 1.00 55.14 H new ATOM 2041 N GLN A 132 13.192 -15.234 19.451 1.00 53.12 N ATOM 2042 CA GLN A 132 11.788 -14.930 19.200 1.00 72.54 C ATOM 2043 C GLN A 132 11.627 -14.124 17.915 1.00 14.14 C ATOM 2044 O GLN A 132 10.684 -14.335 17.153 1.00 63.05 O ATOM 2045 CB GLN A 132 11.192 -14.159 20.379 1.00 61.14 C ATOM 2046 CG GLN A 132 10.013 -14.862 21.032 1.00 24.23 C ATOM 2047 CD GLN A 132 9.773 -14.398 22.455 1.00 24.35 C ATOM 2048 OE1 GLN A 132 10.493 -13.543 22.972 1.00 41.24 O ATOM 2049 NE2 GLN A 132 8.757 -14.962 23.099 1.00 43.44 N ATOM 0 H GLN A 132 13.567 -14.821 20.305 1.00 53.12 H new ATOM 0 HA GLN A 132 11.253 -15.873 19.085 1.00 72.54 H new ATOM 0 HB2 GLN A 132 11.968 -13.998 21.127 1.00 61.14 H new ATOM 0 HB3 GLN A 132 10.873 -13.175 20.035 1.00 61.14 H new ATOM 0 HG2 GLN A 132 9.115 -14.685 20.440 1.00 24.23 H new ATOM 0 HG3 GLN A 132 10.189 -15.938 21.029 1.00 24.23 H new ATOM 0 HE21 GLN A 132 8.186 -15.667 22.633 1.00 43.44 H new ATOM 0 HE22 GLN A 132 8.548 -14.690 24.060 1.00 43.44 H new ATOM 2058 N ALA A 133 12.552 -13.199 17.683 1.00 2.13 N ATOM 2059 CA ALA A 133 12.513 -12.362 16.491 1.00 44.33 C ATOM 2060 C ALA A 133 12.671 -13.200 15.226 1.00 2.34 C ATOM 2061 O ALA A 133 11.904 -13.055 14.274 1.00 61.04 O ATOM 2062 CB ALA A 133 13.597 -11.296 16.558 1.00 1.15 C ATOM 0 H ALA A 133 13.338 -13.010 18.305 1.00 2.13 H new ATOM 0 HA ALA A 133 11.540 -11.873 16.453 1.00 44.33 H new ATOM 0 HB1 ALA A 133 13.556 -10.678 15.661 1.00 1.15 H new ATOM 0 HB2 ALA A 133 13.439 -10.671 17.437 1.00 1.15 H new ATOM 0 HB3 ALA A 133 14.574 -11.774 16.625 1.00 1.15 H new ATOM 2068 N LEU A 134 13.670 -14.075 15.224 1.00 62.24 N ATOM 2069 CA LEU A 134 13.929 -14.937 14.075 1.00 3.32 C ATOM 2070 C LEU A 134 12.667 -15.686 13.661 1.00 60.03 C ATOM 2071 O LEU A 134 12.345 -15.772 12.476 1.00 1.01 O ATOM 2072 CB LEU A 134 15.044 -15.933 14.401 1.00 54.31 C ATOM 2073 CG LEU A 134 16.464 -15.367 14.421 1.00 23.53 C ATOM 2074 CD1 LEU A 134 17.467 -16.456 14.770 1.00 20.42 C ATOM 2075 CD2 LEU A 134 16.806 -14.735 13.080 1.00 31.11 C ATOM 0 H LEU A 134 14.314 -14.207 16.004 1.00 62.24 H new ATOM 0 HA LEU A 134 14.245 -14.307 13.243 1.00 3.32 H new ATOM 0 HB2 LEU A 134 14.836 -16.374 15.376 1.00 54.31 H new ATOM 0 HB3 LEU A 134 15.007 -16.741 13.671 1.00 54.31 H new ATOM 0 HG LEU A 134 16.515 -14.594 15.188 1.00 23.53 H new ATOM 0 HD11 LEU A 134 18.472 -16.035 14.780 1.00 20.42 H new ATOM 0 HD12 LEU A 134 17.235 -16.863 15.754 1.00 20.42 H new ATOM 0 HD13 LEU A 134 17.414 -17.251 14.027 1.00 20.42 H new ATOM 0 HD21 LEU A 134 17.820 -14.338 13.113 1.00 31.11 H new ATOM 0 HD22 LEU A 134 16.737 -15.488 12.295 1.00 31.11 H new ATOM 0 HD23 LEU A 134 16.106 -13.926 12.870 1.00 31.11 H new ATOM 2087 N ALA A 135 11.955 -16.225 14.645 1.00 0.00 N ATOM 2088 CA ALA A 135 10.726 -16.963 14.383 1.00 32.21 C ATOM 2089 C ALA A 135 9.574 -16.016 14.064 1.00 30.03 C ATOM 2090 O ALA A 135 8.605 -16.399 13.407 1.00 64.12 O ATOM 2091 CB ALA A 135 10.374 -17.843 15.574 1.00 43.41 C ATOM 0 H ALA A 135 12.208 -16.164 15.631 1.00 0.00 H new ATOM 0 HA ALA A 135 10.892 -17.598 13.513 1.00 32.21 H new ATOM 0 HB1 ALA A 135 9.454 -18.388 15.364 1.00 43.41 H new ATOM 0 HB2 ALA A 135 11.182 -18.551 15.755 1.00 43.41 H new ATOM 0 HB3 ALA A 135 10.233 -17.220 16.457 1.00 43.41 H new ATOM 2097 N LEU A 136 9.685 -14.779 14.534 1.00 15.54 N ATOM 2098 CA LEU A 136 8.651 -13.776 14.300 1.00 43.32 C ATOM 2099 C LEU A 136 8.647 -13.329 12.841 1.00 4.24 C ATOM 2100 O LEU A 136 7.604 -12.968 12.295 1.00 22.34 O ATOM 2101 CB LEU A 136 8.867 -12.569 15.214 1.00 2.24 C ATOM 2102 CG LEU A 136 7.806 -11.470 15.138 1.00 21.41 C ATOM 2103 CD1 LEU A 136 7.731 -10.709 16.452 1.00 11.41 C ATOM 2104 CD2 LEU A 136 8.102 -10.522 13.986 1.00 43.23 C ATOM 0 H LEU A 136 10.480 -14.446 15.079 1.00 15.54 H new ATOM 0 HA LEU A 136 7.685 -14.227 14.526 1.00 43.32 H new ATOM 0 HB2 LEU A 136 8.921 -12.923 16.243 1.00 2.24 H new ATOM 0 HB3 LEU A 136 9.835 -12.128 14.977 1.00 2.24 H new ATOM 0 HG LEU A 136 6.838 -11.938 14.957 1.00 21.41 H new ATOM 0 HD11 LEU A 136 6.971 -9.931 16.379 1.00 11.41 H new ATOM 0 HD12 LEU A 136 7.470 -11.397 17.256 1.00 11.41 H new ATOM 0 HD13 LEU A 136 8.698 -10.253 16.664 1.00 11.41 H new ATOM 0 HD21 LEU A 136 7.337 -9.747 13.947 1.00 43.23 H new ATOM 0 HD22 LEU A 136 9.078 -10.061 14.136 1.00 43.23 H new ATOM 0 HD23 LEU A 136 8.103 -11.078 13.048 1.00 43.23 H new ATOM 2116 N ILE A 137 9.819 -13.357 12.216 1.00 24.22 N ATOM 2117 CA ILE A 137 9.950 -12.958 10.820 1.00 31.14 C ATOM 2118 C ILE A 137 9.780 -14.153 9.889 1.00 71.23 C ATOM 2119 O ILE A 137 9.042 -14.087 8.906 1.00 51.24 O ATOM 2120 CB ILE A 137 11.315 -12.300 10.548 1.00 4.44 C ATOM 2121 CG1 ILE A 137 11.490 -11.057 11.424 1.00 41.24 C ATOM 2122 CG2 ILE A 137 11.446 -11.940 9.076 1.00 50.20 C ATOM 2123 CD1 ILE A 137 12.721 -11.104 12.302 1.00 34.40 C ATOM 0 H ILE A 137 10.692 -13.652 12.654 1.00 24.22 H new ATOM 0 HA ILE A 137 9.161 -12.232 10.624 1.00 31.14 H new ATOM 0 HB ILE A 137 12.101 -13.012 10.799 1.00 4.44 H new ATOM 0 HG12 ILE A 137 11.544 -10.176 10.784 1.00 41.24 H new ATOM 0 HG13 ILE A 137 10.608 -10.940 12.054 1.00 41.24 H new ATOM 0 HG21 ILE A 137 12.416 -11.476 8.900 1.00 50.20 H new ATOM 0 HG22 ILE A 137 11.361 -12.843 8.472 1.00 50.20 H new ATOM 0 HG23 ILE A 137 10.655 -11.243 8.800 1.00 50.20 H new ATOM 0 HD11 ILE A 137 12.780 -10.191 12.894 1.00 34.40 H new ATOM 0 HD12 ILE A 137 12.661 -11.965 12.967 1.00 34.40 H new ATOM 0 HD13 ILE A 137 13.610 -11.190 11.678 1.00 34.40 H new ATOM 2135 N ARG A 138 10.467 -15.246 10.206 1.00 75.12 N ATOM 2136 CA ARG A 138 10.391 -16.457 9.398 1.00 62.14 C ATOM 2137 C ARG A 138 8.962 -16.989 9.348 1.00 60.52 C ATOM 2138 O ARG A 138 8.550 -17.600 8.361 1.00 42.51 O ATOM 2139 CB ARG A 138 11.327 -17.529 9.959 1.00 71.33 C ATOM 2140 CG ARG A 138 11.426 -18.769 9.085 1.00 33.21 C ATOM 2141 CD ARG A 138 12.873 -19.120 8.778 1.00 70.33 C ATOM 2142 NE ARG A 138 13.540 -19.742 9.919 1.00 54.12 N ATOM 2143 CZ ARG A 138 14.848 -19.965 9.973 1.00 31.43 C ATOM 2144 NH1 ARG A 138 15.626 -19.620 8.957 1.00 52.32 N ATOM 2145 NH2 ARG A 138 15.381 -20.536 11.046 1.00 13.45 N ATOM 0 H ARG A 138 11.082 -15.317 11.016 1.00 75.12 H new ATOM 0 HA ARG A 138 10.702 -16.207 8.384 1.00 62.14 H new ATOM 0 HB2 ARG A 138 12.322 -17.102 10.083 1.00 71.33 H new ATOM 0 HB3 ARG A 138 10.979 -17.820 10.950 1.00 71.33 H new ATOM 0 HG2 ARG A 138 10.945 -19.609 9.587 1.00 33.21 H new ATOM 0 HG3 ARG A 138 10.885 -18.603 8.153 1.00 33.21 H new ATOM 0 HD2 ARG A 138 12.908 -19.797 7.924 1.00 70.33 H new ATOM 0 HD3 ARG A 138 13.412 -18.217 8.491 1.00 70.33 H new ATOM 0 HE ARG A 138 12.970 -20.020 10.718 1.00 54.12 H new ATOM 0 HH11 ARG A 138 15.221 -19.182 8.130 1.00 52.32 H new ATOM 0 HH12 ARG A 138 16.630 -19.793 9.002 1.00 52.32 H new ATOM 0 HH21 ARG A 138 14.786 -20.804 11.830 1.00 13.45 H new ATOM 0 HH22 ARG A 138 16.386 -20.707 11.087 1.00 13.45 H new ATOM 2159 N ASP A 139 8.211 -16.755 10.418 1.00 3.23 N ATOM 2160 CA ASP A 139 6.828 -17.210 10.497 1.00 41.01 C ATOM 2161 C ASP A 139 5.864 -16.086 10.129 1.00 5.02 C ATOM 2162 O ASP A 139 5.806 -15.046 10.785 1.00 2.32 O ATOM 2163 CB ASP A 139 6.517 -17.725 11.903 1.00 24.31 C ATOM 2164 CG ASP A 139 5.317 -18.651 11.928 1.00 21.04 C ATOM 2165 OD1 ASP A 139 4.264 -18.273 11.374 1.00 51.24 O ATOM 2166 OD2 ASP A 139 5.431 -19.754 12.502 1.00 22.11 O ATOM 0 H ASP A 139 8.537 -16.252 11.244 1.00 3.23 H new ATOM 0 HA ASP A 139 6.698 -18.024 9.784 1.00 41.01 H new ATOM 0 HB2 ASP A 139 7.387 -18.252 12.294 1.00 24.31 H new ATOM 0 HB3 ASP A 139 6.333 -16.878 12.564 1.00 24.31 H new ATOM 2171 N PRO A 140 5.090 -16.298 9.054 1.00 4.45 N ATOM 2172 CA PRO A 140 4.116 -15.313 8.575 1.00 74.42 C ATOM 2173 C PRO A 140 2.930 -15.163 9.521 1.00 34.33 C ATOM 2174 O PRO A 140 2.277 -14.121 9.553 1.00 4.34 O ATOM 2175 CB PRO A 140 3.659 -15.891 7.233 1.00 61.31 C ATOM 2176 CG PRO A 140 3.892 -17.358 7.353 1.00 14.12 C ATOM 2177 CD PRO A 140 5.107 -17.514 8.225 1.00 33.32 C ATOM 0 HA PRO A 140 4.548 -14.315 8.501 1.00 74.42 H new ATOM 0 HB2 PRO A 140 2.608 -15.671 7.045 1.00 61.31 H new ATOM 0 HB3 PRO A 140 4.227 -15.466 6.405 1.00 61.31 H new ATOM 0 HG2 PRO A 140 3.028 -17.856 7.794 1.00 14.12 H new ATOM 0 HG3 PRO A 140 4.054 -17.809 6.374 1.00 14.12 H new ATOM 0 HD2 PRO A 140 5.051 -18.416 8.834 1.00 33.32 H new ATOM 0 HD3 PRO A 140 6.020 -17.584 7.633 1.00 33.32 H new ATOM 2185 N ASN A 141 2.656 -16.212 10.291 1.00 42.20 N ATOM 2186 CA ASN A 141 1.548 -16.196 11.239 1.00 51.12 C ATOM 2187 C ASN A 141 2.060 -16.128 12.674 1.00 5.21 C ATOM 2188 O ASN A 141 1.371 -16.532 13.610 1.00 61.11 O ATOM 2189 CB ASN A 141 0.675 -17.439 11.055 1.00 30.15 C ATOM 2190 CG ASN A 141 -0.119 -17.402 9.764 1.00 34.52 C ATOM 2191 OD1 ASN A 141 0.426 -17.611 8.681 1.00 62.34 O ATOM 2192 ND2 ASN A 141 -1.416 -17.136 9.875 1.00 43.24 N ATOM 0 H ASN A 141 3.186 -17.083 10.277 1.00 42.20 H new ATOM 0 HA ASN A 141 0.949 -15.307 11.044 1.00 51.12 H new ATOM 0 HB2 ASN A 141 1.306 -18.328 11.065 1.00 30.15 H new ATOM 0 HB3 ASN A 141 -0.011 -17.526 11.898 1.00 30.15 H new ATOM 0 HD21 ASN A 141 -2.002 -17.099 9.041 1.00 43.24 H new ATOM 0 HD22 ASN A 141 -1.826 -16.969 10.794 1.00 43.24 H new ATOM 2199 N ALA A 142 3.275 -15.613 12.839 1.00 35.03 N ATOM 2200 CA ALA A 142 3.879 -15.489 14.160 1.00 34.30 C ATOM 2201 C ALA A 142 2.936 -14.786 15.131 1.00 43.00 C ATOM 2202 O ALA A 142 2.782 -13.565 15.086 1.00 35.44 O ATOM 2203 CB ALA A 142 5.200 -14.740 14.068 1.00 71.50 C ATOM 0 H ALA A 142 3.860 -15.275 12.074 1.00 35.03 H new ATOM 0 HA ALA A 142 4.069 -16.492 14.541 1.00 34.30 H new ATOM 0 HB1 ALA A 142 5.640 -14.655 15.062 1.00 71.50 H new ATOM 0 HB2 ALA A 142 5.882 -15.284 13.415 1.00 71.50 H new ATOM 0 HB3 ALA A 142 5.026 -13.744 13.662 1.00 71.50 H new ATOM 2209 N ASP A 143 2.309 -15.563 16.007 1.00 73.25 N ATOM 2210 CA ASP A 143 1.381 -15.014 16.989 1.00 22.40 C ATOM 2211 C ASP A 143 1.226 -15.959 18.177 1.00 51.03 C ATOM 2212 O ASP A 143 1.251 -17.180 18.020 1.00 63.53 O ATOM 2213 CB ASP A 143 0.018 -14.755 16.346 1.00 71.31 C ATOM 2214 CG ASP A 143 -0.505 -13.362 16.638 1.00 22.51 C ATOM 2215 OD1 ASP A 143 0.299 -12.408 16.600 1.00 52.42 O ATOM 2216 OD2 ASP A 143 -1.717 -13.227 16.906 1.00 33.50 O ATOM 0 H ASP A 143 2.426 -16.575 16.057 1.00 73.25 H new ATOM 0 HA ASP A 143 1.789 -14.069 17.349 1.00 22.40 H new ATOM 0 HB2 ASP A 143 0.097 -14.892 15.267 1.00 71.31 H new ATOM 0 HB3 ASP A 143 -0.698 -15.492 16.709 1.00 71.31 H new ATOM 2221 N LEU A 144 1.066 -15.386 19.365 1.00 63.24 N ATOM 2222 CA LEU A 144 0.908 -16.177 20.580 1.00 11.13 C ATOM 2223 C LEU A 144 -0.566 -16.436 20.873 1.00 75.53 C ATOM 2224 O LEU A 144 -1.202 -15.692 21.619 1.00 53.14 O ATOM 2225 CB LEU A 144 1.556 -15.461 21.766 1.00 5.22 C ATOM 2226 CG LEU A 144 2.980 -14.948 21.544 1.00 54.43 C ATOM 2227 CD1 LEU A 144 3.050 -13.448 21.785 1.00 51.43 C ATOM 2228 CD2 LEU A 144 3.959 -15.681 22.448 1.00 33.44 C ATOM 0 H LEU A 144 1.042 -14.377 19.512 1.00 63.24 H new ATOM 0 HA LEU A 144 1.404 -17.136 20.427 1.00 11.13 H new ATOM 0 HB2 LEU A 144 0.926 -14.616 22.043 1.00 5.22 H new ATOM 0 HB3 LEU A 144 1.565 -16.144 22.616 1.00 5.22 H new ATOM 0 HG LEU A 144 3.258 -15.143 20.508 1.00 54.43 H new ATOM 0 HD11 LEU A 144 4.070 -13.101 21.623 1.00 51.43 H new ATOM 0 HD12 LEU A 144 2.378 -12.937 21.095 1.00 51.43 H new ATOM 0 HD13 LEU A 144 2.751 -13.230 22.810 1.00 51.43 H new ATOM 0 HD21 LEU A 144 4.967 -15.303 22.276 1.00 33.44 H new ATOM 0 HD22 LEU A 144 3.684 -15.519 23.490 1.00 33.44 H new ATOM 0 HD23 LEU A 144 3.930 -16.748 22.227 1.00 33.44 H new TER 2240 LEU A 144