USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1069 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 12 SER OG : rot -73:sc= 1.17 USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 1.07 USER MOD Set 2.1: A 108 SER OG : rot 180:sc= 1.08 USER MOD Set 2.2: A 130 SER OG : rot -115:sc= 1.05 USER MOD Set 3.1: A 45 TYR OH : rot 180:sc= -0.0417 USER MOD Set 3.2: A 59 LYS NZ :NH3+ 171:sc= -0.423 (180deg=0) USER MOD Set 3.3: A 61 GLN : amide:sc= -0.401 K(o=0.24,f=-2.4) USER MOD Set 3.4: A 63 TYR OH : rot 131:sc= 1.1 USER MOD Set 4.1: A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 80 TYR OH : rot 165:sc= 0 USER MOD Set 5.1: A 20 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.14) USER MOD Set 5.2: A 49 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 3 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ -172:sc= 0 (180deg=-0.0453) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 23:sc= -0.546 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0973 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.888 K(o=-0.89,f=-6.6!) USER MOD Single : A 21 MET CE :methyl -166:sc= -2.56 (180deg=-4.47!) USER MOD Single : A 25 ASN : amide:sc= -3.11! X(o=-3.1!,f=-2.9) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 35 SER OG : rot 180:sc= -0.0117 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0618 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.878 USER MOD Single : A 48 LYS NZ :NH3+ 140:sc= -0.197 (180deg=-1.11) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 17:sc= 1.23 USER MOD Single : A 54 SER OG : rot 180:sc= -0.872 USER MOD Single : A 57 TYR OH : rot 165:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.231 X(o=-0.23,f=0) USER MOD Single : A 60 ASN : amide:sc= -1.36 K(o=-1.4,f=-6!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 19:sc= 0.175 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.13 K(o=-1.1,f=-2.8!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 165:sc= -0.977 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 33:sc= 0.541 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.00387) USER MOD Single : A 100 HIS : no HD1:sc= -0.0942 X(o=-0.094,f=-0.0035) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.36 K(o=-0.36,f=-4.7!) USER MOD Single : A 116 ASN : amide:sc= -0.223 X(o=-0.22,f=-0.58) USER MOD Single : A 118 MET CE :methyl -155:sc= -0.222 (180deg=-1.42!) USER MOD Single : A 120 ASN : amide:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 126 SER OG : rot 27:sc= 1.16 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 134 SER OG : rot -29:sc= 0.563 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 116.142 -21.849 9.671 1.00 0.00 N ATOM 2 CA ALA A 1 116.951 -22.941 9.059 1.00 0.00 C ATOM 3 C ALA A 1 117.666 -22.408 7.822 1.00 0.00 C ATOM 4 O ALA A 1 118.859 -22.647 7.632 1.00 0.00 O ATOM 5 CB ALA A 1 116.028 -24.099 8.672 1.00 0.00 C ATOM 0 H1 ALA A 1 115.763 -22.168 10.585 1.00 0.00 H new ATOM 0 H2 ALA A 1 116.743 -21.013 9.818 1.00 0.00 H new ATOM 0 H3 ALA A 1 115.355 -21.603 9.037 1.00 0.00 H new ATOM 0 HA ALA A 1 117.692 -23.297 9.774 1.00 0.00 H new ATOM 0 HB1 ALA A 1 116.617 -24.899 8.224 1.00 0.00 H new ATOM 0 HB2 ALA A 1 115.523 -24.475 9.562 1.00 0.00 H new ATOM 0 HB3 ALA A 1 115.286 -23.749 7.954 1.00 0.00 H new ATOM 13 N THR A 2 116.929 -21.685 6.984 1.00 0.00 N ATOM 14 CA THR A 2 117.494 -21.117 5.762 1.00 0.00 C ATOM 15 C THR A 2 117.312 -19.603 5.750 1.00 0.00 C ATOM 16 O THR A 2 116.270 -19.092 6.160 1.00 0.00 O ATOM 17 CB THR A 2 116.799 -21.726 4.542 1.00 0.00 C ATOM 18 OG1 THR A 2 116.881 -23.142 4.613 1.00 0.00 O ATOM 19 CG2 THR A 2 117.482 -21.238 3.263 1.00 0.00 C ATOM 0 H THR A 2 115.941 -21.478 7.127 1.00 0.00 H new ATOM 0 HA THR A 2 118.559 -21.346 5.727 1.00 0.00 H new ATOM 0 HB THR A 2 115.753 -21.420 4.530 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.435 -23.535 3.834 1.00 0.00 H new ATOM 0 HG21 THR A 2 116.985 -21.673 2.396 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.420 -20.151 3.209 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.529 -21.541 3.271 1.00 0.00 H new ATOM 27 N SER A 3 118.331 -18.888 5.279 1.00 0.00 N ATOM 28 CA SER A 3 118.280 -17.430 5.239 1.00 0.00 C ATOM 29 C SER A 3 118.697 -16.923 3.865 1.00 0.00 C ATOM 30 O SER A 3 119.520 -17.543 3.192 1.00 0.00 O ATOM 31 CB SER A 3 119.212 -16.847 6.302 1.00 0.00 C ATOM 32 OG SER A 3 118.815 -17.322 7.582 1.00 0.00 O ATOM 0 H SER A 3 119.197 -19.292 4.922 1.00 0.00 H new ATOM 0 HA SER A 3 117.257 -17.113 5.439 1.00 0.00 H new ATOM 0 HB2 SER A 3 120.243 -17.136 6.097 1.00 0.00 H new ATOM 0 HB3 SER A 3 119.175 -15.758 6.277 1.00 0.00 H new ATOM 0 HG SER A 3 119.410 -16.953 8.267 1.00 0.00 H new ATOM 38 N THR A 4 118.118 -15.802 3.446 1.00 0.00 N ATOM 39 CA THR A 4 118.470 -15.196 2.164 1.00 0.00 C ATOM 40 C THR A 4 118.752 -13.709 2.347 1.00 0.00 C ATOM 41 O THR A 4 117.988 -13.000 3.002 1.00 0.00 O ATOM 42 CB THR A 4 117.332 -15.378 1.156 1.00 0.00 C ATOM 43 OG1 THR A 4 116.183 -14.682 1.612 1.00 0.00 O ATOM 44 CG2 THR A 4 117.008 -16.864 1.000 1.00 0.00 C ATOM 0 H THR A 4 117.406 -15.296 3.972 1.00 0.00 H new ATOM 0 HA THR A 4 119.364 -15.690 1.785 1.00 0.00 H new ATOM 0 HB THR A 4 117.639 -14.979 0.189 1.00 0.00 H new ATOM 0 HG1 THR A 4 116.455 -13.972 2.231 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.198 -16.986 0.281 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.892 -17.394 0.644 1.00 0.00 H new ATOM 0 HG23 THR A 4 116.704 -17.273 1.963 1.00 0.00 H new ATOM 52 N VAL A 5 119.853 -13.240 1.766 1.00 0.00 N ATOM 53 CA VAL A 5 120.217 -11.828 1.863 1.00 0.00 C ATOM 54 C VAL A 5 120.084 -11.183 0.489 1.00 0.00 C ATOM 55 O VAL A 5 120.621 -11.696 -0.491 1.00 0.00 O ATOM 56 CB VAL A 5 121.656 -11.683 2.370 1.00 0.00 C ATOM 57 CG1 VAL A 5 121.994 -10.200 2.550 1.00 0.00 C ATOM 58 CG2 VAL A 5 121.804 -12.395 3.717 1.00 0.00 C ATOM 0 H VAL A 5 120.504 -13.811 1.227 1.00 0.00 H new ATOM 0 HA VAL A 5 119.550 -11.332 2.568 1.00 0.00 H new ATOM 0 HB VAL A 5 122.334 -12.129 1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 5 123.018 -10.101 2.911 1.00 0.00 H new ATOM 0 HG12 VAL A 5 121.895 -9.686 1.594 1.00 0.00 H new ATOM 0 HG13 VAL A 5 121.310 -9.756 3.274 1.00 0.00 H new ATOM 0 HG21 VAL A 5 122.829 -12.289 4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 5 121.120 -11.951 4.440 1.00 0.00 H new ATOM 0 HG23 VAL A 5 121.569 -13.453 3.597 1.00 0.00 H new ATOM 68 N THR A 6 119.355 -10.074 0.425 1.00 0.00 N ATOM 69 CA THR A 6 119.098 -9.409 -0.848 1.00 0.00 C ATOM 70 C THR A 6 119.270 -7.899 -0.714 1.00 0.00 C ATOM 71 O THR A 6 118.988 -7.322 0.335 1.00 0.00 O ATOM 72 CB THR A 6 117.674 -9.726 -1.313 1.00 0.00 C ATOM 73 OG1 THR A 6 117.498 -11.134 -1.356 1.00 0.00 O ATOM 74 CG2 THR A 6 117.435 -9.139 -2.705 1.00 0.00 C ATOM 0 H THR A 6 118.934 -9.618 1.234 1.00 0.00 H new ATOM 0 HA THR A 6 119.815 -9.775 -1.583 1.00 0.00 H new ATOM 0 HB THR A 6 116.962 -9.286 -0.615 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.587 -11.341 -1.652 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.420 -9.369 -3.028 1.00 0.00 H new ATOM 0 HG22 THR A 6 117.569 -8.058 -2.672 1.00 0.00 H new ATOM 0 HG23 THR A 6 118.146 -9.571 -3.409 1.00 0.00 H new ATOM 82 N GLY A 7 119.743 -7.267 -1.783 1.00 0.00 N ATOM 83 CA GLY A 7 119.845 -5.814 -1.814 1.00 0.00 C ATOM 84 C GLY A 7 119.502 -5.311 -3.209 1.00 0.00 C ATOM 85 O GLY A 7 119.718 -6.022 -4.189 1.00 0.00 O ATOM 0 H GLY A 7 120.059 -7.734 -2.633 1.00 0.00 H new ATOM 0 HA2 GLY A 7 119.168 -5.376 -1.081 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.854 -5.504 -1.542 1.00 0.00 H new ATOM 89 N GLY A 8 118.969 -4.096 -3.298 1.00 0.00 N ATOM 90 CA GLY A 8 118.580 -3.555 -4.596 1.00 0.00 C ATOM 91 C GLY A 8 118.560 -2.033 -4.594 1.00 0.00 C ATOM 92 O GLY A 8 118.643 -1.397 -3.544 1.00 0.00 O ATOM 0 H GLY A 8 118.799 -3.478 -2.504 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.274 -3.908 -5.359 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.593 -3.931 -4.865 1.00 0.00 H new ATOM 96 N TYR A 9 118.418 -1.470 -5.790 1.00 0.00 N ATOM 97 CA TYR A 9 118.383 -0.023 -5.966 1.00 0.00 C ATOM 98 C TYR A 9 117.072 0.384 -6.628 1.00 0.00 C ATOM 99 O TYR A 9 116.531 -0.359 -7.450 1.00 0.00 O ATOM 100 CB TYR A 9 119.558 0.427 -6.836 1.00 0.00 C ATOM 101 CG TYR A 9 120.906 0.048 -6.269 1.00 0.00 C ATOM 102 CD1 TYR A 9 121.573 0.924 -5.404 1.00 0.00 C ATOM 103 CD2 TYR A 9 121.488 -1.178 -6.609 1.00 0.00 C ATOM 104 CE1 TYR A 9 122.821 0.572 -4.878 1.00 0.00 C ATOM 105 CE2 TYR A 9 122.736 -1.530 -6.083 1.00 0.00 C ATOM 106 CZ TYR A 9 123.403 -0.655 -5.217 1.00 0.00 C ATOM 107 OH TYR A 9 124.635 -1.002 -4.699 1.00 0.00 O ATOM 0 H TYR A 9 118.325 -1.999 -6.657 1.00 0.00 H new ATOM 0 HA TYR A 9 118.458 0.454 -4.989 1.00 0.00 H new ATOM 0 HB2 TYR A 9 119.454 -0.011 -7.829 1.00 0.00 H new ATOM 0 HB3 TYR A 9 119.515 1.509 -6.959 1.00 0.00 H new ATOM 0 HD1 TYR A 9 121.124 1.871 -5.143 1.00 0.00 H new ATOM 0 HD2 TYR A 9 120.974 -1.853 -7.277 1.00 0.00 H new ATOM 0 HE1 TYR A 9 123.335 1.247 -4.210 1.00 0.00 H new ATOM 0 HE2 TYR A 9 123.185 -2.477 -6.345 1.00 0.00 H new ATOM 0 HH TYR A 9 124.894 -1.886 -5.034 1.00 0.00 H new ATOM 117 N ALA A 10 116.539 1.537 -6.230 1.00 0.00 N ATOM 118 CA ALA A 10 115.292 2.028 -6.805 1.00 0.00 C ATOM 119 C ALA A 10 115.355 3.533 -7.047 1.00 0.00 C ATOM 120 O ALA A 10 116.007 4.264 -6.302 1.00 0.00 O ATOM 121 CB ALA A 10 114.125 1.708 -5.869 1.00 0.00 C ATOM 0 H ALA A 10 116.948 2.143 -5.518 1.00 0.00 H new ATOM 0 HA ALA A 10 115.141 1.530 -7.763 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.197 2.078 -6.305 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.056 0.629 -5.729 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.290 2.189 -4.905 1.00 0.00 H new ATOM 127 N GLN A 11 114.671 3.983 -8.095 1.00 0.00 N ATOM 128 CA GLN A 11 114.557 5.409 -8.389 1.00 0.00 C ATOM 129 C GLN A 11 113.084 5.793 -8.479 1.00 0.00 C ATOM 130 O GLN A 11 112.279 5.041 -9.028 1.00 0.00 O ATOM 131 CB GLN A 11 115.255 5.730 -9.712 1.00 0.00 C ATOM 132 CG GLN A 11 116.755 5.446 -9.581 1.00 0.00 C ATOM 133 CD GLN A 11 117.463 5.676 -10.914 1.00 0.00 C ATOM 134 OE1 GLN A 11 116.827 5.710 -11.969 1.00 0.00 O ATOM 135 NE2 GLN A 11 118.758 5.837 -10.930 1.00 0.00 N ATOM 0 H GLN A 11 114.185 3.378 -8.757 1.00 0.00 H new ATOM 0 HA GLN A 11 115.034 5.978 -7.591 1.00 0.00 H new ATOM 0 HB2 GLN A 11 114.829 5.129 -10.515 1.00 0.00 H new ATOM 0 HB3 GLN A 11 115.094 6.775 -9.976 1.00 0.00 H new ATOM 0 HG2 GLN A 11 117.188 6.092 -8.817 1.00 0.00 H new ATOM 0 HG3 GLN A 11 116.909 4.418 -9.254 1.00 0.00 H new ATOM 0 HE21 GLN A 11 119.286 5.809 -10.058 1.00 0.00 H new ATOM 0 HE22 GLN A 11 119.242 5.991 -11.815 1.00 0.00 H new ATOM 144 N SER A 12 112.725 6.959 -7.945 1.00 0.00 N ATOM 145 CA SER A 12 111.323 7.370 -7.909 1.00 0.00 C ATOM 146 C SER A 12 111.123 8.687 -8.646 1.00 0.00 C ATOM 147 O SER A 12 111.924 9.612 -8.510 1.00 0.00 O ATOM 148 CB SER A 12 110.872 7.531 -6.456 1.00 0.00 C ATOM 149 OG SER A 12 111.047 6.297 -5.774 1.00 0.00 O ATOM 0 H SER A 12 113.377 7.629 -7.536 1.00 0.00 H new ATOM 0 HA SER A 12 110.728 6.601 -8.401 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.450 8.315 -5.968 1.00 0.00 H new ATOM 0 HB3 SER A 12 109.826 7.836 -6.419 1.00 0.00 H new ATOM 0 HG SER A 12 110.365 5.659 -6.071 1.00 0.00 H new ATOM 155 N ASP A 13 110.035 8.757 -9.409 1.00 0.00 N ATOM 156 CA ASP A 13 109.677 9.967 -10.138 1.00 0.00 C ATOM 157 C ASP A 13 108.358 10.506 -9.601 1.00 0.00 C ATOM 158 O ASP A 13 107.440 9.735 -9.321 1.00 0.00 O ATOM 159 CB ASP A 13 109.539 9.662 -11.632 1.00 0.00 C ATOM 160 CG ASP A 13 110.873 9.188 -12.206 1.00 0.00 C ATOM 161 OD1 ASP A 13 111.903 9.621 -11.714 1.00 0.00 O ATOM 162 OD2 ASP A 13 110.844 8.397 -13.135 1.00 0.00 O ATOM 0 H ASP A 13 109.383 7.983 -9.538 1.00 0.00 H new ATOM 0 HA ASP A 13 110.461 10.712 -10.002 1.00 0.00 H new ATOM 0 HB2 ASP A 13 108.778 8.896 -11.784 1.00 0.00 H new ATOM 0 HB3 ASP A 13 109.204 10.554 -12.162 1.00 0.00 H new ATOM 167 N ALA A 14 108.269 11.824 -9.456 1.00 0.00 N ATOM 168 CA ALA A 14 107.088 12.448 -8.878 1.00 0.00 C ATOM 169 C ALA A 14 106.259 13.114 -9.969 1.00 0.00 C ATOM 170 O ALA A 14 106.640 14.144 -10.524 1.00 0.00 O ATOM 171 CB ALA A 14 107.512 13.485 -7.833 1.00 0.00 C ATOM 0 H ALA A 14 109.001 12.479 -9.731 1.00 0.00 H new ATOM 0 HA ALA A 14 106.480 11.682 -8.396 1.00 0.00 H new ATOM 0 HB1 ALA A 14 106.626 13.951 -7.402 1.00 0.00 H new ATOM 0 HB2 ALA A 14 108.084 12.995 -7.045 1.00 0.00 H new ATOM 0 HB3 ALA A 14 108.129 14.249 -8.307 1.00 0.00 H new ATOM 177 N GLN A 15 105.125 12.501 -10.265 1.00 0.00 N ATOM 178 CA GLN A 15 104.185 13.055 -11.232 1.00 0.00 C ATOM 179 C GLN A 15 103.302 14.100 -10.561 1.00 0.00 C ATOM 180 O GLN A 15 102.593 13.807 -9.594 1.00 0.00 O ATOM 181 CB GLN A 15 103.315 11.941 -11.816 1.00 0.00 C ATOM 182 CG GLN A 15 102.427 12.511 -12.926 1.00 0.00 C ATOM 183 CD GLN A 15 101.580 11.413 -13.568 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.763 10.225 -13.292 1.00 0.00 O ATOM 185 NE2 GLN A 15 100.648 11.743 -14.420 1.00 0.00 N ATOM 0 H GLN A 15 104.830 11.617 -9.850 1.00 0.00 H new ATOM 0 HA GLN A 15 104.747 13.527 -12.038 1.00 0.00 H new ATOM 0 HB2 GLN A 15 103.944 11.145 -12.213 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.698 11.500 -11.033 1.00 0.00 H new ATOM 0 HG2 GLN A 15 101.777 13.284 -12.516 1.00 0.00 H new ATOM 0 HG3 GLN A 15 103.048 12.987 -13.685 1.00 0.00 H new ATOM 0 HE21 GLN A 15 100.493 12.724 -14.651 1.00 0.00 H new ATOM 0 HE22 GLN A 15 100.075 11.020 -14.854 1.00 0.00 H new ATOM 194 N GLY A 16 103.351 15.311 -11.107 1.00 0.00 N ATOM 195 CA GLY A 16 102.653 16.462 -10.533 1.00 0.00 C ATOM 196 C GLY A 16 103.488 17.194 -9.472 1.00 0.00 C ATOM 197 O GLY A 16 103.160 18.319 -9.096 1.00 0.00 O ATOM 0 H GLY A 16 103.873 15.524 -11.957 1.00 0.00 H new ATOM 0 HA2 GLY A 16 102.394 17.159 -11.330 1.00 0.00 H new ATOM 0 HA3 GLY A 16 101.717 16.128 -10.086 1.00 0.00 H new ATOM 201 N GLN A 17 104.563 16.565 -8.988 1.00 0.00 N ATOM 202 CA GLN A 17 105.524 17.230 -8.115 1.00 0.00 C ATOM 203 C GLN A 17 106.883 17.294 -8.804 1.00 0.00 C ATOM 204 O GLN A 17 107.248 16.371 -9.534 1.00 0.00 O ATOM 205 CB GLN A 17 105.644 16.471 -6.792 1.00 0.00 C ATOM 206 CG GLN A 17 106.552 17.245 -5.835 1.00 0.00 C ATOM 207 CD GLN A 17 106.810 16.420 -4.579 1.00 0.00 C ATOM 208 OE1 GLN A 17 107.302 15.294 -4.666 1.00 0.00 O ATOM 209 NE2 GLN A 17 106.509 16.914 -3.410 1.00 0.00 N ATOM 0 H GLN A 17 104.787 15.591 -9.190 1.00 0.00 H new ATOM 0 HA GLN A 17 105.178 18.243 -7.908 1.00 0.00 H new ATOM 0 HB2 GLN A 17 104.658 16.339 -6.346 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.050 15.475 -6.968 1.00 0.00 H new ATOM 0 HG2 GLN A 17 107.496 17.480 -6.326 1.00 0.00 H new ATOM 0 HG3 GLN A 17 106.087 18.194 -5.568 1.00 0.00 H new ATOM 0 HE21 GLN A 17 106.102 17.847 -3.340 1.00 0.00 H new ATOM 0 HE22 GLN A 17 106.681 16.368 -2.566 1.00 0.00 H new ATOM 218 N MET A 18 107.627 18.374 -8.582 1.00 0.00 N ATOM 219 CA MET A 18 108.973 18.475 -9.135 1.00 0.00 C ATOM 220 C MET A 18 109.990 17.923 -8.141 1.00 0.00 C ATOM 221 O MET A 18 110.420 18.630 -7.230 1.00 0.00 O ATOM 222 CB MET A 18 109.303 19.935 -9.452 1.00 0.00 C ATOM 223 CG MET A 18 108.382 20.438 -10.565 1.00 0.00 C ATOM 224 SD MET A 18 108.848 22.128 -11.017 1.00 0.00 S ATOM 225 CE MET A 18 107.514 22.421 -12.204 1.00 0.00 C ATOM 0 H MET A 18 107.327 19.179 -8.032 1.00 0.00 H new ATOM 0 HA MET A 18 109.018 17.891 -10.054 1.00 0.00 H new ATOM 0 HB2 MET A 18 109.180 20.548 -8.559 1.00 0.00 H new ATOM 0 HB3 MET A 18 110.345 20.025 -9.760 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.454 19.785 -11.434 1.00 0.00 H new ATOM 0 HG3 MET A 18 107.344 20.412 -10.232 1.00 0.00 H new ATOM 0 HE1 MET A 18 107.608 23.426 -12.616 1.00 0.00 H new ATOM 0 HE2 MET A 18 107.578 21.690 -13.010 1.00 0.00 H new ATOM 0 HE3 MET A 18 106.552 22.324 -11.701 1.00 0.00 H new ATOM 235 N ASN A 19 110.389 16.668 -8.337 1.00 0.00 N ATOM 236 CA ASN A 19 111.325 16.021 -7.421 1.00 0.00 C ATOM 237 C ASN A 19 111.687 14.617 -7.900 1.00 0.00 C ATOM 238 O ASN A 19 110.871 13.925 -8.509 1.00 0.00 O ATOM 239 CB ASN A 19 110.707 15.924 -6.024 1.00 0.00 C ATOM 240 CG ASN A 19 111.789 15.604 -4.999 1.00 0.00 C ATOM 241 OD1 ASN A 19 112.837 16.250 -4.979 1.00 0.00 O ATOM 242 ND2 ASN A 19 111.597 14.640 -4.141 1.00 0.00 N ATOM 0 H ASN A 19 110.082 16.084 -9.115 1.00 0.00 H new ATOM 0 HA ASN A 19 112.231 16.627 -7.389 1.00 0.00 H new ATOM 0 HB2 ASN A 19 110.217 16.863 -5.767 1.00 0.00 H new ATOM 0 HB3 ASN A 19 109.940 15.150 -6.009 1.00 0.00 H new ATOM 0 HD21 ASN A 19 112.316 14.420 -3.452 1.00 0.00 H new ATOM 0 HD22 ASN A 19 110.728 14.106 -4.160 1.00 0.00 H new ATOM 249 N LYS A 20 112.921 14.208 -7.617 1.00 0.00 N ATOM 250 CA LYS A 20 113.371 12.850 -7.914 1.00 0.00 C ATOM 251 C LYS A 20 114.134 12.280 -6.717 1.00 0.00 C ATOM 252 O LYS A 20 114.814 13.022 -6.006 1.00 0.00 O ATOM 253 CB LYS A 20 114.232 12.848 -9.186 1.00 0.00 C ATOM 254 CG LYS A 20 115.555 13.590 -8.960 1.00 0.00 C ATOM 255 CD LYS A 20 116.325 13.677 -10.279 1.00 0.00 C ATOM 256 CE LYS A 20 117.760 14.130 -10.005 1.00 0.00 C ATOM 257 NZ LYS A 20 117.747 15.510 -9.445 1.00 0.00 N ATOM 0 H LYS A 20 113.629 14.799 -7.181 1.00 0.00 H new ATOM 0 HA LYS A 20 112.507 12.211 -8.095 1.00 0.00 H new ATOM 0 HB2 LYS A 20 114.435 11.821 -9.489 1.00 0.00 H new ATOM 0 HB3 LYS A 20 113.682 13.319 -10.001 1.00 0.00 H new ATOM 0 HG2 LYS A 20 115.361 14.591 -8.573 1.00 0.00 H new ATOM 0 HG3 LYS A 20 116.153 13.069 -8.212 1.00 0.00 H new ATOM 0 HD2 LYS A 20 116.328 12.707 -10.775 1.00 0.00 H new ATOM 0 HD3 LYS A 20 115.834 14.378 -10.953 1.00 0.00 H new ATOM 0 HE2 LYS A 20 118.241 13.447 -9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 20 118.343 14.105 -10.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 118.713 15.895 -9.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 117.131 16.114 -10.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 117.388 15.485 -8.469 1.00 0.00 H new ATOM 271 N MET A 21 114.028 10.970 -6.493 1.00 0.00 N ATOM 272 CA MET A 21 114.658 10.360 -5.320 1.00 0.00 C ATOM 273 C MET A 21 115.448 9.116 -5.707 1.00 0.00 C ATOM 274 O MET A 21 115.072 8.394 -6.628 1.00 0.00 O ATOM 275 CB MET A 21 113.579 9.970 -4.305 1.00 0.00 C ATOM 276 CG MET A 21 112.757 11.198 -3.900 1.00 0.00 C ATOM 277 SD MET A 21 113.829 12.467 -3.177 1.00 0.00 S ATOM 278 CE MET A 21 114.373 11.518 -1.734 1.00 0.00 C ATOM 0 H MET A 21 113.522 10.320 -7.095 1.00 0.00 H new ATOM 0 HA MET A 21 115.343 11.087 -4.884 1.00 0.00 H new ATOM 0 HB2 MET A 21 112.924 9.212 -4.734 1.00 0.00 H new ATOM 0 HB3 MET A 21 114.043 9.528 -3.423 1.00 0.00 H new ATOM 0 HG2 MET A 21 112.242 11.602 -4.771 1.00 0.00 H new ATOM 0 HG3 MET A 21 111.990 10.909 -3.182 1.00 0.00 H new ATOM 0 HE1 MET A 21 114.846 12.187 -1.015 1.00 0.00 H new ATOM 0 HE2 MET A 21 113.512 11.037 -1.270 1.00 0.00 H new ATOM 0 HE3 MET A 21 115.089 10.758 -2.047 1.00 0.00 H new ATOM 288 N GLY A 22 116.538 8.868 -4.983 1.00 0.00 N ATOM 289 CA GLY A 22 117.330 7.657 -5.185 1.00 0.00 C ATOM 290 C GLY A 22 117.548 6.964 -3.846 1.00 0.00 C ATOM 291 O GLY A 22 117.911 7.619 -2.869 1.00 0.00 O ATOM 0 H GLY A 22 116.892 9.487 -4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.818 6.986 -5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.289 7.908 -5.637 1.00 0.00 H new ATOM 295 N GLY A 23 117.304 5.657 -3.791 1.00 0.00 N ATOM 296 CA GLY A 23 117.371 4.946 -2.520 1.00 0.00 C ATOM 297 C GLY A 23 117.790 3.493 -2.688 1.00 0.00 C ATOM 298 O GLY A 23 117.808 2.957 -3.795 1.00 0.00 O ATOM 0 H GLY A 23 117.063 5.079 -4.596 1.00 0.00 H new ATOM 0 HA2 GLY A 23 118.078 5.451 -1.861 1.00 0.00 H new ATOM 0 HA3 GLY A 23 116.397 4.986 -2.033 1.00 0.00 H new ATOM 302 N PHE A 24 118.105 2.862 -1.560 1.00 0.00 N ATOM 303 CA PHE A 24 118.513 1.462 -1.553 1.00 0.00 C ATOM 304 C PHE A 24 117.704 0.702 -0.509 1.00 0.00 C ATOM 305 O PHE A 24 117.191 1.304 0.434 1.00 0.00 O ATOM 306 CB PHE A 24 120.007 1.351 -1.235 1.00 0.00 C ATOM 307 CG PHE A 24 120.372 1.863 0.138 1.00 0.00 C ATOM 308 CD1 PHE A 24 120.614 3.227 0.336 1.00 0.00 C ATOM 309 CD2 PHE A 24 120.467 0.973 1.215 1.00 0.00 C ATOM 310 CE1 PHE A 24 120.953 3.702 1.608 1.00 0.00 C ATOM 311 CE2 PHE A 24 120.805 1.447 2.488 1.00 0.00 C ATOM 312 CZ PHE A 24 121.049 2.811 2.684 1.00 0.00 C ATOM 0 H PHE A 24 118.085 3.299 -0.639 1.00 0.00 H new ATOM 0 HA PHE A 24 118.330 1.031 -2.537 1.00 0.00 H new ATOM 0 HB2 PHE A 24 120.311 0.307 -1.317 1.00 0.00 H new ATOM 0 HB3 PHE A 24 120.572 1.907 -1.983 1.00 0.00 H new ATOM 0 HD1 PHE A 24 120.539 3.914 -0.494 1.00 0.00 H new ATOM 0 HD2 PHE A 24 120.279 -0.080 1.063 1.00 0.00 H new ATOM 0 HE1 PHE A 24 121.140 4.755 1.760 1.00 0.00 H new ATOM 0 HE2 PHE A 24 120.877 0.760 3.319 1.00 0.00 H new ATOM 0 HZ PHE A 24 121.312 3.177 3.666 1.00 0.00 H new ATOM 322 N ASN A 25 117.582 -0.611 -0.683 1.00 0.00 N ATOM 323 CA ASN A 25 116.785 -1.414 0.238 1.00 0.00 C ATOM 324 C ASN A 25 117.406 -2.788 0.457 1.00 0.00 C ATOM 325 O ASN A 25 118.072 -3.322 -0.428 1.00 0.00 O ATOM 326 CB ASN A 25 115.364 -1.571 -0.312 1.00 0.00 C ATOM 327 CG ASN A 25 115.399 -2.283 -1.660 1.00 0.00 C ATOM 328 OD1 ASN A 25 115.636 -3.489 -1.721 1.00 0.00 O ATOM 329 ND2 ASN A 25 115.178 -1.603 -2.751 1.00 0.00 N ATOM 0 H ASN A 25 118.018 -1.135 -1.442 1.00 0.00 H new ATOM 0 HA ASN A 25 116.755 -0.899 1.198 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.754 -2.138 0.392 1.00 0.00 H new ATOM 0 HB3 ASN A 25 114.898 -0.592 -0.421 1.00 0.00 H new ATOM 0 HD21 ASN A 25 115.201 -2.071 -3.657 1.00 0.00 H new ATOM 0 HD22 ASN A 25 114.982 -0.603 -2.698 1.00 0.00 H new ATOM 336 N LEU A 26 117.181 -3.345 1.645 1.00 0.00 N ATOM 337 CA LEU A 26 117.662 -4.686 1.972 1.00 0.00 C ATOM 338 C LEU A 26 116.499 -5.538 2.471 1.00 0.00 C ATOM 339 O LEU A 26 115.647 -5.059 3.219 1.00 0.00 O ATOM 340 CB LEU A 26 118.768 -4.637 3.035 1.00 0.00 C ATOM 341 CG LEU A 26 118.326 -3.803 4.248 1.00 0.00 C ATOM 342 CD1 LEU A 26 119.041 -4.301 5.509 1.00 0.00 C ATOM 343 CD2 LEU A 26 118.677 -2.329 4.019 1.00 0.00 C ATOM 0 H LEU A 26 116.668 -2.888 2.399 1.00 0.00 H new ATOM 0 HA LEU A 26 118.082 -5.129 1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 26 119.015 -5.649 3.355 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.673 -4.209 2.604 1.00 0.00 H new ATOM 0 HG LEU A 26 117.248 -3.906 4.375 1.00 0.00 H new ATOM 0 HD11 LEU A 26 118.724 -3.706 6.366 1.00 0.00 H new ATOM 0 HD12 LEU A 26 118.789 -5.348 5.681 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.119 -4.204 5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 26 118.362 -1.742 4.881 1.00 0.00 H new ATOM 0 HD22 LEU A 26 119.754 -2.228 3.885 1.00 0.00 H new ATOM 0 HD23 LEU A 26 118.165 -1.967 3.127 1.00 0.00 H new ATOM 355 N LYS A 27 116.452 -6.798 2.044 1.00 0.00 N ATOM 356 CA LYS A 27 115.333 -7.674 2.389 1.00 0.00 C ATOM 357 C LYS A 27 115.805 -8.913 3.144 1.00 0.00 C ATOM 358 O LYS A 27 116.850 -9.487 2.837 1.00 0.00 O ATOM 359 CB LYS A 27 114.607 -8.106 1.114 1.00 0.00 C ATOM 360 CG LYS A 27 114.008 -6.878 0.428 1.00 0.00 C ATOM 361 CD LYS A 27 113.187 -7.316 -0.786 1.00 0.00 C ATOM 362 CE LYS A 27 112.692 -6.082 -1.542 1.00 0.00 C ATOM 363 NZ LYS A 27 111.614 -6.479 -2.491 1.00 0.00 N ATOM 0 H LYS A 27 117.169 -7.233 1.463 1.00 0.00 H new ATOM 0 HA LYS A 27 114.657 -7.116 3.037 1.00 0.00 H new ATOM 0 HB2 LYS A 27 115.301 -8.610 0.441 1.00 0.00 H new ATOM 0 HB3 LYS A 27 113.820 -8.821 1.355 1.00 0.00 H new ATOM 0 HG2 LYS A 27 113.377 -6.330 1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 27 114.802 -6.200 0.117 1.00 0.00 H new ATOM 0 HD2 LYS A 27 113.794 -7.938 -1.443 1.00 0.00 H new ATOM 0 HD3 LYS A 27 112.340 -7.923 -0.465 1.00 0.00 H new ATOM 0 HE2 LYS A 27 112.316 -5.338 -0.839 1.00 0.00 H new ATOM 0 HE3 LYS A 27 113.517 -5.620 -2.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.278 -5.640 -3.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 111.987 -7.174 -3.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 110.824 -6.901 -1.962 1.00 0.00 H new ATOM 377 N TYR A 28 115.015 -9.314 4.136 1.00 0.00 N ATOM 378 CA TYR A 28 115.279 -10.539 4.887 1.00 0.00 C ATOM 379 C TYR A 28 114.077 -11.472 4.781 1.00 0.00 C ATOM 380 O TYR A 28 112.934 -11.014 4.830 1.00 0.00 O ATOM 381 CB TYR A 28 115.544 -10.206 6.357 1.00 0.00 C ATOM 382 CG TYR A 28 115.916 -11.412 7.188 1.00 0.00 C ATOM 383 CD1 TYR A 28 114.917 -12.157 7.826 1.00 0.00 C ATOM 384 CD2 TYR A 28 117.259 -11.785 7.319 1.00 0.00 C ATOM 385 CE1 TYR A 28 115.261 -13.275 8.596 1.00 0.00 C ATOM 386 CE2 TYR A 28 117.603 -12.903 8.088 1.00 0.00 C ATOM 387 CZ TYR A 28 116.604 -13.648 8.727 1.00 0.00 C ATOM 388 OH TYR A 28 116.943 -14.749 9.485 1.00 0.00 O ATOM 0 H TYR A 28 114.184 -8.807 4.440 1.00 0.00 H new ATOM 0 HA TYR A 28 116.158 -11.030 4.470 1.00 0.00 H new ATOM 0 HB2 TYR A 28 116.347 -9.471 6.416 1.00 0.00 H new ATOM 0 HB3 TYR A 28 114.655 -9.741 6.783 1.00 0.00 H new ATOM 0 HD1 TYR A 28 113.881 -11.869 7.724 1.00 0.00 H new ATOM 0 HD2 TYR A 28 118.030 -11.210 6.827 1.00 0.00 H new ATOM 0 HE1 TYR A 28 114.490 -13.849 9.089 1.00 0.00 H new ATOM 0 HE2 TYR A 28 118.639 -13.191 8.189 1.00 0.00 H new ATOM 0 HH TYR A 28 117.915 -14.869 9.471 1.00 0.00 H new ATOM 398 N ARG A 29 114.338 -12.770 4.614 1.00 0.00 N ATOM 399 CA ARG A 29 113.263 -13.741 4.414 1.00 0.00 C ATOM 400 C ARG A 29 113.462 -14.991 5.268 1.00 0.00 C ATOM 401 O ARG A 29 114.581 -15.480 5.422 1.00 0.00 O ATOM 402 CB ARG A 29 113.192 -14.140 2.940 1.00 0.00 C ATOM 403 CG ARG A 29 112.889 -12.905 2.091 1.00 0.00 C ATOM 404 CD ARG A 29 112.779 -13.311 0.620 1.00 0.00 C ATOM 405 NE ARG A 29 111.570 -14.110 0.404 1.00 0.00 N ATOM 406 CZ ARG A 29 111.429 -14.980 -0.609 1.00 0.00 C ATOM 407 NH1 ARG A 29 112.375 -15.183 -1.493 1.00 0.00 N ATOM 408 NH2 ARG A 29 110.311 -15.646 -0.716 1.00 0.00 N ATOM 0 H ARG A 29 115.276 -13.170 4.613 1.00 0.00 H new ATOM 0 HA ARG A 29 112.330 -13.267 4.719 1.00 0.00 H new ATOM 0 HB2 ARG A 29 114.136 -14.587 2.627 1.00 0.00 H new ATOM 0 HB3 ARG A 29 112.419 -14.894 2.793 1.00 0.00 H new ATOM 0 HG2 ARG A 29 111.959 -12.442 2.422 1.00 0.00 H new ATOM 0 HG3 ARG A 29 113.677 -12.162 2.216 1.00 0.00 H new ATOM 0 HD2 ARG A 29 112.753 -12.421 -0.009 1.00 0.00 H new ATOM 0 HD3 ARG A 29 113.659 -13.883 0.326 1.00 0.00 H new ATOM 0 HE ARG A 29 110.795 -14.000 1.058 1.00 0.00 H new ATOM 0 HH11 ARG A 29 113.255 -14.672 -1.425 1.00 0.00 H new ATOM 0 HH12 ARG A 29 112.231 -15.852 -2.249 1.00 0.00 H new ATOM 0 HH21 ARG A 29 109.564 -15.501 -0.037 1.00 0.00 H new ATOM 0 HH22 ARG A 29 110.185 -16.311 -1.479 1.00 0.00 H new ATOM 422 N TYR A 30 112.362 -15.503 5.821 1.00 0.00 N ATOM 423 CA TYR A 30 112.406 -16.710 6.644 1.00 0.00 C ATOM 424 C TYR A 30 111.454 -17.770 6.093 1.00 0.00 C ATOM 425 O TYR A 30 110.323 -17.463 5.717 1.00 0.00 O ATOM 426 CB TYR A 30 112.010 -16.371 8.082 1.00 0.00 C ATOM 427 CG TYR A 30 112.085 -17.552 9.021 1.00 0.00 C ATOM 428 CD1 TYR A 30 113.300 -17.888 9.630 1.00 0.00 C ATOM 429 CD2 TYR A 30 110.938 -18.311 9.282 1.00 0.00 C ATOM 430 CE1 TYR A 30 113.368 -18.983 10.500 1.00 0.00 C ATOM 431 CE2 TYR A 30 111.006 -19.405 10.152 1.00 0.00 C ATOM 432 CZ TYR A 30 112.220 -19.742 10.761 1.00 0.00 C ATOM 433 OH TYR A 30 112.288 -20.821 11.618 1.00 0.00 O ATOM 0 H TYR A 30 111.431 -15.101 5.714 1.00 0.00 H new ATOM 0 HA TYR A 30 113.422 -17.104 6.626 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.661 -15.580 8.453 1.00 0.00 H new ATOM 0 HB3 TYR A 30 110.994 -15.976 8.087 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.185 -17.303 9.429 1.00 0.00 H new ATOM 0 HD2 TYR A 30 110.001 -18.052 8.812 1.00 0.00 H new ATOM 0 HE1 TYR A 30 114.305 -19.242 10.970 1.00 0.00 H new ATOM 0 HE2 TYR A 30 110.121 -19.990 10.354 1.00 0.00 H new ATOM 0 HH TYR A 30 111.404 -21.238 11.690 1.00 0.00 H new ATOM 443 N GLU A 31 111.918 -19.018 6.047 1.00 0.00 N ATOM 444 CA GLU A 31 111.104 -20.113 5.521 1.00 0.00 C ATOM 445 C GLU A 31 111.166 -21.332 6.439 1.00 0.00 C ATOM 446 O GLU A 31 112.183 -21.581 7.087 1.00 0.00 O ATOM 447 CB GLU A 31 111.591 -20.511 4.124 1.00 0.00 C ATOM 448 CG GLU A 31 111.412 -19.338 3.154 1.00 0.00 C ATOM 449 CD GLU A 31 112.509 -18.287 3.335 1.00 0.00 C ATOM 450 OE1 GLU A 31 113.543 -18.603 3.904 1.00 0.00 O ATOM 451 OE2 GLU A 31 112.297 -17.169 2.896 1.00 0.00 O ATOM 0 H GLU A 31 112.847 -19.295 6.365 1.00 0.00 H new ATOM 0 HA GLU A 31 110.073 -19.765 5.466 1.00 0.00 H new ATOM 0 HB2 GLU A 31 112.640 -20.803 4.165 1.00 0.00 H new ATOM 0 HB3 GLU A 31 111.033 -21.377 3.768 1.00 0.00 H new ATOM 0 HG2 GLU A 31 111.426 -19.707 2.129 1.00 0.00 H new ATOM 0 HG3 GLU A 31 110.437 -18.878 3.314 1.00 0.00 H new ATOM 458 N GLU A 32 110.072 -22.089 6.489 1.00 0.00 N ATOM 459 CA GLU A 32 110.032 -23.311 7.290 1.00 0.00 C ATOM 460 C GLU A 32 110.235 -24.534 6.400 1.00 0.00 C ATOM 461 O GLU A 32 109.779 -24.563 5.256 1.00 0.00 O ATOM 462 CB GLU A 32 108.689 -23.419 8.015 1.00 0.00 C ATOM 463 CG GLU A 32 108.526 -22.232 8.972 1.00 0.00 C ATOM 464 CD GLU A 32 107.234 -22.336 9.791 1.00 0.00 C ATOM 465 OE1 GLU A 32 106.404 -23.182 9.493 1.00 0.00 O ATOM 466 OE2 GLU A 32 107.095 -21.555 10.718 1.00 0.00 O ATOM 0 H GLU A 32 109.208 -21.880 5.989 1.00 0.00 H new ATOM 0 HA GLU A 32 110.835 -23.271 8.026 1.00 0.00 H new ATOM 0 HB2 GLU A 32 107.874 -23.431 7.292 1.00 0.00 H new ATOM 0 HB3 GLU A 32 108.637 -24.356 8.569 1.00 0.00 H new ATOM 0 HG2 GLU A 32 109.381 -22.188 9.646 1.00 0.00 H new ATOM 0 HG3 GLU A 32 108.521 -21.303 8.402 1.00 0.00 H new ATOM 473 N ASP A 33 110.921 -25.540 6.931 1.00 0.00 N ATOM 474 CA ASP A 33 111.282 -26.713 6.140 1.00 0.00 C ATOM 475 C ASP A 33 110.065 -27.547 5.742 1.00 0.00 C ATOM 476 O ASP A 33 109.950 -27.963 4.589 1.00 0.00 O ATOM 477 CB ASP A 33 112.257 -27.588 6.932 1.00 0.00 C ATOM 478 CG ASP A 33 113.563 -26.840 7.187 1.00 0.00 C ATOM 479 OD1 ASP A 33 113.934 -26.021 6.360 1.00 0.00 O ATOM 480 OD2 ASP A 33 114.176 -27.097 8.210 1.00 0.00 O ATOM 0 H ASP A 33 111.237 -25.568 7.900 1.00 0.00 H new ATOM 0 HA ASP A 33 111.749 -26.353 5.223 1.00 0.00 H new ATOM 0 HB2 ASP A 33 111.806 -27.878 7.881 1.00 0.00 H new ATOM 0 HB3 ASP A 33 112.459 -28.507 6.382 1.00 0.00 H new ATOM 485 N ASN A 34 109.159 -27.792 6.687 1.00 0.00 N ATOM 486 CA ASN A 34 108.023 -28.683 6.423 1.00 0.00 C ATOM 487 C ASN A 34 106.718 -27.936 6.123 1.00 0.00 C ATOM 488 O ASN A 34 105.758 -28.545 5.652 1.00 0.00 O ATOM 489 CB ASN A 34 107.806 -29.596 7.631 1.00 0.00 C ATOM 490 CG ASN A 34 109.033 -30.475 7.855 1.00 0.00 C ATOM 491 OD1 ASN A 34 109.801 -30.726 6.926 1.00 0.00 O ATOM 492 ND2 ASN A 34 109.266 -30.959 9.045 1.00 0.00 N ATOM 0 H ASN A 34 109.184 -27.396 7.627 1.00 0.00 H new ATOM 0 HA ASN A 34 108.275 -29.256 5.531 1.00 0.00 H new ATOM 0 HB2 ASN A 34 107.613 -28.995 8.520 1.00 0.00 H new ATOM 0 HB3 ASN A 34 106.927 -30.220 7.471 1.00 0.00 H new ATOM 0 HD21 ASN A 34 110.085 -31.546 9.206 1.00 0.00 H new ATOM 0 HD22 ASN A 34 108.629 -30.750 9.814 1.00 0.00 H new ATOM 499 N SER A 35 106.671 -26.633 6.391 1.00 0.00 N ATOM 500 CA SER A 35 105.485 -25.839 6.086 1.00 0.00 C ATOM 501 C SER A 35 105.903 -24.416 5.706 1.00 0.00 C ATOM 502 O SER A 35 105.728 -23.484 6.497 1.00 0.00 O ATOM 503 CB SER A 35 104.541 -25.826 7.291 1.00 0.00 C ATOM 504 OG SER A 35 104.129 -27.155 7.577 1.00 0.00 O ATOM 0 H SER A 35 107.435 -26.108 6.816 1.00 0.00 H new ATOM 0 HA SER A 35 104.956 -26.283 5.243 1.00 0.00 H new ATOM 0 HB2 SER A 35 105.043 -25.394 8.157 1.00 0.00 H new ATOM 0 HB3 SER A 35 103.673 -25.201 7.081 1.00 0.00 H new ATOM 0 HG SER A 35 103.526 -27.151 8.349 1.00 0.00 H new ATOM 510 N PRO A 36 106.435 -24.213 4.517 1.00 0.00 N ATOM 511 CA PRO A 36 107.054 -22.900 4.169 1.00 0.00 C ATOM 512 C PRO A 36 106.035 -21.768 4.081 1.00 0.00 C ATOM 513 O PRO A 36 104.966 -21.910 3.488 1.00 0.00 O ATOM 514 CB PRO A 36 107.717 -23.145 2.810 1.00 0.00 C ATOM 515 CG PRO A 36 106.975 -24.289 2.209 1.00 0.00 C ATOM 516 CD PRO A 36 106.495 -25.150 3.375 1.00 0.00 C ATOM 0 HA PRO A 36 107.756 -22.578 4.938 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.654 -22.260 2.177 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.775 -23.380 2.926 1.00 0.00 H new ATOM 0 HG2 PRO A 36 106.133 -23.936 1.614 1.00 0.00 H new ATOM 0 HG3 PRO A 36 107.619 -24.862 1.542 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.519 -25.591 3.170 1.00 0.00 H new ATOM 0 HD3 PRO A 36 107.182 -25.973 3.571 1.00 0.00 H new ATOM 524 N LEU A 37 106.396 -20.645 4.689 1.00 0.00 N ATOM 525 CA LEU A 37 105.627 -19.413 4.575 1.00 0.00 C ATOM 526 C LEU A 37 106.577 -18.317 4.108 1.00 0.00 C ATOM 527 O LEU A 37 107.666 -18.183 4.672 1.00 0.00 O ATOM 528 CB LEU A 37 105.032 -19.049 5.945 1.00 0.00 C ATOM 529 CG LEU A 37 103.741 -18.223 5.818 1.00 0.00 C ATOM 530 CD1 LEU A 37 103.976 -16.957 4.985 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.641 -19.072 5.175 1.00 0.00 C ATOM 0 H LEU A 37 107.228 -20.563 5.273 1.00 0.00 H new ATOM 0 HA LEU A 37 104.808 -19.531 3.865 1.00 0.00 H new ATOM 0 HB2 LEU A 37 104.823 -19.962 6.503 1.00 0.00 H new ATOM 0 HB3 LEU A 37 105.767 -18.485 6.520 1.00 0.00 H new ATOM 0 HG LEU A 37 103.430 -17.921 6.818 1.00 0.00 H new ATOM 0 HD11 LEU A 37 103.047 -16.392 4.911 1.00 0.00 H new ATOM 0 HD12 LEU A 37 104.738 -16.342 5.465 1.00 0.00 H new ATOM 0 HD13 LEU A 37 104.311 -17.236 3.986 1.00 0.00 H new ATOM 0 HD21 LEU A 37 101.729 -18.481 5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.962 -19.393 4.184 1.00 0.00 H new ATOM 0 HD23 LEU A 37 102.448 -19.948 5.795 1.00 0.00 H new ATOM 543 N GLY A 38 106.186 -17.537 3.100 1.00 0.00 N ATOM 544 CA GLY A 38 107.092 -16.538 2.556 1.00 0.00 C ATOM 545 C GLY A 38 106.871 -15.206 3.249 1.00 0.00 C ATOM 546 O GLY A 38 105.785 -14.641 3.176 1.00 0.00 O ATOM 0 H GLY A 38 105.269 -17.578 2.655 1.00 0.00 H new ATOM 0 HA2 GLY A 38 108.125 -16.860 2.690 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.928 -16.431 1.484 1.00 0.00 H new ATOM 550 N VAL A 39 107.891 -14.721 3.948 1.00 0.00 N ATOM 551 CA VAL A 39 107.801 -13.422 4.602 1.00 0.00 C ATOM 552 C VAL A 39 108.970 -12.554 4.156 1.00 0.00 C ATOM 553 O VAL A 39 110.116 -12.994 4.162 1.00 0.00 O ATOM 554 CB VAL A 39 107.811 -13.610 6.126 1.00 0.00 C ATOM 555 CG1 VAL A 39 109.114 -14.281 6.569 1.00 0.00 C ATOM 556 CG2 VAL A 39 107.678 -12.251 6.818 1.00 0.00 C ATOM 0 H VAL A 39 108.781 -15.202 4.076 1.00 0.00 H new ATOM 0 HA VAL A 39 106.870 -12.928 4.323 1.00 0.00 H new ATOM 0 HB VAL A 39 106.970 -14.245 6.405 1.00 0.00 H new ATOM 0 HG11 VAL A 39 109.108 -14.408 7.652 1.00 0.00 H new ATOM 0 HG12 VAL A 39 109.203 -15.256 6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 39 109.960 -13.657 6.282 1.00 0.00 H new ATOM 0 HG21 VAL A 39 107.686 -12.391 7.899 1.00 0.00 H new ATOM 0 HG22 VAL A 39 108.513 -11.612 6.529 1.00 0.00 H new ATOM 0 HG23 VAL A 39 106.741 -11.781 6.520 1.00 0.00 H new ATOM 566 N ILE A 40 108.666 -11.329 3.749 1.00 0.00 N ATOM 567 CA ILE A 40 109.704 -10.381 3.358 1.00 0.00 C ATOM 568 C ILE A 40 109.554 -9.091 4.149 1.00 0.00 C ATOM 569 O ILE A 40 108.449 -8.563 4.276 1.00 0.00 O ATOM 570 CB ILE A 40 109.613 -10.085 1.853 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.239 -9.473 1.508 1.00 0.00 C ATOM 572 CG2 ILE A 40 109.828 -11.381 1.061 1.00 0.00 C ATOM 573 CD1 ILE A 40 108.309 -7.940 1.523 1.00 0.00 C ATOM 0 H ILE A 40 107.714 -10.968 3.681 1.00 0.00 H new ATOM 0 HA ILE A 40 110.679 -10.820 3.572 1.00 0.00 H new ATOM 0 HB ILE A 40 110.388 -9.367 1.584 1.00 0.00 H new ATOM 0 HG12 ILE A 40 107.918 -9.818 0.525 1.00 0.00 H new ATOM 0 HG13 ILE A 40 107.493 -9.815 2.225 1.00 0.00 H new ATOM 0 HG21 ILE A 40 109.763 -11.170 -0.006 1.00 0.00 H new ATOM 0 HG22 ILE A 40 110.812 -11.789 1.291 1.00 0.00 H new ATOM 0 HG23 ILE A 40 109.062 -12.106 1.335 1.00 0.00 H new ATOM 0 HD11 ILE A 40 107.330 -7.529 1.277 1.00 0.00 H new ATOM 0 HD12 ILE A 40 108.607 -7.599 2.514 1.00 0.00 H new ATOM 0 HD13 ILE A 40 109.040 -7.602 0.788 1.00 0.00 H new ATOM 585 N GLY A 41 110.664 -8.615 4.704 1.00 0.00 N ATOM 586 CA GLY A 41 110.699 -7.294 5.326 1.00 0.00 C ATOM 587 C GLY A 41 111.796 -6.460 4.681 1.00 0.00 C ATOM 588 O GLY A 41 112.929 -6.924 4.549 1.00 0.00 O ATOM 0 H GLY A 41 111.549 -9.121 4.736 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.735 -6.799 5.209 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.881 -7.389 6.397 1.00 0.00 H new ATOM 592 N SER A 42 111.453 -5.243 4.265 1.00 0.00 N ATOM 593 CA SER A 42 112.402 -4.382 3.564 1.00 0.00 C ATOM 594 C SER A 42 112.479 -3.003 4.210 1.00 0.00 C ATOM 595 O SER A 42 111.459 -2.420 4.575 1.00 0.00 O ATOM 596 CB SER A 42 111.977 -4.229 2.103 1.00 0.00 C ATOM 597 OG SER A 42 113.057 -3.680 1.359 1.00 0.00 O ATOM 0 H SER A 42 110.529 -4.832 4.400 1.00 0.00 H new ATOM 0 HA SER A 42 113.386 -4.847 3.622 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.691 -5.197 1.691 1.00 0.00 H new ATOM 0 HB3 SER A 42 111.103 -3.581 2.031 1.00 0.00 H new ATOM 0 HG SER A 42 112.791 -3.581 0.421 1.00 0.00 H new ATOM 603 N PHE A 43 113.697 -2.487 4.351 1.00 0.00 N ATOM 604 CA PHE A 43 113.894 -1.118 4.820 1.00 0.00 C ATOM 605 C PHE A 43 114.477 -0.284 3.686 1.00 0.00 C ATOM 606 O PHE A 43 115.511 -0.642 3.123 1.00 0.00 O ATOM 607 CB PHE A 43 114.850 -1.105 6.013 1.00 0.00 C ATOM 608 CG PHE A 43 114.327 -1.859 7.212 1.00 0.00 C ATOM 609 CD1 PHE A 43 114.607 -3.223 7.359 1.00 0.00 C ATOM 610 CD2 PHE A 43 113.559 -1.195 8.177 1.00 0.00 C ATOM 611 CE1 PHE A 43 114.122 -3.921 8.471 1.00 0.00 C ATOM 612 CE2 PHE A 43 113.075 -1.894 9.289 1.00 0.00 C ATOM 613 CZ PHE A 43 113.355 -3.257 9.435 1.00 0.00 C ATOM 0 H PHE A 43 114.559 -2.993 4.148 1.00 0.00 H new ATOM 0 HA PHE A 43 112.937 -0.700 5.132 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.803 -1.537 5.709 1.00 0.00 H new ATOM 0 HB3 PHE A 43 115.046 -0.072 6.300 1.00 0.00 H new ATOM 0 HD1 PHE A 43 115.197 -3.736 6.614 1.00 0.00 H new ATOM 0 HD2 PHE A 43 113.340 -0.144 8.063 1.00 0.00 H new ATOM 0 HE1 PHE A 43 114.340 -4.973 8.585 1.00 0.00 H new ATOM 0 HE2 PHE A 43 112.485 -1.381 10.034 1.00 0.00 H new ATOM 0 HZ PHE A 43 112.979 -3.797 10.292 1.00 0.00 H new ATOM 623 N THR A 44 113.825 0.829 3.351 1.00 0.00 N ATOM 624 CA THR A 44 114.262 1.642 2.217 1.00 0.00 C ATOM 625 C THR A 44 114.653 3.039 2.674 1.00 0.00 C ATOM 626 O THR A 44 113.944 3.661 3.465 1.00 0.00 O ATOM 627 CB THR A 44 113.131 1.740 1.190 1.00 0.00 C ATOM 628 OG1 THR A 44 112.692 0.434 0.846 1.00 0.00 O ATOM 629 CG2 THR A 44 113.635 2.455 -0.065 1.00 0.00 C ATOM 0 H THR A 44 113.004 1.185 3.841 1.00 0.00 H new ATOM 0 HA THR A 44 115.132 1.166 1.765 1.00 0.00 H new ATOM 0 HB THR A 44 112.302 2.304 1.618 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.967 0.495 0.190 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.828 2.523 -0.794 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.972 3.458 0.198 1.00 0.00 H new ATOM 0 HG23 THR A 44 114.465 1.894 -0.495 1.00 0.00 H new ATOM 637 N TYR A 45 115.781 3.523 2.163 1.00 0.00 N ATOM 638 CA TYR A 45 116.242 4.873 2.463 1.00 0.00 C ATOM 639 C TYR A 45 116.430 5.642 1.162 1.00 0.00 C ATOM 640 O TYR A 45 117.171 5.197 0.286 1.00 0.00 O ATOM 641 CB TYR A 45 117.569 4.817 3.220 1.00 0.00 C ATOM 642 CG TYR A 45 118.096 6.177 3.613 1.00 0.00 C ATOM 643 CD1 TYR A 45 117.671 6.773 4.804 1.00 0.00 C ATOM 644 CD2 TYR A 45 119.008 6.841 2.784 1.00 0.00 C ATOM 645 CE1 TYR A 45 118.157 8.034 5.170 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.495 8.102 3.149 1.00 0.00 C ATOM 647 CZ TYR A 45 119.070 8.699 4.341 1.00 0.00 C ATOM 648 OH TYR A 45 119.550 9.942 4.700 1.00 0.00 O ATOM 0 H TYR A 45 116.393 2.999 1.538 1.00 0.00 H new ATOM 0 HA TYR A 45 115.500 5.376 3.084 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.441 4.212 4.118 1.00 0.00 H new ATOM 0 HB3 TYR A 45 118.311 4.314 2.600 1.00 0.00 H new ATOM 0 HD1 TYR A 45 116.967 6.260 5.443 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.336 6.381 1.864 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.828 8.494 6.090 1.00 0.00 H new ATOM 0 HE2 TYR A 45 120.199 8.614 2.510 1.00 0.00 H new ATOM 0 HH TYR A 45 120.174 10.262 4.016 1.00 0.00 H new ATOM 658 N THR A 46 115.754 6.782 1.042 1.00 0.00 N ATOM 659 CA THR A 46 115.830 7.594 -0.169 1.00 0.00 C ATOM 660 C THR A 46 116.293 9.006 0.171 1.00 0.00 C ATOM 661 O THR A 46 115.903 9.565 1.197 1.00 0.00 O ATOM 662 CB THR A 46 114.457 7.659 -0.848 1.00 0.00 C ATOM 663 OG1 THR A 46 113.436 7.677 0.140 1.00 0.00 O ATOM 664 CG2 THR A 46 114.260 6.444 -1.755 1.00 0.00 C ATOM 0 H THR A 46 115.148 7.164 1.768 1.00 0.00 H new ATOM 0 HA THR A 46 116.548 7.134 -0.848 1.00 0.00 H new ATOM 0 HB THR A 46 114.404 8.567 -1.448 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.559 7.720 -0.296 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.282 6.501 -2.232 1.00 0.00 H new ATOM 0 HG22 THR A 46 115.036 6.431 -2.520 1.00 0.00 H new ATOM 0 HG23 THR A 46 114.321 5.532 -1.161 1.00 0.00 H new ATOM 672 N GLU A 47 117.106 9.580 -0.711 1.00 0.00 N ATOM 673 CA GLU A 47 117.643 10.919 -0.503 1.00 0.00 C ATOM 674 C GLU A 47 117.414 11.776 -1.743 1.00 0.00 C ATOM 675 O GLU A 47 117.385 11.262 -2.862 1.00 0.00 O ATOM 676 CB GLU A 47 119.141 10.832 -0.201 1.00 0.00 C ATOM 677 CG GLU A 47 119.671 12.211 0.215 1.00 0.00 C ATOM 678 CD GLU A 47 121.186 12.196 0.450 1.00 0.00 C ATOM 679 OE1 GLU A 47 121.811 11.162 0.266 1.00 0.00 O ATOM 680 OE2 GLU A 47 121.706 13.237 0.815 1.00 0.00 O ATOM 0 H GLU A 47 117.407 9.136 -1.579 1.00 0.00 H new ATOM 0 HA GLU A 47 117.131 11.379 0.342 1.00 0.00 H new ATOM 0 HB2 GLU A 47 119.319 10.109 0.595 1.00 0.00 H new ATOM 0 HB3 GLU A 47 119.678 10.476 -1.080 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.431 12.940 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 47 119.166 12.534 1.125 1.00 0.00 H new ATOM 687 N LYS A 48 117.212 13.072 -1.528 1.00 0.00 N ATOM 688 CA LYS A 48 117.039 14.011 -2.631 1.00 0.00 C ATOM 689 C LYS A 48 118.381 14.623 -3.017 1.00 0.00 C ATOM 690 O LYS A 48 119.169 15.005 -2.152 1.00 0.00 O ATOM 691 CB LYS A 48 116.069 15.121 -2.221 1.00 0.00 C ATOM 692 CG LYS A 48 115.780 16.022 -3.423 1.00 0.00 C ATOM 693 CD LYS A 48 114.729 17.070 -3.046 1.00 0.00 C ATOM 694 CE LYS A 48 115.317 18.065 -2.041 1.00 0.00 C ATOM 695 NZ LYS A 48 116.549 18.684 -2.608 1.00 0.00 N ATOM 0 H LYS A 48 117.164 13.496 -0.601 1.00 0.00 H new ATOM 0 HA LYS A 48 116.633 13.474 -3.488 1.00 0.00 H new ATOM 0 HB2 LYS A 48 115.141 14.687 -1.848 1.00 0.00 H new ATOM 0 HB3 LYS A 48 116.496 15.708 -1.408 1.00 0.00 H new ATOM 0 HG2 LYS A 48 116.696 16.514 -3.749 1.00 0.00 H new ATOM 0 HG3 LYS A 48 115.425 15.423 -4.261 1.00 0.00 H new ATOM 0 HD2 LYS A 48 114.394 17.598 -3.939 1.00 0.00 H new ATOM 0 HD3 LYS A 48 113.854 16.581 -2.617 1.00 0.00 H new ATOM 0 HE2 LYS A 48 114.584 18.838 -1.809 1.00 0.00 H new ATOM 0 HE3 LYS A 48 115.551 17.556 -1.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 116.572 19.695 -2.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 117.388 18.214 -2.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 116.548 18.575 -3.642 1.00 0.00 H new ATOM 709 N SER A 49 118.639 14.717 -4.320 1.00 0.00 N ATOM 710 CA SER A 49 119.892 15.289 -4.807 1.00 0.00 C ATOM 711 C SER A 49 119.634 16.604 -5.533 1.00 0.00 C ATOM 712 O SER A 49 118.634 16.753 -6.236 1.00 0.00 O ATOM 713 CB SER A 49 120.573 14.307 -5.760 1.00 0.00 C ATOM 714 OG SER A 49 119.757 14.132 -6.911 1.00 0.00 O ATOM 0 H SER A 49 118.001 14.407 -5.053 1.00 0.00 H new ATOM 0 HA SER A 49 120.541 15.480 -3.952 1.00 0.00 H new ATOM 0 HB2 SER A 49 121.554 14.683 -6.049 1.00 0.00 H new ATOM 0 HB3 SER A 49 120.732 13.350 -5.263 1.00 0.00 H new ATOM 0 HG SER A 49 120.190 13.504 -7.527 1.00 0.00 H new ATOM 720 N ARG A 50 120.545 17.557 -5.358 1.00 0.00 N ATOM 721 CA ARG A 50 120.419 18.857 -6.008 1.00 0.00 C ATOM 722 C ARG A 50 121.782 19.333 -6.500 1.00 0.00 C ATOM 723 O ARG A 50 122.796 19.133 -5.830 1.00 0.00 O ATOM 724 CB ARG A 50 119.834 19.873 -5.021 1.00 0.00 C ATOM 725 CG ARG A 50 119.594 21.218 -5.713 1.00 0.00 C ATOM 726 CD ARG A 50 118.348 21.136 -6.601 1.00 0.00 C ATOM 727 NE ARG A 50 118.149 22.403 -7.311 1.00 0.00 N ATOM 728 CZ ARG A 50 117.274 22.558 -8.317 1.00 0.00 C ATOM 729 NH1 ARG A 50 116.519 21.576 -8.745 1.00 0.00 N ATOM 730 NH2 ARG A 50 117.172 23.728 -8.887 1.00 0.00 N ATOM 0 H ARG A 50 121.375 17.454 -4.774 1.00 0.00 H new ATOM 0 HA ARG A 50 119.751 18.763 -6.864 1.00 0.00 H new ATOM 0 HB2 ARG A 50 118.896 19.495 -4.614 1.00 0.00 H new ATOM 0 HB3 ARG A 50 120.516 20.006 -4.181 1.00 0.00 H new ATOM 0 HG2 ARG A 50 119.468 22.003 -4.967 1.00 0.00 H new ATOM 0 HG3 ARG A 50 120.462 21.487 -6.315 1.00 0.00 H new ATOM 0 HD2 ARG A 50 118.456 20.322 -7.318 1.00 0.00 H new ATOM 0 HD3 ARG A 50 117.473 20.910 -5.992 1.00 0.00 H new ATOM 0 HE ARG A 50 118.705 23.209 -7.026 1.00 0.00 H new ATOM 0 HH11 ARG A 50 116.585 20.655 -8.311 1.00 0.00 H new ATOM 0 HH12 ARG A 50 115.865 21.732 -9.512 1.00 0.00 H new ATOM 0 HH21 ARG A 50 117.751 24.504 -8.566 1.00 0.00 H new ATOM 0 HH22 ARG A 50 116.513 23.866 -9.653 1.00 0.00 H new ATOM 744 N THR A 51 121.805 19.961 -7.671 1.00 0.00 N ATOM 745 CA THR A 51 123.053 20.467 -8.228 1.00 0.00 C ATOM 746 C THR A 51 123.551 21.658 -7.415 1.00 0.00 C ATOM 747 O THR A 51 122.778 22.551 -7.066 1.00 0.00 O ATOM 748 CB THR A 51 122.843 20.890 -9.684 1.00 0.00 C ATOM 749 OG1 THR A 51 122.283 19.807 -10.413 1.00 0.00 O ATOM 750 CG2 THR A 51 124.186 21.284 -10.303 1.00 0.00 C ATOM 0 H THR A 51 120.981 20.130 -8.248 1.00 0.00 H new ATOM 0 HA THR A 51 123.799 19.673 -8.188 1.00 0.00 H new ATOM 0 HB THR A 51 122.165 21.743 -9.721 1.00 0.00 H new ATOM 0 HG1 THR A 51 122.146 20.076 -11.345 1.00 0.00 H new ATOM 0 HG21 THR A 51 124.035 21.585 -11.340 1.00 0.00 H new ATOM 0 HG22 THR A 51 124.615 22.115 -9.743 1.00 0.00 H new ATOM 0 HG23 THR A 51 124.866 20.433 -10.268 1.00 0.00 H new ATOM 758 N ALA A 52 124.846 21.666 -7.116 1.00 0.00 N ATOM 759 CA ALA A 52 125.430 22.741 -6.321 1.00 0.00 C ATOM 760 C ALA A 52 125.812 23.923 -7.207 1.00 0.00 C ATOM 761 O ALA A 52 126.387 23.747 -8.281 1.00 0.00 O ATOM 762 CB ALA A 52 126.671 22.230 -5.587 1.00 0.00 C ATOM 0 H ALA A 52 125.507 20.946 -7.409 1.00 0.00 H new ATOM 0 HA ALA A 52 124.687 23.074 -5.596 1.00 0.00 H new ATOM 0 HB1 ALA A 52 127.102 23.038 -4.995 1.00 0.00 H new ATOM 0 HB2 ALA A 52 126.391 21.407 -4.929 1.00 0.00 H new ATOM 0 HB3 ALA A 52 127.405 21.880 -6.313 1.00 0.00 H new ATOM 768 N SER A 53 125.488 25.126 -6.745 1.00 0.00 N ATOM 769 CA SER A 53 125.820 26.337 -7.487 1.00 0.00 C ATOM 770 C SER A 53 125.574 27.571 -6.626 1.00 0.00 C ATOM 771 O SER A 53 126.509 28.279 -6.255 1.00 0.00 O ATOM 772 CB SER A 53 124.974 26.419 -8.759 1.00 0.00 C ATOM 773 OG SER A 53 125.601 25.662 -9.786 1.00 0.00 O ATOM 0 H SER A 53 124.998 25.288 -5.865 1.00 0.00 H new ATOM 0 HA SER A 53 126.875 26.300 -7.758 1.00 0.00 H new ATOM 0 HB2 SER A 53 123.971 26.036 -8.569 1.00 0.00 H new ATOM 0 HB3 SER A 53 124.865 27.458 -9.071 1.00 0.00 H new ATOM 0 HG SER A 53 126.267 25.062 -9.390 1.00 0.00 H new ATOM 779 N SER A 54 124.306 27.821 -6.313 1.00 0.00 N ATOM 780 CA SER A 54 123.945 28.959 -5.470 1.00 0.00 C ATOM 781 C SER A 54 124.536 28.835 -4.064 1.00 0.00 C ATOM 782 O SER A 54 124.816 29.844 -3.415 1.00 0.00 O ATOM 783 CB SER A 54 122.423 29.068 -5.374 1.00 0.00 C ATOM 784 OG SER A 54 121.920 27.956 -4.645 1.00 0.00 O ATOM 0 H SER A 54 123.516 27.257 -6.627 1.00 0.00 H new ATOM 0 HA SER A 54 124.357 29.857 -5.931 1.00 0.00 H new ATOM 0 HB2 SER A 54 122.143 29.999 -4.880 1.00 0.00 H new ATOM 0 HB3 SER A 54 121.984 29.093 -6.372 1.00 0.00 H new ATOM 0 HG SER A 54 120.944 28.022 -4.579 1.00 0.00 H new ATOM 790 N GLY A 55 124.726 27.604 -3.590 1.00 0.00 N ATOM 791 CA GLY A 55 125.273 27.381 -2.251 1.00 0.00 C ATOM 792 C GLY A 55 124.205 27.018 -1.209 1.00 0.00 C ATOM 793 O GLY A 55 124.542 26.758 -0.054 1.00 0.00 O ATOM 0 H GLY A 55 124.511 26.752 -4.108 1.00 0.00 H new ATOM 0 HA2 GLY A 55 126.012 26.581 -2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 55 125.796 28.280 -1.926 1.00 0.00 H new ATOM 797 N ASP A 56 122.929 26.997 -1.599 1.00 0.00 N ATOM 798 CA ASP A 56 121.861 26.636 -0.673 1.00 0.00 C ATOM 799 C ASP A 56 121.818 25.123 -0.473 1.00 0.00 C ATOM 800 O ASP A 56 121.963 24.360 -1.427 1.00 0.00 O ATOM 801 CB ASP A 56 120.512 27.132 -1.207 1.00 0.00 C ATOM 802 CG ASP A 56 120.163 26.455 -2.532 1.00 0.00 C ATOM 803 OD1 ASP A 56 121.075 26.063 -3.243 1.00 0.00 O ATOM 804 OD2 ASP A 56 118.983 26.340 -2.818 1.00 0.00 O ATOM 0 H ASP A 56 122.615 27.224 -2.542 1.00 0.00 H new ATOM 0 HA ASP A 56 122.059 27.110 0.288 1.00 0.00 H new ATOM 0 HB2 ASP A 56 119.731 26.929 -0.475 1.00 0.00 H new ATOM 0 HB3 ASP A 56 120.547 28.213 -1.345 1.00 0.00 H new ATOM 809 N TYR A 57 121.617 24.696 0.771 1.00 0.00 N ATOM 810 CA TYR A 57 121.568 23.270 1.089 1.00 0.00 C ATOM 811 C TYR A 57 120.188 22.880 1.605 1.00 0.00 C ATOM 812 O TYR A 57 119.666 23.492 2.538 1.00 0.00 O ATOM 813 CB TYR A 57 122.619 22.942 2.151 1.00 0.00 C ATOM 814 CG TYR A 57 122.694 21.472 2.488 1.00 0.00 C ATOM 815 CD1 TYR A 57 123.479 20.613 1.710 1.00 0.00 C ATOM 816 CD2 TYR A 57 121.978 20.967 3.580 1.00 0.00 C ATOM 817 CE1 TYR A 57 123.549 19.251 2.022 1.00 0.00 C ATOM 818 CE2 TYR A 57 122.047 19.605 3.893 1.00 0.00 C ATOM 819 CZ TYR A 57 122.833 18.747 3.115 1.00 0.00 C ATOM 820 OH TYR A 57 122.901 17.403 3.424 1.00 0.00 O ATOM 0 H TYR A 57 121.486 25.313 1.573 1.00 0.00 H new ATOM 0 HA TYR A 57 121.774 22.706 0.179 1.00 0.00 H new ATOM 0 HB2 TYR A 57 123.595 23.277 1.801 1.00 0.00 H new ATOM 0 HB3 TYR A 57 122.396 23.504 3.058 1.00 0.00 H new ATOM 0 HD1 TYR A 57 124.031 21.002 0.868 1.00 0.00 H new ATOM 0 HD2 TYR A 57 121.372 21.629 4.181 1.00 0.00 H new ATOM 0 HE1 TYR A 57 124.154 18.589 1.421 1.00 0.00 H new ATOM 0 HE2 TYR A 57 121.494 19.216 4.735 1.00 0.00 H new ATOM 0 HH TYR A 57 122.552 17.257 4.328 1.00 0.00 H new ATOM 830 N ASN A 58 119.600 21.855 0.991 1.00 0.00 N ATOM 831 CA ASN A 58 118.294 21.358 1.411 1.00 0.00 C ATOM 832 C ASN A 58 118.422 19.944 1.968 1.00 0.00 C ATOM 833 O ASN A 58 119.038 19.078 1.348 1.00 0.00 O ATOM 834 CB ASN A 58 117.331 21.353 0.221 1.00 0.00 C ATOM 835 CG ASN A 58 117.189 22.763 -0.341 1.00 0.00 C ATOM 836 OD1 ASN A 58 117.254 22.958 -1.556 1.00 0.00 O ATOM 837 ND2 ASN A 58 116.995 23.765 0.472 1.00 0.00 N ATOM 0 H ASN A 58 120.008 21.354 0.202 1.00 0.00 H new ATOM 0 HA ASN A 58 117.905 22.014 2.190 1.00 0.00 H new ATOM 0 HB2 ASN A 58 117.700 20.680 -0.553 1.00 0.00 H new ATOM 0 HB3 ASN A 58 116.357 20.977 0.533 1.00 0.00 H new ATOM 0 HD21 ASN A 58 116.897 24.710 0.102 1.00 0.00 H new ATOM 0 HD22 ASN A 58 116.941 23.603 1.478 1.00 0.00 H new ATOM 844 N LYS A 59 117.837 19.713 3.141 1.00 0.00 N ATOM 845 CA LYS A 59 117.910 18.402 3.781 1.00 0.00 C ATOM 846 C LYS A 59 116.558 17.699 3.722 1.00 0.00 C ATOM 847 O LYS A 59 115.634 18.049 4.457 1.00 0.00 O ATOM 848 CB LYS A 59 118.338 18.571 5.241 1.00 0.00 C ATOM 849 CG LYS A 59 118.574 17.201 5.882 1.00 0.00 C ATOM 850 CD LYS A 59 119.901 16.619 5.389 1.00 0.00 C ATOM 851 CE LYS A 59 120.184 15.302 6.113 1.00 0.00 C ATOM 852 NZ LYS A 59 121.070 14.452 5.268 1.00 0.00 N ATOM 0 H LYS A 59 117.310 20.412 3.665 1.00 0.00 H new ATOM 0 HA LYS A 59 118.642 17.793 3.250 1.00 0.00 H new ATOM 0 HB2 LYS A 59 119.249 19.168 5.294 1.00 0.00 H new ATOM 0 HB3 LYS A 59 117.569 19.112 5.793 1.00 0.00 H new ATOM 0 HG2 LYS A 59 118.589 17.295 6.968 1.00 0.00 H new ATOM 0 HG3 LYS A 59 117.755 16.526 5.632 1.00 0.00 H new ATOM 0 HD2 LYS A 59 119.859 16.452 4.313 1.00 0.00 H new ATOM 0 HD3 LYS A 59 120.710 17.327 5.571 1.00 0.00 H new ATOM 0 HE2 LYS A 59 120.659 15.498 7.074 1.00 0.00 H new ATOM 0 HE3 LYS A 59 119.250 14.780 6.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 121.387 13.627 5.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 120.545 14.129 4.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 121.897 15.005 4.966 1.00 0.00 H new ATOM 866 N ASN A 60 116.450 16.705 2.845 1.00 0.00 N ATOM 867 CA ASN A 60 115.216 15.933 2.709 1.00 0.00 C ATOM 868 C ASN A 60 115.507 14.438 2.805 1.00 0.00 C ATOM 869 O ASN A 60 116.380 13.925 2.103 1.00 0.00 O ATOM 870 CB ASN A 60 114.554 16.240 1.363 1.00 0.00 C ATOM 871 CG ASN A 60 113.121 15.710 1.325 1.00 0.00 C ATOM 872 OD1 ASN A 60 112.692 14.977 2.218 1.00 0.00 O ATOM 873 ND2 ASN A 60 112.344 16.041 0.330 1.00 0.00 N ATOM 0 H ASN A 60 117.200 16.414 2.218 1.00 0.00 H new ATOM 0 HA ASN A 60 114.542 16.214 3.518 1.00 0.00 H new ATOM 0 HB2 ASN A 60 114.552 17.316 1.191 1.00 0.00 H new ATOM 0 HB3 ASN A 60 115.134 15.790 0.557 1.00 0.00 H new ATOM 0 HD21 ASN A 60 111.386 15.693 0.294 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.695 16.647 -0.411 1.00 0.00 H new ATOM 880 N GLN A 61 114.777 13.737 3.670 1.00 0.00 N ATOM 881 CA GLN A 61 114.968 12.296 3.822 1.00 0.00 C ATOM 882 C GLN A 61 113.628 11.573 3.866 1.00 0.00 C ATOM 883 O GLN A 61 112.654 12.097 4.405 1.00 0.00 O ATOM 884 CB GLN A 61 115.745 11.997 5.107 1.00 0.00 C ATOM 885 CG GLN A 61 117.166 12.554 4.993 1.00 0.00 C ATOM 886 CD GLN A 61 117.931 12.328 6.296 1.00 0.00 C ATOM 887 OE1 GLN A 61 117.330 12.127 7.351 1.00 0.00 O ATOM 888 NE2 GLN A 61 119.236 12.342 6.282 1.00 0.00 N ATOM 0 H GLN A 61 114.056 14.137 4.270 1.00 0.00 H new ATOM 0 HA GLN A 61 115.534 11.940 2.961 1.00 0.00 H new ATOM 0 HB2 GLN A 61 115.237 12.443 5.962 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.779 10.922 5.281 1.00 0.00 H new ATOM 0 HG2 GLN A 61 117.688 12.070 4.168 1.00 0.00 H new ATOM 0 HG3 GLN A 61 117.129 13.619 4.765 1.00 0.00 H new ATOM 0 HE21 GLN A 61 119.735 12.508 5.408 1.00 0.00 H new ATOM 0 HE22 GLN A 61 119.757 12.186 7.145 1.00 0.00 H new ATOM 897 N TYR A 62 113.585 10.377 3.281 1.00 0.00 N ATOM 898 CA TYR A 62 112.382 9.548 3.321 1.00 0.00 C ATOM 899 C TYR A 62 112.728 8.123 3.749 1.00 0.00 C ATOM 900 O TYR A 62 113.712 7.552 3.279 1.00 0.00 O ATOM 901 CB TYR A 62 111.723 9.522 1.940 1.00 0.00 C ATOM 902 CG TYR A 62 110.862 10.728 1.644 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.450 11.988 1.487 1.00 0.00 C ATOM 904 CD2 TYR A 62 109.476 10.580 1.515 1.00 0.00 C ATOM 905 CE1 TYR A 62 110.650 13.102 1.200 1.00 0.00 C ATOM 906 CE2 TYR A 62 108.676 11.694 1.230 1.00 0.00 C ATOM 907 CZ TYR A 62 109.264 12.954 1.072 1.00 0.00 C ATOM 908 OH TYR A 62 108.477 14.052 0.790 1.00 0.00 O ATOM 0 H TYR A 62 114.367 9.961 2.775 1.00 0.00 H new ATOM 0 HA TYR A 62 111.690 9.976 4.047 1.00 0.00 H new ATOM 0 HB2 TYR A 62 112.501 9.449 1.180 1.00 0.00 H new ATOM 0 HB3 TYR A 62 111.111 8.623 1.858 1.00 0.00 H new ATOM 0 HD1 TYR A 62 112.519 12.102 1.587 1.00 0.00 H new ATOM 0 HD2 TYR A 62 109.023 9.607 1.635 1.00 0.00 H new ATOM 0 HE1 TYR A 62 111.103 14.075 1.078 1.00 0.00 H new ATOM 0 HE2 TYR A 62 107.606 11.581 1.132 1.00 0.00 H new ATOM 0 HH TYR A 62 107.538 13.776 0.733 1.00 0.00 H new ATOM 918 N TYR A 63 111.912 7.553 4.631 1.00 0.00 N ATOM 919 CA TYR A 63 112.119 6.182 5.095 1.00 0.00 C ATOM 920 C TYR A 63 110.859 5.362 4.837 1.00 0.00 C ATOM 921 O TYR A 63 109.756 5.865 5.034 1.00 0.00 O ATOM 922 CB TYR A 63 112.421 6.179 6.595 1.00 0.00 C ATOM 923 CG TYR A 63 113.558 7.092 6.988 1.00 0.00 C ATOM 924 CD1 TYR A 63 114.878 6.625 6.957 1.00 0.00 C ATOM 925 CD2 TYR A 63 113.291 8.407 7.387 1.00 0.00 C ATOM 926 CE1 TYR A 63 115.930 7.473 7.325 1.00 0.00 C ATOM 927 CE2 TYR A 63 114.343 9.256 7.755 1.00 0.00 C ATOM 928 CZ TYR A 63 115.662 8.788 7.724 1.00 0.00 C ATOM 929 OH TYR A 63 116.699 9.624 8.086 1.00 0.00 O ATOM 0 H TYR A 63 111.101 8.018 5.039 1.00 0.00 H new ATOM 0 HA TYR A 63 112.960 5.747 4.556 1.00 0.00 H new ATOM 0 HB2 TYR A 63 111.524 6.477 7.138 1.00 0.00 H new ATOM 0 HB3 TYR A 63 112.659 5.162 6.906 1.00 0.00 H new ATOM 0 HD1 TYR A 63 115.085 5.611 6.649 1.00 0.00 H new ATOM 0 HD2 TYR A 63 112.273 8.767 7.411 1.00 0.00 H new ATOM 0 HE1 TYR A 63 116.948 7.113 7.301 1.00 0.00 H new ATOM 0 HE2 TYR A 63 114.137 10.271 8.062 1.00 0.00 H new ATOM 0 HH TYR A 63 116.612 10.477 7.612 1.00 0.00 H new ATOM 939 N GLY A 64 111.013 4.110 4.405 1.00 0.00 N ATOM 940 CA GLY A 64 109.851 3.276 4.098 1.00 0.00 C ATOM 941 C GLY A 64 109.958 1.902 4.748 1.00 0.00 C ATOM 942 O GLY A 64 110.992 1.241 4.645 1.00 0.00 O ATOM 0 H GLY A 64 111.915 3.657 4.261 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.945 3.773 4.444 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.760 3.162 3.018 1.00 0.00 H new ATOM 946 N ILE A 65 108.889 1.489 5.426 1.00 0.00 N ATOM 947 CA ILE A 65 108.832 0.161 6.035 1.00 0.00 C ATOM 948 C ILE A 65 107.722 -0.648 5.375 1.00 0.00 C ATOM 949 O ILE A 65 106.590 -0.175 5.279 1.00 0.00 O ATOM 950 CB ILE A 65 108.556 0.274 7.540 1.00 0.00 C ATOM 951 CG1 ILE A 65 109.575 1.207 8.215 1.00 0.00 C ATOM 952 CG2 ILE A 65 108.634 -1.115 8.176 1.00 0.00 C ATOM 953 CD1 ILE A 65 111.010 0.705 8.009 1.00 0.00 C ATOM 0 H ILE A 65 108.051 2.054 5.568 1.00 0.00 H new ATOM 0 HA ILE A 65 109.791 -0.337 5.890 1.00 0.00 H new ATOM 0 HB ILE A 65 107.559 0.692 7.681 1.00 0.00 H new ATOM 0 HG12 ILE A 65 109.477 2.213 7.807 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.360 1.274 9.282 1.00 0.00 H new ATOM 0 HG21 ILE A 65 108.438 -1.037 9.245 1.00 0.00 H new ATOM 0 HG22 ILE A 65 107.891 -1.767 7.718 1.00 0.00 H new ATOM 0 HG23 ILE A 65 109.629 -1.532 8.019 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.707 1.386 8.498 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.113 -0.291 8.440 1.00 0.00 H new ATOM 0 HD13 ILE A 65 111.231 0.663 6.943 1.00 0.00 H new ATOM 965 N THR A 66 108.043 -1.853 4.910 1.00 0.00 N ATOM 966 CA THR A 66 107.051 -2.681 4.229 1.00 0.00 C ATOM 967 C THR A 66 107.173 -4.153 4.621 1.00 0.00 C ATOM 968 O THR A 66 108.210 -4.597 5.113 1.00 0.00 O ATOM 969 CB THR A 66 107.196 -2.521 2.710 1.00 0.00 C ATOM 970 OG1 THR A 66 106.159 -3.239 2.058 1.00 0.00 O ATOM 971 CG2 THR A 66 108.559 -3.039 2.243 1.00 0.00 C ATOM 0 H THR A 66 108.969 -2.273 4.990 1.00 0.00 H new ATOM 0 HA THR A 66 106.062 -2.343 4.539 1.00 0.00 H new ATOM 0 HB THR A 66 107.123 -1.463 2.458 1.00 0.00 H new ATOM 0 HG1 THR A 66 105.430 -3.407 2.691 1.00 0.00 H new ATOM 0 HG21 THR A 66 108.644 -2.917 1.163 1.00 0.00 H new ATOM 0 HG22 THR A 66 109.351 -2.474 2.735 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.654 -4.095 2.498 1.00 0.00 H new ATOM 979 N ALA A 67 106.095 -4.896 4.395 1.00 0.00 N ATOM 980 CA ALA A 67 106.080 -6.332 4.651 1.00 0.00 C ATOM 981 C ALA A 67 105.154 -7.010 3.648 1.00 0.00 C ATOM 982 O ALA A 67 104.205 -6.386 3.169 1.00 0.00 O ATOM 983 CB ALA A 67 105.594 -6.610 6.076 1.00 0.00 C ATOM 0 H ALA A 67 105.216 -4.525 4.033 1.00 0.00 H new ATOM 0 HA ALA A 67 107.090 -6.727 4.544 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.587 -7.685 6.255 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.263 -6.128 6.789 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.586 -6.215 6.200 1.00 0.00 H new ATOM 989 N GLY A 68 105.443 -8.265 3.308 1.00 0.00 N ATOM 990 CA GLY A 68 104.627 -8.967 2.320 1.00 0.00 C ATOM 991 C GLY A 68 104.628 -10.490 2.525 1.00 0.00 C ATOM 992 O GLY A 68 105.672 -11.051 2.858 1.00 0.00 O ATOM 0 H GLY A 68 106.218 -8.806 3.692 1.00 0.00 H new ATOM 0 HA2 GLY A 68 103.603 -8.598 2.372 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.997 -8.739 1.321 1.00 0.00 H new ATOM 996 N PRO A 69 103.510 -11.175 2.368 1.00 0.00 N ATOM 997 CA PRO A 69 103.510 -12.668 2.284 1.00 0.00 C ATOM 998 C PRO A 69 104.015 -13.147 0.918 1.00 0.00 C ATOM 999 O PRO A 69 104.026 -12.365 -0.037 1.00 0.00 O ATOM 1000 CB PRO A 69 102.046 -13.081 2.516 1.00 0.00 C ATOM 1001 CG PRO A 69 101.294 -11.829 2.824 1.00 0.00 C ATOM 1002 CD PRO A 69 102.129 -10.670 2.285 1.00 0.00 C ATOM 0 HA PRO A 69 104.178 -13.117 3.019 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.637 -13.571 1.633 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.970 -13.791 3.339 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.309 -11.845 2.358 1.00 0.00 H new ATOM 0 HG3 PRO A 69 101.137 -11.726 3.898 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.854 -10.419 1.260 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.995 -9.767 2.881 1.00 0.00 H new ATOM 1010 N ALA A 70 104.398 -14.425 0.808 1.00 0.00 N ATOM 1011 CA ALA A 70 104.833 -14.962 -0.482 1.00 0.00 C ATOM 1012 C ALA A 70 104.310 -16.386 -0.676 1.00 0.00 C ATOM 1013 O ALA A 70 104.128 -17.126 0.290 1.00 0.00 O ATOM 1014 CB ALA A 70 106.365 -14.927 -0.583 1.00 0.00 C ATOM 0 H ALA A 70 104.415 -15.092 1.580 1.00 0.00 H new ATOM 0 HA ALA A 70 104.420 -14.339 -1.275 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.675 -15.329 -1.547 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.712 -13.898 -0.490 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.796 -15.529 0.217 1.00 0.00 H new ATOM 1020 N TYR A 71 104.073 -16.760 -1.931 1.00 0.00 N ATOM 1021 CA TYR A 71 103.542 -18.082 -2.248 1.00 0.00 C ATOM 1022 C TYR A 71 104.491 -18.815 -3.187 1.00 0.00 C ATOM 1023 O TYR A 71 104.923 -18.255 -4.195 1.00 0.00 O ATOM 1024 CB TYR A 71 102.168 -17.949 -2.908 1.00 0.00 C ATOM 1025 CG TYR A 71 101.139 -17.283 -2.024 1.00 0.00 C ATOM 1026 CD1 TYR A 71 100.480 -18.024 -1.036 1.00 0.00 C ATOM 1027 CD2 TYR A 71 100.846 -15.924 -2.193 1.00 0.00 C ATOM 1028 CE1 TYR A 71 99.527 -17.408 -0.217 1.00 0.00 C ATOM 1029 CE2 TYR A 71 99.892 -15.308 -1.374 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.234 -16.049 -0.386 1.00 0.00 C ATOM 1031 OH TYR A 71 98.294 -15.442 0.421 1.00 0.00 O ATOM 0 H TYR A 71 104.240 -16.167 -2.744 1.00 0.00 H new ATOM 0 HA TYR A 71 103.443 -18.651 -1.324 1.00 0.00 H new ATOM 0 HB2 TYR A 71 102.270 -17.376 -3.830 1.00 0.00 H new ATOM 0 HB3 TYR A 71 101.810 -18.940 -3.187 1.00 0.00 H new ATOM 0 HD1 TYR A 71 100.707 -19.072 -0.906 1.00 0.00 H new ATOM 0 HD2 TYR A 71 101.355 -15.352 -2.954 1.00 0.00 H new ATOM 0 HE1 TYR A 71 99.018 -17.980 0.545 1.00 0.00 H new ATOM 0 HE2 TYR A 71 99.664 -14.261 -1.505 1.00 0.00 H new ATOM 0 HH TYR A 71 98.211 -14.497 0.173 1.00 0.00 H new ATOM 1041 N ARG A 72 104.830 -20.054 -2.840 1.00 0.00 N ATOM 1042 CA ARG A 72 105.693 -20.871 -3.688 1.00 0.00 C ATOM 1043 C ARG A 72 104.918 -22.065 -4.235 1.00 0.00 C ATOM 1044 O ARG A 72 104.604 -23.004 -3.503 1.00 0.00 O ATOM 1045 CB ARG A 72 106.894 -21.359 -2.873 1.00 0.00 C ATOM 1046 CG ARG A 72 107.862 -22.113 -3.785 1.00 0.00 C ATOM 1047 CD ARG A 72 109.116 -22.496 -2.997 1.00 0.00 C ATOM 1048 NE ARG A 72 108.800 -23.526 -2.004 1.00 0.00 N ATOM 1049 CZ ARG A 72 109.658 -23.927 -1.055 1.00 0.00 C ATOM 1050 NH1 ARG A 72 110.861 -23.419 -0.939 1.00 0.00 N ATOM 1051 NH2 ARG A 72 109.283 -24.855 -0.218 1.00 0.00 N ATOM 0 H ARG A 72 104.522 -20.512 -1.982 1.00 0.00 H new ATOM 0 HA ARG A 72 106.043 -20.269 -4.526 1.00 0.00 H new ATOM 0 HB2 ARG A 72 107.400 -20.512 -2.410 1.00 0.00 H new ATOM 0 HB3 ARG A 72 106.558 -22.010 -2.066 1.00 0.00 H new ATOM 0 HG2 ARG A 72 107.382 -23.008 -4.181 1.00 0.00 H new ATOM 0 HG3 ARG A 72 108.132 -21.491 -4.639 1.00 0.00 H new ATOM 0 HD2 ARG A 72 109.884 -22.862 -3.678 1.00 0.00 H new ATOM 0 HD3 ARG A 72 109.524 -21.616 -2.500 1.00 0.00 H new ATOM 0 HE ARG A 72 107.878 -23.961 -2.036 1.00 0.00 H new ATOM 0 HH11 ARG A 72 111.172 -22.693 -1.584 1.00 0.00 H new ATOM 0 HH12 ARG A 72 111.486 -23.750 -0.204 1.00 0.00 H new ATOM 0 HH21 ARG A 72 108.351 -25.262 -0.292 1.00 0.00 H new ATOM 0 HH22 ARG A 72 109.922 -25.173 0.511 1.00 0.00 H new ATOM 1065 N ILE A 73 104.614 -22.022 -5.528 1.00 0.00 N ATOM 1066 CA ILE A 73 103.891 -23.114 -6.174 1.00 0.00 C ATOM 1067 C ILE A 73 104.777 -24.355 -6.285 1.00 0.00 C ATOM 1068 O ILE A 73 104.368 -25.455 -5.914 1.00 0.00 O ATOM 1069 CB ILE A 73 103.415 -22.680 -7.568 1.00 0.00 C ATOM 1070 CG1 ILE A 73 102.547 -21.423 -7.448 1.00 0.00 C ATOM 1071 CG2 ILE A 73 102.583 -23.797 -8.209 1.00 0.00 C ATOM 1072 CD1 ILE A 73 102.219 -20.889 -8.843 1.00 0.00 C ATOM 0 H ILE A 73 104.855 -21.248 -6.147 1.00 0.00 H new ATOM 0 HA ILE A 73 103.023 -23.362 -5.563 1.00 0.00 H new ATOM 0 HB ILE A 73 104.287 -22.472 -8.188 1.00 0.00 H new ATOM 0 HG12 ILE A 73 101.627 -21.654 -6.911 1.00 0.00 H new ATOM 0 HG13 ILE A 73 103.071 -20.661 -6.870 1.00 0.00 H new ATOM 0 HG21 ILE A 73 102.249 -23.481 -9.197 1.00 0.00 H new ATOM 0 HG22 ILE A 73 103.192 -24.696 -8.302 1.00 0.00 H new ATOM 0 HG23 ILE A 73 101.716 -24.009 -7.584 1.00 0.00 H new ATOM 0 HD11 ILE A 73 101.602 -19.995 -8.755 1.00 0.00 H new ATOM 0 HD12 ILE A 73 103.144 -20.641 -9.364 1.00 0.00 H new ATOM 0 HD13 ILE A 73 101.678 -21.650 -9.406 1.00 0.00 H new ATOM 1084 N ASN A 74 105.991 -24.170 -6.797 1.00 0.00 N ATOM 1085 CA ASN A 74 106.910 -25.286 -6.999 1.00 0.00 C ATOM 1086 C ASN A 74 108.315 -24.910 -6.536 1.00 0.00 C ATOM 1087 O ASN A 74 108.525 -23.840 -5.965 1.00 0.00 O ATOM 1088 CB ASN A 74 106.937 -25.669 -8.482 1.00 0.00 C ATOM 1089 CG ASN A 74 105.564 -26.164 -8.925 1.00 0.00 C ATOM 1090 OD1 ASN A 74 104.771 -26.624 -8.103 1.00 0.00 O ATOM 1091 ND2 ASN A 74 105.234 -26.098 -10.185 1.00 0.00 N ATOM 0 H ASN A 74 106.360 -23.262 -7.078 1.00 0.00 H new ATOM 0 HA ASN A 74 106.565 -26.136 -6.411 1.00 0.00 H new ATOM 0 HB2 ASN A 74 107.232 -24.808 -9.082 1.00 0.00 H new ATOM 0 HB3 ASN A 74 107.683 -26.446 -8.651 1.00 0.00 H new ATOM 0 HD21 ASN A 74 104.318 -26.428 -10.490 1.00 0.00 H new ATOM 0 HD22 ASN A 74 105.892 -25.717 -10.865 1.00 0.00 H new ATOM 1098 N ASP A 75 109.282 -25.786 -6.801 1.00 0.00 N ATOM 1099 CA ASP A 75 110.667 -25.554 -6.389 1.00 0.00 C ATOM 1100 C ASP A 75 111.156 -24.155 -6.769 1.00 0.00 C ATOM 1101 O ASP A 75 111.980 -23.567 -6.068 1.00 0.00 O ATOM 1102 CB ASP A 75 111.579 -26.600 -7.033 1.00 0.00 C ATOM 1103 CG ASP A 75 112.988 -26.487 -6.462 1.00 0.00 C ATOM 1104 OD1 ASP A 75 113.226 -27.054 -5.409 1.00 0.00 O ATOM 1105 OD2 ASP A 75 113.809 -25.836 -7.088 1.00 0.00 O ATOM 0 H ASP A 75 109.133 -26.663 -7.299 1.00 0.00 H new ATOM 0 HA ASP A 75 110.702 -25.636 -5.303 1.00 0.00 H new ATOM 0 HB2 ASP A 75 111.184 -27.600 -6.852 1.00 0.00 H new ATOM 0 HB3 ASP A 75 111.603 -26.457 -8.113 1.00 0.00 H new ATOM 1110 N TRP A 76 110.647 -23.624 -7.879 1.00 0.00 N ATOM 1111 CA TRP A 76 111.048 -22.298 -8.344 1.00 0.00 C ATOM 1112 C TRP A 76 109.821 -21.443 -8.646 1.00 0.00 C ATOM 1113 O TRP A 76 108.685 -21.897 -8.509 1.00 0.00 O ATOM 1114 CB TRP A 76 111.904 -22.428 -9.604 1.00 0.00 C ATOM 1115 CG TRP A 76 111.183 -23.059 -10.752 1.00 0.00 C ATOM 1116 CD1 TRP A 76 110.984 -24.388 -10.908 1.00 0.00 C ATOM 1117 CD2 TRP A 76 110.565 -22.415 -11.904 1.00 0.00 C ATOM 1118 NE1 TRP A 76 110.283 -24.602 -12.080 1.00 0.00 N ATOM 1119 CE2 TRP A 76 110.001 -23.417 -12.731 1.00 0.00 C ATOM 1120 CE3 TRP A 76 110.439 -21.075 -12.309 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 109.335 -23.097 -13.918 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 109.771 -20.750 -13.498 1.00 0.00 C ATOM 1123 CH2 TRP A 76 109.221 -21.757 -14.302 1.00 0.00 C ATOM 0 H TRP A 76 109.959 -24.089 -8.471 1.00 0.00 H new ATOM 0 HA TRP A 76 111.628 -21.815 -7.557 1.00 0.00 H new ATOM 0 HB2 TRP A 76 112.250 -21.438 -9.902 1.00 0.00 H new ATOM 0 HB3 TRP A 76 112.790 -23.019 -9.372 1.00 0.00 H new ATOM 0 HD1 TRP A 76 111.319 -25.157 -10.227 1.00 0.00 H new ATOM 0 HE1 TRP A 76 110.008 -25.523 -12.422 1.00 0.00 H new ATOM 0 HE3 TRP A 76 110.860 -20.289 -11.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 108.912 -23.878 -14.533 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 109.680 -19.716 -13.796 1.00 0.00 H new ATOM 0 HH2 TRP A 76 108.709 -21.499 -15.217 1.00 0.00 H new ATOM 1134 N ALA A 77 110.065 -20.196 -9.040 1.00 0.00 N ATOM 1135 CA ALA A 77 108.986 -19.269 -9.367 1.00 0.00 C ATOM 1136 C ALA A 77 108.093 -19.018 -8.153 1.00 0.00 C ATOM 1137 O ALA A 77 107.139 -19.755 -7.904 1.00 0.00 O ATOM 1138 CB ALA A 77 108.153 -19.820 -10.530 1.00 0.00 C ATOM 0 H ALA A 77 111.001 -19.804 -9.141 1.00 0.00 H new ATOM 0 HA ALA A 77 109.431 -18.319 -9.664 1.00 0.00 H new ATOM 0 HB1 ALA A 77 107.351 -19.121 -10.766 1.00 0.00 H new ATOM 0 HB2 ALA A 77 108.790 -19.950 -11.405 1.00 0.00 H new ATOM 0 HB3 ALA A 77 107.725 -20.782 -10.247 1.00 0.00 H new ATOM 1144 N SER A 78 108.417 -17.968 -7.402 1.00 0.00 N ATOM 1145 CA SER A 78 107.611 -17.560 -6.255 1.00 0.00 C ATOM 1146 C SER A 78 107.185 -16.105 -6.417 1.00 0.00 C ATOM 1147 O SER A 78 107.890 -15.318 -7.050 1.00 0.00 O ATOM 1148 CB SER A 78 108.416 -17.720 -4.965 1.00 0.00 C ATOM 1149 OG SER A 78 109.520 -16.825 -4.990 1.00 0.00 O ATOM 0 H SER A 78 109.235 -17.383 -7.569 1.00 0.00 H new ATOM 0 HA SER A 78 106.725 -18.192 -6.202 1.00 0.00 H new ATOM 0 HB2 SER A 78 107.785 -17.514 -4.100 1.00 0.00 H new ATOM 0 HB3 SER A 78 108.767 -18.747 -4.866 1.00 0.00 H new ATOM 0 HG SER A 78 110.039 -16.922 -4.164 1.00 0.00 H new ATOM 1155 N ILE A 79 106.037 -15.740 -5.848 1.00 0.00 N ATOM 1156 CA ILE A 79 105.521 -14.379 -5.997 1.00 0.00 C ATOM 1157 C ILE A 79 105.190 -13.789 -4.633 1.00 0.00 C ATOM 1158 O ILE A 79 104.862 -14.526 -3.706 1.00 0.00 O ATOM 1159 CB ILE A 79 104.275 -14.389 -6.889 1.00 0.00 C ATOM 1160 CG1 ILE A 79 103.183 -15.260 -6.258 1.00 0.00 C ATOM 1161 CG2 ILE A 79 104.638 -14.953 -8.264 1.00 0.00 C ATOM 1162 CD1 ILE A 79 101.892 -15.127 -7.068 1.00 0.00 C ATOM 0 H ILE A 79 105.452 -16.359 -5.286 1.00 0.00 H new ATOM 0 HA ILE A 79 106.286 -13.760 -6.466 1.00 0.00 H new ATOM 0 HB ILE A 79 103.905 -13.369 -6.993 1.00 0.00 H new ATOM 0 HG12 ILE A 79 103.503 -16.302 -6.233 1.00 0.00 H new ATOM 0 HG13 ILE A 79 103.010 -14.954 -5.226 1.00 0.00 H new ATOM 0 HG21 ILE A 79 103.752 -14.961 -8.899 1.00 0.00 H new ATOM 0 HG22 ILE A 79 105.407 -14.331 -8.721 1.00 0.00 H new ATOM 0 HG23 ILE A 79 105.013 -15.970 -8.152 1.00 0.00 H new ATOM 0 HD11 ILE A 79 101.115 -15.746 -6.619 1.00 0.00 H new ATOM 0 HD12 ILE A 79 101.570 -14.086 -7.070 1.00 0.00 H new ATOM 0 HD13 ILE A 79 102.070 -15.454 -8.092 1.00 0.00 H new ATOM 1174 N TYR A 80 105.270 -12.466 -4.514 1.00 0.00 N ATOM 1175 CA TYR A 80 104.967 -11.816 -3.244 1.00 0.00 C ATOM 1176 C TYR A 80 104.279 -10.473 -3.466 1.00 0.00 C ATOM 1177 O TYR A 80 104.401 -9.873 -4.532 1.00 0.00 O ATOM 1178 CB TYR A 80 106.260 -11.633 -2.440 1.00 0.00 C ATOM 1179 CG TYR A 80 107.209 -10.601 -3.007 1.00 0.00 C ATOM 1180 CD1 TYR A 80 108.071 -10.941 -4.057 1.00 0.00 C ATOM 1181 CD2 TYR A 80 107.229 -9.306 -2.477 1.00 0.00 C ATOM 1182 CE1 TYR A 80 108.950 -9.984 -4.578 1.00 0.00 C ATOM 1183 CE2 TYR A 80 108.108 -8.350 -2.997 1.00 0.00 C ATOM 1184 CZ TYR A 80 108.970 -8.689 -4.047 1.00 0.00 C ATOM 1185 OH TYR A 80 109.837 -7.746 -4.561 1.00 0.00 O ATOM 0 H TYR A 80 105.537 -11.833 -5.268 1.00 0.00 H new ATOM 0 HA TYR A 80 104.281 -12.450 -2.681 1.00 0.00 H new ATOM 0 HB2 TYR A 80 106.002 -11.349 -1.420 1.00 0.00 H new ATOM 0 HB3 TYR A 80 106.777 -12.591 -2.383 1.00 0.00 H new ATOM 0 HD1 TYR A 80 108.058 -11.941 -4.465 1.00 0.00 H new ATOM 0 HD2 TYR A 80 106.565 -9.044 -1.666 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.613 -10.245 -5.390 1.00 0.00 H new ATOM 0 HE2 TYR A 80 108.122 -7.350 -2.588 1.00 0.00 H new ATOM 0 HH TYR A 80 109.566 -6.854 -4.259 1.00 0.00 H new ATOM 1195 N GLY A 81 103.582 -10.003 -2.438 1.00 0.00 N ATOM 1196 CA GLY A 81 102.942 -8.690 -2.493 1.00 0.00 C ATOM 1197 C GLY A 81 103.248 -7.920 -1.217 1.00 0.00 C ATOM 1198 O GLY A 81 103.306 -8.510 -0.140 1.00 0.00 O ATOM 0 H GLY A 81 103.445 -10.506 -1.561 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.301 -8.135 -3.360 1.00 0.00 H new ATOM 0 HA3 GLY A 81 101.864 -8.804 -2.612 1.00 0.00 H new ATOM 1202 N VAL A 82 103.393 -6.601 -1.321 1.00 0.00 N ATOM 1203 CA VAL A 82 103.895 -5.815 -0.197 1.00 0.00 C ATOM 1204 C VAL A 82 103.071 -4.552 0.021 1.00 0.00 C ATOM 1205 O VAL A 82 102.542 -3.971 -0.926 1.00 0.00 O ATOM 1206 CB VAL A 82 105.354 -5.427 -0.459 1.00 0.00 C ATOM 1207 CG1 VAL A 82 106.198 -6.692 -0.612 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.456 -4.608 -1.750 1.00 0.00 C ATOM 0 H VAL A 82 103.174 -6.061 -2.158 1.00 0.00 H new ATOM 0 HA VAL A 82 103.819 -6.428 0.701 1.00 0.00 H new ATOM 0 HB VAL A 82 105.716 -4.833 0.380 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.236 -6.417 -0.798 1.00 0.00 H new ATOM 0 HG12 VAL A 82 106.138 -7.282 0.302 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.823 -7.281 -1.449 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.497 -4.337 -1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.087 -5.201 -2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 82 104.856 -3.703 -1.655 1.00 0.00 H new ATOM 1218 N VAL A 83 102.984 -4.144 1.281 1.00 0.00 N ATOM 1219 CA VAL A 83 102.415 -2.851 1.629 1.00 0.00 C ATOM 1220 C VAL A 83 103.326 -2.186 2.654 1.00 0.00 C ATOM 1221 O VAL A 83 104.033 -2.886 3.379 1.00 0.00 O ATOM 1222 CB VAL A 83 101.002 -3.033 2.195 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.113 -3.700 1.140 1.00 0.00 C ATOM 1224 CG2 VAL A 83 101.047 -3.918 3.447 1.00 0.00 C ATOM 0 H VAL A 83 103.302 -4.693 2.080 1.00 0.00 H new ATOM 0 HA VAL A 83 102.341 -2.220 0.743 1.00 0.00 H new ATOM 0 HB VAL A 83 100.597 -2.056 2.459 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.108 -3.830 1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 83 100.070 -3.072 0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 83 100.528 -4.673 0.877 1.00 0.00 H new ATOM 0 HG21 VAL A 83 100.039 -4.041 3.842 1.00 0.00 H new ATOM 0 HG22 VAL A 83 101.457 -4.894 3.188 1.00 0.00 H new ATOM 0 HG23 VAL A 83 101.677 -3.448 4.202 1.00 0.00 H new ATOM 1234 N GLY A 84 103.318 -0.856 2.714 1.00 0.00 N ATOM 1235 CA GLY A 84 104.162 -0.164 3.683 1.00 0.00 C ATOM 1236 C GLY A 84 103.809 1.310 3.803 1.00 0.00 C ATOM 1237 O GLY A 84 102.922 1.811 3.113 1.00 0.00 O ATOM 0 H GLY A 84 102.752 -0.250 2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 84 104.059 -0.641 4.658 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.207 -0.263 3.388 1.00 0.00 H new ATOM 1241 N VAL A 85 104.546 2.000 4.669 1.00 0.00 N ATOM 1242 CA VAL A 85 104.307 3.415 4.927 1.00 0.00 C ATOM 1243 C VAL A 85 105.610 4.183 4.753 1.00 0.00 C ATOM 1244 O VAL A 85 106.670 3.717 5.171 1.00 0.00 O ATOM 1245 CB VAL A 85 103.769 3.617 6.348 1.00 0.00 C ATOM 1246 CG1 VAL A 85 103.434 5.094 6.569 1.00 0.00 C ATOM 1247 CG2 VAL A 85 102.498 2.783 6.544 1.00 0.00 C ATOM 0 H VAL A 85 105.316 1.600 5.205 1.00 0.00 H new ATOM 0 HA VAL A 85 103.564 3.786 4.221 1.00 0.00 H new ATOM 0 HB VAL A 85 104.529 3.302 7.062 1.00 0.00 H new ATOM 0 HG11 VAL A 85 103.052 5.233 7.580 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.333 5.695 6.435 1.00 0.00 H new ATOM 0 HG13 VAL A 85 102.678 5.407 5.849 1.00 0.00 H new ATOM 0 HG21 VAL A 85 102.119 2.930 7.555 1.00 0.00 H new ATOM 0 HG22 VAL A 85 101.742 3.097 5.824 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.728 1.728 6.392 1.00 0.00 H new ATOM 1257 N GLY A 86 105.527 5.346 4.117 1.00 0.00 N ATOM 1258 CA GLY A 86 106.708 6.173 3.889 1.00 0.00 C ATOM 1259 C GLY A 86 106.531 7.532 4.552 1.00 0.00 C ATOM 1260 O GLY A 86 105.476 8.147 4.426 1.00 0.00 O ATOM 0 H GLY A 86 104.659 5.737 3.751 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.592 5.677 4.290 1.00 0.00 H new ATOM 0 HA3 GLY A 86 106.871 6.300 2.819 1.00 0.00 H new ATOM 1264 N TYR A 87 107.559 7.981 5.265 1.00 0.00 N ATOM 1265 CA TYR A 87 107.516 9.274 5.941 1.00 0.00 C ATOM 1266 C TYR A 87 108.670 10.140 5.455 1.00 0.00 C ATOM 1267 O TYR A 87 109.786 9.651 5.297 1.00 0.00 O ATOM 1268 CB TYR A 87 107.623 9.079 7.454 1.00 0.00 C ATOM 1269 CG TYR A 87 106.517 8.226 8.030 1.00 0.00 C ATOM 1270 CD1 TYR A 87 105.266 8.792 8.304 1.00 0.00 C ATOM 1271 CD2 TYR A 87 106.744 6.869 8.290 1.00 0.00 C ATOM 1272 CE1 TYR A 87 104.243 8.001 8.839 1.00 0.00 C ATOM 1273 CE2 TYR A 87 105.719 6.079 8.824 1.00 0.00 C ATOM 1274 CZ TYR A 87 104.469 6.644 9.099 1.00 0.00 C ATOM 1275 OH TYR A 87 103.459 5.865 9.626 1.00 0.00 O ATOM 0 H TYR A 87 108.432 7.469 5.390 1.00 0.00 H new ATOM 0 HA TYR A 87 106.570 9.765 5.713 1.00 0.00 H new ATOM 0 HB2 TYR A 87 108.584 8.620 7.686 1.00 0.00 H new ATOM 0 HB3 TYR A 87 107.610 10.054 7.940 1.00 0.00 H new ATOM 0 HD1 TYR A 87 105.091 9.838 8.103 1.00 0.00 H new ATOM 0 HD2 TYR A 87 107.709 6.432 8.079 1.00 0.00 H new ATOM 0 HE1 TYR A 87 103.278 8.438 9.051 1.00 0.00 H new ATOM 0 HE2 TYR A 87 105.893 5.032 9.024 1.00 0.00 H new ATOM 0 HH TYR A 87 103.689 4.918 9.524 1.00 0.00 H new ATOM 1285 N GLY A 88 108.401 11.420 5.219 1.00 0.00 N ATOM 1286 CA GLY A 88 109.423 12.322 4.697 1.00 0.00 C ATOM 1287 C GLY A 88 109.444 13.645 5.453 1.00 0.00 C ATOM 1288 O GLY A 88 108.405 14.131 5.906 1.00 0.00 O ATOM 0 H GLY A 88 107.492 11.854 5.379 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.401 11.846 4.769 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.237 12.510 3.639 1.00 0.00 H new ATOM 1292 N LYS A 89 110.640 14.215 5.573 1.00 0.00 N ATOM 1293 CA LYS A 89 110.808 15.499 6.240 1.00 0.00 C ATOM 1294 C LYS A 89 111.801 16.361 5.467 1.00 0.00 C ATOM 1295 O LYS A 89 112.839 15.869 5.025 1.00 0.00 O ATOM 1296 CB LYS A 89 111.312 15.286 7.670 1.00 0.00 C ATOM 1297 CG LYS A 89 111.365 16.628 8.403 1.00 0.00 C ATOM 1298 CD LYS A 89 111.773 16.400 9.860 1.00 0.00 C ATOM 1299 CE LYS A 89 113.226 15.926 9.916 1.00 0.00 C ATOM 1300 NZ LYS A 89 113.718 15.995 11.321 1.00 0.00 N ATOM 0 H LYS A 89 111.505 13.807 5.217 1.00 0.00 H new ATOM 0 HA LYS A 89 109.844 16.007 6.274 1.00 0.00 H new ATOM 0 HB2 LYS A 89 110.653 14.597 8.199 1.00 0.00 H new ATOM 0 HB3 LYS A 89 112.302 14.831 7.653 1.00 0.00 H new ATOM 0 HG2 LYS A 89 112.078 17.293 7.915 1.00 0.00 H new ATOM 0 HG3 LYS A 89 110.392 17.117 8.359 1.00 0.00 H new ATOM 0 HD2 LYS A 89 111.658 17.322 10.429 1.00 0.00 H new ATOM 0 HD3 LYS A 89 111.120 15.658 10.320 1.00 0.00 H new ATOM 0 HE2 LYS A 89 113.301 14.905 9.543 1.00 0.00 H new ATOM 0 HE3 LYS A 89 113.847 16.547 9.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 114.706 15.673 11.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 113.661 16.976 11.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 113.131 15.384 11.925 1.00 0.00 H new ATOM 1314 N PHE A 90 111.464 17.636 5.295 1.00 0.00 N ATOM 1315 CA PHE A 90 112.345 18.571 4.601 1.00 0.00 C ATOM 1316 C PHE A 90 112.448 19.874 5.389 1.00 0.00 C ATOM 1317 O PHE A 90 111.554 20.205 6.168 1.00 0.00 O ATOM 1318 CB PHE A 90 111.802 18.855 3.199 1.00 0.00 C ATOM 1319 CG PHE A 90 110.423 19.470 3.201 1.00 0.00 C ATOM 1320 CD1 PHE A 90 110.277 20.861 3.235 1.00 0.00 C ATOM 1321 CD2 PHE A 90 109.290 18.647 3.169 1.00 0.00 C ATOM 1322 CE1 PHE A 90 108.998 21.431 3.235 1.00 0.00 C ATOM 1323 CE2 PHE A 90 108.011 19.217 3.169 1.00 0.00 C ATOM 1324 CZ PHE A 90 107.865 20.608 3.202 1.00 0.00 C ATOM 0 H PHE A 90 110.590 18.045 5.625 1.00 0.00 H new ATOM 0 HA PHE A 90 113.337 18.127 4.517 1.00 0.00 H new ATOM 0 HB2 PHE A 90 112.489 19.524 2.680 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.775 17.924 2.633 1.00 0.00 H new ATOM 0 HD1 PHE A 90 111.151 21.495 3.261 1.00 0.00 H new ATOM 0 HD2 PHE A 90 109.403 17.573 3.144 1.00 0.00 H new ATOM 0 HE1 PHE A 90 108.885 22.505 3.260 1.00 0.00 H new ATOM 0 HE2 PHE A 90 107.137 18.583 3.144 1.00 0.00 H new ATOM 0 HZ PHE A 90 106.878 21.047 3.202 1.00 0.00 H new ATOM 1334 N GLN A 91 113.537 20.612 5.188 1.00 0.00 N ATOM 1335 CA GLN A 91 113.761 21.845 5.942 1.00 0.00 C ATOM 1336 C GLN A 91 113.531 23.080 5.075 1.00 0.00 C ATOM 1337 O GLN A 91 114.199 23.280 4.061 1.00 0.00 O ATOM 1338 CB GLN A 91 115.192 21.862 6.483 1.00 0.00 C ATOM 1339 CG GLN A 91 115.379 23.069 7.410 1.00 0.00 C ATOM 1340 CD GLN A 91 116.786 23.088 8.007 1.00 0.00 C ATOM 1341 OE1 GLN A 91 117.553 22.134 7.857 1.00 0.00 O ATOM 1342 NE2 GLN A 91 117.176 24.132 8.685 1.00 0.00 N ATOM 0 H GLN A 91 114.271 20.383 4.518 1.00 0.00 H new ATOM 0 HA GLN A 91 113.048 21.871 6.766 1.00 0.00 H new ATOM 0 HB2 GLN A 91 115.397 20.939 7.026 1.00 0.00 H new ATOM 0 HB3 GLN A 91 115.903 21.911 5.658 1.00 0.00 H new ATOM 0 HG2 GLN A 91 115.204 23.990 6.854 1.00 0.00 H new ATOM 0 HG3 GLN A 91 114.641 23.035 8.211 1.00 0.00 H new ATOM 0 HE21 GLN A 91 116.545 24.923 8.811 1.00 0.00 H new ATOM 0 HE22 GLN A 91 118.112 24.157 9.089 1.00 0.00 H new ATOM 1351 N THR A 92 112.575 23.901 5.496 1.00 0.00 N ATOM 1352 CA THR A 92 112.327 25.195 4.868 1.00 0.00 C ATOM 1353 C THR A 92 111.897 26.197 5.935 1.00 0.00 C ATOM 1354 O THR A 92 111.647 25.809 7.078 1.00 0.00 O ATOM 1355 CB THR A 92 111.231 25.076 3.805 1.00 0.00 C ATOM 1356 OG1 THR A 92 110.065 24.517 4.391 1.00 0.00 O ATOM 1357 CG2 THR A 92 111.713 24.181 2.661 1.00 0.00 C ATOM 0 H THR A 92 111.953 23.691 6.277 1.00 0.00 H new ATOM 0 HA THR A 92 113.243 25.535 4.386 1.00 0.00 H new ATOM 0 HB THR A 92 111.001 26.066 3.410 1.00 0.00 H new ATOM 0 HG1 THR A 92 109.362 24.441 3.712 1.00 0.00 H new ATOM 0 HG21 THR A 92 110.929 24.100 1.908 1.00 0.00 H new ATOM 0 HG22 THR A 92 112.606 24.615 2.211 1.00 0.00 H new ATOM 0 HG23 THR A 92 111.948 23.190 3.049 1.00 0.00 H new ATOM 1365 N THR A 93 111.809 27.478 5.574 1.00 0.00 N ATOM 1366 CA THR A 93 111.317 28.477 6.519 1.00 0.00 C ATOM 1367 C THR A 93 109.846 28.774 6.247 1.00 0.00 C ATOM 1368 O THR A 93 109.476 29.153 5.136 1.00 0.00 O ATOM 1369 CB THR A 93 112.132 29.766 6.388 1.00 0.00 C ATOM 1370 OG1 THR A 93 111.974 30.292 5.078 1.00 0.00 O ATOM 1371 CG2 THR A 93 113.610 29.469 6.646 1.00 0.00 C ATOM 0 H THR A 93 112.066 27.841 4.656 1.00 0.00 H new ATOM 0 HA THR A 93 111.423 28.085 7.531 1.00 0.00 H new ATOM 0 HB THR A 93 111.779 30.494 7.118 1.00 0.00 H new ATOM 0 HG1 THR A 93 111.071 30.093 4.752 1.00 0.00 H new ATOM 0 HG21 THR A 93 114.188 30.389 6.552 1.00 0.00 H new ATOM 0 HG22 THR A 93 113.730 29.066 7.652 1.00 0.00 H new ATOM 0 HG23 THR A 93 113.967 28.740 5.918 1.00 0.00 H new ATOM 1379 N GLU A 94 109.032 28.631 7.289 1.00 0.00 N ATOM 1380 CA GLU A 94 107.589 28.840 7.195 1.00 0.00 C ATOM 1381 C GLU A 94 106.937 28.444 8.515 1.00 0.00 C ATOM 1382 O GLU A 94 107.440 27.552 9.201 1.00 0.00 O ATOM 1383 CB GLU A 94 106.974 28.000 6.070 1.00 0.00 C ATOM 1384 CG GLU A 94 107.350 26.523 6.256 1.00 0.00 C ATOM 1385 CD GLU A 94 106.862 25.658 5.090 1.00 0.00 C ATOM 1386 OE1 GLU A 94 106.140 26.154 4.236 1.00 0.00 O ATOM 1387 OE2 GLU A 94 107.223 24.492 5.066 1.00 0.00 O ATOM 0 H GLU A 94 109.352 28.368 8.221 1.00 0.00 H new ATOM 0 HA GLU A 94 107.413 29.894 6.978 1.00 0.00 H new ATOM 0 HB2 GLU A 94 105.890 28.111 6.072 1.00 0.00 H new ATOM 0 HB3 GLU A 94 107.329 28.356 5.103 1.00 0.00 H new ATOM 0 HG2 GLU A 94 108.432 26.433 6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 94 106.920 26.153 7.187 1.00 0.00 H new ATOM 1394 N TYR A 95 105.832 29.097 8.874 1.00 0.00 N ATOM 1395 CA TYR A 95 105.062 28.644 10.027 1.00 0.00 C ATOM 1396 C TYR A 95 104.175 27.472 9.579 1.00 0.00 C ATOM 1397 O TYR A 95 103.298 27.675 8.735 1.00 0.00 O ATOM 1398 CB TYR A 95 104.204 29.787 10.586 1.00 0.00 C ATOM 1399 CG TYR A 95 103.185 30.351 9.620 1.00 0.00 C ATOM 1400 CD1 TYR A 95 103.564 31.314 8.678 1.00 0.00 C ATOM 1401 CD2 TYR A 95 101.856 29.914 9.677 1.00 0.00 C ATOM 1402 CE1 TYR A 95 102.616 31.839 7.791 1.00 0.00 C ATOM 1403 CE2 TYR A 95 100.908 30.438 8.790 1.00 0.00 C ATOM 1404 CZ TYR A 95 101.287 31.400 7.847 1.00 0.00 C ATOM 1405 OH TYR A 95 100.353 31.918 6.972 1.00 0.00 O ATOM 0 H TYR A 95 105.459 29.918 8.397 1.00 0.00 H new ATOM 0 HA TYR A 95 105.735 28.320 10.821 1.00 0.00 H new ATOM 0 HB2 TYR A 95 103.682 29.429 11.474 1.00 0.00 H new ATOM 0 HB3 TYR A 95 104.864 30.593 10.907 1.00 0.00 H new ATOM 0 HD1 TYR A 95 104.589 31.653 8.635 1.00 0.00 H new ATOM 0 HD2 TYR A 95 101.562 29.173 10.405 1.00 0.00 H new ATOM 0 HE1 TYR A 95 102.909 32.582 7.064 1.00 0.00 H new ATOM 0 HE2 TYR A 95 99.883 30.100 8.834 1.00 0.00 H new ATOM 0 HH TYR A 95 99.480 31.506 7.144 1.00 0.00 H new ATOM 1415 N PRO A 96 104.371 26.260 10.071 1.00 0.00 N ATOM 1416 CA PRO A 96 103.653 25.073 9.510 1.00 0.00 C ATOM 1417 C PRO A 96 102.183 25.005 9.913 1.00 0.00 C ATOM 1418 O PRO A 96 101.837 25.205 11.076 1.00 0.00 O ATOM 1419 CB PRO A 96 104.421 23.878 10.073 1.00 0.00 C ATOM 1420 CG PRO A 96 104.980 24.355 11.368 1.00 0.00 C ATOM 1421 CD PRO A 96 105.223 25.856 11.211 1.00 0.00 C ATOM 0 HA PRO A 96 103.632 25.109 8.421 1.00 0.00 H new ATOM 0 HB2 PRO A 96 103.765 23.020 10.219 1.00 0.00 H new ATOM 0 HB3 PRO A 96 105.213 23.562 9.394 1.00 0.00 H new ATOM 0 HG2 PRO A 96 104.287 24.158 12.186 1.00 0.00 H new ATOM 0 HG3 PRO A 96 105.908 23.835 11.605 1.00 0.00 H new ATOM 0 HD2 PRO A 96 104.953 26.397 12.118 1.00 0.00 H new ATOM 0 HD3 PRO A 96 106.274 26.068 11.014 1.00 0.00 H new ATOM 1429 N THR A 97 101.323 24.723 8.937 1.00 0.00 N ATOM 1430 CA THR A 97 99.946 24.334 9.224 1.00 0.00 C ATOM 1431 C THR A 97 99.707 22.925 8.692 1.00 0.00 C ATOM 1432 O THR A 97 99.860 22.683 7.494 1.00 0.00 O ATOM 1433 CB THR A 97 98.973 25.309 8.557 1.00 0.00 C ATOM 1434 OG1 THR A 97 99.275 26.634 8.970 1.00 0.00 O ATOM 1435 CG2 THR A 97 97.540 24.959 8.964 1.00 0.00 C ATOM 0 H THR A 97 101.555 24.757 7.944 1.00 0.00 H new ATOM 0 HA THR A 97 99.780 24.356 10.301 1.00 0.00 H new ATOM 0 HB THR A 97 99.069 25.236 7.474 1.00 0.00 H new ATOM 0 HG1 THR A 97 98.654 27.260 8.542 1.00 0.00 H new ATOM 0 HG21 THR A 97 96.847 25.653 8.489 1.00 0.00 H new ATOM 0 HG22 THR A 97 97.310 23.942 8.646 1.00 0.00 H new ATOM 0 HG23 THR A 97 97.441 25.032 10.047 1.00 0.00 H new ATOM 1443 N TYR A 98 99.335 22.001 9.573 1.00 0.00 N ATOM 1444 CA TYR A 98 99.081 20.628 9.147 1.00 0.00 C ATOM 1445 C TYR A 98 98.247 19.880 10.184 1.00 0.00 C ATOM 1446 O TYR A 98 98.152 20.299 11.337 1.00 0.00 O ATOM 1447 CB TYR A 98 100.406 19.903 8.914 1.00 0.00 C ATOM 1448 CG TYR A 98 100.293 18.744 7.952 1.00 0.00 C ATOM 1449 CD1 TYR A 98 100.284 18.979 6.573 1.00 0.00 C ATOM 1450 CD2 TYR A 98 100.197 17.437 8.439 1.00 0.00 C ATOM 1451 CE1 TYR A 98 100.178 17.906 5.680 1.00 0.00 C ATOM 1452 CE2 TYR A 98 100.091 16.362 7.548 1.00 0.00 C ATOM 1453 CZ TYR A 98 100.082 16.596 6.167 1.00 0.00 C ATOM 1454 OH TYR A 98 99.977 15.539 5.288 1.00 0.00 O ATOM 0 H TYR A 98 99.204 22.173 10.570 1.00 0.00 H new ATOM 0 HA TYR A 98 98.517 20.655 8.214 1.00 0.00 H new ATOM 0 HB2 TYR A 98 101.138 20.614 8.531 1.00 0.00 H new ATOM 0 HB3 TYR A 98 100.785 19.538 9.869 1.00 0.00 H new ATOM 0 HD1 TYR A 98 100.359 19.989 6.197 1.00 0.00 H new ATOM 0 HD2 TYR A 98 100.205 17.256 9.504 1.00 0.00 H new ATOM 0 HE1 TYR A 98 100.170 18.088 4.616 1.00 0.00 H new ATOM 0 HE2 TYR A 98 100.016 15.353 7.925 1.00 0.00 H new ATOM 0 HH TYR A 98 99.921 14.700 5.791 1.00 0.00 H new ATOM 1464 N LYS A 99 97.644 18.772 9.763 1.00 0.00 N ATOM 1465 CA LYS A 99 96.846 17.948 10.667 1.00 0.00 C ATOM 1466 C LYS A 99 97.634 16.722 11.134 1.00 0.00 C ATOM 1467 O LYS A 99 98.551 16.272 10.452 1.00 0.00 O ATOM 1468 CB LYS A 99 95.538 17.537 9.972 1.00 0.00 C ATOM 1469 CG LYS A 99 95.810 16.579 8.806 1.00 0.00 C ATOM 1470 CD LYS A 99 94.504 16.296 8.062 1.00 0.00 C ATOM 1471 CE LYS A 99 94.705 15.118 7.106 1.00 0.00 C ATOM 1472 NZ LYS A 99 94.570 13.838 7.859 1.00 0.00 N ATOM 0 H LYS A 99 97.692 18.424 8.805 1.00 0.00 H new ATOM 0 HA LYS A 99 96.602 18.532 11.554 1.00 0.00 H new ATOM 0 HB2 LYS A 99 94.874 17.059 10.692 1.00 0.00 H new ATOM 0 HB3 LYS A 99 95.023 18.425 9.605 1.00 0.00 H new ATOM 0 HG2 LYS A 99 96.541 17.016 8.126 1.00 0.00 H new ATOM 0 HG3 LYS A 99 96.238 15.648 9.179 1.00 0.00 H new ATOM 0 HD2 LYS A 99 93.710 16.069 8.773 1.00 0.00 H new ATOM 0 HD3 LYS A 99 94.191 17.180 7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 99 93.970 15.159 6.302 1.00 0.00 H new ATOM 0 HE3 LYS A 99 95.689 15.177 6.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 95.083 13.085 7.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 94.968 13.953 8.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 93.565 13.582 7.932 1.00 0.00 H new ATOM 1486 N HIS A 100 97.259 16.195 12.296 1.00 0.00 N ATOM 1487 CA HIS A 100 97.912 15.018 12.867 1.00 0.00 C ATOM 1488 C HIS A 100 99.365 15.312 13.257 1.00 0.00 C ATOM 1489 O HIS A 100 99.638 15.596 14.424 1.00 0.00 O ATOM 1490 CB HIS A 100 97.826 13.830 11.902 1.00 0.00 C ATOM 1491 CG HIS A 100 98.319 12.540 12.499 1.00 0.00 C ATOM 1492 ND1 HIS A 100 97.672 11.922 13.559 1.00 0.00 N ATOM 1493 CD2 HIS A 100 99.393 11.739 12.197 1.00 0.00 C ATOM 1494 CE1 HIS A 100 98.356 10.802 13.853 1.00 0.00 C ATOM 1495 NE2 HIS A 100 99.414 10.641 13.054 1.00 0.00 N ATOM 0 H HIS A 100 96.500 16.567 12.866 1.00 0.00 H new ATOM 0 HA HIS A 100 97.381 14.753 13.781 1.00 0.00 H new ATOM 0 HB2 HIS A 100 96.791 13.703 11.585 1.00 0.00 H new ATOM 0 HB3 HIS A 100 98.408 14.054 11.008 1.00 0.00 H new ATOM 0 HD2 HIS A 100 100.112 11.931 11.414 1.00 0.00 H new ATOM 0 HE1 HIS A 100 98.083 10.115 14.641 1.00 0.00 H new ATOM 0 HE2 HIS A 100 100.091 9.878 13.068 1.00 0.00 H new ATOM 1503 N ASP A 101 100.298 15.251 12.303 1.00 0.00 N ATOM 1504 CA ASP A 101 101.706 15.492 12.610 1.00 0.00 C ATOM 1505 C ASP A 101 102.380 16.318 11.517 1.00 0.00 C ATOM 1506 O ASP A 101 101.940 16.326 10.368 1.00 0.00 O ATOM 1507 CB ASP A 101 102.438 14.156 12.781 1.00 0.00 C ATOM 1508 CG ASP A 101 102.328 13.289 11.525 1.00 0.00 C ATOM 1509 OD1 ASP A 101 102.031 13.817 10.464 1.00 0.00 O ATOM 1510 OD2 ASP A 101 102.545 12.094 11.645 1.00 0.00 O ATOM 0 H ASP A 101 100.105 15.039 11.324 1.00 0.00 H new ATOM 0 HA ASP A 101 101.757 16.058 13.540 1.00 0.00 H new ATOM 0 HB2 ASP A 101 103.488 14.342 13.005 1.00 0.00 H new ATOM 0 HB3 ASP A 101 102.021 13.618 13.633 1.00 0.00 H new ATOM 1515 N THR A 102 103.460 17.000 11.885 1.00 0.00 N ATOM 1516 CA THR A 102 104.164 17.877 10.955 1.00 0.00 C ATOM 1517 C THR A 102 104.698 17.099 9.754 1.00 0.00 C ATOM 1518 O THR A 102 104.644 17.580 8.621 1.00 0.00 O ATOM 1519 CB THR A 102 105.325 18.567 11.673 1.00 0.00 C ATOM 1520 OG1 THR A 102 104.841 19.205 12.846 1.00 0.00 O ATOM 1521 CG2 THR A 102 105.956 19.610 10.749 1.00 0.00 C ATOM 0 H THR A 102 103.867 16.963 12.820 1.00 0.00 H new ATOM 0 HA THR A 102 103.456 18.622 10.593 1.00 0.00 H new ATOM 0 HB THR A 102 106.076 17.824 11.943 1.00 0.00 H new ATOM 0 HG1 THR A 102 105.584 19.646 13.309 1.00 0.00 H new ATOM 0 HG21 THR A 102 106.783 20.100 11.264 1.00 0.00 H new ATOM 0 HG22 THR A 102 106.328 19.121 9.849 1.00 0.00 H new ATOM 0 HG23 THR A 102 105.208 20.354 10.475 1.00 0.00 H new ATOM 1529 N SER A 103 105.212 15.900 10.004 1.00 0.00 N ATOM 1530 CA SER A 103 105.797 15.096 8.937 1.00 0.00 C ATOM 1531 C SER A 103 104.724 14.653 7.946 1.00 0.00 C ATOM 1532 O SER A 103 103.547 14.566 8.293 1.00 0.00 O ATOM 1533 CB SER A 103 106.486 13.866 9.529 1.00 0.00 C ATOM 1534 OG SER A 103 107.482 14.287 10.449 1.00 0.00 O ATOM 0 H SER A 103 105.236 15.466 10.927 1.00 0.00 H new ATOM 0 HA SER A 103 106.531 15.706 8.410 1.00 0.00 H new ATOM 0 HB2 SER A 103 105.756 13.231 10.031 1.00 0.00 H new ATOM 0 HB3 SER A 103 106.936 13.269 8.736 1.00 0.00 H new ATOM 0 HG SER A 103 107.926 13.502 10.833 1.00 0.00 H new ATOM 1540 N ASP A 104 105.138 14.375 6.712 1.00 0.00 N ATOM 1541 CA ASP A 104 104.198 13.938 5.683 1.00 0.00 C ATOM 1542 C ASP A 104 104.303 12.430 5.495 1.00 0.00 C ATOM 1543 O ASP A 104 105.398 11.874 5.565 1.00 0.00 O ATOM 1544 CB ASP A 104 104.503 14.646 4.361 1.00 0.00 C ATOM 1545 CG ASP A 104 104.316 16.154 4.503 1.00 0.00 C ATOM 1546 OD1 ASP A 104 103.478 16.563 5.291 1.00 0.00 O ATOM 1547 OD2 ASP A 104 105.018 16.882 3.820 1.00 0.00 O ATOM 0 H ASP A 104 106.107 14.443 6.402 1.00 0.00 H new ATOM 0 HA ASP A 104 103.185 14.191 5.997 1.00 0.00 H new ATOM 0 HB2 ASP A 104 105.526 14.428 4.053 1.00 0.00 H new ATOM 0 HB3 ASP A 104 103.847 14.265 3.578 1.00 0.00 H new ATOM 1552 N TYR A 105 103.174 11.770 5.244 1.00 0.00 N ATOM 1553 CA TYR A 105 103.172 10.316 5.092 1.00 0.00 C ATOM 1554 C TYR A 105 102.317 9.874 3.905 1.00 0.00 C ATOM 1555 O TYR A 105 101.394 10.576 3.491 1.00 0.00 O ATOM 1556 CB TYR A 105 102.662 9.664 6.381 1.00 0.00 C ATOM 1557 CG TYR A 105 101.194 9.903 6.657 1.00 0.00 C ATOM 1558 CD1 TYR A 105 100.794 11.018 7.402 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.236 9.008 6.167 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.435 11.239 7.658 1.00 0.00 C ATOM 1561 CE2 TYR A 105 98.877 9.229 6.422 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.477 10.345 7.168 1.00 0.00 C ATOM 1563 OH TYR A 105 97.137 10.562 7.420 1.00 0.00 O ATOM 0 H TYR A 105 102.260 12.211 5.143 1.00 0.00 H new ATOM 0 HA TYR A 105 104.195 9.995 4.898 1.00 0.00 H new ATOM 0 HB2 TYR A 105 102.840 8.590 6.327 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.245 10.042 7.221 1.00 0.00 H new ATOM 0 HD1 TYR A 105 101.534 11.708 7.780 1.00 0.00 H new ATOM 0 HD2 TYR A 105 100.545 8.147 5.592 1.00 0.00 H new ATOM 0 HE1 TYR A 105 99.127 12.099 8.234 1.00 0.00 H new ATOM 0 HE2 TYR A 105 98.137 8.539 6.044 1.00 0.00 H new ATOM 0 HH TYR A 105 96.607 9.848 7.008 1.00 0.00 H new ATOM 1573 N GLY A 106 102.639 8.700 3.366 1.00 0.00 N ATOM 1574 CA GLY A 106 101.870 8.131 2.264 1.00 0.00 C ATOM 1575 C GLY A 106 101.896 6.606 2.312 1.00 0.00 C ATOM 1576 O GLY A 106 102.662 6.019 3.075 1.00 0.00 O ATOM 0 H GLY A 106 103.424 8.127 3.674 1.00 0.00 H new ATOM 0 HA2 GLY A 106 100.840 8.483 2.315 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.278 8.476 1.314 1.00 0.00 H new ATOM 1580 N PHE A 107 101.080 5.974 1.471 1.00 0.00 N ATOM 1581 CA PHE A 107 100.966 4.514 1.466 1.00 0.00 C ATOM 1582 C PHE A 107 101.516 3.932 0.167 1.00 0.00 C ATOM 1583 O PHE A 107 101.365 4.536 -0.893 1.00 0.00 O ATOM 1584 CB PHE A 107 99.500 4.107 1.626 1.00 0.00 C ATOM 1585 CG PHE A 107 98.893 4.548 2.938 1.00 0.00 C ATOM 1586 CD1 PHE A 107 98.268 5.796 3.035 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.958 3.708 4.056 1.00 0.00 C ATOM 1588 CE1 PHE A 107 97.705 6.205 4.250 1.00 0.00 C ATOM 1589 CE2 PHE A 107 98.395 4.117 5.271 1.00 0.00 C ATOM 1590 CZ PHE A 107 97.768 5.365 5.368 1.00 0.00 C ATOM 0 H PHE A 107 100.490 6.446 0.786 1.00 0.00 H new ATOM 0 HA PHE A 107 101.549 4.122 2.299 1.00 0.00 H new ATOM 0 HB2 PHE A 107 98.921 4.532 0.806 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.421 3.023 1.544 1.00 0.00 H new ATOM 0 HD1 PHE A 107 98.220 6.444 2.172 1.00 0.00 H new ATOM 0 HD2 PHE A 107 99.442 2.745 3.981 1.00 0.00 H new ATOM 0 HE1 PHE A 107 97.222 7.168 4.325 1.00 0.00 H new ATOM 0 HE2 PHE A 107 98.444 3.469 6.134 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.333 5.680 6.305 1.00 0.00 H new ATOM 1600 N SER A 108 102.146 2.758 0.249 1.00 0.00 N ATOM 1601 CA SER A 108 102.722 2.125 -0.939 1.00 0.00 C ATOM 1602 C SER A 108 102.254 0.678 -1.077 1.00 0.00 C ATOM 1603 O SER A 108 102.120 -0.034 -0.081 1.00 0.00 O ATOM 1604 CB SER A 108 104.249 2.156 -0.849 1.00 0.00 C ATOM 1605 OG SER A 108 104.682 3.505 -0.734 1.00 0.00 O ATOM 0 H SER A 108 102.269 2.232 1.114 1.00 0.00 H new ATOM 0 HA SER A 108 102.387 2.681 -1.815 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.587 1.578 0.012 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.687 1.695 -1.734 1.00 0.00 H new ATOM 0 HG SER A 108 105.660 3.531 -0.675 1.00 0.00 H new ATOM 1611 N TYR A 109 102.023 0.262 -2.321 1.00 0.00 N ATOM 1612 CA TYR A 109 101.615 -1.109 -2.625 1.00 0.00 C ATOM 1613 C TYR A 109 102.394 -1.615 -3.837 1.00 0.00 C ATOM 1614 O TYR A 109 102.699 -0.829 -4.736 1.00 0.00 O ATOM 1615 CB TYR A 109 100.119 -1.140 -2.944 1.00 0.00 C ATOM 1616 CG TYR A 109 99.248 -0.601 -1.833 1.00 0.00 C ATOM 1617 CD1 TYR A 109 98.930 0.762 -1.792 1.00 0.00 C ATOM 1618 CD2 TYR A 109 98.763 -1.461 -0.841 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.126 1.264 -0.761 1.00 0.00 C ATOM 1620 CE2 TYR A 109 97.961 -0.960 0.190 1.00 0.00 C ATOM 1621 CZ TYR A 109 97.642 0.402 0.230 1.00 0.00 C ATOM 1622 OH TYR A 109 96.850 0.896 1.247 1.00 0.00 O ATOM 0 H TYR A 109 102.112 0.861 -3.142 1.00 0.00 H new ATOM 0 HA TYR A 109 101.820 -1.745 -1.763 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.938 -0.560 -3.849 1.00 0.00 H new ATOM 0 HB3 TYR A 109 99.824 -2.167 -3.159 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.305 1.427 -2.556 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.008 -2.512 -0.871 1.00 0.00 H new ATOM 0 HE1 TYR A 109 97.880 2.315 -0.731 1.00 0.00 H new ATOM 0 HE2 TYR A 109 97.588 -1.625 0.955 1.00 0.00 H new ATOM 0 HH TYR A 109 96.598 0.166 1.850 1.00 0.00 H new ATOM 1632 N GLY A 110 102.726 -2.909 -3.869 1.00 0.00 N ATOM 1633 CA GLY A 110 103.412 -3.465 -5.034 1.00 0.00 C ATOM 1634 C GLY A 110 103.500 -4.986 -4.983 1.00 0.00 C ATOM 1635 O GLY A 110 103.031 -5.614 -4.038 1.00 0.00 O ATOM 0 H GLY A 110 102.536 -3.575 -3.121 1.00 0.00 H new ATOM 0 HA2 GLY A 110 102.886 -3.164 -5.940 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.417 -3.047 -5.095 1.00 0.00 H new ATOM 1639 N ALA A 111 104.110 -5.565 -6.013 1.00 0.00 N ATOM 1640 CA ALA A 111 104.303 -7.011 -6.082 1.00 0.00 C ATOM 1641 C ALA A 111 105.576 -7.326 -6.859 1.00 0.00 C ATOM 1642 O ALA A 111 106.030 -6.508 -7.662 1.00 0.00 O ATOM 1643 CB ALA A 111 103.104 -7.670 -6.767 1.00 0.00 C ATOM 0 H ALA A 111 104.480 -5.054 -6.814 1.00 0.00 H new ATOM 0 HA ALA A 111 104.393 -7.404 -5.069 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.259 -8.748 -6.813 1.00 0.00 H new ATOM 0 HB2 ALA A 111 102.198 -7.457 -6.199 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.000 -7.275 -7.778 1.00 0.00 H new ATOM 1649 N GLY A 112 106.150 -8.507 -6.630 1.00 0.00 N ATOM 1650 CA GLY A 112 107.407 -8.860 -7.284 1.00 0.00 C ATOM 1651 C GLY A 112 107.511 -10.358 -7.544 1.00 0.00 C ATOM 1652 O GLY A 112 106.825 -11.158 -6.908 1.00 0.00 O ATOM 0 H GLY A 112 105.773 -9.222 -6.009 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.489 -8.321 -8.228 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.243 -8.541 -6.661 1.00 0.00 H new ATOM 1656 N LEU A 113 108.378 -10.720 -8.488 1.00 0.00 N ATOM 1657 CA LEU A 113 108.612 -12.120 -8.829 1.00 0.00 C ATOM 1658 C LEU A 113 110.094 -12.453 -8.685 1.00 0.00 C ATOM 1659 O LEU A 113 110.949 -11.603 -8.934 1.00 0.00 O ATOM 1660 CB LEU A 113 108.165 -12.399 -10.267 1.00 0.00 C ATOM 1661 CG LEU A 113 106.665 -12.117 -10.412 1.00 0.00 C ATOM 1662 CD1 LEU A 113 106.447 -10.636 -10.732 1.00 0.00 C ATOM 1663 CD2 LEU A 113 106.088 -12.971 -11.546 1.00 0.00 C ATOM 0 H LEU A 113 108.932 -10.059 -9.032 1.00 0.00 H new ATOM 0 HA LEU A 113 108.033 -12.743 -8.147 1.00 0.00 H new ATOM 0 HB2 LEU A 113 108.730 -11.775 -10.960 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.376 -13.436 -10.528 1.00 0.00 H new ATOM 0 HG LEU A 113 106.162 -12.365 -9.477 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.380 -10.439 -10.834 1.00 0.00 H new ATOM 0 HD12 LEU A 113 106.853 -10.026 -9.925 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.953 -10.387 -11.665 1.00 0.00 H new ATOM 0 HD21 LEU A 113 105.022 -12.769 -11.647 1.00 0.00 H new ATOM 0 HD22 LEU A 113 106.594 -12.726 -12.480 1.00 0.00 H new ATOM 0 HD23 LEU A 113 106.237 -14.027 -11.319 1.00 0.00 H new ATOM 1675 N GLN A 114 110.389 -13.686 -8.281 1.00 0.00 N ATOM 1676 CA GLN A 114 111.772 -14.124 -8.104 1.00 0.00 C ATOM 1677 C GLN A 114 112.155 -15.136 -9.181 1.00 0.00 C ATOM 1678 O GLN A 114 111.420 -16.090 -9.434 1.00 0.00 O ATOM 1679 CB GLN A 114 111.936 -14.760 -6.721 1.00 0.00 C ATOM 1680 CG GLN A 114 113.409 -15.104 -6.478 1.00 0.00 C ATOM 1681 CD GLN A 114 113.608 -15.693 -5.081 1.00 0.00 C ATOM 1682 OE1 GLN A 114 112.692 -15.695 -4.256 1.00 0.00 O ATOM 1683 NE2 GLN A 114 114.766 -16.202 -4.764 1.00 0.00 N ATOM 0 H GLN A 114 109.691 -14.399 -8.070 1.00 0.00 H new ATOM 0 HA GLN A 114 112.427 -13.257 -8.189 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.582 -14.074 -5.951 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.326 -15.661 -6.651 1.00 0.00 H new ATOM 0 HG2 GLN A 114 113.749 -15.817 -7.229 1.00 0.00 H new ATOM 0 HG3 GLN A 114 114.019 -14.208 -6.590 1.00 0.00 H new ATOM 0 HE21 GLN A 114 115.526 -16.202 -5.444 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.911 -16.600 -3.836 1.00 0.00 H new ATOM 1692 N PHE A 115 113.308 -14.925 -9.814 1.00 0.00 N ATOM 1693 CA PHE A 115 113.771 -15.819 -10.872 1.00 0.00 C ATOM 1694 C PHE A 115 115.148 -16.375 -10.524 1.00 0.00 C ATOM 1695 O PHE A 115 116.003 -15.647 -10.021 1.00 0.00 O ATOM 1696 CB PHE A 115 113.838 -15.061 -12.199 1.00 0.00 C ATOM 1697 CG PHE A 115 114.097 -15.953 -13.392 1.00 0.00 C ATOM 1698 CD1 PHE A 115 113.052 -16.705 -13.940 1.00 0.00 C ATOM 1699 CD2 PHE A 115 115.379 -16.023 -13.950 1.00 0.00 C ATOM 1700 CE1 PHE A 115 113.288 -17.528 -15.048 1.00 0.00 C ATOM 1701 CE2 PHE A 115 115.614 -16.847 -15.057 1.00 0.00 C ATOM 1702 CZ PHE A 115 114.569 -17.600 -15.606 1.00 0.00 C ATOM 0 H PHE A 115 113.936 -14.146 -9.613 1.00 0.00 H new ATOM 0 HA PHE A 115 113.069 -16.647 -10.967 1.00 0.00 H new ATOM 0 HB2 PHE A 115 112.900 -14.528 -12.351 1.00 0.00 H new ATOM 0 HB3 PHE A 115 114.625 -14.310 -12.140 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.063 -16.651 -13.508 1.00 0.00 H new ATOM 0 HD2 PHE A 115 116.185 -15.442 -13.527 1.00 0.00 H new ATOM 0 HE1 PHE A 115 112.481 -18.107 -15.472 1.00 0.00 H new ATOM 0 HE2 PHE A 115 116.603 -16.902 -15.488 1.00 0.00 H new ATOM 0 HZ PHE A 115 114.752 -18.236 -16.460 1.00 0.00 H new ATOM 1712 N ASN A 116 115.355 -17.662 -10.795 1.00 0.00 N ATOM 1713 CA ASN A 116 116.611 -18.325 -10.454 1.00 0.00 C ATOM 1714 C ASN A 116 117.255 -18.950 -11.696 1.00 0.00 C ATOM 1715 O ASN A 116 117.010 -20.122 -11.987 1.00 0.00 O ATOM 1716 CB ASN A 116 116.349 -19.414 -9.411 1.00 0.00 C ATOM 1717 CG ASN A 116 116.062 -18.780 -8.055 1.00 0.00 C ATOM 1718 OD1 ASN A 116 116.893 -18.847 -7.149 1.00 0.00 O ATOM 1719 ND2 ASN A 116 114.929 -18.163 -7.858 1.00 0.00 N ATOM 0 H ASN A 116 114.670 -18.266 -11.249 1.00 0.00 H new ATOM 0 HA ASN A 116 117.295 -17.580 -10.048 1.00 0.00 H new ATOM 0 HB2 ASN A 116 115.504 -20.029 -9.720 1.00 0.00 H new ATOM 0 HB3 ASN A 116 117.213 -20.074 -9.337 1.00 0.00 H new ATOM 0 HD21 ASN A 116 114.732 -17.736 -6.953 1.00 0.00 H new ATOM 0 HD22 ASN A 116 114.241 -18.108 -8.609 1.00 0.00 H new ATOM 1726 N PRO A 117 118.057 -18.212 -12.438 1.00 0.00 N ATOM 1727 CA PRO A 117 118.731 -18.772 -13.650 1.00 0.00 C ATOM 1728 C PRO A 117 119.890 -19.696 -13.282 1.00 0.00 C ATOM 1729 O PRO A 117 120.045 -20.081 -12.123 1.00 0.00 O ATOM 1730 CB PRO A 117 119.230 -17.537 -14.402 1.00 0.00 C ATOM 1731 CG PRO A 117 119.435 -16.498 -13.354 1.00 0.00 C ATOM 1732 CD PRO A 117 118.426 -16.793 -12.243 1.00 0.00 C ATOM 0 HA PRO A 117 118.056 -19.386 -14.246 1.00 0.00 H new ATOM 0 HB2 PRO A 117 120.158 -17.748 -14.934 1.00 0.00 H new ATOM 0 HB3 PRO A 117 118.504 -17.209 -15.145 1.00 0.00 H new ATOM 0 HG2 PRO A 117 120.455 -16.531 -12.970 1.00 0.00 H new ATOM 0 HG3 PRO A 117 119.280 -15.499 -13.763 1.00 0.00 H new ATOM 0 HD2 PRO A 117 118.863 -16.629 -11.258 1.00 0.00 H new ATOM 0 HD3 PRO A 117 117.554 -16.143 -12.317 1.00 0.00 H new ATOM 1740 N MET A 118 120.702 -20.047 -14.275 1.00 0.00 N ATOM 1741 CA MET A 118 121.853 -20.915 -14.039 1.00 0.00 C ATOM 1742 C MET A 118 122.774 -20.332 -12.967 1.00 0.00 C ATOM 1743 O MET A 118 123.361 -21.071 -12.177 1.00 0.00 O ATOM 1744 CB MET A 118 122.639 -21.099 -15.339 1.00 0.00 C ATOM 1745 CG MET A 118 121.773 -21.840 -16.359 1.00 0.00 C ATOM 1746 SD MET A 118 122.764 -22.261 -17.815 1.00 0.00 S ATOM 1747 CE MET A 118 123.217 -20.575 -18.292 1.00 0.00 C ATOM 0 H MET A 118 120.587 -19.747 -15.243 1.00 0.00 H new ATOM 0 HA MET A 118 121.483 -21.879 -13.690 1.00 0.00 H new ATOM 0 HB2 MET A 118 122.937 -20.129 -15.736 1.00 0.00 H new ATOM 0 HB3 MET A 118 123.554 -21.660 -15.147 1.00 0.00 H new ATOM 0 HG2 MET A 118 121.364 -22.746 -15.912 1.00 0.00 H new ATOM 0 HG3 MET A 118 120.927 -21.218 -16.651 1.00 0.00 H new ATOM 0 HE1 MET A 118 123.436 -20.545 -19.359 1.00 0.00 H new ATOM 0 HE2 MET A 118 122.390 -19.900 -18.072 1.00 0.00 H new ATOM 0 HE3 MET A 118 124.098 -20.263 -17.732 1.00 0.00 H new ATOM 1757 N GLU A 119 122.897 -19.007 -12.943 1.00 0.00 N ATOM 1758 CA GLU A 119 123.738 -18.337 -11.955 1.00 0.00 C ATOM 1759 C GLU A 119 123.329 -18.734 -10.539 1.00 0.00 C ATOM 1760 O GLU A 119 122.180 -19.105 -10.295 1.00 0.00 O ATOM 1761 CB GLU A 119 123.621 -16.820 -12.114 1.00 0.00 C ATOM 1762 CG GLU A 119 124.127 -16.410 -13.501 1.00 0.00 C ATOM 1763 CD GLU A 119 124.115 -14.888 -13.685 1.00 0.00 C ATOM 1764 OE1 GLU A 119 123.553 -14.190 -12.853 1.00 0.00 O ATOM 1765 OE2 GLU A 119 124.676 -14.437 -14.670 1.00 0.00 O ATOM 0 H GLU A 119 122.427 -18.378 -13.594 1.00 0.00 H new ATOM 0 HA GLU A 119 124.771 -18.643 -12.120 1.00 0.00 H new ATOM 0 HB2 GLU A 119 122.584 -16.509 -11.987 1.00 0.00 H new ATOM 0 HB3 GLU A 119 124.201 -16.317 -11.340 1.00 0.00 H new ATOM 0 HG2 GLU A 119 125.140 -16.785 -13.644 1.00 0.00 H new ATOM 0 HG3 GLU A 119 123.505 -16.874 -14.267 1.00 0.00 H new ATOM 1772 N ASN A 120 124.276 -18.651 -9.611 1.00 0.00 N ATOM 1773 CA ASN A 120 124.008 -19.026 -8.222 1.00 0.00 C ATOM 1774 C ASN A 120 123.300 -17.917 -7.429 1.00 0.00 C ATOM 1775 O ASN A 120 123.211 -17.998 -6.205 1.00 0.00 O ATOM 1776 CB ASN A 120 125.324 -19.376 -7.524 1.00 0.00 C ATOM 1777 CG ASN A 120 126.029 -20.504 -8.273 1.00 0.00 C ATOM 1778 OD1 ASN A 120 127.231 -20.426 -8.525 1.00 0.00 O ATOM 1779 ND2 ASN A 120 125.348 -21.554 -8.644 1.00 0.00 N ATOM 0 H ASN A 120 125.228 -18.331 -9.790 1.00 0.00 H new ATOM 0 HA ASN A 120 123.339 -19.886 -8.249 1.00 0.00 H new ATOM 0 HB2 ASN A 120 125.968 -18.498 -7.483 1.00 0.00 H new ATOM 0 HB3 ASN A 120 125.130 -19.678 -6.495 1.00 0.00 H new ATOM 0 HD21 ASN A 120 125.812 -22.312 -9.144 1.00 0.00 H new ATOM 0 HD22 ASN A 120 124.352 -21.616 -8.434 1.00 0.00 H new ATOM 1786 N VAL A 121 122.798 -16.886 -8.111 1.00 0.00 N ATOM 1787 CA VAL A 121 122.086 -15.799 -7.445 1.00 0.00 C ATOM 1788 C VAL A 121 120.700 -15.624 -8.059 1.00 0.00 C ATOM 1789 O VAL A 121 120.465 -16.015 -9.202 1.00 0.00 O ATOM 1790 CB VAL A 121 122.881 -14.496 -7.575 1.00 0.00 C ATOM 1791 CG1 VAL A 121 124.238 -14.658 -6.888 1.00 0.00 C ATOM 1792 CG2 VAL A 121 123.101 -14.169 -9.055 1.00 0.00 C ATOM 0 H VAL A 121 122.872 -16.783 -9.123 1.00 0.00 H new ATOM 0 HA VAL A 121 121.976 -16.046 -6.389 1.00 0.00 H new ATOM 0 HB VAL A 121 122.323 -13.687 -7.104 1.00 0.00 H new ATOM 0 HG11 VAL A 121 124.805 -13.732 -6.980 1.00 0.00 H new ATOM 0 HG12 VAL A 121 124.087 -14.888 -5.833 1.00 0.00 H new ATOM 0 HG13 VAL A 121 124.791 -15.470 -7.361 1.00 0.00 H new ATOM 0 HG21 VAL A 121 123.667 -13.241 -9.142 1.00 0.00 H new ATOM 0 HG22 VAL A 121 123.656 -14.979 -9.528 1.00 0.00 H new ATOM 0 HG23 VAL A 121 122.136 -14.054 -9.549 1.00 0.00 H new ATOM 1802 N ALA A 122 119.786 -15.034 -7.294 1.00 0.00 N ATOM 1803 CA ALA A 122 118.411 -14.847 -7.752 1.00 0.00 C ATOM 1804 C ALA A 122 118.109 -13.362 -7.891 1.00 0.00 C ATOM 1805 O ALA A 122 118.694 -12.541 -7.188 1.00 0.00 O ATOM 1806 CB ALA A 122 117.439 -15.477 -6.753 1.00 0.00 C ATOM 0 H ALA A 122 119.971 -14.678 -6.356 1.00 0.00 H new ATOM 0 HA ALA A 122 118.292 -15.330 -8.722 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.416 -15.334 -7.101 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.647 -16.543 -6.666 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.561 -15.003 -5.779 1.00 0.00 H new ATOM 1812 N LEU A 123 117.186 -13.023 -8.788 1.00 0.00 N ATOM 1813 CA LEU A 123 116.849 -11.625 -9.041 1.00 0.00 C ATOM 1814 C LEU A 123 115.380 -11.378 -8.724 1.00 0.00 C ATOM 1815 O LEU A 123 114.548 -12.265 -8.904 1.00 0.00 O ATOM 1816 CB LEU A 123 117.147 -11.273 -10.503 1.00 0.00 C ATOM 1817 CG LEU A 123 116.292 -12.132 -11.457 1.00 0.00 C ATOM 1818 CD1 LEU A 123 115.011 -11.382 -11.839 1.00 0.00 C ATOM 1819 CD2 LEU A 123 117.079 -12.443 -12.736 1.00 0.00 C ATOM 0 H LEU A 123 116.661 -13.694 -9.349 1.00 0.00 H new ATOM 0 HA LEU A 123 117.456 -10.989 -8.397 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.943 -10.216 -10.676 1.00 0.00 H new ATOM 0 HB3 LEU A 123 118.205 -11.432 -10.712 1.00 0.00 H new ATOM 0 HG LEU A 123 116.037 -13.060 -10.946 1.00 0.00 H new ATOM 0 HD11 LEU A 123 114.416 -11.998 -12.513 1.00 0.00 H new ATOM 0 HD12 LEU A 123 114.434 -11.166 -10.940 1.00 0.00 H new ATOM 0 HD13 LEU A 123 115.271 -10.448 -12.337 1.00 0.00 H new ATOM 0 HD21 LEU A 123 116.466 -13.050 -13.402 1.00 0.00 H new ATOM 0 HD22 LEU A 123 117.344 -11.511 -13.236 1.00 0.00 H new ATOM 0 HD23 LEU A 123 117.987 -12.989 -12.481 1.00 0.00 H new ATOM 1831 N ASP A 124 115.073 -10.186 -8.220 1.00 0.00 N ATOM 1832 CA ASP A 124 113.695 -9.831 -7.895 1.00 0.00 C ATOM 1833 C ASP A 124 113.284 -8.584 -8.667 1.00 0.00 C ATOM 1834 O ASP A 124 113.983 -7.569 -8.631 1.00 0.00 O ATOM 1835 CB ASP A 124 113.552 -9.588 -6.387 1.00 0.00 C ATOM 1836 CG ASP A 124 114.403 -8.402 -5.935 1.00 0.00 C ATOM 1837 OD1 ASP A 124 115.406 -8.131 -6.575 1.00 0.00 O ATOM 1838 OD2 ASP A 124 114.038 -7.782 -4.951 1.00 0.00 O ATOM 0 H ASP A 124 115.756 -9.453 -8.029 1.00 0.00 H new ATOM 0 HA ASP A 124 113.042 -10.656 -8.180 1.00 0.00 H new ATOM 0 HB2 ASP A 124 112.506 -9.402 -6.144 1.00 0.00 H new ATOM 0 HB3 ASP A 124 113.852 -10.483 -5.842 1.00 0.00 H new ATOM 1843 N PHE A 125 112.165 -8.687 -9.376 1.00 0.00 N ATOM 1844 CA PHE A 125 111.633 -7.567 -10.144 1.00 0.00 C ATOM 1845 C PHE A 125 110.271 -7.173 -9.589 1.00 0.00 C ATOM 1846 O PHE A 125 109.389 -8.021 -9.463 1.00 0.00 O ATOM 1847 CB PHE A 125 111.493 -7.967 -11.614 1.00 0.00 C ATOM 1848 CG PHE A 125 111.001 -6.847 -12.499 1.00 0.00 C ATOM 1849 CD1 PHE A 125 111.909 -5.934 -13.047 1.00 0.00 C ATOM 1850 CD2 PHE A 125 109.633 -6.723 -12.773 1.00 0.00 C ATOM 1851 CE1 PHE A 125 111.451 -4.897 -13.868 1.00 0.00 C ATOM 1852 CE2 PHE A 125 109.174 -5.686 -13.593 1.00 0.00 C ATOM 1853 CZ PHE A 125 110.083 -4.773 -14.141 1.00 0.00 C ATOM 0 H PHE A 125 111.607 -9.539 -9.435 1.00 0.00 H new ATOM 0 HA PHE A 125 112.315 -6.721 -10.067 1.00 0.00 H new ATOM 0 HB2 PHE A 125 112.459 -8.312 -11.982 1.00 0.00 H new ATOM 0 HB3 PHE A 125 110.804 -8.808 -11.689 1.00 0.00 H new ATOM 0 HD1 PHE A 125 112.964 -6.030 -12.836 1.00 0.00 H new ATOM 0 HD2 PHE A 125 108.932 -7.428 -12.351 1.00 0.00 H new ATOM 0 HE1 PHE A 125 112.152 -4.193 -14.291 1.00 0.00 H new ATOM 0 HE2 PHE A 125 108.119 -5.590 -13.803 1.00 0.00 H new ATOM 0 HZ PHE A 125 109.729 -3.973 -14.774 1.00 0.00 H new ATOM 1863 N SER A 126 110.106 -5.900 -9.249 1.00 0.00 N ATOM 1864 CA SER A 126 108.854 -5.440 -8.659 1.00 0.00 C ATOM 1865 C SER A 126 108.489 -4.043 -9.148 1.00 0.00 C ATOM 1866 O SER A 126 109.362 -3.223 -9.431 1.00 0.00 O ATOM 1867 CB SER A 126 108.973 -5.431 -7.135 1.00 0.00 C ATOM 1868 OG SER A 126 107.731 -5.032 -6.571 1.00 0.00 O ATOM 0 H SER A 126 110.814 -5.175 -9.370 1.00 0.00 H new ATOM 0 HA SER A 126 108.065 -6.127 -8.966 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.248 -6.422 -6.774 1.00 0.00 H new ATOM 0 HB3 SER A 126 109.763 -4.748 -6.824 1.00 0.00 H new ATOM 0 HG SER A 126 107.003 -5.263 -7.185 1.00 0.00 H new ATOM 1874 N TYR A 127 107.188 -3.784 -9.249 1.00 0.00 N ATOM 1875 CA TYR A 127 106.692 -2.455 -9.593 1.00 0.00 C ATOM 1876 C TYR A 127 105.891 -1.889 -8.425 1.00 0.00 C ATOM 1877 O TYR A 127 104.916 -2.494 -7.979 1.00 0.00 O ATOM 1878 CB TYR A 127 105.821 -2.531 -10.851 1.00 0.00 C ATOM 1879 CG TYR A 127 104.530 -3.296 -10.663 1.00 0.00 C ATOM 1880 CD1 TYR A 127 104.517 -4.689 -10.797 1.00 0.00 C ATOM 1881 CD2 TYR A 127 103.349 -2.611 -10.355 1.00 0.00 C ATOM 1882 CE1 TYR A 127 103.323 -5.398 -10.622 1.00 0.00 C ATOM 1883 CE2 TYR A 127 102.155 -3.320 -10.180 1.00 0.00 C ATOM 1884 CZ TYR A 127 102.141 -4.713 -10.313 1.00 0.00 C ATOM 1885 OH TYR A 127 100.963 -5.412 -10.141 1.00 0.00 O ATOM 0 H TYR A 127 106.457 -4.479 -9.097 1.00 0.00 H new ATOM 0 HA TYR A 127 107.536 -1.796 -9.795 1.00 0.00 H new ATOM 0 HB2 TYR A 127 105.586 -1.518 -11.179 1.00 0.00 H new ATOM 0 HB3 TYR A 127 106.396 -3.000 -11.650 1.00 0.00 H new ATOM 0 HD1 TYR A 127 105.428 -5.217 -11.035 1.00 0.00 H new ATOM 0 HD2 TYR A 127 103.359 -1.536 -10.252 1.00 0.00 H new ATOM 0 HE1 TYR A 127 103.313 -6.473 -10.725 1.00 0.00 H new ATOM 0 HE2 TYR A 127 101.244 -2.792 -9.942 1.00 0.00 H new ATOM 0 HH TYR A 127 100.239 -4.786 -9.930 1.00 0.00 H new ATOM 1895 N GLU A 128 106.308 -0.728 -7.928 1.00 0.00 N ATOM 1896 CA GLU A 128 105.675 -0.131 -6.754 1.00 0.00 C ATOM 1897 C GLU A 128 105.048 1.217 -7.092 1.00 0.00 C ATOM 1898 O GLU A 128 105.633 2.025 -7.813 1.00 0.00 O ATOM 1899 CB GLU A 128 106.716 0.056 -5.649 1.00 0.00 C ATOM 1900 CG GLU A 128 107.278 -1.310 -5.238 1.00 0.00 C ATOM 1901 CD GLU A 128 108.267 -1.191 -4.073 1.00 0.00 C ATOM 1902 OE1 GLU A 128 108.654 -0.083 -3.728 1.00 0.00 O ATOM 1903 OE2 GLU A 128 108.627 -2.225 -3.535 1.00 0.00 O ATOM 0 H GLU A 128 107.078 -0.183 -8.317 1.00 0.00 H new ATOM 0 HA GLU A 128 104.886 -0.802 -6.414 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.521 0.702 -5.999 1.00 0.00 H new ATOM 0 HB3 GLU A 128 106.264 0.549 -4.788 1.00 0.00 H new ATOM 0 HG2 GLU A 128 106.458 -1.970 -4.953 1.00 0.00 H new ATOM 0 HG3 GLU A 128 107.775 -1.770 -6.092 1.00 0.00 H new ATOM 1910 N GLN A 129 103.851 1.448 -6.561 1.00 0.00 N ATOM 1911 CA GLN A 129 103.172 2.728 -6.730 1.00 0.00 C ATOM 1912 C GLN A 129 102.804 3.284 -5.361 1.00 0.00 C ATOM 1913 O GLN A 129 102.377 2.538 -4.481 1.00 0.00 O ATOM 1914 CB GLN A 129 101.906 2.544 -7.570 1.00 0.00 C ATOM 1915 CG GLN A 129 102.290 2.082 -8.980 1.00 0.00 C ATOM 1916 CD GLN A 129 101.041 1.806 -9.813 1.00 0.00 C ATOM 1917 OE1 GLN A 129 99.947 1.635 -9.273 1.00 0.00 O ATOM 1918 NE2 GLN A 129 101.141 1.753 -11.113 1.00 0.00 N ATOM 0 H GLN A 129 103.331 0.765 -6.010 1.00 0.00 H new ATOM 0 HA GLN A 129 103.836 3.424 -7.243 1.00 0.00 H new ATOM 0 HB2 GLN A 129 101.250 1.810 -7.102 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.352 3.481 -7.621 1.00 0.00 H new ATOM 0 HG2 GLN A 129 102.897 2.846 -9.466 1.00 0.00 H new ATOM 0 HG3 GLN A 129 102.900 1.181 -8.920 1.00 0.00 H new ATOM 0 HE21 GLN A 129 102.046 1.894 -11.561 1.00 0.00 H new ATOM 0 HE22 GLN A 129 100.314 1.570 -11.681 1.00 0.00 H new ATOM 1927 N SER A 130 102.984 4.588 -5.175 1.00 0.00 N ATOM 1928 CA SER A 130 102.700 5.211 -3.885 1.00 0.00 C ATOM 1929 C SER A 130 101.828 6.448 -4.060 1.00 0.00 C ATOM 1930 O SER A 130 101.955 7.177 -5.044 1.00 0.00 O ATOM 1931 CB SER A 130 104.008 5.604 -3.201 1.00 0.00 C ATOM 1932 OG SER A 130 104.815 4.446 -3.039 1.00 0.00 O ATOM 0 H SER A 130 103.322 5.229 -5.893 1.00 0.00 H new ATOM 0 HA SER A 130 102.163 4.490 -3.268 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.535 6.349 -3.797 1.00 0.00 H new ATOM 0 HB3 SER A 130 103.803 6.058 -2.232 1.00 0.00 H new ATOM 0 HG SER A 130 104.924 4.254 -2.084 1.00 0.00 H new ATOM 1938 N ARG A 131 100.958 6.683 -3.084 1.00 0.00 N ATOM 1939 CA ARG A 131 100.104 7.866 -3.084 1.00 0.00 C ATOM 1940 C ARG A 131 100.449 8.742 -1.886 1.00 0.00 C ATOM 1941 O ARG A 131 100.374 8.293 -0.740 1.00 0.00 O ATOM 1942 CB ARG A 131 98.634 7.451 -3.013 1.00 0.00 C ATOM 1943 CG ARG A 131 97.745 8.686 -3.164 1.00 0.00 C ATOM 1944 CD ARG A 131 96.276 8.260 -3.178 1.00 0.00 C ATOM 1945 NE ARG A 131 95.878 7.770 -1.856 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.713 8.568 -0.789 1.00 0.00 C ATOM 1947 NH1 ARG A 131 95.899 9.865 -0.850 1.00 0.00 N ATOM 1948 NH2 ARG A 131 95.357 8.035 0.347 1.00 0.00 N ATOM 0 H ARG A 131 100.825 6.069 -2.281 1.00 0.00 H new ATOM 0 HA ARG A 131 100.269 8.427 -4.004 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.410 6.731 -3.800 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.430 6.958 -2.063 1.00 0.00 H new ATOM 0 HG2 ARG A 131 97.926 9.379 -2.343 1.00 0.00 H new ATOM 0 HG3 ARG A 131 97.990 9.213 -4.086 1.00 0.00 H new ATOM 0 HD2 ARG A 131 95.648 9.103 -3.465 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.123 7.480 -3.924 1.00 0.00 H new ATOM 0 HE ARG A 131 95.718 6.769 -1.740 1.00 0.00 H new ATOM 0 HH11 ARG A 131 96.179 10.299 -1.730 1.00 0.00 H new ATOM 0 HH12 ARG A 131 95.764 10.439 -0.018 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.209 7.028 0.414 1.00 0.00 H new ATOM 0 HH22 ARG A 131 95.227 8.625 1.169 1.00 0.00 H new ATOM 1962 N ILE A 132 100.851 9.979 -2.167 1.00 0.00 N ATOM 1963 CA ILE A 132 101.242 10.914 -1.121 1.00 0.00 C ATOM 1964 C ILE A 132 100.445 12.187 -1.328 1.00 0.00 C ATOM 1965 O ILE A 132 100.860 13.045 -2.107 1.00 0.00 O ATOM 1966 CB ILE A 132 102.740 11.218 -1.208 1.00 0.00 C ATOM 1967 CG1 ILE A 132 103.537 9.914 -1.099 1.00 0.00 C ATOM 1968 CG2 ILE A 132 103.143 12.151 -0.064 1.00 0.00 C ATOM 1969 CD1 ILE A 132 105.018 10.197 -1.354 1.00 0.00 C ATOM 0 H ILE A 132 100.914 10.356 -3.113 1.00 0.00 H new ATOM 0 HA ILE A 132 101.043 10.487 -0.138 1.00 0.00 H new ATOM 0 HB ILE A 132 102.953 11.698 -2.163 1.00 0.00 H new ATOM 0 HG12 ILE A 132 103.405 9.476 -0.109 1.00 0.00 H new ATOM 0 HG13 ILE A 132 103.165 9.187 -1.821 1.00 0.00 H new ATOM 0 HG21 ILE A 132 104.210 12.366 -0.128 1.00 0.00 H new ATOM 0 HG22 ILE A 132 102.580 13.082 -0.138 1.00 0.00 H new ATOM 0 HG23 ILE A 132 102.926 11.671 0.890 1.00 0.00 H new ATOM 0 HD11 ILE A 132 105.584 9.269 -1.276 1.00 0.00 H new ATOM 0 HD12 ILE A 132 105.142 10.615 -2.353 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.385 10.909 -0.615 1.00 0.00 H new ATOM 1981 N ARG A 133 99.314 12.293 -0.623 1.00 0.00 N ATOM 1982 CA ARG A 133 98.241 13.273 -0.886 1.00 0.00 C ATOM 1983 C ARG A 133 98.320 13.947 -2.266 1.00 0.00 C ATOM 1984 O ARG A 133 99.028 14.938 -2.447 1.00 0.00 O ATOM 1985 CB ARG A 133 98.276 14.349 0.206 1.00 0.00 C ATOM 1986 CG ARG A 133 97.076 15.297 0.086 1.00 0.00 C ATOM 1987 CD ARG A 133 95.809 14.610 0.602 1.00 0.00 C ATOM 1988 NE ARG A 133 94.653 15.494 0.434 1.00 0.00 N ATOM 1989 CZ ARG A 133 93.385 15.055 0.399 1.00 0.00 C ATOM 1990 NH1 ARG A 133 93.080 13.784 0.511 1.00 0.00 N ATOM 1991 NH2 ARG A 133 92.422 15.923 0.247 1.00 0.00 N ATOM 0 H ARG A 133 99.108 11.685 0.170 1.00 0.00 H new ATOM 0 HA ARG A 133 97.304 12.716 -0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 133 98.272 13.875 1.188 1.00 0.00 H new ATOM 0 HB3 ARG A 133 99.202 14.918 0.130 1.00 0.00 H new ATOM 0 HG2 ARG A 133 97.263 16.207 0.656 1.00 0.00 H new ATOM 0 HG3 ARG A 133 96.940 15.594 -0.954 1.00 0.00 H new ATOM 0 HD2 ARG A 133 95.645 13.678 0.061 1.00 0.00 H new ATOM 0 HD3 ARG A 133 95.929 14.351 1.654 1.00 0.00 H new ATOM 0 HE ARG A 133 94.820 16.496 0.339 1.00 0.00 H new ATOM 0 HH11 ARG A 133 93.819 13.091 0.629 1.00 0.00 H new ATOM 0 HH12 ARG A 133 92.104 13.489 0.480 1.00 0.00 H new ATOM 0 HH21 ARG A 133 92.639 16.915 0.157 1.00 0.00 H new ATOM 0 HH22 ARG A 133 91.452 15.609 0.218 1.00 0.00 H new ATOM 2005 N SER A 134 97.584 13.391 -3.225 1.00 0.00 N ATOM 2006 CA SER A 134 97.386 14.016 -4.540 1.00 0.00 C ATOM 2007 C SER A 134 98.620 13.934 -5.448 1.00 0.00 C ATOM 2008 O SER A 134 98.526 14.277 -6.627 1.00 0.00 O ATOM 2009 CB SER A 134 96.961 15.482 -4.401 1.00 0.00 C ATOM 2010 OG SER A 134 96.531 15.965 -5.666 1.00 0.00 O ATOM 0 H SER A 134 97.107 12.496 -3.118 1.00 0.00 H new ATOM 0 HA SER A 134 96.590 13.441 -5.014 1.00 0.00 H new ATOM 0 HB2 SER A 134 96.157 15.572 -3.671 1.00 0.00 H new ATOM 0 HB3 SER A 134 97.794 16.081 -4.033 1.00 0.00 H new ATOM 0 HG SER A 134 97.000 15.481 -6.378 1.00 0.00 H new ATOM 2016 N VAL A 135 99.767 13.492 -4.927 1.00 0.00 N ATOM 2017 CA VAL A 135 100.961 13.338 -5.756 1.00 0.00 C ATOM 2018 C VAL A 135 101.191 11.858 -6.046 1.00 0.00 C ATOM 2019 O VAL A 135 101.103 11.025 -5.143 1.00 0.00 O ATOM 2020 CB VAL A 135 102.184 13.924 -5.039 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.410 13.838 -5.952 1.00 0.00 C ATOM 2022 CG2 VAL A 135 101.925 15.392 -4.690 1.00 0.00 C ATOM 0 H VAL A 135 99.893 13.238 -3.947 1.00 0.00 H new ATOM 0 HA VAL A 135 100.815 13.874 -6.694 1.00 0.00 H new ATOM 0 HB VAL A 135 102.365 13.356 -4.127 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.276 14.255 -5.438 1.00 0.00 H new ATOM 0 HG12 VAL A 135 103.605 12.795 -6.203 1.00 0.00 H new ATOM 0 HG13 VAL A 135 103.223 14.402 -6.866 1.00 0.00 H new ATOM 0 HG21 VAL A 135 102.796 15.804 -4.181 1.00 0.00 H new ATOM 0 HG22 VAL A 135 101.738 15.956 -5.604 1.00 0.00 H new ATOM 0 HG23 VAL A 135 101.056 15.463 -4.036 1.00 0.00 H new ATOM 2032 N ASP A 136 101.478 11.534 -7.304 1.00 0.00 N ATOM 2033 CA ASP A 136 101.659 10.141 -7.703 1.00 0.00 C ATOM 2034 C ASP A 136 103.140 9.820 -7.874 1.00 0.00 C ATOM 2035 O ASP A 136 103.832 10.471 -8.655 1.00 0.00 O ATOM 2036 CB ASP A 136 100.922 9.873 -9.018 1.00 0.00 C ATOM 2037 CG ASP A 136 100.997 8.391 -9.382 1.00 0.00 C ATOM 2038 OD1 ASP A 136 101.044 7.574 -8.476 1.00 0.00 O ATOM 2039 OD2 ASP A 136 101.008 8.096 -10.566 1.00 0.00 O ATOM 0 H ASP A 136 101.590 12.211 -8.059 1.00 0.00 H new ATOM 0 HA ASP A 136 101.249 9.503 -6.920 1.00 0.00 H new ATOM 0 HB2 ASP A 136 99.880 10.179 -8.926 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.361 10.472 -9.816 1.00 0.00 H new ATOM 2044 N VAL A 137 103.630 8.815 -7.152 1.00 0.00 N ATOM 2045 CA VAL A 137 105.043 8.448 -7.226 1.00 0.00 C ATOM 2046 C VAL A 137 105.191 7.051 -7.818 1.00 0.00 C ATOM 2047 O VAL A 137 104.494 6.122 -7.412 1.00 0.00 O ATOM 2048 CB VAL A 137 105.674 8.487 -5.827 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.176 8.201 -5.925 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.474 9.872 -5.205 1.00 0.00 C ATOM 0 H VAL A 137 103.075 8.244 -6.514 1.00 0.00 H new ATOM 0 HA VAL A 137 105.556 9.164 -7.868 1.00 0.00 H new ATOM 0 HB VAL A 137 105.195 7.731 -5.205 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.618 8.230 -4.929 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.331 7.214 -6.362 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.650 8.955 -6.554 1.00 0.00 H new ATOM 0 HG21 VAL A 137 105.924 9.893 -4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 137 105.948 10.625 -5.834 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.408 10.084 -5.125 1.00 0.00 H new ATOM 2060 N GLY A 138 106.105 6.911 -8.774 1.00 0.00 N ATOM 2061 CA GLY A 138 106.358 5.618 -9.405 1.00 0.00 C ATOM 2062 C GLY A 138 107.815 5.220 -9.208 1.00 0.00 C ATOM 2063 O GLY A 138 108.713 6.030 -9.428 1.00 0.00 O ATOM 0 H GLY A 138 106.682 7.674 -9.128 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.704 4.860 -8.975 1.00 0.00 H new ATOM 0 HA3 GLY A 138 106.127 5.672 -10.469 1.00 0.00 H new ATOM 2067 N THR A 139 108.048 3.982 -8.781 1.00 0.00 N ATOM 2068 CA THR A 139 109.405 3.525 -8.492 1.00 0.00 C ATOM 2069 C THR A 139 109.730 2.241 -9.249 1.00 0.00 C ATOM 2070 O THR A 139 108.919 1.317 -9.310 1.00 0.00 O ATOM 2071 CB THR A 139 109.554 3.280 -6.989 1.00 0.00 C ATOM 2072 OG1 THR A 139 109.145 4.441 -6.280 1.00 0.00 O ATOM 2073 CG2 THR A 139 111.015 2.970 -6.660 1.00 0.00 C ATOM 0 H THR A 139 107.322 3.282 -8.628 1.00 0.00 H new ATOM 0 HA THR A 139 110.100 4.299 -8.816 1.00 0.00 H new ATOM 0 HB THR A 139 108.932 2.434 -6.696 1.00 0.00 H new ATOM 0 HG1 THR A 139 109.238 4.286 -5.317 1.00 0.00 H new ATOM 0 HG21 THR A 139 111.118 2.796 -5.589 1.00 0.00 H new ATOM 0 HG22 THR A 139 111.329 2.079 -7.204 1.00 0.00 H new ATOM 0 HG23 THR A 139 111.641 3.813 -6.952 1.00 0.00 H new ATOM 2081 N TRP A 140 110.929 2.197 -9.821 1.00 0.00 N ATOM 2082 CA TRP A 140 111.421 0.989 -10.473 1.00 0.00 C ATOM 2083 C TRP A 140 112.506 0.365 -9.603 1.00 0.00 C ATOM 2084 O TRP A 140 113.513 1.007 -9.311 1.00 0.00 O ATOM 2085 CB TRP A 140 112.000 1.345 -11.844 1.00 0.00 C ATOM 2086 CG TRP A 140 112.228 0.162 -12.730 1.00 0.00 C ATOM 2087 CD1 TRP A 140 113.282 -0.683 -12.645 1.00 0.00 C ATOM 2088 CD2 TRP A 140 111.411 -0.313 -13.840 1.00 0.00 C ATOM 2089 NE1 TRP A 140 113.161 -1.648 -13.627 1.00 0.00 N ATOM 2090 CE2 TRP A 140 112.026 -1.463 -14.392 1.00 0.00 C ATOM 2091 CE3 TRP A 140 110.210 0.138 -14.415 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 111.465 -2.141 -15.476 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 109.644 -0.542 -15.504 1.00 0.00 C ATOM 2094 CH2 TRP A 140 110.269 -1.678 -16.034 1.00 0.00 C ATOM 0 H TRP A 140 111.578 2.984 -9.846 1.00 0.00 H new ATOM 0 HA TRP A 140 110.603 0.281 -10.605 1.00 0.00 H new ATOM 0 HB2 TRP A 140 111.323 2.037 -12.345 1.00 0.00 H new ATOM 0 HB3 TRP A 140 112.945 1.869 -11.704 1.00 0.00 H new ATOM 0 HD1 TRP A 140 114.086 -0.614 -11.927 1.00 0.00 H new ATOM 0 HE1 TRP A 140 113.829 -2.405 -13.770 1.00 0.00 H new ATOM 0 HE3 TRP A 140 109.720 1.014 -14.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 111.951 -3.016 -15.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 108.720 -0.187 -15.937 1.00 0.00 H new ATOM 0 HH2 TRP A 140 109.828 -2.196 -16.873 1.00 0.00 H new ATOM 2105 N ILE A 141 112.309 -0.887 -9.196 1.00 0.00 N ATOM 2106 CA ILE A 141 113.224 -1.528 -8.252 1.00 0.00 C ATOM 2107 C ILE A 141 113.724 -2.870 -8.784 1.00 0.00 C ATOM 2108 O ILE A 141 112.958 -3.660 -9.337 1.00 0.00 O ATOM 2109 CB ILE A 141 112.505 -1.716 -6.907 1.00 0.00 C ATOM 2110 CG1 ILE A 141 113.460 -2.327 -5.876 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.293 -2.634 -7.083 1.00 0.00 C ATOM 2112 CD1 ILE A 141 112.848 -2.207 -4.478 1.00 0.00 C ATOM 0 H ILE A 141 111.532 -1.474 -9.501 1.00 0.00 H new ATOM 0 HA ILE A 141 114.096 -0.888 -8.117 1.00 0.00 H new ATOM 0 HB ILE A 141 112.172 -0.740 -6.553 1.00 0.00 H new ATOM 0 HG12 ILE A 141 113.647 -3.374 -6.114 1.00 0.00 H new ATOM 0 HG13 ILE A 141 114.422 -1.816 -5.908 1.00 0.00 H new ATOM 0 HG21 ILE A 141 110.790 -2.761 -6.124 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.601 -2.190 -7.799 1.00 0.00 H new ATOM 0 HG23 ILE A 141 111.623 -3.606 -7.451 1.00 0.00 H new ATOM 0 HD11 ILE A 141 113.527 -2.642 -3.745 1.00 0.00 H new ATOM 0 HD12 ILE A 141 112.684 -1.156 -4.242 1.00 0.00 H new ATOM 0 HD13 ILE A 141 111.897 -2.738 -4.451 1.00 0.00 H new ATOM 2124 N ALA A 142 115.020 -3.111 -8.610 1.00 0.00 N ATOM 2125 CA ALA A 142 115.604 -4.404 -8.955 1.00 0.00 C ATOM 2126 C ALA A 142 116.680 -4.774 -7.938 1.00 0.00 C ATOM 2127 O ALA A 142 117.456 -3.915 -7.517 1.00 0.00 O ATOM 2128 CB ALA A 142 116.217 -4.345 -10.355 1.00 0.00 C ATOM 0 H ALA A 142 115.683 -2.433 -8.234 1.00 0.00 H new ATOM 0 HA ALA A 142 114.820 -5.161 -8.941 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.650 -5.314 -10.604 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.443 -4.097 -11.081 1.00 0.00 H new ATOM 0 HB3 ALA A 142 116.996 -3.582 -10.379 1.00 0.00 H new ATOM 2134 N GLY A 143 116.722 -6.046 -7.542 1.00 0.00 N ATOM 2135 CA GLY A 143 117.702 -6.481 -6.549 1.00 0.00 C ATOM 2136 C GLY A 143 118.193 -7.903 -6.806 1.00 0.00 C ATOM 2137 O GLY A 143 117.632 -8.628 -7.624 1.00 0.00 O ATOM 0 H GLY A 143 116.102 -6.780 -7.886 1.00 0.00 H new ATOM 0 HA2 GLY A 143 118.552 -5.798 -6.557 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.258 -6.426 -5.555 1.00 0.00 H new ATOM 2141 N VAL A 144 119.237 -8.293 -6.076 1.00 0.00 N ATOM 2142 CA VAL A 144 119.816 -9.627 -6.205 1.00 0.00 C ATOM 2143 C VAL A 144 120.127 -10.174 -4.816 1.00 0.00 C ATOM 2144 O VAL A 144 120.479 -9.409 -3.917 1.00 0.00 O ATOM 2145 CB VAL A 144 121.096 -9.576 -7.047 1.00 0.00 C ATOM 2146 CG1 VAL A 144 121.640 -10.994 -7.245 1.00 0.00 C ATOM 2147 CG2 VAL A 144 120.789 -8.962 -8.416 1.00 0.00 C ATOM 0 H VAL A 144 119.700 -7.700 -5.387 1.00 0.00 H new ATOM 0 HA VAL A 144 119.102 -10.281 -6.705 1.00 0.00 H new ATOM 0 HB VAL A 144 121.838 -8.967 -6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 144 122.550 -10.954 -7.844 1.00 0.00 H new ATOM 0 HG12 VAL A 144 121.864 -11.437 -6.274 1.00 0.00 H new ATOM 0 HG13 VAL A 144 120.894 -11.601 -7.758 1.00 0.00 H new ATOM 0 HG21 VAL A 144 121.701 -8.927 -9.012 1.00 0.00 H new ATOM 0 HG22 VAL A 144 120.044 -9.570 -8.929 1.00 0.00 H new ATOM 0 HG23 VAL A 144 120.404 -7.951 -8.283 1.00 0.00 H new ATOM 2157 N GLY A 145 119.968 -11.483 -4.628 1.00 0.00 N ATOM 2158 CA GLY A 145 120.204 -12.080 -3.317 1.00 0.00 C ATOM 2159 C GLY A 145 120.788 -13.484 -3.434 1.00 0.00 C ATOM 2160 O GLY A 145 120.792 -14.077 -4.511 1.00 0.00 O ATOM 0 H GLY A 145 119.682 -12.140 -5.354 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.886 -11.449 -2.747 1.00 0.00 H new ATOM 0 HA3 GLY A 145 119.267 -12.121 -2.761 1.00 0.00 H new ATOM 2164 N TYR A 146 121.261 -14.010 -2.308 1.00 0.00 N ATOM 2165 CA TYR A 146 121.848 -15.346 -2.273 1.00 0.00 C ATOM 2166 C TYR A 146 121.307 -16.136 -1.083 1.00 0.00 C ATOM 2167 O TYR A 146 121.069 -15.573 -0.014 1.00 0.00 O ATOM 2168 CB TYR A 146 123.377 -15.252 -2.203 1.00 0.00 C ATOM 2169 CG TYR A 146 123.908 -14.706 -0.897 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.073 -13.325 -0.732 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.237 -15.581 0.145 1.00 0.00 C ATOM 2172 CE1 TYR A 146 124.569 -12.820 0.476 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.732 -15.074 1.353 1.00 0.00 C ATOM 2174 CZ TYR A 146 124.897 -13.695 1.520 1.00 0.00 C ATOM 2175 OH TYR A 146 125.386 -13.196 2.710 1.00 0.00 O ATOM 0 H TYR A 146 121.249 -13.531 -1.407 1.00 0.00 H new ATOM 0 HA TYR A 146 121.573 -15.871 -3.188 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.798 -16.244 -2.366 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.728 -14.618 -3.018 1.00 0.00 H new ATOM 0 HD1 TYR A 146 123.818 -12.650 -1.536 1.00 0.00 H new ATOM 0 HD2 TYR A 146 124.109 -16.646 0.017 1.00 0.00 H new ATOM 0 HE1 TYR A 146 124.699 -11.755 0.603 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.987 -15.749 2.157 1.00 0.00 H new ATOM 0 HH TYR A 146 125.562 -13.936 3.328 1.00 0.00 H new ATOM 2185 N ARG A 147 121.101 -17.433 -1.288 1.00 0.00 N ATOM 2186 CA ARG A 147 120.547 -18.292 -0.248 1.00 0.00 C ATOM 2187 C ARG A 147 121.640 -19.147 0.386 1.00 0.00 C ATOM 2188 O ARG A 147 122.543 -19.624 -0.301 1.00 0.00 O ATOM 2189 CB ARG A 147 119.475 -19.199 -0.858 1.00 0.00 C ATOM 2190 CG ARG A 147 118.797 -20.023 0.238 1.00 0.00 C ATOM 2191 CD ARG A 147 117.812 -21.003 -0.403 1.00 0.00 C ATOM 2192 NE ARG A 147 116.778 -20.271 -1.141 1.00 0.00 N ATOM 2193 CZ ARG A 147 115.791 -19.583 -0.547 1.00 0.00 C ATOM 2194 NH1 ARG A 147 115.677 -19.508 0.758 1.00 0.00 N ATOM 2195 NH2 ARG A 147 114.915 -18.966 -1.291 1.00 0.00 N ATOM 0 H ARG A 147 121.309 -17.912 -2.164 1.00 0.00 H new ATOM 0 HA ARG A 147 120.106 -17.665 0.527 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.733 -18.596 -1.382 1.00 0.00 H new ATOM 0 HB3 ARG A 147 119.926 -19.862 -1.596 1.00 0.00 H new ATOM 0 HG2 ARG A 147 119.545 -20.567 0.816 1.00 0.00 H new ATOM 0 HG3 ARG A 147 118.274 -19.366 0.932 1.00 0.00 H new ATOM 0 HD2 ARG A 147 118.343 -21.675 -1.077 1.00 0.00 H new ATOM 0 HD3 ARG A 147 117.351 -21.622 0.367 1.00 0.00 H new ATOM 0 HE ARG A 147 116.811 -20.286 -2.160 1.00 0.00 H new ATOM 0 HH11 ARG A 147 116.353 -19.983 1.357 1.00 0.00 H new ATOM 0 HH12 ARG A 147 114.913 -18.975 1.173 1.00 0.00 H new ATOM 0 HH21 ARG A 147 114.987 -19.011 -2.307 1.00 0.00 H new ATOM 0 HH22 ARG A 147 114.158 -18.438 -0.856 1.00 0.00 H new ATOM 2209 N PHE A 148 121.554 -19.338 1.700 1.00 0.00 N ATOM 2210 CA PHE A 148 122.534 -20.151 2.409 1.00 0.00 C ATOM 2211 C PHE A 148 121.879 -20.883 3.576 1.00 0.00 C ATOM 2212 O PHE A 148 120.900 -20.372 4.094 1.00 0.00 O ATOM 2213 CB PHE A 148 123.668 -19.266 2.931 1.00 0.00 C ATOM 2214 CG PHE A 148 124.788 -20.044 3.579 1.00 0.00 C ATOM 2215 CD1 PHE A 148 125.821 -20.570 2.794 1.00 0.00 C ATOM 2216 CD2 PHE A 148 124.795 -20.240 4.966 1.00 0.00 C ATOM 2217 CE1 PHE A 148 126.860 -21.291 3.393 1.00 0.00 C ATOM 2218 CE2 PHE A 148 125.835 -20.961 5.566 1.00 0.00 C ATOM 2219 CZ PHE A 148 126.866 -21.487 4.780 1.00 0.00 C ATOM 2220 OXT PHE A 148 122.365 -21.942 3.934 1.00 0.00 O ATOM 0 H PHE A 148 120.821 -18.944 2.290 1.00 0.00 H new ATOM 0 HA PHE A 148 122.939 -20.887 1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.073 -18.682 2.104 1.00 0.00 H new ATOM 0 HB3 PHE A 148 123.263 -18.558 3.653 1.00 0.00 H new ATOM 0 HD1 PHE A 148 125.816 -20.419 1.725 1.00 0.00 H new ATOM 0 HD2 PHE A 148 123.998 -19.835 5.573 1.00 0.00 H new ATOM 0 HE1 PHE A 148 127.657 -21.696 2.786 1.00 0.00 H new ATOM 0 HE2 PHE A 148 125.841 -21.111 6.636 1.00 0.00 H new ATOM 0 HZ PHE A 148 127.667 -22.044 5.243 1.00 0.00 H new TER 2230 PHE A 148