USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 841 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 107 LYS NZ :NH3+ -139:sc= -0.262 (180deg=0) USER MOD Set 1.2: A 150 LYS NZ :NH3+ 148:sc= -1.14 (180deg=-0.331) USER MOD Set 2.1: A 83 SER OG : rot -172:sc= -3.92! USER MOD Set 2.2: A 116 GLN :FLIP amide:sc= -0.052 F(o=-6.5!,f=-4) USER MOD Set 3.1: A 105 CYS SG : rot -31:sc= -2.98! USER MOD Set 3.2: A 108 THR OG1 : rot -126:sc= 0.0629 USER MOD Set 4.1: A 3 THR OG1 : rot 141:sc= 1.03 USER MOD Set 4.2: A 52 THR OG1 : rot 171:sc= -0.155 USER MOD Set 5.1: A 26 ASN : amide:sc= -2.66! C(o=-11!,f=-25!) USER MOD Set 5.2: A 162 GLN : amide:sc= -8.29! C(o=-11!,f=-13!) USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 5 LYS NZ :NH3+ -171:sc= -0.64 (180deg=-1.1!) USER MOD Single : A 6 CYS SG : rot -51:sc= -1.12 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0722 USER MOD Single : A 18 CYS SG : rot 180:sc= -0.414 USER MOD Single : A 22 SER OG : rot -86:sc= 0.192 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -160:sc= -0.672 USER MOD Single : A 25 THR OG1 : rot 160:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -115:sc= 0.246 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN :FLIP amide:sc= -0.142 F(o=-4.2!,f=-0.14) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl -175:sc= 0 (180deg=-0.0173) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.777 USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 75 THR OG1 : rot 102:sc= -2.27! USER MOD Single : A 81 CYS SG : rot -134:sc= -4.35! USER MOD Single : A 86 SER OG : rot 105:sc= -1.26! USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 152:sc= 0.69 USER MOD Single : A 92 ASN : amide:sc= -1.27 K(o=-1.3,f=-2.7!) USER MOD Single : A 94 LYS NZ :NH3+ -152:sc= -4.6! (180deg=-6.28!) USER MOD Single : A 96 LYS NZ :NH3+ 158:sc= -0.0346 (180deg=-0.46) USER MOD Single : A 102 THR OG1 : rot 71:sc= 0.5 USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.671 K(o=-0.67,f=-2.7!) USER MOD Single : A 115 THR OG1 : rot -123:sc= -4.2! USER MOD Single : A 138 THR OG1 : rot -129:sc= -0.819 USER MOD Single : A 141 THR OG1 : rot -130:sc= -1.5 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ -157:sc= 0.29 (180deg=-1.08!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 CYS SG : rot 28:sc= -13.3! USER MOD Single : A 158 SER OG : rot -140:sc= -1.04 USER MOD Single : A 161 THR OG1 : rot -80:sc= -4.94! USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.213) USER MOD Single : A 167 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLN A 2 122.367 -2.340 13.263 1.00 0.00 N ATOM 21 CA GLN A 2 122.977 -3.581 12.804 1.00 0.00 C ATOM 22 C GLN A 2 123.884 -3.320 11.604 1.00 0.00 C ATOM 23 O GLN A 2 125.110 -3.311 11.725 1.00 0.00 O ATOM 24 CB GLN A 2 121.879 -4.575 12.416 1.00 0.00 C ATOM 25 CG GLN A 2 121.091 -4.980 13.665 1.00 0.00 C ATOM 26 CD GLN A 2 119.976 -5.949 13.286 1.00 0.00 C ATOM 27 OE1 GLN A 2 119.379 -5.821 12.217 1.00 0.00 O ATOM 28 NE2 GLN A 2 119.665 -6.921 14.099 1.00 0.00 N ATOM 0 HA GLN A 2 123.580 -3.997 13.611 1.00 0.00 H new ATOM 0 HB2 GLN A 2 121.211 -4.126 11.681 1.00 0.00 H new ATOM 0 HB3 GLN A 2 122.320 -5.456 11.950 1.00 0.00 H new ATOM 0 HG2 GLN A 2 121.758 -5.446 14.391 1.00 0.00 H new ATOM 0 HG3 GLN A 2 120.669 -4.095 14.142 1.00 0.00 H new ATOM 0 HE21 GLN A 2 120.162 -7.024 14.984 1.00 0.00 H new ATOM 0 HE22 GLN A 2 118.925 -7.578 13.850 1.00 0.00 H new ATOM 35 N THR A 3 123.267 -3.101 10.451 1.00 0.00 N ATOM 36 CA THR A 3 124.012 -2.830 9.230 1.00 0.00 C ATOM 37 C THR A 3 124.592 -1.422 9.276 1.00 0.00 C ATOM 38 O THR A 3 123.908 -0.471 9.655 1.00 0.00 O ATOM 39 CB THR A 3 123.096 -2.972 8.014 1.00 0.00 C ATOM 40 OG1 THR A 3 123.347 -1.908 7.107 1.00 0.00 O ATOM 41 CG2 THR A 3 121.634 -2.927 8.463 1.00 0.00 C ATOM 0 H THR A 3 122.254 -3.106 10.336 1.00 0.00 H new ATOM 0 HA THR A 3 124.826 -3.550 9.148 1.00 0.00 H new ATOM 0 HB THR A 3 123.292 -3.925 7.522 1.00 0.00 H new ATOM 0 HG1 THR A 3 123.313 -2.247 6.188 1.00 0.00 H new ATOM 0 HG21 THR A 3 120.983 -3.028 7.594 1.00 0.00 H new ATOM 0 HG22 THR A 3 121.442 -3.744 9.158 1.00 0.00 H new ATOM 0 HG23 THR A 3 121.434 -1.976 8.957 1.00 0.00 H new ATOM 46 N ILE A 4 125.859 -1.294 8.897 1.00 0.00 N ATOM 47 CA ILE A 4 126.515 0.006 8.913 1.00 0.00 C ATOM 48 C ILE A 4 127.128 0.314 7.553 1.00 0.00 C ATOM 49 O ILE A 4 127.484 -0.593 6.801 1.00 0.00 O ATOM 50 CB ILE A 4 127.595 0.019 9.994 1.00 0.00 C ATOM 51 CG1 ILE A 4 127.991 1.465 10.309 1.00 0.00 C ATOM 52 CG2 ILE A 4 128.822 -0.746 9.494 1.00 0.00 C ATOM 53 CD1 ILE A 4 126.806 2.203 10.939 1.00 0.00 C ATOM 0 H ILE A 4 126.446 -2.065 8.579 1.00 0.00 H new ATOM 0 HA ILE A 4 125.774 0.774 9.134 1.00 0.00 H new ATOM 0 HB ILE A 4 127.210 -0.455 10.897 1.00 0.00 H new ATOM 0 HG12 ILE A 4 128.843 1.478 10.989 1.00 0.00 H new ATOM 0 HG13 ILE A 4 128.304 1.973 9.397 1.00 0.00 H new ATOM 0 HG21 ILE A 4 129.594 -0.738 10.263 1.00 0.00 H new ATOM 0 HG22 ILE A 4 128.543 -1.776 9.271 1.00 0.00 H new ATOM 0 HG23 ILE A 4 129.205 -0.270 8.591 1.00 0.00 H new ATOM 0 HD11 ILE A 4 127.094 3.231 11.161 1.00 0.00 H new ATOM 0 HD12 ILE A 4 125.966 2.203 10.244 1.00 0.00 H new ATOM 0 HD13 ILE A 4 126.513 1.701 11.861 1.00 0.00 H new ATOM 57 N LYS A 5 127.237 1.601 7.238 1.00 0.00 N ATOM 58 CA LYS A 5 127.794 2.015 5.956 1.00 0.00 C ATOM 59 C LYS A 5 129.219 2.535 6.112 1.00 0.00 C ATOM 60 O LYS A 5 129.581 3.105 7.142 1.00 0.00 O ATOM 61 CB LYS A 5 126.919 3.109 5.341 1.00 0.00 C ATOM 62 CG LYS A 5 125.524 2.544 5.056 1.00 0.00 C ATOM 63 CD LYS A 5 124.684 3.596 4.328 1.00 0.00 C ATOM 64 CE LYS A 5 123.251 3.085 4.175 1.00 0.00 C ATOM 65 NZ LYS A 5 123.247 1.596 4.230 1.00 0.00 N ATOM 0 H LYS A 5 126.950 2.368 7.846 1.00 0.00 H new ATOM 0 HA LYS A 5 127.816 1.144 5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 5 126.848 3.958 6.021 1.00 0.00 H new ATOM 0 HB3 LYS A 5 127.370 3.476 4.419 1.00 0.00 H new ATOM 0 HG2 LYS A 5 125.603 1.642 4.448 1.00 0.00 H new ATOM 0 HG3 LYS A 5 125.039 2.258 5.989 1.00 0.00 H new ATOM 0 HD2 LYS A 5 124.690 4.532 4.886 1.00 0.00 H new ATOM 0 HD3 LYS A 5 125.113 3.806 3.348 1.00 0.00 H new ATOM 0 HE2 LYS A 5 122.622 3.491 4.968 1.00 0.00 H new ATOM 0 HE3 LYS A 5 122.831 3.426 3.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 122.303 1.242 3.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 123.949 1.222 3.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 123.486 1.284 5.193 1.00 0.00 H new ATOM 79 N CYS A 6 130.018 2.336 5.069 1.00 0.00 N ATOM 80 CA CYS A 6 131.402 2.789 5.070 1.00 0.00 C ATOM 81 C CYS A 6 131.663 3.658 3.844 1.00 0.00 C ATOM 82 O CYS A 6 131.371 3.257 2.717 1.00 0.00 O ATOM 83 CB CYS A 6 132.346 1.585 5.056 1.00 0.00 C ATOM 84 SG CYS A 6 133.644 1.851 3.822 1.00 0.00 S ATOM 0 H CYS A 6 129.730 1.864 4.212 1.00 0.00 H new ATOM 0 HA CYS A 6 131.582 3.374 5.972 1.00 0.00 H new ATOM 0 HB2 CYS A 6 132.790 1.446 6.042 1.00 0.00 H new ATOM 0 HB3 CYS A 6 131.790 0.676 4.825 1.00 0.00 H new ATOM 0 HG CYS A 6 133.103 2.180 2.687 1.00 0.00 H new ATOM 90 N VAL A 7 132.211 4.848 4.064 1.00 0.00 N ATOM 91 CA VAL A 7 132.498 5.755 2.959 1.00 0.00 C ATOM 92 C VAL A 7 133.966 5.668 2.567 1.00 0.00 C ATOM 93 O VAL A 7 134.841 5.572 3.426 1.00 0.00 O ATOM 94 CB VAL A 7 132.158 7.194 3.350 1.00 0.00 C ATOM 95 CG1 VAL A 7 132.527 8.132 2.200 1.00 0.00 C ATOM 96 CG2 VAL A 7 130.658 7.304 3.629 1.00 0.00 C ATOM 0 H VAL A 7 132.463 5.204 4.986 1.00 0.00 H new ATOM 0 HA VAL A 7 131.884 5.460 2.108 1.00 0.00 H new ATOM 0 HB VAL A 7 132.718 7.471 4.243 1.00 0.00 H new ATOM 0 HG11 VAL A 7 132.286 9.158 2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 7 133.594 8.053 1.994 1.00 0.00 H new ATOM 0 HG13 VAL A 7 131.964 7.854 1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 7 130.414 8.329 3.908 1.00 0.00 H new ATOM 0 HG22 VAL A 7 130.100 7.029 2.734 1.00 0.00 H new ATOM 0 HG23 VAL A 7 130.389 6.632 4.444 1.00 0.00 H new ATOM 100 N VAL A 8 134.235 5.692 1.263 1.00 0.00 N ATOM 101 CA VAL A 8 135.604 5.604 0.783 1.00 0.00 C ATOM 102 C VAL A 8 136.181 6.990 0.518 1.00 0.00 C ATOM 103 O VAL A 8 135.512 7.853 -0.054 1.00 0.00 O ATOM 104 CB VAL A 8 135.633 4.792 -0.501 1.00 0.00 C ATOM 105 CG1 VAL A 8 137.061 4.743 -1.044 1.00 0.00 C ATOM 106 CG2 VAL A 8 135.146 3.369 -0.214 1.00 0.00 C ATOM 0 H VAL A 8 133.529 5.771 0.531 1.00 0.00 H new ATOM 0 HA VAL A 8 136.210 5.120 1.549 1.00 0.00 H new ATOM 0 HB VAL A 8 134.981 5.258 -1.240 1.00 0.00 H new ATOM 0 HG11 VAL A 8 137.080 4.160 -1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 8 137.408 5.756 -1.248 1.00 0.00 H new ATOM 0 HG13 VAL A 8 137.715 4.278 -0.306 1.00 0.00 H new ATOM 0 HG21 VAL A 8 135.166 2.785 -1.134 1.00 0.00 H new ATOM 0 HG22 VAL A 8 135.798 2.904 0.525 1.00 0.00 H new ATOM 0 HG23 VAL A 8 134.127 3.404 0.171 1.00 0.00 H new ATOM 110 N VAL A 9 137.423 7.198 0.939 1.00 0.00 N ATOM 111 CA VAL A 9 138.079 8.484 0.743 1.00 0.00 C ATOM 112 C VAL A 9 139.340 8.325 -0.102 1.00 0.00 C ATOM 113 O VAL A 9 140.118 7.388 0.091 1.00 0.00 O ATOM 114 CB VAL A 9 138.443 9.092 2.098 1.00 0.00 C ATOM 115 CG1 VAL A 9 138.964 10.518 1.900 1.00 0.00 C ATOM 116 CG2 VAL A 9 137.201 9.123 2.992 1.00 0.00 C ATOM 0 H VAL A 9 137.992 6.498 1.415 1.00 0.00 H new ATOM 0 HA VAL A 9 137.390 9.146 0.219 1.00 0.00 H new ATOM 0 HB VAL A 9 139.218 8.487 2.569 1.00 0.00 H new ATOM 0 HG11 VAL A 9 139.223 10.949 2.867 1.00 0.00 H new ATOM 0 HG12 VAL A 9 139.849 10.497 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 9 138.192 11.125 1.427 1.00 0.00 H new ATOM 0 HG21 VAL A 9 137.459 9.556 3.958 1.00 0.00 H new ATOM 0 HG22 VAL A 9 136.427 9.727 2.519 1.00 0.00 H new ATOM 0 HG23 VAL A 9 136.831 8.108 3.137 1.00 0.00 H new ATOM 120 N GLY A 10 139.536 9.252 -1.036 1.00 0.00 N ATOM 121 CA GLY A 10 140.707 9.219 -1.905 1.00 0.00 C ATOM 122 C GLY A 10 140.509 8.257 -3.070 1.00 0.00 C ATOM 123 O GLY A 10 140.177 8.676 -4.179 1.00 0.00 O ATOM 0 H GLY A 10 138.902 10.032 -1.209 1.00 0.00 H new ATOM 0 HA2 GLY A 10 140.906 10.220 -2.288 1.00 0.00 H new ATOM 0 HA3 GLY A 10 141.582 8.919 -1.328 1.00 0.00 H new ATOM 127 N ASP A 11 140.723 6.971 -2.812 1.00 0.00 N ATOM 128 CA ASP A 11 140.574 5.954 -3.848 1.00 0.00 C ATOM 129 C ASP A 11 141.594 6.168 -4.961 1.00 0.00 C ATOM 130 O ASP A 11 142.329 5.249 -5.326 1.00 0.00 O ATOM 131 CB ASP A 11 139.161 5.998 -4.435 1.00 0.00 C ATOM 132 CG ASP A 11 138.928 4.779 -5.321 1.00 0.00 C ATOM 133 OD1 ASP A 11 139.807 3.934 -5.378 1.00 0.00 O ATOM 134 OD2 ASP A 11 137.874 4.709 -5.931 1.00 0.00 O ATOM 0 H ASP A 11 140.999 6.609 -1.899 1.00 0.00 H new ATOM 0 HA ASP A 11 140.745 4.978 -3.393 1.00 0.00 H new ATOM 0 HB2 ASP A 11 138.425 6.020 -3.632 1.00 0.00 H new ATOM 0 HB3 ASP A 11 139.027 6.911 -5.015 1.00 0.00 H new ATOM 139 N GLY A 12 141.634 7.382 -5.498 1.00 0.00 N ATOM 140 CA GLY A 12 142.568 7.699 -6.572 1.00 0.00 C ATOM 141 C GLY A 12 141.913 7.497 -7.935 1.00 0.00 C ATOM 142 O GLY A 12 142.479 7.866 -8.964 1.00 0.00 O ATOM 0 H GLY A 12 141.036 8.157 -5.211 1.00 0.00 H new ATOM 0 HA2 GLY A 12 142.905 8.731 -6.475 1.00 0.00 H new ATOM 0 HA3 GLY A 12 143.452 7.066 -6.490 1.00 0.00 H new ATOM 146 N ALA A 13 140.722 6.899 -7.923 1.00 0.00 N ATOM 147 CA ALA A 13 139.978 6.631 -9.154 1.00 0.00 C ATOM 148 C ALA A 13 140.325 5.252 -9.704 1.00 0.00 C ATOM 149 O ALA A 13 139.741 4.802 -10.690 1.00 0.00 O ATOM 150 CB ALA A 13 140.282 7.696 -10.211 1.00 0.00 C ATOM 0 H ALA A 13 140.251 6.590 -7.073 1.00 0.00 H new ATOM 0 HA ALA A 13 138.915 6.660 -8.915 1.00 0.00 H new ATOM 0 HB1 ALA A 13 139.719 7.479 -11.119 1.00 0.00 H new ATOM 0 HB2 ALA A 13 139.995 8.677 -9.832 1.00 0.00 H new ATOM 0 HB3 ALA A 13 141.349 7.692 -10.436 1.00 0.00 H new ATOM 156 N VAL A 14 141.277 4.583 -9.061 1.00 0.00 N ATOM 157 CA VAL A 14 141.689 3.253 -9.497 1.00 0.00 C ATOM 158 C VAL A 14 141.684 2.273 -8.327 1.00 0.00 C ATOM 159 O VAL A 14 141.980 2.648 -7.191 1.00 0.00 O ATOM 160 CB VAL A 14 143.091 3.319 -10.107 1.00 0.00 C ATOM 161 CG1 VAL A 14 143.072 4.240 -11.326 1.00 0.00 C ATOM 162 CG2 VAL A 14 144.075 3.872 -9.070 1.00 0.00 C ATOM 0 H VAL A 14 141.774 4.936 -8.243 1.00 0.00 H new ATOM 0 HA VAL A 14 140.980 2.902 -10.247 1.00 0.00 H new ATOM 0 HB VAL A 14 143.402 2.319 -10.408 1.00 0.00 H new ATOM 0 HG11 VAL A 14 144.070 4.288 -11.761 1.00 0.00 H new ATOM 0 HG12 VAL A 14 142.372 3.851 -12.065 1.00 0.00 H new ATOM 0 HG13 VAL A 14 142.760 5.239 -11.022 1.00 0.00 H new ATOM 0 HG21 VAL A 14 145.073 3.919 -9.505 1.00 0.00 H new ATOM 0 HG22 VAL A 14 143.763 4.872 -8.769 1.00 0.00 H new ATOM 0 HG23 VAL A 14 144.089 3.219 -8.198 1.00 0.00 H new ATOM 166 N GLY A 15 141.347 1.017 -8.612 1.00 0.00 N ATOM 167 CA GLY A 15 141.309 -0.004 -7.574 1.00 0.00 C ATOM 168 C GLY A 15 139.933 -0.663 -7.453 1.00 0.00 C ATOM 169 O GLY A 15 139.820 -1.889 -7.487 1.00 0.00 O ATOM 0 H GLY A 15 141.099 0.686 -9.544 1.00 0.00 H new ATOM 0 HA2 GLY A 15 142.056 -0.767 -7.791 1.00 0.00 H new ATOM 0 HA3 GLY A 15 141.580 0.444 -6.618 1.00 0.00 H new ATOM 173 N LYS A 16 138.900 0.157 -7.287 1.00 0.00 N ATOM 174 CA LYS A 16 137.531 -0.341 -7.133 1.00 0.00 C ATOM 175 C LYS A 16 137.214 -1.490 -8.092 1.00 0.00 C ATOM 176 O LYS A 16 136.165 -2.123 -7.978 1.00 0.00 O ATOM 177 CB LYS A 16 136.544 0.796 -7.399 1.00 0.00 C ATOM 178 CG LYS A 16 136.890 1.461 -8.733 1.00 0.00 C ATOM 179 CD LYS A 16 135.610 1.696 -9.538 1.00 0.00 C ATOM 180 CE LYS A 16 135.966 2.282 -10.906 1.00 0.00 C ATOM 181 NZ LYS A 16 135.594 1.312 -11.975 1.00 0.00 N ATOM 0 H LYS A 16 138.982 1.173 -7.255 1.00 0.00 H new ATOM 0 HA LYS A 16 137.439 -0.715 -6.113 1.00 0.00 H new ATOM 0 HB2 LYS A 16 135.525 0.410 -7.425 1.00 0.00 H new ATOM 0 HB3 LYS A 16 136.588 1.528 -6.592 1.00 0.00 H new ATOM 0 HG2 LYS A 16 137.400 2.408 -8.557 1.00 0.00 H new ATOM 0 HG3 LYS A 16 137.576 0.830 -9.298 1.00 0.00 H new ATOM 0 HD2 LYS A 16 135.069 0.758 -9.662 1.00 0.00 H new ATOM 0 HD3 LYS A 16 134.950 2.376 -9.000 1.00 0.00 H new ATOM 0 HE2 LYS A 16 135.441 3.225 -11.057 1.00 0.00 H new ATOM 0 HE3 LYS A 16 137.033 2.500 -10.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 135.836 1.710 -12.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 136.114 0.423 -11.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 134.572 1.125 -11.934 1.00 0.00 H new ATOM 195 N THR A 17 138.097 -1.735 -9.050 1.00 0.00 N ATOM 196 CA THR A 17 137.863 -2.789 -10.034 1.00 0.00 C ATOM 197 C THR A 17 137.766 -4.182 -9.403 1.00 0.00 C ATOM 198 O THR A 17 136.903 -4.971 -9.784 1.00 0.00 O ATOM 199 CB THR A 17 138.990 -2.782 -11.070 1.00 0.00 C ATOM 200 OG1 THR A 17 140.214 -3.128 -10.436 1.00 0.00 O ATOM 201 CG2 THR A 17 139.108 -1.388 -11.687 1.00 0.00 C ATOM 0 H THR A 17 138.973 -1.226 -9.169 1.00 0.00 H new ATOM 0 HA THR A 17 136.903 -2.578 -10.505 1.00 0.00 H new ATOM 0 HB THR A 17 138.769 -3.506 -11.855 1.00 0.00 H new ATOM 0 HG1 THR A 17 140.937 -3.126 -11.097 1.00 0.00 H new ATOM 0 HG21 THR A 17 139.911 -1.383 -12.425 1.00 0.00 H new ATOM 0 HG22 THR A 17 138.168 -1.124 -12.172 1.00 0.00 H new ATOM 0 HG23 THR A 17 139.330 -0.662 -10.905 1.00 0.00 H new ATOM 206 N CYS A 18 138.655 -4.498 -8.466 1.00 0.00 N ATOM 207 CA CYS A 18 138.637 -5.825 -7.844 1.00 0.00 C ATOM 208 C CYS A 18 138.595 -5.752 -6.320 1.00 0.00 C ATOM 209 O CYS A 18 138.553 -6.781 -5.643 1.00 0.00 O ATOM 210 CB CYS A 18 139.875 -6.605 -8.278 1.00 0.00 C ATOM 211 SG CYS A 18 139.606 -7.300 -9.927 1.00 0.00 S ATOM 0 H CYS A 18 139.383 -3.871 -8.124 1.00 0.00 H new ATOM 0 HA CYS A 18 137.729 -6.329 -8.175 1.00 0.00 H new ATOM 0 HB2 CYS A 18 140.746 -5.950 -8.286 1.00 0.00 H new ATOM 0 HB3 CYS A 18 140.083 -7.403 -7.565 1.00 0.00 H new ATOM 0 HG CYS A 18 140.662 -7.962 -10.296 1.00 0.00 H new ATOM 217 N LEU A 19 138.570 -4.550 -5.777 1.00 0.00 N ATOM 218 CA LEU A 19 138.504 -4.394 -4.328 1.00 0.00 C ATOM 219 C LEU A 19 137.054 -4.253 -3.881 1.00 0.00 C ATOM 220 O LEU A 19 136.593 -4.975 -2.997 1.00 0.00 O ATOM 221 CB LEU A 19 139.326 -3.169 -3.893 1.00 0.00 C ATOM 222 CG LEU A 19 138.644 -2.425 -2.733 1.00 0.00 C ATOM 223 CD1 LEU A 19 138.346 -3.388 -1.577 1.00 0.00 C ATOM 224 CD2 LEU A 19 139.579 -1.324 -2.229 1.00 0.00 C ATOM 0 H LEU A 19 138.594 -3.677 -6.303 1.00 0.00 H new ATOM 0 HA LEU A 19 138.926 -5.281 -3.855 1.00 0.00 H new ATOM 0 HB2 LEU A 19 140.323 -3.486 -3.589 1.00 0.00 H new ATOM 0 HB3 LEU A 19 139.451 -2.493 -4.739 1.00 0.00 H new ATOM 0 HG LEU A 19 137.707 -1.998 -3.091 1.00 0.00 H new ATOM 0 HD11 LEU A 19 137.863 -2.844 -0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 19 137.685 -4.181 -1.926 1.00 0.00 H new ATOM 0 HD13 LEU A 19 139.278 -3.824 -1.218 1.00 0.00 H new ATOM 0 HD21 LEU A 19 139.103 -0.791 -1.406 1.00 0.00 H new ATOM 0 HD22 LEU A 19 140.512 -1.769 -1.882 1.00 0.00 H new ATOM 0 HD23 LEU A 19 139.790 -0.626 -3.039 1.00 0.00 H new ATOM 230 N LEU A 20 136.339 -3.323 -4.504 1.00 0.00 N ATOM 231 CA LEU A 20 134.944 -3.099 -4.167 1.00 0.00 C ATOM 232 C LEU A 20 134.178 -4.412 -4.218 1.00 0.00 C ATOM 233 O LEU A 20 133.284 -4.658 -3.408 1.00 0.00 O ATOM 234 CB LEU A 20 134.336 -2.107 -5.162 1.00 0.00 C ATOM 235 CG LEU A 20 132.904 -1.775 -4.747 1.00 0.00 C ATOM 236 CD1 LEU A 20 132.924 -1.068 -3.394 1.00 0.00 C ATOM 237 CD2 LEU A 20 132.276 -0.855 -5.794 1.00 0.00 C ATOM 0 H LEU A 20 136.702 -2.717 -5.240 1.00 0.00 H new ATOM 0 HA LEU A 20 134.878 -2.692 -3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 20 134.935 -1.197 -5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 20 134.345 -2.532 -6.166 1.00 0.00 H new ATOM 0 HG LEU A 20 132.320 -2.692 -4.671 1.00 0.00 H new ATOM 0 HD11 LEU A 20 131.904 -0.829 -3.093 1.00 0.00 H new ATOM 0 HD12 LEU A 20 133.378 -1.721 -2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 20 133.504 -0.149 -3.472 1.00 0.00 H new ATOM 0 HD21 LEU A 20 131.254 -0.616 -5.502 1.00 0.00 H new ATOM 0 HD22 LEU A 20 132.857 0.064 -5.866 1.00 0.00 H new ATOM 0 HD23 LEU A 20 132.269 -1.357 -6.762 1.00 0.00 H new ATOM 243 N ILE A 21 134.535 -5.248 -5.183 1.00 0.00 N ATOM 244 CA ILE A 21 133.883 -6.539 -5.351 1.00 0.00 C ATOM 245 C ILE A 21 134.628 -7.633 -4.580 1.00 0.00 C ATOM 246 O ILE A 21 134.292 -8.812 -4.688 1.00 0.00 O ATOM 247 CB ILE A 21 133.851 -6.892 -6.844 1.00 0.00 C ATOM 248 CG1 ILE A 21 132.633 -7.764 -7.162 1.00 0.00 C ATOM 249 CG2 ILE A 21 135.123 -7.657 -7.211 1.00 0.00 C ATOM 250 CD1 ILE A 21 132.476 -7.881 -8.680 1.00 0.00 C ATOM 0 H ILE A 21 135.272 -5.055 -5.861 1.00 0.00 H new ATOM 0 HA ILE A 21 132.869 -6.475 -4.958 1.00 0.00 H new ATOM 0 HB ILE A 21 133.788 -5.969 -7.421 1.00 0.00 H new ATOM 0 HG12 ILE A 21 132.754 -8.753 -6.720 1.00 0.00 H new ATOM 0 HG13 ILE A 21 131.735 -7.328 -6.725 1.00 0.00 H new ATOM 0 HG21 ILE A 21 135.103 -7.909 -8.271 1.00 0.00 H new ATOM 0 HG22 ILE A 21 135.994 -7.036 -7.002 1.00 0.00 H new ATOM 0 HG23 ILE A 21 135.180 -8.572 -6.622 1.00 0.00 H new ATOM 0 HD11 ILE A 21 131.610 -8.501 -8.909 1.00 0.00 H new ATOM 0 HD12 ILE A 21 132.336 -6.889 -9.109 1.00 0.00 H new ATOM 0 HD13 ILE A 21 133.371 -8.336 -9.104 1.00 0.00 H new ATOM 254 N SER A 22 135.665 -7.242 -3.837 1.00 0.00 N ATOM 255 CA SER A 22 136.472 -8.213 -3.096 1.00 0.00 C ATOM 256 C SER A 22 135.618 -9.333 -2.484 1.00 0.00 C ATOM 257 O SER A 22 135.545 -10.415 -3.064 1.00 0.00 O ATOM 258 CB SER A 22 137.235 -7.484 -1.998 1.00 0.00 C ATOM 259 OG SER A 22 136.313 -6.801 -1.160 1.00 0.00 O ATOM 0 H SER A 22 135.963 -6.272 -3.733 1.00 0.00 H new ATOM 0 HA SER A 22 137.163 -8.683 -3.795 1.00 0.00 H new ATOM 0 HB2 SER A 22 137.819 -8.194 -1.413 1.00 0.00 H new ATOM 0 HB3 SER A 22 137.939 -6.777 -2.436 1.00 0.00 H new ATOM 0 HG SER A 22 136.112 -5.922 -1.543 1.00 0.00 H new ATOM 265 N TYR A 23 134.963 -9.114 -1.327 1.00 0.00 N ATOM 266 CA TYR A 23 134.151 -10.184 -0.750 1.00 0.00 C ATOM 267 C TYR A 23 132.877 -10.406 -1.557 1.00 0.00 C ATOM 268 O TYR A 23 132.335 -11.510 -1.589 1.00 0.00 O ATOM 269 CB TYR A 23 133.784 -9.853 0.695 1.00 0.00 C ATOM 270 CG TYR A 23 132.851 -10.918 1.224 1.00 0.00 C ATOM 271 CD1 TYR A 23 133.294 -12.240 1.349 1.00 0.00 C ATOM 272 CD2 TYR A 23 131.539 -10.584 1.579 1.00 0.00 C ATOM 273 CE1 TYR A 23 132.425 -13.227 1.829 1.00 0.00 C ATOM 274 CE2 TYR A 23 130.670 -11.571 2.058 1.00 0.00 C ATOM 275 CZ TYR A 23 131.114 -12.893 2.184 1.00 0.00 C ATOM 276 OH TYR A 23 130.258 -13.868 2.656 1.00 0.00 O ATOM 0 H TYR A 23 134.981 -8.242 -0.798 1.00 0.00 H new ATOM 0 HA TYR A 23 134.744 -11.098 -0.775 1.00 0.00 H new ATOM 0 HB2 TYR A 23 134.683 -9.802 1.309 1.00 0.00 H new ATOM 0 HB3 TYR A 23 133.306 -8.875 0.747 1.00 0.00 H new ATOM 0 HD1 TYR A 23 134.306 -12.498 1.075 1.00 0.00 H new ATOM 0 HD2 TYR A 23 131.197 -9.564 1.483 1.00 0.00 H new ATOM 0 HE1 TYR A 23 132.767 -14.247 1.925 1.00 0.00 H new ATOM 0 HE2 TYR A 23 129.657 -11.313 2.330 1.00 0.00 H new ATOM 0 HH TYR A 23 129.386 -13.468 2.857 1.00 0.00 H new ATOM 286 N THR A 24 132.393 -9.346 -2.188 1.00 0.00 N ATOM 287 CA THR A 24 131.169 -9.431 -2.971 1.00 0.00 C ATOM 288 C THR A 24 131.135 -10.717 -3.791 1.00 0.00 C ATOM 289 O THR A 24 130.129 -11.427 -3.806 1.00 0.00 O ATOM 290 CB THR A 24 131.084 -8.237 -3.916 1.00 0.00 C ATOM 291 OG1 THR A 24 131.507 -7.062 -3.235 1.00 0.00 O ATOM 292 CG2 THR A 24 129.643 -8.064 -4.397 1.00 0.00 C ATOM 0 H THR A 24 132.826 -8.423 -2.174 1.00 0.00 H new ATOM 0 HA THR A 24 130.323 -9.429 -2.284 1.00 0.00 H new ATOM 0 HB THR A 24 131.731 -8.409 -4.776 1.00 0.00 H new ATOM 0 HG1 THR A 24 131.166 -6.272 -3.703 1.00 0.00 H new ATOM 0 HG21 THR A 24 129.585 -7.210 -5.072 1.00 0.00 H new ATOM 0 HG22 THR A 24 129.324 -8.964 -4.922 1.00 0.00 H new ATOM 0 HG23 THR A 24 128.991 -7.894 -3.540 1.00 0.00 H new ATOM 297 N THR A 25 132.237 -11.012 -4.474 1.00 0.00 N ATOM 298 CA THR A 25 132.311 -12.217 -5.291 1.00 0.00 C ATOM 299 C THR A 25 133.432 -13.135 -4.807 1.00 0.00 C ATOM 300 O THR A 25 133.548 -14.277 -5.254 1.00 0.00 O ATOM 301 CB THR A 25 132.547 -11.836 -6.754 1.00 0.00 C ATOM 302 OG1 THR A 25 131.505 -10.972 -7.188 1.00 0.00 O ATOM 303 CG2 THR A 25 132.557 -13.099 -7.615 1.00 0.00 C ATOM 0 H THR A 25 133.082 -10.440 -4.478 1.00 0.00 H new ATOM 0 HA THR A 25 131.366 -12.753 -5.202 1.00 0.00 H new ATOM 0 HB THR A 25 133.506 -11.327 -6.849 1.00 0.00 H new ATOM 0 HG1 THR A 25 131.799 -10.477 -7.981 1.00 0.00 H new ATOM 0 HG21 THR A 25 132.725 -12.828 -8.657 1.00 0.00 H new ATOM 0 HG22 THR A 25 133.355 -13.762 -7.279 1.00 0.00 H new ATOM 0 HG23 THR A 25 131.598 -13.610 -7.523 1.00 0.00 H new ATOM 308 N ASN A 26 134.246 -12.632 -3.887 1.00 0.00 N ATOM 309 CA ASN A 26 135.349 -13.417 -3.339 1.00 0.00 C ATOM 310 C ASN A 26 136.269 -13.930 -4.446 1.00 0.00 C ATOM 311 O ASN A 26 136.018 -14.981 -5.036 1.00 0.00 O ATOM 312 CB ASN A 26 134.799 -14.603 -2.544 1.00 0.00 C ATOM 313 CG ASN A 26 135.895 -15.191 -1.661 1.00 0.00 C ATOM 314 OD1 ASN A 26 137.041 -14.744 -1.710 1.00 0.00 O ATOM 315 ND2 ASN A 26 135.609 -16.173 -0.850 1.00 0.00 N ATOM 0 H ASN A 26 134.165 -11.690 -3.505 1.00 0.00 H new ATOM 0 HA ASN A 26 135.929 -12.768 -2.683 1.00 0.00 H new ATOM 0 HB2 ASN A 26 133.959 -14.281 -1.929 1.00 0.00 H new ATOM 0 HB3 ASN A 26 134.422 -15.365 -3.226 1.00 0.00 H new ATOM 0 HD21 ASN A 26 136.336 -16.571 -0.255 1.00 0.00 H new ATOM 0 HD22 ASN A 26 134.659 -16.542 -0.811 1.00 0.00 H new ATOM 320 N LYS A 27 137.339 -13.184 -4.709 1.00 0.00 N ATOM 321 CA LYS A 27 138.306 -13.570 -5.735 1.00 0.00 C ATOM 322 C LYS A 27 137.648 -13.677 -7.107 1.00 0.00 C ATOM 323 O LYS A 27 137.218 -14.755 -7.517 1.00 0.00 O ATOM 324 CB LYS A 27 138.952 -14.910 -5.369 1.00 0.00 C ATOM 325 CG LYS A 27 139.704 -14.766 -4.046 1.00 0.00 C ATOM 326 CD LYS A 27 140.472 -16.056 -3.750 1.00 0.00 C ATOM 327 CE LYS A 27 141.128 -15.956 -2.371 1.00 0.00 C ATOM 328 NZ LYS A 27 142.107 -17.068 -2.207 1.00 0.00 N ATOM 0 H LYS A 27 137.559 -12.312 -4.228 1.00 0.00 H new ATOM 0 HA LYS A 27 139.071 -12.795 -5.782 1.00 0.00 H new ATOM 0 HB2 LYS A 27 138.188 -15.683 -5.284 1.00 0.00 H new ATOM 0 HB3 LYS A 27 139.637 -15.224 -6.157 1.00 0.00 H new ATOM 0 HG2 LYS A 27 140.394 -13.924 -4.098 1.00 0.00 H new ATOM 0 HG3 LYS A 27 139.003 -14.555 -3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 27 139.795 -16.910 -3.781 1.00 0.00 H new ATOM 0 HD3 LYS A 27 141.231 -16.223 -4.514 1.00 0.00 H new ATOM 0 HE2 LYS A 27 141.631 -14.995 -2.264 1.00 0.00 H new ATOM 0 HE3 LYS A 27 140.369 -16.007 -1.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 142.554 -17.002 -1.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 141.614 -17.980 -2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 142.837 -16.999 -2.944 1.00 0.00 H new ATOM 342 N LEU A 28 137.574 -12.553 -7.815 1.00 0.00 N ATOM 343 CA LEU A 28 136.968 -12.541 -9.141 1.00 0.00 C ATOM 344 C LEU A 28 137.905 -11.900 -10.166 1.00 0.00 C ATOM 345 O LEU A 28 137.628 -10.813 -10.672 1.00 0.00 O ATOM 346 CB LEU A 28 135.652 -11.761 -9.103 1.00 0.00 C ATOM 347 CG LEU A 28 134.913 -11.931 -10.432 1.00 0.00 C ATOM 348 CD1 LEU A 28 134.475 -13.390 -10.599 1.00 0.00 C ATOM 349 CD2 LEU A 28 133.678 -11.025 -10.444 1.00 0.00 C ATOM 0 H LEU A 28 137.922 -11.649 -7.496 1.00 0.00 H new ATOM 0 HA LEU A 28 136.779 -13.573 -9.437 1.00 0.00 H new ATOM 0 HB2 LEU A 28 135.030 -12.118 -8.282 1.00 0.00 H new ATOM 0 HB3 LEU A 28 135.849 -10.705 -8.918 1.00 0.00 H new ATOM 0 HG LEU A 28 135.577 -11.659 -11.252 1.00 0.00 H new ATOM 0 HD11 LEU A 28 133.949 -13.506 -11.547 1.00 0.00 H new ATOM 0 HD12 LEU A 28 135.352 -14.037 -10.589 1.00 0.00 H new ATOM 0 HD13 LEU A 28 133.811 -13.667 -9.780 1.00 0.00 H new ATOM 0 HD21 LEU A 28 133.149 -11.144 -11.390 1.00 0.00 H new ATOM 0 HD22 LEU A 28 133.017 -11.300 -9.622 1.00 0.00 H new ATOM 0 HD23 LEU A 28 133.988 -9.986 -10.329 1.00 0.00 H new ATOM 355 N PRO A 29 138.997 -12.547 -10.483 1.00 0.00 N ATOM 356 CA PRO A 29 139.978 -12.017 -11.474 1.00 0.00 C ATOM 357 C PRO A 29 139.427 -12.053 -12.897 1.00 0.00 C ATOM 358 O PRO A 29 138.940 -13.086 -13.358 1.00 0.00 O ATOM 359 CB PRO A 29 141.189 -12.941 -11.329 1.00 0.00 C ATOM 360 CG PRO A 29 140.664 -14.210 -10.742 1.00 0.00 C ATOM 361 CD PRO A 29 139.416 -13.848 -9.935 1.00 0.00 C ATOM 0 HA PRO A 29 140.220 -10.970 -11.290 1.00 0.00 H new ATOM 0 HB2 PRO A 29 141.660 -13.123 -12.295 1.00 0.00 H new ATOM 0 HB3 PRO A 29 141.946 -12.495 -10.684 1.00 0.00 H new ATOM 0 HG2 PRO A 29 140.421 -14.926 -11.527 1.00 0.00 H new ATOM 0 HG3 PRO A 29 141.413 -14.678 -10.104 1.00 0.00 H new ATOM 0 HD2 PRO A 29 138.635 -14.599 -10.051 1.00 0.00 H new ATOM 0 HD3 PRO A 29 139.636 -13.779 -8.870 1.00 0.00 H new ATOM 369 N SER A 30 139.508 -10.920 -13.588 1.00 0.00 N ATOM 370 CA SER A 30 139.014 -10.838 -14.957 1.00 0.00 C ATOM 371 C SER A 30 139.814 -9.816 -15.759 1.00 0.00 C ATOM 372 O SER A 30 140.233 -8.787 -15.229 1.00 0.00 O ATOM 373 CB SER A 30 137.537 -10.444 -14.958 1.00 0.00 C ATOM 374 OG SER A 30 137.045 -10.466 -16.292 1.00 0.00 O ATOM 0 H SER A 30 139.907 -10.054 -13.226 1.00 0.00 H new ATOM 0 HA SER A 30 139.130 -11.817 -15.421 1.00 0.00 H new ATOM 0 HB2 SER A 30 136.965 -11.132 -14.336 1.00 0.00 H new ATOM 0 HB3 SER A 30 137.414 -9.449 -14.529 1.00 0.00 H new ATOM 0 HG SER A 30 136.793 -9.559 -16.563 1.00 0.00 H new ATOM 380 N GLU A 31 140.015 -10.106 -17.041 1.00 0.00 N ATOM 381 CA GLU A 31 140.760 -9.202 -17.910 1.00 0.00 C ATOM 382 C GLU A 31 140.034 -7.866 -18.038 1.00 0.00 C ATOM 383 O GLU A 31 140.664 -6.814 -18.147 1.00 0.00 O ATOM 384 CB GLU A 31 140.925 -9.832 -19.294 1.00 0.00 C ATOM 385 CG GLU A 31 141.781 -11.094 -19.180 1.00 0.00 C ATOM 386 CD GLU A 31 141.992 -11.707 -20.560 1.00 0.00 C ATOM 387 OE1 GLU A 31 141.332 -11.268 -21.488 1.00 0.00 O ATOM 388 OE2 GLU A 31 142.806 -12.608 -20.668 1.00 0.00 O ATOM 0 H GLU A 31 139.676 -10.952 -17.498 1.00 0.00 H new ATOM 0 HA GLU A 31 141.742 -9.027 -17.471 1.00 0.00 H new ATOM 0 HB2 GLU A 31 139.949 -10.078 -19.712 1.00 0.00 H new ATOM 0 HB3 GLU A 31 141.394 -9.122 -19.975 1.00 0.00 H new ATOM 0 HG2 GLU A 31 142.744 -10.851 -18.730 1.00 0.00 H new ATOM 0 HG3 GLU A 31 141.295 -11.815 -18.523 1.00 0.00 H new ATOM 395 N TYR A 32 138.706 -7.916 -18.019 1.00 0.00 N ATOM 396 CA TYR A 32 137.901 -6.704 -18.129 1.00 0.00 C ATOM 397 C TYR A 32 137.071 -6.501 -16.866 1.00 0.00 C ATOM 398 O TYR A 32 136.546 -7.457 -16.296 1.00 0.00 O ATOM 399 CB TYR A 32 136.975 -6.799 -19.344 1.00 0.00 C ATOM 400 CG TYR A 32 137.802 -6.959 -20.596 1.00 0.00 C ATOM 401 CD1 TYR A 32 138.408 -5.842 -21.183 1.00 0.00 C ATOM 402 CD2 TYR A 32 137.964 -8.225 -21.170 1.00 0.00 C ATOM 403 CE1 TYR A 32 139.174 -5.990 -22.344 1.00 0.00 C ATOM 404 CE2 TYR A 32 138.730 -8.373 -22.333 1.00 0.00 C ATOM 405 CZ TYR A 32 139.336 -7.256 -22.920 1.00 0.00 C ATOM 406 OH TYR A 32 140.090 -7.402 -24.066 1.00 0.00 O ATOM 0 H TYR A 32 138.167 -8.777 -17.929 1.00 0.00 H new ATOM 0 HA TYR A 32 138.571 -5.853 -18.252 1.00 0.00 H new ATOM 0 HB2 TYR A 32 136.297 -7.645 -19.233 1.00 0.00 H new ATOM 0 HB3 TYR A 32 136.358 -5.903 -19.415 1.00 0.00 H new ATOM 0 HD1 TYR A 32 138.284 -4.865 -20.739 1.00 0.00 H new ATOM 0 HD2 TYR A 32 137.499 -9.087 -20.716 1.00 0.00 H new ATOM 0 HE1 TYR A 32 139.641 -5.127 -22.796 1.00 0.00 H new ATOM 0 HE2 TYR A 32 138.853 -9.350 -22.777 1.00 0.00 H new ATOM 0 HH TYR A 32 140.101 -8.345 -24.332 1.00 0.00 H new ATOM 416 N VAL A 33 136.962 -5.250 -16.429 1.00 0.00 N ATOM 417 CA VAL A 33 136.198 -4.937 -15.228 1.00 0.00 C ATOM 418 C VAL A 33 135.127 -3.891 -15.521 1.00 0.00 C ATOM 419 O VAL A 33 135.300 -2.710 -15.221 1.00 0.00 O ATOM 420 CB VAL A 33 137.130 -4.413 -14.136 1.00 0.00 C ATOM 421 CG1 VAL A 33 136.327 -4.155 -12.863 1.00 0.00 C ATOM 422 CG2 VAL A 33 138.218 -5.451 -13.847 1.00 0.00 C ATOM 0 H VAL A 33 137.389 -4.444 -16.884 1.00 0.00 H new ATOM 0 HA VAL A 33 135.712 -5.852 -14.889 1.00 0.00 H new ATOM 0 HB VAL A 33 137.593 -3.485 -14.471 1.00 0.00 H new ATOM 0 HG11 VAL A 33 136.991 -3.781 -12.084 1.00 0.00 H new ATOM 0 HG12 VAL A 33 135.552 -3.415 -13.065 1.00 0.00 H new ATOM 0 HG13 VAL A 33 135.864 -5.084 -12.530 1.00 0.00 H new ATOM 0 HG21 VAL A 33 138.882 -5.075 -13.068 1.00 0.00 H new ATOM 0 HG22 VAL A 33 137.755 -6.380 -13.513 1.00 0.00 H new ATOM 0 HG23 VAL A 33 138.793 -5.638 -14.754 1.00 0.00 H new ATOM 426 N PRO A 34 134.028 -4.305 -16.093 1.00 0.00 N ATOM 427 CA PRO A 34 132.900 -3.386 -16.428 1.00 0.00 C ATOM 428 C PRO A 34 132.438 -2.592 -15.208 1.00 0.00 C ATOM 429 O PRO A 34 132.404 -3.113 -14.093 1.00 0.00 O ATOM 430 CB PRO A 34 131.795 -4.322 -16.926 1.00 0.00 C ATOM 431 CG PRO A 34 132.483 -5.582 -17.336 1.00 0.00 C ATOM 432 CD PRO A 34 133.745 -5.692 -16.482 1.00 0.00 C ATOM 0 HA PRO A 34 133.184 -2.637 -17.167 1.00 0.00 H new ATOM 0 HB2 PRO A 34 131.062 -4.514 -16.142 1.00 0.00 H new ATOM 0 HB3 PRO A 34 131.256 -3.880 -17.764 1.00 0.00 H new ATOM 0 HG2 PRO A 34 131.835 -6.445 -17.181 1.00 0.00 H new ATOM 0 HG3 PRO A 34 132.734 -5.558 -18.396 1.00 0.00 H new ATOM 0 HD2 PRO A 34 133.584 -6.327 -15.611 1.00 0.00 H new ATOM 0 HD3 PRO A 34 134.572 -6.126 -17.044 1.00 0.00 H new ATOM 440 N THR A 35 132.090 -1.328 -15.426 1.00 0.00 N ATOM 441 CA THR A 35 131.640 -0.468 -14.335 1.00 0.00 C ATOM 442 C THR A 35 130.274 -0.904 -13.813 1.00 0.00 C ATOM 443 O THR A 35 129.921 -0.619 -12.668 1.00 0.00 O ATOM 444 CB THR A 35 131.560 0.983 -14.816 1.00 0.00 C ATOM 445 OG1 THR A 35 130.569 1.089 -15.829 1.00 0.00 O ATOM 446 CG2 THR A 35 132.917 1.411 -15.379 1.00 0.00 C ATOM 0 H THR A 35 132.110 -0.878 -16.341 1.00 0.00 H new ATOM 0 HA THR A 35 132.362 -0.551 -13.523 1.00 0.00 H new ATOM 0 HB THR A 35 131.296 1.631 -13.980 1.00 0.00 H new ATOM 0 HG1 THR A 35 130.515 2.018 -16.138 1.00 0.00 H new ATOM 0 HG21 THR A 35 132.859 2.444 -15.721 1.00 0.00 H new ATOM 0 HG22 THR A 35 133.676 1.328 -14.601 1.00 0.00 H new ATOM 0 HG23 THR A 35 133.183 0.766 -16.216 1.00 0.00 H new ATOM 451 N VAL A 36 129.507 -1.590 -14.653 1.00 0.00 N ATOM 452 CA VAL A 36 128.179 -2.049 -14.253 1.00 0.00 C ATOM 453 C VAL A 36 127.494 -1.001 -13.381 1.00 0.00 C ATOM 454 O VAL A 36 127.360 0.158 -13.776 1.00 0.00 O ATOM 455 CB VAL A 36 128.289 -3.362 -13.479 1.00 0.00 C ATOM 456 CG1 VAL A 36 126.902 -3.993 -13.341 1.00 0.00 C ATOM 457 CG2 VAL A 36 129.211 -4.322 -14.230 1.00 0.00 C ATOM 0 H VAL A 36 129.776 -1.839 -15.605 1.00 0.00 H new ATOM 0 HA VAL A 36 127.584 -2.208 -15.152 1.00 0.00 H new ATOM 0 HB VAL A 36 128.698 -3.164 -12.488 1.00 0.00 H new ATOM 0 HG11 VAL A 36 126.982 -4.929 -12.789 1.00 0.00 H new ATOM 0 HG12 VAL A 36 126.243 -3.310 -12.804 1.00 0.00 H new ATOM 0 HG13 VAL A 36 126.492 -4.190 -14.331 1.00 0.00 H new ATOM 0 HG21 VAL A 36 129.289 -5.258 -13.678 1.00 0.00 H new ATOM 0 HG22 VAL A 36 128.802 -4.518 -15.221 1.00 0.00 H new ATOM 0 HG23 VAL A 36 130.200 -3.875 -14.328 1.00 0.00 H new ATOM 461 N PHE A 37 127.067 -1.415 -12.193 1.00 0.00 N ATOM 462 CA PHE A 37 126.402 -0.500 -11.272 1.00 0.00 C ATOM 463 C PHE A 37 127.261 -0.279 -10.032 1.00 0.00 C ATOM 464 O PHE A 37 127.981 -1.178 -9.597 1.00 0.00 O ATOM 465 CB PHE A 37 125.041 -1.062 -10.855 1.00 0.00 C ATOM 466 CG PHE A 37 124.156 -1.203 -12.070 1.00 0.00 C ATOM 467 CD1 PHE A 37 123.520 -0.077 -12.609 1.00 0.00 C ATOM 468 CD2 PHE A 37 123.968 -2.459 -12.657 1.00 0.00 C ATOM 469 CE1 PHE A 37 122.699 -0.208 -13.734 1.00 0.00 C ATOM 470 CE2 PHE A 37 123.145 -2.591 -13.782 1.00 0.00 C ATOM 471 CZ PHE A 37 122.512 -1.466 -14.321 1.00 0.00 C ATOM 0 H PHE A 37 127.168 -2.369 -11.847 1.00 0.00 H new ATOM 0 HA PHE A 37 126.256 0.453 -11.781 1.00 0.00 H new ATOM 0 HB2 PHE A 37 125.169 -2.031 -10.372 1.00 0.00 H new ATOM 0 HB3 PHE A 37 124.572 -0.402 -10.126 1.00 0.00 H new ATOM 0 HD1 PHE A 37 123.664 0.893 -12.156 1.00 0.00 H new ATOM 0 HD2 PHE A 37 124.458 -3.327 -12.242 1.00 0.00 H new ATOM 0 HE1 PHE A 37 122.210 0.660 -14.150 1.00 0.00 H new ATOM 0 HE2 PHE A 37 122.999 -3.561 -14.234 1.00 0.00 H new ATOM 0 HZ PHE A 37 121.879 -1.567 -15.190 1.00 0.00 H new ATOM 481 N ASP A 38 127.182 0.921 -9.466 1.00 0.00 N ATOM 482 CA ASP A 38 127.960 1.241 -8.276 1.00 0.00 C ATOM 483 C ASP A 38 127.452 0.445 -7.079 1.00 0.00 C ATOM 484 O ASP A 38 126.246 0.332 -6.860 1.00 0.00 O ATOM 485 CB ASP A 38 127.868 2.738 -7.977 1.00 0.00 C ATOM 486 CG ASP A 38 128.582 3.529 -9.068 1.00 0.00 C ATOM 487 OD1 ASP A 38 129.272 2.914 -9.863 1.00 0.00 O ATOM 488 OD2 ASP A 38 128.427 4.739 -9.092 1.00 0.00 O ATOM 0 H ASP A 38 126.593 1.680 -9.808 1.00 0.00 H new ATOM 0 HA ASP A 38 129.001 0.975 -8.460 1.00 0.00 H new ATOM 0 HB2 ASP A 38 126.823 3.043 -7.919 1.00 0.00 H new ATOM 0 HB3 ASP A 38 128.317 2.952 -7.007 1.00 0.00 H new ATOM 493 N ASN A 39 128.382 -0.109 -6.310 1.00 0.00 N ATOM 494 CA ASN A 39 128.020 -0.901 -5.142 1.00 0.00 C ATOM 495 C ASN A 39 128.286 -0.129 -3.856 1.00 0.00 C ATOM 496 O ASN A 39 129.315 0.534 -3.717 1.00 0.00 O ATOM 497 CB ASN A 39 128.821 -2.205 -5.130 1.00 0.00 C ATOM 498 CG ASN A 39 128.447 -3.057 -6.338 1.00 0.00 C ATOM 499 OD1 ASN A 39 127.574 -2.606 -7.199 1.00 0.00 O flip ATOM 500 ND2 ASN A 39 128.962 -4.162 -6.503 1.00 0.00 N flip ATOM 0 H ASN A 39 129.385 -0.025 -6.473 1.00 0.00 H new ATOM 0 HA ASN A 39 126.955 -1.124 -5.199 1.00 0.00 H new ATOM 0 HB2 ASN A 39 129.889 -1.986 -5.146 1.00 0.00 H new ATOM 0 HB3 ASN A 39 128.622 -2.755 -4.211 1.00 0.00 H new ATOM 0 HD21 ASN A 39 129.643 -4.513 -5.830 1.00 0.00 H new ATOM 0 HD22 ASN A 39 128.708 -4.727 -7.313 1.00 0.00 H new ATOM 505 N TYR A 40 127.355 -0.229 -2.912 1.00 0.00 N ATOM 506 CA TYR A 40 127.495 0.450 -1.634 1.00 0.00 C ATOM 507 C TYR A 40 126.344 0.072 -0.712 1.00 0.00 C ATOM 508 O TYR A 40 126.223 0.593 0.395 1.00 0.00 O ATOM 509 CB TYR A 40 127.533 1.968 -1.829 1.00 0.00 C ATOM 510 CG TYR A 40 126.126 2.494 -1.984 1.00 0.00 C ATOM 511 CD1 TYR A 40 125.499 2.464 -3.236 1.00 0.00 C ATOM 512 CD2 TYR A 40 125.448 3.012 -0.874 1.00 0.00 C ATOM 513 CE1 TYR A 40 124.194 2.951 -3.376 1.00 0.00 C ATOM 514 CE2 TYR A 40 124.144 3.499 -1.015 1.00 0.00 C ATOM 515 CZ TYR A 40 123.517 3.469 -2.266 1.00 0.00 C ATOM 516 OH TYR A 40 122.231 3.948 -2.404 1.00 0.00 O ATOM 0 H TYR A 40 126.498 -0.773 -3.010 1.00 0.00 H new ATOM 0 HA TYR A 40 128.435 0.136 -1.179 1.00 0.00 H new ATOM 0 HB2 TYR A 40 128.017 2.442 -0.976 1.00 0.00 H new ATOM 0 HB3 TYR A 40 128.124 2.217 -2.710 1.00 0.00 H new ATOM 0 HD1 TYR A 40 126.022 2.065 -4.093 1.00 0.00 H new ATOM 0 HD2 TYR A 40 125.932 3.036 0.091 1.00 0.00 H new ATOM 0 HE1 TYR A 40 123.709 2.927 -4.341 1.00 0.00 H new ATOM 0 HE2 TYR A 40 123.621 3.898 -0.158 1.00 0.00 H new ATOM 0 HH TYR A 40 121.907 4.270 -1.537 1.00 0.00 H new ATOM 526 N ALA A 41 125.509 -0.848 -1.183 1.00 0.00 N ATOM 527 CA ALA A 41 124.368 -1.316 -0.407 1.00 0.00 C ATOM 528 C ALA A 41 124.021 -2.742 -0.817 1.00 0.00 C ATOM 529 O ALA A 41 123.363 -2.961 -1.834 1.00 0.00 O ATOM 530 CB ALA A 41 123.162 -0.406 -0.638 1.00 0.00 C ATOM 0 H ALA A 41 125.602 -1.285 -2.100 1.00 0.00 H new ATOM 0 HA ALA A 41 124.628 -1.295 0.651 1.00 0.00 H new ATOM 0 HB1 ALA A 41 122.316 -0.767 -0.052 1.00 0.00 H new ATOM 0 HB2 ALA A 41 123.409 0.610 -0.331 1.00 0.00 H new ATOM 0 HB3 ALA A 41 122.899 -0.411 -1.696 1.00 0.00 H new ATOM 536 N VAL A 42 124.466 -3.708 -0.022 1.00 0.00 N ATOM 537 CA VAL A 42 124.190 -5.106 -0.320 1.00 0.00 C ATOM 538 C VAL A 42 124.009 -5.901 0.962 1.00 0.00 C ATOM 539 O VAL A 42 124.752 -5.722 1.925 1.00 0.00 O ATOM 540 CB VAL A 42 125.330 -5.704 -1.142 1.00 0.00 C ATOM 541 CG1 VAL A 42 126.628 -5.648 -0.338 1.00 0.00 C ATOM 542 CG2 VAL A 42 125.003 -7.160 -1.480 1.00 0.00 C ATOM 0 H VAL A 42 125.013 -3.551 0.824 1.00 0.00 H new ATOM 0 HA VAL A 42 123.267 -5.157 -0.897 1.00 0.00 H new ATOM 0 HB VAL A 42 125.451 -5.133 -2.062 1.00 0.00 H new ATOM 0 HG11 VAL A 42 127.440 -6.075 -0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 42 126.862 -4.611 -0.096 1.00 0.00 H new ATOM 0 HG13 VAL A 42 126.510 -6.218 0.584 1.00 0.00 H new ATOM 0 HG21 VAL A 42 125.815 -7.589 -2.067 1.00 0.00 H new ATOM 0 HG22 VAL A 42 124.882 -7.729 -0.558 1.00 0.00 H new ATOM 0 HG23 VAL A 42 124.079 -7.201 -2.056 1.00 0.00 H new ATOM 546 N THR A 43 123.021 -6.782 0.962 1.00 0.00 N ATOM 547 CA THR A 43 122.750 -7.604 2.133 1.00 0.00 C ATOM 548 C THR A 43 123.333 -9.000 1.949 1.00 0.00 C ATOM 549 O THR A 43 122.912 -9.750 1.069 1.00 0.00 O ATOM 550 CB THR A 43 121.242 -7.694 2.362 1.00 0.00 C ATOM 551 OG1 THR A 43 120.970 -8.690 3.338 1.00 0.00 O ATOM 552 CG2 THR A 43 120.544 -8.055 1.050 1.00 0.00 C ATOM 0 H THR A 43 122.397 -6.946 0.172 1.00 0.00 H new ATOM 0 HA THR A 43 123.219 -7.144 3.002 1.00 0.00 H new ATOM 0 HB THR A 43 120.870 -6.732 2.714 1.00 0.00 H new ATOM 0 HG1 THR A 43 120.003 -8.747 3.486 1.00 0.00 H new ATOM 0 HG21 THR A 43 119.469 -8.119 1.216 1.00 0.00 H new ATOM 0 HG22 THR A 43 120.752 -7.288 0.304 1.00 0.00 H new ATOM 0 HG23 THR A 43 120.914 -9.016 0.694 1.00 0.00 H new ATOM 557 N VAL A 44 124.311 -9.338 2.783 1.00 0.00 N ATOM 558 CA VAL A 44 124.953 -10.642 2.702 1.00 0.00 C ATOM 559 C VAL A 44 125.146 -11.243 4.089 1.00 0.00 C ATOM 560 O VAL A 44 125.409 -10.528 5.058 1.00 0.00 O ATOM 561 CB VAL A 44 126.312 -10.511 2.010 1.00 0.00 C ATOM 562 CG1 VAL A 44 127.229 -9.621 2.852 1.00 0.00 C ATOM 563 CG2 VAL A 44 126.945 -11.897 1.866 1.00 0.00 C ATOM 0 H VAL A 44 124.673 -8.730 3.518 1.00 0.00 H new ATOM 0 HA VAL A 44 124.307 -11.303 2.124 1.00 0.00 H new ATOM 0 HB VAL A 44 126.176 -10.066 1.024 1.00 0.00 H new ATOM 0 HG11 VAL A 44 128.197 -9.527 2.360 1.00 0.00 H new ATOM 0 HG12 VAL A 44 126.779 -8.634 2.960 1.00 0.00 H new ATOM 0 HG13 VAL A 44 127.365 -10.067 3.837 1.00 0.00 H new ATOM 0 HG21 VAL A 44 127.913 -11.806 1.373 1.00 0.00 H new ATOM 0 HG22 VAL A 44 127.081 -12.339 2.853 1.00 0.00 H new ATOM 0 HG23 VAL A 44 126.293 -12.535 1.269 1.00 0.00 H new ATOM 567 N MET A 45 125.021 -12.562 4.174 1.00 0.00 N ATOM 568 CA MET A 45 125.196 -13.254 5.443 1.00 0.00 C ATOM 569 C MET A 45 126.570 -13.913 5.486 1.00 0.00 C ATOM 570 O MET A 45 126.941 -14.649 4.572 1.00 0.00 O ATOM 571 CB MET A 45 124.114 -14.324 5.612 1.00 0.00 C ATOM 572 CG MET A 45 122.734 -13.663 5.632 1.00 0.00 C ATOM 573 SD MET A 45 121.479 -14.891 6.073 1.00 0.00 S ATOM 574 CE MET A 45 121.274 -15.626 4.431 1.00 0.00 C ATOM 0 H MET A 45 124.801 -13.169 3.385 1.00 0.00 H new ATOM 0 HA MET A 45 125.114 -12.529 6.253 1.00 0.00 H new ATOM 0 HB2 MET A 45 124.171 -15.045 4.796 1.00 0.00 H new ATOM 0 HB3 MET A 45 124.277 -14.877 6.537 1.00 0.00 H new ATOM 0 HG2 MET A 45 122.723 -12.843 6.350 1.00 0.00 H new ATOM 0 HG3 MET A 45 122.511 -13.235 4.655 1.00 0.00 H new ATOM 0 HE1 MET A 45 120.468 -16.359 4.459 1.00 0.00 H new ATOM 0 HE2 MET A 45 121.030 -14.845 3.711 1.00 0.00 H new ATOM 0 HE3 MET A 45 122.201 -16.117 4.134 1.00 0.00 H new ATOM 584 N ILE A 46 127.321 -13.650 6.549 1.00 0.00 N ATOM 585 CA ILE A 46 128.650 -14.232 6.686 1.00 0.00 C ATOM 586 C ILE A 46 128.763 -15.000 7.998 1.00 0.00 C ATOM 587 O ILE A 46 128.504 -14.458 9.071 1.00 0.00 O ATOM 588 CB ILE A 46 129.706 -13.126 6.644 1.00 0.00 C ATOM 589 CG1 ILE A 46 131.099 -13.745 6.785 1.00 0.00 C ATOM 590 CG2 ILE A 46 129.466 -12.148 7.795 1.00 0.00 C ATOM 591 CD1 ILE A 46 132.150 -12.761 6.269 1.00 0.00 C ATOM 0 H ILE A 46 127.037 -13.045 7.320 1.00 0.00 H new ATOM 0 HA ILE A 46 128.815 -14.923 5.860 1.00 0.00 H new ATOM 0 HB ILE A 46 129.638 -12.595 5.695 1.00 0.00 H new ATOM 0 HG12 ILE A 46 131.296 -13.989 7.829 1.00 0.00 H new ATOM 0 HG13 ILE A 46 131.152 -14.678 6.224 1.00 0.00 H new ATOM 0 HG21 ILE A 46 130.218 -11.360 7.766 1.00 0.00 H new ATOM 0 HG22 ILE A 46 128.474 -11.707 7.697 1.00 0.00 H new ATOM 0 HG23 ILE A 46 129.534 -12.679 8.744 1.00 0.00 H new ATOM 0 HD11 ILE A 46 133.142 -13.202 6.370 1.00 0.00 H new ATOM 0 HD12 ILE A 46 131.956 -12.539 5.220 1.00 0.00 H new ATOM 0 HD13 ILE A 46 132.102 -11.840 6.850 1.00 0.00 H new ATOM 595 N GLY A 47 129.155 -16.266 7.903 1.00 0.00 N ATOM 596 CA GLY A 47 129.303 -17.097 9.091 1.00 0.00 C ATOM 597 C GLY A 47 128.005 -17.137 9.888 1.00 0.00 C ATOM 598 O GLY A 47 128.018 -17.368 11.098 1.00 0.00 O ATOM 0 H GLY A 47 129.374 -16.735 7.024 1.00 0.00 H new ATOM 0 HA2 GLY A 47 129.588 -18.108 8.800 1.00 0.00 H new ATOM 0 HA3 GLY A 47 130.107 -16.707 9.715 1.00 0.00 H new ATOM 602 N GLY A 48 126.885 -16.902 9.212 1.00 0.00 N ATOM 603 CA GLY A 48 125.592 -16.906 9.882 1.00 0.00 C ATOM 604 C GLY A 48 125.426 -15.648 10.725 1.00 0.00 C ATOM 605 O GLY A 48 125.188 -15.722 11.929 1.00 0.00 O ATOM 0 H GLY A 48 126.847 -16.708 8.211 1.00 0.00 H new ATOM 0 HA2 GLY A 48 124.793 -16.964 9.143 1.00 0.00 H new ATOM 0 HA3 GLY A 48 125.506 -17.789 10.515 1.00 0.00 H new ATOM 609 N GLU A 49 125.554 -14.493 10.080 1.00 0.00 N ATOM 610 CA GLU A 49 125.419 -13.219 10.775 1.00 0.00 C ATOM 611 C GLU A 49 124.688 -12.206 9.889 1.00 0.00 C ATOM 612 O GLU A 49 125.317 -11.499 9.102 1.00 0.00 O ATOM 613 CB GLU A 49 126.803 -12.675 11.134 1.00 0.00 C ATOM 614 CG GLU A 49 127.503 -13.642 12.092 1.00 0.00 C ATOM 615 CD GLU A 49 128.596 -12.908 12.861 1.00 0.00 C ATOM 616 OE1 GLU A 49 128.317 -11.835 13.369 1.00 0.00 O ATOM 617 OE2 GLU A 49 129.697 -13.429 12.929 1.00 0.00 O ATOM 0 H GLU A 49 125.750 -14.413 9.082 1.00 0.00 H new ATOM 0 HA GLU A 49 124.842 -13.378 11.686 1.00 0.00 H new ATOM 0 HB2 GLU A 49 127.400 -12.546 10.231 1.00 0.00 H new ATOM 0 HB3 GLU A 49 126.710 -11.693 11.597 1.00 0.00 H new ATOM 0 HG2 GLU A 49 126.779 -14.067 12.787 1.00 0.00 H new ATOM 0 HG3 GLU A 49 127.934 -14.473 11.534 1.00 0.00 H new ATOM 624 N PRO A 50 123.384 -12.126 9.989 1.00 0.00 N ATOM 625 CA PRO A 50 122.570 -11.175 9.169 1.00 0.00 C ATOM 626 C PRO A 50 122.979 -9.715 9.379 1.00 0.00 C ATOM 627 O PRO A 50 122.630 -9.101 10.387 1.00 0.00 O ATOM 628 CB PRO A 50 121.131 -11.404 9.647 1.00 0.00 C ATOM 629 CG PRO A 50 121.133 -12.732 10.328 1.00 0.00 C ATOM 630 CD PRO A 50 122.540 -12.933 10.883 1.00 0.00 C ATOM 0 HA PRO A 50 122.706 -11.356 8.103 1.00 0.00 H new ATOM 0 HB2 PRO A 50 120.816 -10.615 10.330 1.00 0.00 H new ATOM 0 HB3 PRO A 50 120.435 -11.396 8.808 1.00 0.00 H new ATOM 0 HG2 PRO A 50 120.393 -12.759 11.128 1.00 0.00 H new ATOM 0 HG3 PRO A 50 120.875 -13.527 9.628 1.00 0.00 H new ATOM 0 HD2 PRO A 50 122.615 -12.596 11.917 1.00 0.00 H new ATOM 0 HD3 PRO A 50 122.830 -13.984 10.868 1.00 0.00 H new ATOM 638 N TYR A 51 123.707 -9.163 8.410 1.00 0.00 N ATOM 639 CA TYR A 51 124.148 -7.770 8.477 1.00 0.00 C ATOM 640 C TYR A 51 124.502 -7.283 7.077 1.00 0.00 C ATOM 641 O TYR A 51 124.739 -8.097 6.184 1.00 0.00 O ATOM 642 CB TYR A 51 125.374 -7.642 9.382 1.00 0.00 C ATOM 643 CG TYR A 51 124.984 -7.889 10.820 1.00 0.00 C ATOM 644 CD1 TYR A 51 124.497 -6.837 11.602 1.00 0.00 C ATOM 645 CD2 TYR A 51 125.112 -9.167 11.370 1.00 0.00 C ATOM 646 CE1 TYR A 51 124.136 -7.067 12.937 1.00 0.00 C ATOM 647 CE2 TYR A 51 124.751 -9.398 12.702 1.00 0.00 C ATOM 648 CZ TYR A 51 124.263 -8.347 13.485 1.00 0.00 C ATOM 649 OH TYR A 51 123.904 -8.573 14.799 1.00 0.00 O ATOM 0 H TYR A 51 124.004 -9.658 7.569 1.00 0.00 H new ATOM 0 HA TYR A 51 123.340 -7.164 8.888 1.00 0.00 H new ATOM 0 HB2 TYR A 51 126.138 -8.357 9.076 1.00 0.00 H new ATOM 0 HB3 TYR A 51 125.809 -6.648 9.280 1.00 0.00 H new ATOM 0 HD1 TYR A 51 124.399 -5.849 11.178 1.00 0.00 H new ATOM 0 HD2 TYR A 51 125.490 -9.978 10.766 1.00 0.00 H new ATOM 0 HE1 TYR A 51 123.760 -6.255 13.542 1.00 0.00 H new ATOM 0 HE2 TYR A 51 124.849 -10.387 13.125 1.00 0.00 H new ATOM 0 HH TYR A 51 124.053 -9.516 15.021 1.00 0.00 H new ATOM 659 N THR A 52 124.553 -5.966 6.872 1.00 0.00 N ATOM 660 CA THR A 52 124.898 -5.442 5.553 1.00 0.00 C ATOM 661 C THR A 52 125.958 -4.348 5.662 1.00 0.00 C ATOM 662 O THR A 52 125.945 -3.549 6.599 1.00 0.00 O ATOM 663 CB THR A 52 123.652 -4.868 4.876 1.00 0.00 C ATOM 664 OG1 THR A 52 123.474 -3.519 5.282 1.00 0.00 O ATOM 665 CG2 THR A 52 122.428 -5.692 5.278 1.00 0.00 C ATOM 0 H THR A 52 124.365 -5.259 7.583 1.00 0.00 H new ATOM 0 HA THR A 52 125.297 -6.263 4.957 1.00 0.00 H new ATOM 0 HB THR A 52 123.773 -4.907 3.794 1.00 0.00 H new ATOM 0 HG1 THR A 52 122.767 -3.106 4.744 1.00 0.00 H new ATOM 0 HG21 THR A 52 121.540 -5.283 4.796 1.00 0.00 H new ATOM 0 HG22 THR A 52 122.567 -6.727 4.965 1.00 0.00 H new ATOM 0 HG23 THR A 52 122.303 -5.654 6.360 1.00 0.00 H new ATOM 670 N LEU A 53 126.863 -4.308 4.688 1.00 0.00 N ATOM 671 CA LEU A 53 127.917 -3.298 4.669 1.00 0.00 C ATOM 672 C LEU A 53 127.826 -2.464 3.395 1.00 0.00 C ATOM 673 O LEU A 53 127.571 -2.996 2.313 1.00 0.00 O ATOM 674 CB LEU A 53 129.292 -3.960 4.754 1.00 0.00 C ATOM 675 CG LEU A 53 130.378 -2.881 4.777 1.00 0.00 C ATOM 676 CD1 LEU A 53 130.201 -1.998 6.012 1.00 0.00 C ATOM 677 CD2 LEU A 53 131.754 -3.549 4.822 1.00 0.00 C ATOM 0 H LEU A 53 126.888 -4.960 3.904 1.00 0.00 H new ATOM 0 HA LEU A 53 127.784 -2.647 5.533 1.00 0.00 H new ATOM 0 HB2 LEU A 53 129.356 -4.575 5.652 1.00 0.00 H new ATOM 0 HB3 LEU A 53 129.441 -4.623 3.902 1.00 0.00 H new ATOM 0 HG LEU A 53 130.297 -2.267 3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 53 130.976 -1.231 6.025 1.00 0.00 H new ATOM 0 HD12 LEU A 53 129.220 -1.523 5.982 1.00 0.00 H new ATOM 0 HD13 LEU A 53 130.281 -2.609 6.911 1.00 0.00 H new ATOM 0 HD21 LEU A 53 132.530 -2.783 4.838 1.00 0.00 H new ATOM 0 HD22 LEU A 53 131.831 -4.163 5.719 1.00 0.00 H new ATOM 0 HD23 LEU A 53 131.883 -4.177 3.940 1.00 0.00 H new ATOM 683 N GLY A 54 128.029 -1.157 3.527 1.00 0.00 N ATOM 684 CA GLY A 54 127.961 -0.272 2.370 1.00 0.00 C ATOM 685 C GLY A 54 129.337 0.282 2.003 1.00 0.00 C ATOM 686 O GLY A 54 130.009 0.904 2.825 1.00 0.00 O ATOM 0 H GLY A 54 128.239 -0.692 4.410 1.00 0.00 H new ATOM 0 HA2 GLY A 54 127.548 -0.815 1.520 1.00 0.00 H new ATOM 0 HA3 GLY A 54 127.281 0.553 2.582 1.00 0.00 H new ATOM 690 N LEU A 55 129.745 0.053 0.757 1.00 0.00 N ATOM 691 CA LEU A 55 131.041 0.539 0.276 1.00 0.00 C ATOM 692 C LEU A 55 130.847 1.676 -0.727 1.00 0.00 C ATOM 693 O LEU A 55 130.044 1.566 -1.650 1.00 0.00 O ATOM 694 CB LEU A 55 131.803 -0.604 -0.393 1.00 0.00 C ATOM 695 CG LEU A 55 131.947 -1.776 0.581 1.00 0.00 C ATOM 696 CD1 LEU A 55 132.791 -2.874 -0.068 1.00 0.00 C ATOM 697 CD2 LEU A 55 132.637 -1.301 1.862 1.00 0.00 C ATOM 0 H LEU A 55 129.203 -0.463 0.064 1.00 0.00 H new ATOM 0 HA LEU A 55 131.611 0.912 1.127 1.00 0.00 H new ATOM 0 HB2 LEU A 55 131.275 -0.928 -1.290 1.00 0.00 H new ATOM 0 HB3 LEU A 55 132.788 -0.260 -0.709 1.00 0.00 H new ATOM 0 HG LEU A 55 130.959 -2.166 0.824 1.00 0.00 H new ATOM 0 HD11 LEU A 55 132.895 -3.710 0.624 1.00 0.00 H new ATOM 0 HD12 LEU A 55 132.303 -3.217 -0.980 1.00 0.00 H new ATOM 0 HD13 LEU A 55 133.778 -2.479 -0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 55 132.738 -2.138 2.553 1.00 0.00 H new ATOM 0 HD22 LEU A 55 133.625 -0.910 1.619 1.00 0.00 H new ATOM 0 HD23 LEU A 55 132.040 -0.516 2.327 1.00 0.00 H new ATOM 703 N PHE A 56 131.576 2.774 -0.543 1.00 0.00 N ATOM 704 CA PHE A 56 131.436 3.913 -1.447 1.00 0.00 C ATOM 705 C PHE A 56 132.696 4.172 -2.277 1.00 0.00 C ATOM 706 O PHE A 56 132.983 5.321 -2.600 1.00 0.00 O ATOM 707 CB PHE A 56 131.087 5.173 -0.656 1.00 0.00 C ATOM 708 CG PHE A 56 130.615 6.249 -1.607 1.00 0.00 C ATOM 709 CD1 PHE A 56 129.310 6.208 -2.113 1.00 0.00 C ATOM 710 CD2 PHE A 56 131.480 7.283 -1.985 1.00 0.00 C ATOM 711 CE1 PHE A 56 128.870 7.202 -2.997 1.00 0.00 C ATOM 712 CE2 PHE A 56 131.041 8.275 -2.871 1.00 0.00 C ATOM 713 CZ PHE A 56 129.736 8.235 -3.376 1.00 0.00 C ATOM 0 H PHE A 56 132.256 2.899 0.207 1.00 0.00 H new ATOM 0 HA PHE A 56 130.632 3.664 -2.139 1.00 0.00 H new ATOM 0 HB2 PHE A 56 130.310 4.953 0.076 1.00 0.00 H new ATOM 0 HB3 PHE A 56 131.958 5.520 -0.101 1.00 0.00 H new ATOM 0 HD1 PHE A 56 128.643 5.410 -1.822 1.00 0.00 H new ATOM 0 HD2 PHE A 56 132.486 7.316 -1.593 1.00 0.00 H new ATOM 0 HE1 PHE A 56 127.863 7.171 -3.386 1.00 0.00 H new ATOM 0 HE2 PHE A 56 131.709 9.071 -3.165 1.00 0.00 H new ATOM 0 HZ PHE A 56 129.397 9.001 -4.058 1.00 0.00 H new ATOM 723 N ASP A 57 133.460 3.127 -2.607 1.00 0.00 N ATOM 724 CA ASP A 57 134.678 3.300 -3.405 1.00 0.00 C ATOM 725 C ASP A 57 134.378 4.047 -4.705 1.00 0.00 C ATOM 726 O ASP A 57 133.418 4.811 -4.785 1.00 0.00 O ATOM 727 CB ASP A 57 135.278 1.930 -3.731 1.00 0.00 C ATOM 728 CG ASP A 57 136.743 2.080 -4.124 1.00 0.00 C ATOM 729 OD1 ASP A 57 137.245 3.190 -4.053 1.00 0.00 O ATOM 730 OD2 ASP A 57 137.344 1.083 -4.490 1.00 0.00 O ATOM 0 H ASP A 57 133.261 2.163 -2.338 1.00 0.00 H new ATOM 0 HA ASP A 57 135.389 3.887 -2.824 1.00 0.00 H new ATOM 0 HB2 ASP A 57 135.191 1.271 -2.867 1.00 0.00 H new ATOM 0 HB3 ASP A 57 134.721 1.465 -4.544 1.00 0.00 H new ATOM 735 N THR A 58 135.212 3.821 -5.719 1.00 0.00 N ATOM 736 CA THR A 58 135.038 4.478 -7.012 1.00 0.00 C ATOM 737 C THR A 58 135.248 5.985 -6.883 1.00 0.00 C ATOM 738 O THR A 58 136.245 6.524 -7.365 1.00 0.00 O ATOM 739 CB THR A 58 133.634 4.201 -7.565 1.00 0.00 C ATOM 740 OG1 THR A 58 133.346 2.814 -7.452 1.00 0.00 O ATOM 741 CG2 THR A 58 133.553 4.623 -9.037 1.00 0.00 C ATOM 0 H THR A 58 136.012 3.190 -5.670 1.00 0.00 H new ATOM 0 HA THR A 58 135.782 4.075 -7.700 1.00 0.00 H new ATOM 0 HB THR A 58 132.906 4.775 -6.991 1.00 0.00 H new ATOM 0 HG1 THR A 58 132.449 2.637 -7.803 1.00 0.00 H new ATOM 0 HG21 THR A 58 132.552 4.422 -9.419 1.00 0.00 H new ATOM 0 HG22 THR A 58 133.766 5.689 -9.122 1.00 0.00 H new ATOM 0 HG23 THR A 58 134.283 4.059 -9.618 1.00 0.00 H new ATOM 746 N ALA A 59 134.307 6.658 -6.230 1.00 0.00 N ATOM 747 CA ALA A 59 134.405 8.102 -6.044 1.00 0.00 C ATOM 748 C ALA A 59 135.566 8.444 -5.116 1.00 0.00 C ATOM 749 O ALA A 59 135.874 7.690 -4.192 1.00 0.00 O ATOM 750 CB ALA A 59 133.100 8.644 -5.455 1.00 0.00 C ATOM 0 H ALA A 59 133.474 6.232 -5.823 1.00 0.00 H new ATOM 0 HA ALA A 59 134.583 8.563 -7.015 1.00 0.00 H new ATOM 0 HB1 ALA A 59 133.182 9.722 -5.320 1.00 0.00 H new ATOM 0 HB2 ALA A 59 132.276 8.425 -6.134 1.00 0.00 H new ATOM 0 HB3 ALA A 59 132.911 8.171 -4.491 1.00 0.00 H new ATOM 756 N GLY A 60 136.206 9.582 -5.364 1.00 0.00 N ATOM 757 CA GLY A 60 137.329 10.003 -4.536 1.00 0.00 C ATOM 758 C GLY A 60 138.314 10.857 -5.327 1.00 0.00 C ATOM 759 O GLY A 60 139.526 10.741 -5.147 1.00 0.00 O ATOM 0 H GLY A 60 135.970 10.222 -6.122 1.00 0.00 H new ATOM 0 HA2 GLY A 60 136.960 10.569 -3.680 1.00 0.00 H new ATOM 0 HA3 GLY A 60 137.841 9.125 -4.141 1.00 0.00 H new ATOM 972 N GLN A 74 125.869 9.892 6.424 1.00 0.00 N ATOM 973 CA GLN A 74 125.475 8.890 7.410 1.00 0.00 C ATOM 974 C GLN A 74 126.433 7.703 7.367 1.00 0.00 C ATOM 975 O GLN A 74 126.076 6.619 6.906 1.00 0.00 O ATOM 976 CB GLN A 74 124.049 8.408 7.128 1.00 0.00 C ATOM 977 CG GLN A 74 123.594 7.468 8.248 1.00 0.00 C ATOM 978 CD GLN A 74 122.166 6.999 7.987 1.00 0.00 C ATOM 979 OE1 GLN A 74 121.511 7.486 7.065 1.00 0.00 O ATOM 980 NE2 GLN A 74 121.643 6.077 8.748 1.00 0.00 N ATOM 0 HA GLN A 74 125.512 9.343 8.401 1.00 0.00 H new ATOM 0 HB2 GLN A 74 123.373 9.260 7.058 1.00 0.00 H new ATOM 0 HB3 GLN A 74 124.012 7.892 6.169 1.00 0.00 H new ATOM 0 HG2 GLN A 74 124.263 6.609 8.307 1.00 0.00 H new ATOM 0 HG3 GLN A 74 123.647 7.981 9.208 1.00 0.00 H new ATOM 0 HE21 GLN A 74 122.188 5.676 9.511 1.00 0.00 H new ATOM 0 HE22 GLN A 74 120.689 5.758 8.580 1.00 0.00 H new ATOM 987 N THR A 75 127.650 7.917 7.855 1.00 0.00 N ATOM 988 CA THR A 75 128.656 6.860 7.875 1.00 0.00 C ATOM 989 C THR A 75 129.551 7.011 9.100 1.00 0.00 C ATOM 990 O THR A 75 130.043 8.104 9.379 1.00 0.00 O ATOM 991 CB THR A 75 129.508 6.932 6.607 1.00 0.00 C ATOM 992 OG1 THR A 75 128.657 6.962 5.469 1.00 0.00 O ATOM 993 CG2 THR A 75 130.418 5.706 6.531 1.00 0.00 C ATOM 0 H THR A 75 127.963 8.808 8.240 1.00 0.00 H new ATOM 0 HA THR A 75 128.152 5.895 7.919 1.00 0.00 H new ATOM 0 HB THR A 75 130.119 7.834 6.630 1.00 0.00 H new ATOM 0 HG1 THR A 75 128.594 7.880 5.131 1.00 0.00 H new ATOM 0 HG21 THR A 75 131.025 5.759 5.627 1.00 0.00 H new ATOM 0 HG22 THR A 75 131.070 5.682 7.404 1.00 0.00 H new ATOM 0 HG23 THR A 75 129.809 4.802 6.507 1.00 0.00 H new ATOM 998 N ASP A 76 129.764 5.917 9.830 1.00 0.00 N ATOM 999 CA ASP A 76 130.610 5.974 11.019 1.00 0.00 C ATOM 1000 C ASP A 76 131.871 5.129 10.850 1.00 0.00 C ATOM 1001 O ASP A 76 132.642 4.967 11.796 1.00 0.00 O ATOM 1002 CB ASP A 76 129.837 5.497 12.251 1.00 0.00 C ATOM 1003 CG ASP A 76 129.575 3.999 12.164 1.00 0.00 C ATOM 1004 OD1 ASP A 76 130.041 3.391 11.218 1.00 0.00 O ATOM 1005 OD2 ASP A 76 128.908 3.484 13.046 1.00 0.00 O ATOM 0 H ASP A 76 129.371 4.998 9.624 1.00 0.00 H new ATOM 0 HA ASP A 76 130.907 7.014 11.157 1.00 0.00 H new ATOM 0 HB2 ASP A 76 130.404 5.722 13.154 1.00 0.00 H new ATOM 0 HB3 ASP A 76 128.892 6.035 12.326 1.00 0.00 H new ATOM 1010 N VAL A 77 132.087 4.594 9.649 1.00 0.00 N ATOM 1011 CA VAL A 77 133.274 3.775 9.403 1.00 0.00 C ATOM 1012 C VAL A 77 134.117 4.361 8.276 1.00 0.00 C ATOM 1013 O VAL A 77 133.708 4.352 7.114 1.00 0.00 O ATOM 1014 CB VAL A 77 132.860 2.353 9.022 1.00 0.00 C ATOM 1015 CG1 VAL A 77 134.108 1.480 8.884 1.00 0.00 C ATOM 1016 CG2 VAL A 77 131.951 1.769 10.103 1.00 0.00 C ATOM 0 H VAL A 77 131.470 4.709 8.845 1.00 0.00 H new ATOM 0 HA VAL A 77 133.865 3.759 10.319 1.00 0.00 H new ATOM 0 HB VAL A 77 132.322 2.378 8.074 1.00 0.00 H new ATOM 0 HG11 VAL A 77 133.814 0.466 8.612 1.00 0.00 H new ATOM 0 HG12 VAL A 77 134.755 1.890 8.109 1.00 0.00 H new ATOM 0 HG13 VAL A 77 134.645 1.461 9.832 1.00 0.00 H new ATOM 0 HG21 VAL A 77 131.660 0.756 9.825 1.00 0.00 H new ATOM 0 HG22 VAL A 77 132.484 1.746 11.053 1.00 0.00 H new ATOM 0 HG23 VAL A 77 131.060 2.388 10.202 1.00 0.00 H new ATOM 1020 N PHE A 78 135.291 4.883 8.624 1.00 0.00 N ATOM 1021 CA PHE A 78 136.165 5.481 7.625 1.00 0.00 C ATOM 1022 C PHE A 78 137.063 4.422 7.001 1.00 0.00 C ATOM 1023 O PHE A 78 137.839 3.762 7.691 1.00 0.00 O ATOM 1024 CB PHE A 78 137.022 6.573 8.266 1.00 0.00 C ATOM 1025 CG PHE A 78 136.139 7.720 8.692 1.00 0.00 C ATOM 1026 CD1 PHE A 78 135.816 8.730 7.779 1.00 0.00 C ATOM 1027 CD2 PHE A 78 135.642 7.775 10.001 1.00 0.00 C ATOM 1028 CE1 PHE A 78 134.996 9.796 8.173 1.00 0.00 C ATOM 1029 CE2 PHE A 78 134.823 8.839 10.395 1.00 0.00 C ATOM 1030 CZ PHE A 78 134.500 9.849 9.481 1.00 0.00 C ATOM 0 H PHE A 78 135.653 4.903 9.577 1.00 0.00 H new ATOM 0 HA PHE A 78 135.547 5.922 6.843 1.00 0.00 H new ATOM 0 HB2 PHE A 78 137.556 6.172 9.127 1.00 0.00 H new ATOM 0 HB3 PHE A 78 137.774 6.922 7.558 1.00 0.00 H new ATOM 0 HD1 PHE A 78 136.199 8.688 6.770 1.00 0.00 H new ATOM 0 HD2 PHE A 78 135.891 6.996 10.706 1.00 0.00 H new ATOM 0 HE1 PHE A 78 134.747 10.576 7.468 1.00 0.00 H new ATOM 0 HE2 PHE A 78 134.440 8.881 11.404 1.00 0.00 H new ATOM 0 HZ PHE A 78 133.868 10.670 9.785 1.00 0.00 H new ATOM 1040 N LEU A 79 136.949 4.267 5.688 1.00 0.00 N ATOM 1041 CA LEU A 79 137.749 3.289 4.968 1.00 0.00 C ATOM 1042 C LEU A 79 138.621 3.982 3.926 1.00 0.00 C ATOM 1043 O LEU A 79 138.123 4.749 3.102 1.00 0.00 O ATOM 1044 CB LEU A 79 136.823 2.275 4.284 1.00 0.00 C ATOM 1045 CG LEU A 79 137.637 1.105 3.719 1.00 0.00 C ATOM 1046 CD1 LEU A 79 136.834 -0.188 3.877 1.00 0.00 C ATOM 1047 CD2 LEU A 79 137.914 1.343 2.231 1.00 0.00 C ATOM 0 H LEU A 79 136.311 4.806 5.102 1.00 0.00 H new ATOM 0 HA LEU A 79 138.397 2.770 5.674 1.00 0.00 H new ATOM 0 HB2 LEU A 79 136.088 1.904 4.999 1.00 0.00 H new ATOM 0 HB3 LEU A 79 136.269 2.762 3.482 1.00 0.00 H new ATOM 0 HG LEU A 79 138.581 1.026 4.258 1.00 0.00 H new ATOM 0 HD11 LEU A 79 137.408 -1.024 3.477 1.00 0.00 H new ATOM 0 HD12 LEU A 79 136.628 -0.362 4.933 1.00 0.00 H new ATOM 0 HD13 LEU A 79 135.893 -0.101 3.334 1.00 0.00 H new ATOM 0 HD21 LEU A 79 138.493 0.510 1.831 1.00 0.00 H new ATOM 0 HD22 LEU A 79 136.969 1.420 1.693 1.00 0.00 H new ATOM 0 HD23 LEU A 79 138.477 2.268 2.109 1.00 0.00 H new ATOM 1053 N VAL A 80 139.918 3.703 3.960 1.00 0.00 N ATOM 1054 CA VAL A 80 140.837 4.304 3.003 1.00 0.00 C ATOM 1055 C VAL A 80 141.293 3.252 1.999 1.00 0.00 C ATOM 1056 O VAL A 80 141.739 2.174 2.385 1.00 0.00 O ATOM 1057 CB VAL A 80 142.050 4.881 3.735 1.00 0.00 C ATOM 1058 CG1 VAL A 80 142.958 5.602 2.737 1.00 0.00 C ATOM 1059 CG2 VAL A 80 141.579 5.873 4.802 1.00 0.00 C ATOM 0 H VAL A 80 140.353 3.071 4.632 1.00 0.00 H new ATOM 0 HA VAL A 80 140.326 5.109 2.474 1.00 0.00 H new ATOM 0 HB VAL A 80 142.604 4.071 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 80 143.821 6.012 3.261 1.00 0.00 H new ATOM 0 HG12 VAL A 80 143.296 4.897 1.977 1.00 0.00 H new ATOM 0 HG13 VAL A 80 142.405 6.411 2.261 1.00 0.00 H new ATOM 0 HG21 VAL A 80 142.443 6.284 5.324 1.00 0.00 H new ATOM 0 HG22 VAL A 80 141.023 6.682 4.327 1.00 0.00 H new ATOM 0 HG23 VAL A 80 140.934 5.360 5.516 1.00 0.00 H new ATOM 1063 N CYS A 81 141.170 3.564 0.711 1.00 0.00 N ATOM 1064 CA CYS A 81 141.566 2.614 -0.325 1.00 0.00 C ATOM 1065 C CYS A 81 142.389 3.291 -1.413 1.00 0.00 C ATOM 1066 O CYS A 81 142.189 4.466 -1.721 1.00 0.00 O ATOM 1067 CB CYS A 81 140.322 1.983 -0.949 1.00 0.00 C ATOM 1068 SG CYS A 81 140.488 1.983 -2.751 1.00 0.00 S ATOM 0 H CYS A 81 140.806 4.451 0.364 1.00 0.00 H new ATOM 0 HA CYS A 81 142.181 1.844 0.141 1.00 0.00 H new ATOM 0 HB2 CYS A 81 140.196 0.964 -0.584 1.00 0.00 H new ATOM 0 HB3 CYS A 81 139.432 2.539 -0.655 1.00 0.00 H new ATOM 0 HG CYS A 81 139.379 2.397 -3.289 1.00 0.00 H new ATOM 1074 N PHE A 82 143.318 2.536 -1.991 1.00 0.00 N ATOM 1075 CA PHE A 82 144.173 3.061 -3.047 1.00 0.00 C ATOM 1076 C PHE A 82 144.977 1.933 -3.683 1.00 0.00 C ATOM 1077 O PHE A 82 145.373 0.991 -2.999 1.00 0.00 O ATOM 1078 CB PHE A 82 145.137 4.082 -2.451 1.00 0.00 C ATOM 1079 CG PHE A 82 146.143 3.358 -1.587 1.00 0.00 C ATOM 1080 CD1 PHE A 82 145.774 2.905 -0.313 1.00 0.00 C ATOM 1081 CD2 PHE A 82 147.439 3.127 -2.063 1.00 0.00 C ATOM 1082 CE1 PHE A 82 146.703 2.226 0.485 1.00 0.00 C ATOM 1083 CE2 PHE A 82 148.367 2.448 -1.265 1.00 0.00 C ATOM 1084 CZ PHE A 82 147.999 1.997 0.009 1.00 0.00 C ATOM 0 H PHE A 82 143.497 1.562 -1.746 1.00 0.00 H new ATOM 0 HA PHE A 82 143.549 3.531 -3.808 1.00 0.00 H new ATOM 0 HB2 PHE A 82 145.646 4.628 -3.245 1.00 0.00 H new ATOM 0 HB3 PHE A 82 144.590 4.816 -1.859 1.00 0.00 H new ATOM 0 HD1 PHE A 82 144.773 3.080 0.053 1.00 0.00 H new ATOM 0 HD2 PHE A 82 147.723 3.473 -3.046 1.00 0.00 H new ATOM 0 HE1 PHE A 82 146.419 1.879 1.468 1.00 0.00 H new ATOM 0 HE2 PHE A 82 149.367 2.272 -1.632 1.00 0.00 H new ATOM 0 HZ PHE A 82 148.715 1.473 0.624 1.00 0.00 H new ATOM 1094 N SER A 83 145.246 2.035 -4.980 1.00 0.00 N ATOM 1095 CA SER A 83 146.036 1.006 -5.643 1.00 0.00 C ATOM 1096 C SER A 83 147.423 0.986 -5.021 1.00 0.00 C ATOM 1097 O SER A 83 148.067 2.026 -4.884 1.00 0.00 O ATOM 1098 CB SER A 83 146.102 1.273 -7.150 1.00 0.00 C ATOM 1099 OG SER A 83 146.991 0.341 -7.753 1.00 0.00 O ATOM 0 H SER A 83 144.937 2.800 -5.580 1.00 0.00 H new ATOM 0 HA SER A 83 145.571 0.029 -5.508 1.00 0.00 H new ATOM 0 HB2 SER A 83 145.109 1.184 -7.591 1.00 0.00 H new ATOM 0 HB3 SER A 83 146.443 2.291 -7.336 1.00 0.00 H new ATOM 0 HG SER A 83 147.134 0.585 -8.691 1.00 0.00 H new ATOM 1105 N VAL A 84 147.853 -0.195 -4.589 1.00 0.00 N ATOM 1106 CA VAL A 84 149.143 -0.319 -3.916 1.00 0.00 C ATOM 1107 C VAL A 84 150.321 -0.261 -4.886 1.00 0.00 C ATOM 1108 O VAL A 84 151.373 -0.854 -4.627 1.00 0.00 O ATOM 1109 CB VAL A 84 149.184 -1.629 -3.126 1.00 0.00 C ATOM 1110 CG1 VAL A 84 150.335 -1.597 -2.114 1.00 0.00 C ATOM 1111 CG2 VAL A 84 147.861 -1.812 -2.375 1.00 0.00 C ATOM 0 H VAL A 84 147.337 -1.069 -4.690 1.00 0.00 H new ATOM 0 HA VAL A 84 149.242 0.532 -3.243 1.00 0.00 H new ATOM 0 HB VAL A 84 149.336 -2.457 -3.819 1.00 0.00 H new ATOM 0 HG11 VAL A 84 150.356 -2.534 -1.557 1.00 0.00 H new ATOM 0 HG12 VAL A 84 151.280 -1.468 -2.642 1.00 0.00 H new ATOM 0 HG13 VAL A 84 150.189 -0.767 -1.423 1.00 0.00 H new ATOM 0 HG21 VAL A 84 147.888 -2.745 -1.812 1.00 0.00 H new ATOM 0 HG22 VAL A 84 147.714 -0.978 -1.689 1.00 0.00 H new ATOM 0 HG23 VAL A 84 147.038 -1.844 -3.089 1.00 0.00 H new ATOM 1115 N VAL A 85 150.169 0.474 -5.983 1.00 0.00 N ATOM 1116 CA VAL A 85 151.252 0.603 -6.947 1.00 0.00 C ATOM 1117 C VAL A 85 151.484 2.076 -7.277 1.00 0.00 C ATOM 1118 O VAL A 85 150.536 2.853 -7.384 1.00 0.00 O ATOM 1119 CB VAL A 85 150.910 -0.160 -8.227 1.00 0.00 C ATOM 1120 CG1 VAL A 85 149.678 0.468 -8.884 1.00 0.00 C ATOM 1121 CG2 VAL A 85 152.094 -0.082 -9.194 1.00 0.00 C ATOM 0 H VAL A 85 149.318 0.982 -6.223 1.00 0.00 H new ATOM 0 HA VAL A 85 152.159 0.184 -6.512 1.00 0.00 H new ATOM 0 HB VAL A 85 150.701 -1.202 -7.984 1.00 0.00 H new ATOM 0 HG11 VAL A 85 149.435 -0.076 -9.796 1.00 0.00 H new ATOM 0 HG12 VAL A 85 148.834 0.419 -8.196 1.00 0.00 H new ATOM 0 HG13 VAL A 85 149.887 1.510 -9.128 1.00 0.00 H new ATOM 0 HG21 VAL A 85 151.854 -0.625 -10.108 1.00 0.00 H new ATOM 0 HG22 VAL A 85 152.299 0.961 -9.435 1.00 0.00 H new ATOM 0 HG23 VAL A 85 152.974 -0.526 -8.729 1.00 0.00 H new ATOM 1125 N SER A 86 152.748 2.453 -7.435 1.00 0.00 N ATOM 1126 CA SER A 86 153.093 3.835 -7.750 1.00 0.00 C ATOM 1127 C SER A 86 153.160 4.676 -6.471 1.00 0.00 C ATOM 1128 O SER A 86 152.357 4.482 -5.558 1.00 0.00 O ATOM 1129 CB SER A 86 152.053 4.432 -8.699 1.00 0.00 C ATOM 1130 OG SER A 86 151.481 3.393 -9.483 1.00 0.00 O ATOM 0 H SER A 86 153.547 1.825 -7.351 1.00 0.00 H new ATOM 0 HA SER A 86 154.071 3.844 -8.232 1.00 0.00 H new ATOM 0 HB2 SER A 86 151.276 4.944 -8.130 1.00 0.00 H new ATOM 0 HB3 SER A 86 152.518 5.177 -9.345 1.00 0.00 H new ATOM 0 HG SER A 86 150.578 3.197 -9.157 1.00 0.00 H new ATOM 1136 N PRO A 87 154.092 5.597 -6.381 1.00 0.00 N ATOM 1137 CA PRO A 87 154.246 6.470 -5.177 1.00 0.00 C ATOM 1138 C PRO A 87 153.146 7.529 -5.075 1.00 0.00 C ATOM 1139 O PRO A 87 153.105 8.303 -4.118 1.00 0.00 O ATOM 1140 CB PRO A 87 155.612 7.126 -5.382 1.00 0.00 C ATOM 1141 CG PRO A 87 155.816 7.147 -6.858 1.00 0.00 C ATOM 1142 CD PRO A 87 155.100 5.916 -7.410 1.00 0.00 C ATOM 0 HA PRO A 87 154.170 5.900 -4.251 1.00 0.00 H new ATOM 0 HB2 PRO A 87 155.631 8.134 -4.967 1.00 0.00 H new ATOM 0 HB3 PRO A 87 156.399 6.561 -4.883 1.00 0.00 H new ATOM 0 HG2 PRO A 87 155.410 8.060 -7.293 1.00 0.00 H new ATOM 0 HG3 PRO A 87 156.878 7.122 -7.104 1.00 0.00 H new ATOM 0 HD2 PRO A 87 154.635 6.124 -8.374 1.00 0.00 H new ATOM 0 HD3 PRO A 87 155.791 5.087 -7.562 1.00 0.00 H new ATOM 1150 N SER A 88 152.271 7.573 -6.075 1.00 0.00 N ATOM 1151 CA SER A 88 151.190 8.556 -6.087 1.00 0.00 C ATOM 1152 C SER A 88 149.918 8.013 -5.435 1.00 0.00 C ATOM 1153 O SER A 88 149.205 8.744 -4.748 1.00 0.00 O ATOM 1154 CB SER A 88 150.883 8.966 -7.527 1.00 0.00 C ATOM 1155 OG SER A 88 152.069 9.459 -8.138 1.00 0.00 O ATOM 0 H SER A 88 152.287 6.947 -6.880 1.00 0.00 H new ATOM 0 HA SER A 88 151.523 9.419 -5.510 1.00 0.00 H new ATOM 0 HB2 SER A 88 150.500 8.113 -8.086 1.00 0.00 H new ATOM 0 HB3 SER A 88 150.107 9.731 -7.542 1.00 0.00 H new ATOM 0 HG SER A 88 151.876 9.721 -9.062 1.00 0.00 H new ATOM 1161 N SER A 89 149.625 6.737 -5.671 1.00 0.00 N ATOM 1162 CA SER A 89 148.421 6.120 -5.117 1.00 0.00 C ATOM 1163 C SER A 89 148.419 6.143 -3.589 1.00 0.00 C ATOM 1164 O SER A 89 147.364 6.266 -2.967 1.00 0.00 O ATOM 1165 CB SER A 89 148.311 4.676 -5.606 1.00 0.00 C ATOM 1166 OG SER A 89 149.382 3.915 -5.062 1.00 0.00 O ATOM 0 H SER A 89 150.199 6.113 -6.238 1.00 0.00 H new ATOM 0 HA SER A 89 147.564 6.700 -5.461 1.00 0.00 H new ATOM 0 HB2 SER A 89 147.355 4.249 -5.303 1.00 0.00 H new ATOM 0 HB3 SER A 89 148.343 4.645 -6.695 1.00 0.00 H new ATOM 0 HG SER A 89 149.109 2.977 -4.982 1.00 0.00 H new ATOM 1172 N PHE A 90 149.597 6.016 -2.986 1.00 0.00 N ATOM 1173 CA PHE A 90 149.696 6.017 -1.527 1.00 0.00 C ATOM 1174 C PHE A 90 149.713 7.442 -0.981 1.00 0.00 C ATOM 1175 O PHE A 90 149.079 7.737 0.032 1.00 0.00 O ATOM 1176 CB PHE A 90 150.966 5.289 -1.086 1.00 0.00 C ATOM 1177 CG PHE A 90 152.034 6.301 -0.753 1.00 0.00 C ATOM 1178 CD1 PHE A 90 152.836 6.826 -1.769 1.00 0.00 C ATOM 1179 CD2 PHE A 90 152.223 6.712 0.571 1.00 0.00 C ATOM 1180 CE1 PHE A 90 153.829 7.766 -1.465 1.00 0.00 C ATOM 1181 CE2 PHE A 90 153.216 7.652 0.878 1.00 0.00 C ATOM 1182 CZ PHE A 90 154.019 8.178 -0.141 1.00 0.00 C ATOM 0 H PHE A 90 150.486 5.912 -3.475 1.00 0.00 H new ATOM 0 HA PHE A 90 148.822 5.501 -1.130 1.00 0.00 H new ATOM 0 HB2 PHE A 90 150.757 4.665 -0.217 1.00 0.00 H new ATOM 0 HB3 PHE A 90 151.312 4.626 -1.879 1.00 0.00 H new ATOM 0 HD1 PHE A 90 152.690 6.507 -2.790 1.00 0.00 H new ATOM 0 HD2 PHE A 90 151.604 6.305 1.356 1.00 0.00 H new ATOM 0 HE1 PHE A 90 154.447 8.172 -2.252 1.00 0.00 H new ATOM 0 HE2 PHE A 90 153.362 7.970 1.900 1.00 0.00 H new ATOM 0 HZ PHE A 90 154.785 8.902 0.095 1.00 0.00 H new ATOM 1192 N GLU A 91 150.451 8.317 -1.651 1.00 0.00 N ATOM 1193 CA GLU A 91 150.556 9.707 -1.221 1.00 0.00 C ATOM 1194 C GLU A 91 149.188 10.386 -1.213 1.00 0.00 C ATOM 1195 O GLU A 91 148.946 11.300 -0.425 1.00 0.00 O ATOM 1196 CB GLU A 91 151.498 10.469 -2.157 1.00 0.00 C ATOM 1197 CG GLU A 91 151.716 11.888 -1.624 1.00 0.00 C ATOM 1198 CD GLU A 91 152.561 12.691 -2.608 1.00 0.00 C ATOM 1199 OE1 GLU A 91 152.888 12.153 -3.652 1.00 0.00 O ATOM 1200 OE2 GLU A 91 152.870 13.830 -2.300 1.00 0.00 O ATOM 0 H GLU A 91 150.984 8.092 -2.491 1.00 0.00 H new ATOM 0 HA GLU A 91 150.953 9.719 -0.206 1.00 0.00 H new ATOM 0 HB2 GLU A 91 152.452 9.948 -2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 91 151.076 10.508 -3.161 1.00 0.00 H new ATOM 0 HG2 GLU A 91 150.755 12.380 -1.471 1.00 0.00 H new ATOM 0 HG3 GLU A 91 152.212 11.849 -0.654 1.00 0.00 H new ATOM 1207 N ASN A 92 148.303 9.948 -2.102 1.00 0.00 N ATOM 1208 CA ASN A 92 146.976 10.536 -2.193 1.00 0.00 C ATOM 1209 C ASN A 92 146.143 10.264 -0.939 1.00 0.00 C ATOM 1210 O ASN A 92 145.439 11.144 -0.450 1.00 0.00 O ATOM 1211 CB ASN A 92 146.246 9.965 -3.408 1.00 0.00 C ATOM 1212 CG ASN A 92 146.964 10.373 -4.689 1.00 0.00 C ATOM 1213 OD1 ASN A 92 147.740 11.328 -4.690 1.00 0.00 O ATOM 1214 ND2 ASN A 92 146.751 9.699 -5.787 1.00 0.00 N ATOM 0 H ASN A 92 148.481 9.193 -2.765 1.00 0.00 H new ATOM 0 HA ASN A 92 147.100 11.614 -2.291 1.00 0.00 H new ATOM 0 HB2 ASN A 92 146.201 8.878 -3.337 1.00 0.00 H new ATOM 0 HB3 ASN A 92 145.218 10.326 -3.427 1.00 0.00 H new ATOM 0 HD21 ASN A 92 147.228 9.964 -6.649 1.00 0.00 H new ATOM 0 HD22 ASN A 92 146.107 8.908 -5.783 1.00 0.00 H new ATOM 1219 N VAL A 93 146.197 9.034 -0.444 1.00 0.00 N ATOM 1220 CA VAL A 93 145.402 8.656 0.723 1.00 0.00 C ATOM 1221 C VAL A 93 146.143 8.833 2.040 1.00 0.00 C ATOM 1222 O VAL A 93 145.802 9.699 2.844 1.00 0.00 O ATOM 1223 CB VAL A 93 144.973 7.200 0.575 1.00 0.00 C ATOM 1224 CG1 VAL A 93 143.599 7.139 -0.096 1.00 0.00 C ATOM 1225 CG2 VAL A 93 145.995 6.466 -0.292 1.00 0.00 C ATOM 0 H VAL A 93 146.776 8.286 -0.826 1.00 0.00 H new ATOM 0 HA VAL A 93 144.540 9.323 0.757 1.00 0.00 H new ATOM 0 HB VAL A 93 144.917 6.730 1.557 1.00 0.00 H new ATOM 0 HG11 VAL A 93 143.292 6.099 -0.202 1.00 0.00 H new ATOM 0 HG12 VAL A 93 142.871 7.672 0.516 1.00 0.00 H new ATOM 0 HG13 VAL A 93 143.654 7.603 -1.081 1.00 0.00 H new ATOM 0 HG21 VAL A 93 145.696 5.424 -0.403 1.00 0.00 H new ATOM 0 HG22 VAL A 93 146.044 6.936 -1.274 1.00 0.00 H new ATOM 0 HG23 VAL A 93 146.975 6.514 0.182 1.00 0.00 H new ATOM 1229 N LYS A 94 147.128 7.985 2.268 1.00 0.00 N ATOM 1230 CA LYS A 94 147.884 8.019 3.510 1.00 0.00 C ATOM 1231 C LYS A 94 148.445 9.408 3.827 1.00 0.00 C ATOM 1232 O LYS A 94 148.862 9.650 4.959 1.00 0.00 O ATOM 1233 CB LYS A 94 149.024 7.001 3.449 1.00 0.00 C ATOM 1234 CG LYS A 94 148.446 5.579 3.438 1.00 0.00 C ATOM 1235 CD LYS A 94 149.593 4.569 3.507 1.00 0.00 C ATOM 1236 CE LYS A 94 149.029 3.148 3.472 1.00 0.00 C ATOM 1237 NZ LYS A 94 149.434 2.426 4.711 1.00 0.00 N ATOM 0 H LYS A 94 147.425 7.264 1.611 1.00 0.00 H new ATOM 0 HA LYS A 94 147.192 7.764 4.313 1.00 0.00 H new ATOM 0 HB2 LYS A 94 149.625 7.167 2.555 1.00 0.00 H new ATOM 0 HB3 LYS A 94 149.685 7.129 4.306 1.00 0.00 H new ATOM 0 HG2 LYS A 94 147.773 5.441 4.284 1.00 0.00 H new ATOM 0 HG3 LYS A 94 147.859 5.419 2.534 1.00 0.00 H new ATOM 0 HD2 LYS A 94 150.275 4.721 2.671 1.00 0.00 H new ATOM 0 HD3 LYS A 94 150.169 4.720 4.420 1.00 0.00 H new ATOM 0 HE2 LYS A 94 147.942 3.178 3.394 1.00 0.00 H new ATOM 0 HE3 LYS A 94 149.398 2.620 2.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 149.490 1.406 4.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 150.364 2.770 5.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 148.731 2.598 5.458 1.00 0.00 H new ATOM 1251 N GLU A 95 148.489 10.315 2.845 1.00 0.00 N ATOM 1252 CA GLU A 95 149.050 11.644 3.111 1.00 0.00 C ATOM 1253 C GLU A 95 148.163 12.810 2.650 1.00 0.00 C ATOM 1254 O GLU A 95 147.918 13.735 3.423 1.00 0.00 O ATOM 1255 CB GLU A 95 150.420 11.763 2.441 1.00 0.00 C ATOM 1256 CG GLU A 95 151.372 10.730 3.045 1.00 0.00 C ATOM 1257 CD GLU A 95 152.766 10.892 2.450 1.00 0.00 C ATOM 1258 OE1 GLU A 95 152.907 11.676 1.526 1.00 0.00 O ATOM 1259 OE2 GLU A 95 153.672 10.229 2.926 1.00 0.00 O ATOM 0 H GLU A 95 148.156 10.163 1.893 1.00 0.00 H new ATOM 0 HA GLU A 95 149.126 11.725 4.195 1.00 0.00 H new ATOM 0 HB2 GLU A 95 150.327 11.604 1.367 1.00 0.00 H new ATOM 0 HB3 GLU A 95 150.819 12.767 2.581 1.00 0.00 H new ATOM 0 HG2 GLU A 95 151.414 10.851 4.127 1.00 0.00 H new ATOM 0 HG3 GLU A 95 151.000 9.724 2.851 1.00 0.00 H new ATOM 1266 N LYS A 96 147.740 12.813 1.388 1.00 0.00 N ATOM 1267 CA LYS A 96 146.951 13.940 0.873 1.00 0.00 C ATOM 1268 C LYS A 96 145.504 13.980 1.382 1.00 0.00 C ATOM 1269 O LYS A 96 145.027 15.037 1.801 1.00 0.00 O ATOM 1270 CB LYS A 96 146.934 13.923 -0.654 1.00 0.00 C ATOM 1271 CG LYS A 96 146.487 15.292 -1.169 1.00 0.00 C ATOM 1272 CD LYS A 96 146.417 15.262 -2.697 1.00 0.00 C ATOM 1273 CE LYS A 96 146.164 16.676 -3.223 1.00 0.00 C ATOM 1274 NZ LYS A 96 147.373 17.515 -2.991 1.00 0.00 N ATOM 0 H LYS A 96 147.922 12.070 0.714 1.00 0.00 H new ATOM 0 HA LYS A 96 147.447 14.834 1.251 1.00 0.00 H new ATOM 0 HB2 LYS A 96 147.926 13.683 -1.038 1.00 0.00 H new ATOM 0 HB3 LYS A 96 146.257 13.148 -1.013 1.00 0.00 H new ATOM 0 HG2 LYS A 96 145.512 15.548 -0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 96 147.185 16.062 -0.841 1.00 0.00 H new ATOM 0 HD2 LYS A 96 147.348 14.871 -3.107 1.00 0.00 H new ATOM 0 HD3 LYS A 96 145.620 14.593 -3.022 1.00 0.00 H new ATOM 0 HE2 LYS A 96 145.929 16.643 -4.287 1.00 0.00 H new ATOM 0 HE3 LYS A 96 145.302 17.114 -2.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 147.366 18.322 -3.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 147.370 17.865 -2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 148.228 16.945 -3.153 1.00 0.00 H new ATOM 1288 N TRP A 97 144.789 12.856 1.343 1.00 0.00 N ATOM 1289 CA TRP A 97 143.401 12.868 1.802 1.00 0.00 C ATOM 1290 C TRP A 97 143.323 12.754 3.323 1.00 0.00 C ATOM 1291 O TRP A 97 142.398 13.278 3.943 1.00 0.00 O ATOM 1292 CB TRP A 97 142.587 11.742 1.150 1.00 0.00 C ATOM 1293 CG TRP A 97 142.565 11.920 -0.342 1.00 0.00 C ATOM 1294 CD1 TRP A 97 143.045 11.025 -1.237 1.00 0.00 C ATOM 1295 CD2 TRP A 97 142.042 13.035 -1.130 1.00 0.00 C ATOM 1296 NE1 TRP A 97 142.871 11.519 -2.512 1.00 0.00 N ATOM 1297 CE2 TRP A 97 142.253 12.752 -2.503 1.00 0.00 C ATOM 1298 CE3 TRP A 97 141.418 14.252 -0.794 1.00 0.00 C ATOM 1299 CZ2 TRP A 97 141.860 13.643 -3.502 1.00 0.00 C ATOM 1300 CZ3 TRP A 97 141.019 15.148 -1.800 1.00 0.00 C ATOM 1301 CH2 TRP A 97 141.241 14.845 -3.151 1.00 0.00 C ATOM 0 H TRP A 97 145.132 11.955 1.011 1.00 0.00 H new ATOM 0 HA TRP A 97 142.971 13.823 1.501 1.00 0.00 H new ATOM 0 HB2 TRP A 97 143.022 10.775 1.403 1.00 0.00 H new ATOM 0 HB3 TRP A 97 141.569 11.746 1.540 1.00 0.00 H new ATOM 0 HD1 TRP A 97 143.494 10.074 -0.991 1.00 0.00 H new ATOM 0 HE1 TRP A 97 143.164 11.032 -3.359 1.00 0.00 H new ATOM 0 HE3 TRP A 97 141.245 14.498 0.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 142.033 13.405 -4.541 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 140.538 16.077 -1.531 1.00 0.00 H new ATOM 0 HH2 TRP A 97 140.934 15.540 -3.919 1.00 0.00 H new ATOM 1312 N VAL A 98 144.296 12.076 3.923 1.00 0.00 N ATOM 1313 CA VAL A 98 144.310 11.920 5.374 1.00 0.00 C ATOM 1314 C VAL A 98 143.995 13.245 6.066 1.00 0.00 C ATOM 1315 O VAL A 98 143.048 13.318 6.848 1.00 0.00 O ATOM 1316 CB VAL A 98 145.666 11.382 5.845 1.00 0.00 C ATOM 1317 CG1 VAL A 98 145.937 11.841 7.282 1.00 0.00 C ATOM 1318 CG2 VAL A 98 145.640 9.852 5.807 1.00 0.00 C ATOM 0 H VAL A 98 145.074 11.632 3.436 1.00 0.00 H new ATOM 0 HA VAL A 98 143.538 11.200 5.644 1.00 0.00 H new ATOM 0 HB VAL A 98 146.451 11.760 5.189 1.00 0.00 H new ATOM 0 HG11 VAL A 98 146.902 11.456 7.611 1.00 0.00 H new ATOM 0 HG12 VAL A 98 145.949 12.930 7.320 1.00 0.00 H new ATOM 0 HG13 VAL A 98 145.153 11.464 7.938 1.00 0.00 H new ATOM 0 HG21 VAL A 98 146.602 9.463 6.141 1.00 0.00 H new ATOM 0 HG22 VAL A 98 144.852 9.485 6.465 1.00 0.00 H new ATOM 0 HG23 VAL A 98 145.447 9.517 4.788 1.00 0.00 H new ATOM 1322 N PRO A 99 144.742 14.297 5.803 1.00 0.00 N ATOM 1323 CA PRO A 99 144.475 15.616 6.437 1.00 0.00 C ATOM 1324 C PRO A 99 143.056 16.085 6.140 1.00 0.00 C ATOM 1325 O PRO A 99 142.391 16.666 6.998 1.00 0.00 O ATOM 1326 CB PRO A 99 145.515 16.562 5.822 1.00 0.00 C ATOM 1327 CG PRO A 99 146.056 15.853 4.626 1.00 0.00 C ATOM 1328 CD PRO A 99 145.899 14.359 4.896 1.00 0.00 C ATOM 0 HA PRO A 99 144.554 15.576 7.523 1.00 0.00 H new ATOM 0 HB2 PRO A 99 145.061 17.512 5.541 1.00 0.00 H new ATOM 0 HB3 PRO A 99 146.308 16.787 6.535 1.00 0.00 H new ATOM 0 HG2 PRO A 99 145.514 16.143 3.726 1.00 0.00 H new ATOM 0 HG3 PRO A 99 147.103 16.110 4.464 1.00 0.00 H new ATOM 0 HD2 PRO A 99 145.720 13.801 3.977 1.00 0.00 H new ATOM 0 HD3 PRO A 99 146.793 13.937 5.355 1.00 0.00 H new ATOM 1336 N GLU A 100 142.589 15.808 4.924 1.00 0.00 N ATOM 1337 CA GLU A 100 141.236 16.192 4.542 1.00 0.00 C ATOM 1338 C GLU A 100 140.224 15.455 5.415 1.00 0.00 C ATOM 1339 O GLU A 100 139.230 16.032 5.855 1.00 0.00 O ATOM 1340 CB GLU A 100 140.987 15.855 3.070 1.00 0.00 C ATOM 1341 CG GLU A 100 139.632 16.420 2.637 1.00 0.00 C ATOM 1342 CD GLU A 100 139.692 17.943 2.594 1.00 0.00 C ATOM 1343 OE1 GLU A 100 140.782 18.468 2.439 1.00 0.00 O ATOM 1344 OE2 GLU A 100 138.648 18.562 2.715 1.00 0.00 O ATOM 0 H GLU A 100 143.120 15.327 4.198 1.00 0.00 H new ATOM 0 HA GLU A 100 141.122 17.267 4.684 1.00 0.00 H new ATOM 0 HB2 GLU A 100 141.781 16.273 2.451 1.00 0.00 H new ATOM 0 HB3 GLU A 100 141.005 14.775 2.925 1.00 0.00 H new ATOM 0 HG2 GLU A 100 139.363 16.031 1.655 1.00 0.00 H new ATOM 0 HG3 GLU A 100 138.856 16.098 3.331 1.00 0.00 H new ATOM 1351 N ILE A 101 140.494 14.174 5.668 1.00 0.00 N ATOM 1352 CA ILE A 101 139.610 13.365 6.501 1.00 0.00 C ATOM 1353 C ILE A 101 139.657 13.847 7.945 1.00 0.00 C ATOM 1354 O ILE A 101 138.636 13.893 8.632 1.00 0.00 O ATOM 1355 CB ILE A 101 140.031 11.895 6.443 1.00 0.00 C ATOM 1356 CG1 ILE A 101 139.941 11.394 5.000 1.00 0.00 C ATOM 1357 CG2 ILE A 101 139.104 11.062 7.330 1.00 0.00 C ATOM 1358 CD1 ILE A 101 140.511 9.976 4.917 1.00 0.00 C ATOM 0 H ILE A 101 141.311 13.679 5.311 1.00 0.00 H new ATOM 0 HA ILE A 101 138.593 13.465 6.122 1.00 0.00 H new ATOM 0 HB ILE A 101 141.057 11.798 6.798 1.00 0.00 H new ATOM 0 HG12 ILE A 101 138.904 11.401 4.665 1.00 0.00 H new ATOM 0 HG13 ILE A 101 140.494 12.059 4.337 1.00 0.00 H new ATOM 0 HG21 ILE A 101 139.404 10.015 7.288 1.00 0.00 H new ATOM 0 HG22 ILE A 101 139.168 11.417 8.358 1.00 0.00 H new ATOM 0 HG23 ILE A 101 138.078 11.159 6.976 1.00 0.00 H new ATOM 0 HD11 ILE A 101 140.447 9.618 3.889 1.00 0.00 H new ATOM 0 HD12 ILE A 101 141.554 9.984 5.235 1.00 0.00 H new ATOM 0 HD13 ILE A 101 139.938 9.315 5.568 1.00 0.00 H new ATOM 1362 N THR A 102 140.855 14.200 8.400 1.00 0.00 N ATOM 1363 CA THR A 102 141.027 14.674 9.769 1.00 0.00 C ATOM 1364 C THR A 102 140.096 15.849 10.050 1.00 0.00 C ATOM 1365 O THR A 102 139.452 15.907 11.097 1.00 0.00 O ATOM 1366 CB THR A 102 142.477 15.108 9.997 1.00 0.00 C ATOM 1367 OG1 THR A 102 143.348 14.038 9.660 1.00 0.00 O ATOM 1368 CG2 THR A 102 142.673 15.488 11.466 1.00 0.00 C ATOM 0 H THR A 102 141.712 14.168 7.848 1.00 0.00 H new ATOM 0 HA THR A 102 140.781 13.857 10.447 1.00 0.00 H new ATOM 0 HB THR A 102 142.702 15.970 9.369 1.00 0.00 H new ATOM 0 HG1 THR A 102 143.352 13.913 8.688 1.00 0.00 H new ATOM 0 HG21 THR A 102 143.706 15.797 11.627 1.00 0.00 H new ATOM 0 HG22 THR A 102 142.004 16.310 11.722 1.00 0.00 H new ATOM 0 HG23 THR A 102 142.449 14.628 12.097 1.00 0.00 H new ATOM 1373 N HIS A 103 140.027 16.780 9.104 1.00 0.00 N ATOM 1374 CA HIS A 103 139.168 17.947 9.255 1.00 0.00 C ATOM 1375 C HIS A 103 137.697 17.545 9.260 1.00 0.00 C ATOM 1376 O HIS A 103 136.898 18.078 10.030 1.00 0.00 O ATOM 1377 CB HIS A 103 139.424 18.930 8.112 1.00 0.00 C ATOM 1378 CG HIS A 103 138.593 20.166 8.314 1.00 0.00 C ATOM 1379 ND1 HIS A 103 138.818 21.046 9.361 1.00 0.00 N ATOM 1380 CD2 HIS A 103 137.534 20.684 7.611 1.00 0.00 C ATOM 1381 CE1 HIS A 103 137.915 22.039 9.258 1.00 0.00 C ATOM 1382 NE2 HIS A 103 137.108 21.867 8.208 1.00 0.00 N ATOM 0 H HIS A 103 140.552 16.749 8.230 1.00 0.00 H new ATOM 0 HA HIS A 103 139.401 18.421 10.208 1.00 0.00 H new ATOM 0 HB2 HIS A 103 140.481 19.193 8.075 1.00 0.00 H new ATOM 0 HB3 HIS A 103 139.177 18.466 7.157 1.00 0.00 H new ATOM 0 HD2 HIS A 103 137.097 20.241 6.728 1.00 0.00 H new ATOM 0 HE1 HIS A 103 137.851 22.873 9.941 1.00 0.00 H new ATOM 0 HE2 HIS A 103 136.344 22.472 7.908 1.00 0.00 H new ATOM 1390 N HIS A 104 137.344 16.610 8.382 1.00 0.00 N ATOM 1391 CA HIS A 104 135.963 16.150 8.276 1.00 0.00 C ATOM 1392 C HIS A 104 135.454 15.594 9.603 1.00 0.00 C ATOM 1393 O HIS A 104 134.346 15.917 10.032 1.00 0.00 O ATOM 1394 CB HIS A 104 135.859 15.069 7.199 1.00 0.00 C ATOM 1395 CG HIS A 104 134.431 14.614 7.080 1.00 0.00 C ATOM 1396 ND1 HIS A 104 133.855 13.740 7.990 1.00 0.00 N ATOM 1397 CD2 HIS A 104 133.449 14.902 6.165 1.00 0.00 C ATOM 1398 CE1 HIS A 104 132.582 13.534 7.606 1.00 0.00 C ATOM 1399 NE2 HIS A 104 132.283 14.219 6.498 1.00 0.00 N ATOM 0 H HIS A 104 137.992 16.158 7.737 1.00 0.00 H new ATOM 0 HA HIS A 104 135.346 17.007 8.006 1.00 0.00 H new ATOM 0 HB2 HIS A 104 136.208 15.459 6.243 1.00 0.00 H new ATOM 0 HB3 HIS A 104 136.501 14.225 7.453 1.00 0.00 H new ATOM 0 HD2 HIS A 104 133.564 15.559 5.316 1.00 0.00 H new ATOM 0 HE1 HIS A 104 131.887 12.894 8.129 1.00 0.00 H new ATOM 0 HE2 HIS A 104 131.392 14.237 6.003 1.00 0.00 H new ATOM 1407 N CYS A 105 136.257 14.752 10.246 1.00 0.00 N ATOM 1408 CA CYS A 105 135.852 14.160 11.516 1.00 0.00 C ATOM 1409 C CYS A 105 137.034 14.059 12.476 1.00 0.00 C ATOM 1410 O CYS A 105 138.191 14.135 12.066 1.00 0.00 O ATOM 1411 CB CYS A 105 135.268 12.766 11.277 1.00 0.00 C ATOM 1412 SG CYS A 105 136.253 11.538 12.172 1.00 0.00 S ATOM 0 H CYS A 105 137.179 14.467 9.915 1.00 0.00 H new ATOM 0 HA CYS A 105 135.096 14.804 11.965 1.00 0.00 H new ATOM 0 HB2 CYS A 105 134.232 12.732 11.613 1.00 0.00 H new ATOM 0 HB3 CYS A 105 135.265 12.539 10.211 1.00 0.00 H new ATOM 0 HG CYS A 105 137.487 11.941 12.245 1.00 0.00 H new ATOM 1418 N PRO A 106 136.755 13.878 13.741 1.00 0.00 N ATOM 1419 CA PRO A 106 137.804 13.749 14.794 1.00 0.00 C ATOM 1420 C PRO A 106 138.511 12.394 14.728 1.00 0.00 C ATOM 1421 O PRO A 106 138.551 11.757 13.675 1.00 0.00 O ATOM 1422 CB PRO A 106 137.019 13.902 16.100 1.00 0.00 C ATOM 1423 CG PRO A 106 135.635 13.444 15.780 1.00 0.00 C ATOM 1424 CD PRO A 106 135.397 13.779 14.308 1.00 0.00 C ATOM 0 HA PRO A 106 138.599 14.487 14.684 1.00 0.00 H new ATOM 0 HB2 PRO A 106 137.458 13.301 16.896 1.00 0.00 H new ATOM 0 HB3 PRO A 106 137.022 14.937 16.443 1.00 0.00 H new ATOM 0 HG2 PRO A 106 135.530 12.373 15.956 1.00 0.00 H new ATOM 0 HG3 PRO A 106 134.904 13.945 16.415 1.00 0.00 H new ATOM 0 HD2 PRO A 106 134.813 13.004 13.812 1.00 0.00 H new ATOM 0 HD3 PRO A 106 134.848 14.714 14.195 1.00 0.00 H new ATOM 1432 N LYS A 107 139.066 11.958 15.854 1.00 0.00 N ATOM 1433 CA LYS A 107 139.764 10.680 15.903 1.00 0.00 C ATOM 1434 C LYS A 107 138.768 9.534 16.058 1.00 0.00 C ATOM 1435 O LYS A 107 138.009 9.484 17.027 1.00 0.00 O ATOM 1436 CB LYS A 107 140.742 10.668 17.077 1.00 0.00 C ATOM 1437 CG LYS A 107 141.805 11.750 16.872 1.00 0.00 C ATOM 1438 CD LYS A 107 142.838 11.669 17.998 1.00 0.00 C ATOM 1439 CE LYS A 107 143.839 12.816 17.859 1.00 0.00 C ATOM 1440 NZ LYS A 107 145.131 12.287 17.338 1.00 0.00 N ATOM 0 H LYS A 107 139.046 12.467 16.738 1.00 0.00 H new ATOM 0 HA LYS A 107 140.312 10.548 14.970 1.00 0.00 H new ATOM 0 HB2 LYS A 107 140.207 10.842 18.011 1.00 0.00 H new ATOM 0 HB3 LYS A 107 141.216 9.690 17.159 1.00 0.00 H new ATOM 0 HG2 LYS A 107 142.293 11.618 15.906 1.00 0.00 H new ATOM 0 HG3 LYS A 107 141.339 12.735 16.861 1.00 0.00 H new ATOM 0 HD2 LYS A 107 142.340 11.723 18.966 1.00 0.00 H new ATOM 0 HD3 LYS A 107 143.358 10.712 17.960 1.00 0.00 H new ATOM 0 HE2 LYS A 107 143.446 13.576 17.184 1.00 0.00 H new ATOM 0 HE3 LYS A 107 143.994 13.297 18.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 145.920 12.743 17.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 145.172 11.259 17.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 145.204 12.489 16.320 1.00 0.00 H new ATOM 1454 N THR A 108 138.779 8.615 15.099 1.00 0.00 N ATOM 1455 CA THR A 108 137.877 7.470 15.134 1.00 0.00 C ATOM 1456 C THR A 108 138.487 6.300 14.370 1.00 0.00 C ATOM 1457 O THR A 108 139.333 6.495 13.498 1.00 0.00 O ATOM 1458 CB THR A 108 136.533 7.850 14.505 1.00 0.00 C ATOM 1459 OG1 THR A 108 136.726 8.916 13.587 1.00 0.00 O ATOM 1460 CG2 THR A 108 135.560 8.291 15.600 1.00 0.00 C ATOM 0 H THR A 108 139.400 8.640 14.290 1.00 0.00 H new ATOM 0 HA THR A 108 137.720 7.175 16.172 1.00 0.00 H new ATOM 0 HB THR A 108 136.121 6.987 13.981 1.00 0.00 H new ATOM 0 HG1 THR A 108 136.117 9.651 13.807 1.00 0.00 H new ATOM 0 HG21 THR A 108 134.604 8.561 15.150 1.00 0.00 H new ATOM 0 HG22 THR A 108 135.411 7.473 16.305 1.00 0.00 H new ATOM 0 HG23 THR A 108 135.970 9.153 16.126 1.00 0.00 H new ATOM 1465 N PRO A 109 138.076 5.098 14.668 1.00 0.00 N ATOM 1466 CA PRO A 109 138.603 3.887 13.980 1.00 0.00 C ATOM 1467 C PRO A 109 138.496 4.015 12.463 1.00 0.00 C ATOM 1468 O PRO A 109 137.449 4.390 11.933 1.00 0.00 O ATOM 1469 CB PRO A 109 137.725 2.738 14.498 1.00 0.00 C ATOM 1470 CG PRO A 109 136.596 3.375 15.250 1.00 0.00 C ATOM 1471 CD PRO A 109 137.075 4.758 15.681 1.00 0.00 C ATOM 0 HA PRO A 109 139.661 3.729 14.187 1.00 0.00 H new ATOM 0 HB2 PRO A 109 137.350 2.133 13.672 1.00 0.00 H new ATOM 0 HB3 PRO A 109 138.297 2.073 15.145 1.00 0.00 H new ATOM 0 HG2 PRO A 109 135.709 3.452 14.622 1.00 0.00 H new ATOM 0 HG3 PRO A 109 136.322 2.774 16.117 1.00 0.00 H new ATOM 0 HD2 PRO A 109 136.258 5.480 15.698 1.00 0.00 H new ATOM 0 HD3 PRO A 109 137.506 4.741 16.682 1.00 0.00 H new ATOM 1479 N PHE A 110 139.586 3.707 11.767 1.00 0.00 N ATOM 1480 CA PHE A 110 139.593 3.801 10.312 1.00 0.00 C ATOM 1481 C PHE A 110 140.210 2.555 9.701 1.00 0.00 C ATOM 1482 O PHE A 110 141.279 2.117 10.116 1.00 0.00 O ATOM 1483 CB PHE A 110 140.390 5.029 9.854 1.00 0.00 C ATOM 1484 CG PHE A 110 140.904 5.796 11.051 1.00 0.00 C ATOM 1485 CD1 PHE A 110 141.678 5.148 12.023 1.00 0.00 C ATOM 1486 CD2 PHE A 110 140.611 7.158 11.185 1.00 0.00 C ATOM 1487 CE1 PHE A 110 142.156 5.861 13.128 1.00 0.00 C ATOM 1488 CE2 PHE A 110 141.090 7.872 12.289 1.00 0.00 C ATOM 1489 CZ PHE A 110 141.862 7.224 13.261 1.00 0.00 C ATOM 0 H PHE A 110 140.465 3.394 12.180 1.00 0.00 H new ATOM 0 HA PHE A 110 138.560 3.896 9.979 1.00 0.00 H new ATOM 0 HB2 PHE A 110 141.225 4.716 9.228 1.00 0.00 H new ATOM 0 HB3 PHE A 110 139.758 5.674 9.244 1.00 0.00 H new ATOM 0 HD1 PHE A 110 141.906 4.097 11.919 1.00 0.00 H new ATOM 0 HD2 PHE A 110 140.015 7.658 10.436 1.00 0.00 H new ATOM 0 HE1 PHE A 110 142.751 5.361 13.878 1.00 0.00 H new ATOM 0 HE2 PHE A 110 140.864 8.923 12.391 1.00 0.00 H new ATOM 0 HZ PHE A 110 142.231 7.775 14.113 1.00 0.00 H new ATOM 1499 N LEU A 111 139.541 1.991 8.709 1.00 0.00 N ATOM 1500 CA LEU A 111 140.060 0.794 8.057 1.00 0.00 C ATOM 1501 C LEU A 111 141.026 1.160 6.935 1.00 0.00 C ATOM 1502 O LEU A 111 140.700 1.958 6.057 1.00 0.00 O ATOM 1503 CB LEU A 111 138.908 -0.044 7.496 1.00 0.00 C ATOM 1504 CG LEU A 111 138.170 -0.731 8.648 1.00 0.00 C ATOM 1505 CD1 LEU A 111 137.404 0.310 9.468 1.00 0.00 C ATOM 1506 CD2 LEU A 111 137.183 -1.759 8.085 1.00 0.00 C ATOM 0 H LEU A 111 138.653 2.333 8.341 1.00 0.00 H new ATOM 0 HA LEU A 111 140.600 0.210 8.802 1.00 0.00 H new ATOM 0 HB2 LEU A 111 138.221 0.591 6.937 1.00 0.00 H new ATOM 0 HB3 LEU A 111 139.292 -0.790 6.800 1.00 0.00 H new ATOM 0 HG LEU A 111 138.896 -1.233 9.288 1.00 0.00 H new ATOM 0 HD11 LEU A 111 136.881 -0.185 10.286 1.00 0.00 H new ATOM 0 HD12 LEU A 111 138.104 1.040 9.874 1.00 0.00 H new ATOM 0 HD13 LEU A 111 136.681 0.817 8.829 1.00 0.00 H new ATOM 0 HD21 LEU A 111 136.658 -2.247 8.906 1.00 0.00 H new ATOM 0 HD22 LEU A 111 136.461 -1.256 7.441 1.00 0.00 H new ATOM 0 HD23 LEU A 111 137.726 -2.506 7.506 1.00 0.00 H new ATOM 1512 N LEU A 112 142.212 0.555 6.967 1.00 0.00 N ATOM 1513 CA LEU A 112 143.220 0.808 5.941 1.00 0.00 C ATOM 1514 C LEU A 112 143.079 -0.226 4.835 1.00 0.00 C ATOM 1515 O LEU A 112 142.992 -1.424 5.107 1.00 0.00 O ATOM 1516 CB LEU A 112 144.623 0.722 6.542 1.00 0.00 C ATOM 1517 CG LEU A 112 145.658 1.125 5.486 1.00 0.00 C ATOM 1518 CD1 LEU A 112 145.535 2.622 5.181 1.00 0.00 C ATOM 1519 CD2 LEU A 112 147.070 0.830 6.004 1.00 0.00 C ATOM 0 H LEU A 112 142.497 -0.109 7.687 1.00 0.00 H new ATOM 0 HA LEU A 112 143.072 1.809 5.536 1.00 0.00 H new ATOM 0 HB2 LEU A 112 144.699 1.377 7.410 1.00 0.00 H new ATOM 0 HB3 LEU A 112 144.819 -0.292 6.890 1.00 0.00 H new ATOM 0 HG LEU A 112 145.476 0.552 4.577 1.00 0.00 H new ATOM 0 HD11 LEU A 112 146.273 2.902 4.430 1.00 0.00 H new ATOM 0 HD12 LEU A 112 144.535 2.836 4.804 1.00 0.00 H new ATOM 0 HD13 LEU A 112 145.709 3.194 6.092 1.00 0.00 H new ATOM 0 HD21 LEU A 112 147.802 1.118 5.250 1.00 0.00 H new ATOM 0 HD22 LEU A 112 147.248 1.397 6.918 1.00 0.00 H new ATOM 0 HD23 LEU A 112 147.165 -0.235 6.214 1.00 0.00 H new ATOM 1525 N VAL A 113 143.038 0.229 3.590 1.00 0.00 N ATOM 1526 CA VAL A 113 142.885 -0.702 2.481 1.00 0.00 C ATOM 1527 C VAL A 113 143.712 -0.287 1.273 1.00 0.00 C ATOM 1528 O VAL A 113 144.097 0.872 1.125 1.00 0.00 O ATOM 1529 CB VAL A 113 141.411 -0.806 2.081 1.00 0.00 C ATOM 1530 CG1 VAL A 113 141.235 -1.924 1.051 1.00 0.00 C ATOM 1531 CG2 VAL A 113 140.571 -1.123 3.320 1.00 0.00 C ATOM 0 H VAL A 113 143.107 1.212 3.326 1.00 0.00 H new ATOM 0 HA VAL A 113 143.247 -1.673 2.819 1.00 0.00 H new ATOM 0 HB VAL A 113 141.086 0.140 1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 113 140.185 -1.996 0.768 1.00 0.00 H new ATOM 0 HG12 VAL A 113 141.835 -1.703 0.168 1.00 0.00 H new ATOM 0 HG13 VAL A 113 141.560 -2.871 1.482 1.00 0.00 H new ATOM 0 HG21 VAL A 113 139.521 -1.198 3.038 1.00 0.00 H new ATOM 0 HG22 VAL A 113 140.899 -2.069 3.750 1.00 0.00 H new ATOM 0 HG23 VAL A 113 140.694 -0.328 4.056 1.00 0.00 H new ATOM 1535 N GLY A 114 143.957 -1.257 0.403 1.00 0.00 N ATOM 1536 CA GLY A 114 144.712 -1.024 -0.819 1.00 0.00 C ATOM 1537 C GLY A 114 144.018 -1.722 -1.979 1.00 0.00 C ATOM 1538 O GLY A 114 143.156 -2.574 -1.763 1.00 0.00 O ATOM 0 H GLY A 114 143.641 -2.219 0.523 1.00 0.00 H new ATOM 0 HA2 GLY A 114 144.787 0.046 -1.015 1.00 0.00 H new ATOM 0 HA3 GLY A 114 145.729 -1.400 -0.709 1.00 0.00 H new ATOM 1542 N THR A 115 144.396 -1.381 -3.208 1.00 0.00 N ATOM 1543 CA THR A 115 143.791 -2.021 -4.369 1.00 0.00 C ATOM 1544 C THR A 115 144.868 -2.521 -5.322 1.00 0.00 C ATOM 1545 O THR A 115 146.057 -2.264 -5.127 1.00 0.00 O ATOM 1546 CB THR A 115 142.836 -1.082 -5.116 1.00 0.00 C ATOM 1547 OG1 THR A 115 143.552 -0.389 -6.123 1.00 0.00 O ATOM 1548 CG2 THR A 115 142.196 -0.078 -4.152 1.00 0.00 C ATOM 0 H THR A 115 145.104 -0.679 -3.423 1.00 0.00 H new ATOM 0 HA THR A 115 143.208 -2.865 -4.000 1.00 0.00 H new ATOM 0 HB THR A 115 142.043 -1.676 -5.569 1.00 0.00 H new ATOM 0 HG1 THR A 115 143.456 0.577 -5.987 1.00 0.00 H new ATOM 0 HG21 THR A 115 141.523 0.578 -4.704 1.00 0.00 H new ATOM 0 HG22 THR A 115 141.634 -0.615 -3.388 1.00 0.00 H new ATOM 0 HG23 THR A 115 142.975 0.518 -3.678 1.00 0.00 H new ATOM 1553 N GLN A 116 144.441 -3.257 -6.337 1.00 0.00 N ATOM 1554 CA GLN A 116 145.366 -3.824 -7.310 1.00 0.00 C ATOM 1555 C GLN A 116 146.501 -4.556 -6.603 1.00 0.00 C ATOM 1556 O GLN A 116 147.571 -4.726 -7.177 1.00 0.00 O ATOM 1557 CB GLN A 116 145.957 -2.731 -8.197 1.00 0.00 C ATOM 1558 CG GLN A 116 144.843 -2.050 -8.992 1.00 0.00 C ATOM 1559 CD GLN A 116 145.455 -1.184 -10.085 1.00 0.00 C ATOM 1560 OE1 GLN A 116 146.745 -1.223 -10.287 1.00 0.00 O flip ATOM 1561 NE2 GLN A 116 144.740 -0.464 -10.783 1.00 0.00 N flip ATOM 0 H GLN A 116 143.460 -3.476 -6.509 1.00 0.00 H new ATOM 0 HA GLN A 116 144.807 -4.526 -7.929 1.00 0.00 H new ATOM 0 HB2 GLN A 116 146.480 -1.997 -7.585 1.00 0.00 H new ATOM 0 HB3 GLN A 116 146.692 -3.160 -8.878 1.00 0.00 H new ATOM 0 HG2 GLN A 116 144.186 -2.800 -9.433 1.00 0.00 H new ATOM 0 HG3 GLN A 116 144.230 -1.439 -8.329 1.00 0.00 H new ATOM 0 HE21 GLN A 116 143.733 -0.436 -10.623 1.00 0.00 H new ATOM 0 HE22 GLN A 116 145.155 0.104 -11.522 1.00 0.00 H new ATOM 1568 N ILE A 117 146.246 -5.000 -5.365 1.00 0.00 N ATOM 1569 CA ILE A 117 147.258 -5.722 -4.557 1.00 0.00 C ATOM 1570 C ILE A 117 148.697 -5.458 -5.019 1.00 0.00 C ATOM 1571 O ILE A 117 149.532 -6.346 -4.942 1.00 0.00 O ATOM 1572 CB ILE A 117 146.983 -7.245 -4.571 1.00 0.00 C ATOM 1573 CG1 ILE A 117 148.001 -8.046 -3.723 1.00 0.00 C ATOM 1574 CG2 ILE A 117 147.079 -7.776 -6.003 1.00 0.00 C ATOM 1575 CD1 ILE A 117 148.486 -7.271 -2.488 1.00 0.00 C ATOM 0 H ILE A 117 145.350 -4.876 -4.894 1.00 0.00 H new ATOM 0 HA ILE A 117 147.166 -5.336 -3.542 1.00 0.00 H new ATOM 0 HB ILE A 117 145.986 -7.378 -4.150 1.00 0.00 H new ATOM 0 HG12 ILE A 117 147.544 -8.982 -3.403 1.00 0.00 H new ATOM 0 HG13 ILE A 117 148.859 -8.306 -4.343 1.00 0.00 H new ATOM 0 HG21 ILE A 117 146.885 -8.849 -6.007 1.00 0.00 H new ATOM 0 HG22 ILE A 117 146.343 -7.271 -6.628 1.00 0.00 H new ATOM 0 HG23 ILE A 117 148.078 -7.587 -6.395 1.00 0.00 H new ATOM 0 HD11 ILE A 117 149.197 -7.881 -1.932 1.00 0.00 H new ATOM 0 HD12 ILE A 117 148.970 -6.347 -2.805 1.00 0.00 H new ATOM 0 HD13 ILE A 117 147.635 -7.034 -1.850 1.00 0.00 H new ATOM 1579 N ASP A 118 148.990 -4.266 -5.533 1.00 0.00 N ATOM 1580 CA ASP A 118 150.337 -3.950 -6.021 1.00 0.00 C ATOM 1581 C ASP A 118 150.429 -4.218 -7.520 1.00 0.00 C ATOM 1582 O ASP A 118 151.356 -4.868 -7.997 1.00 0.00 O ATOM 1583 CB ASP A 118 151.417 -4.745 -5.277 1.00 0.00 C ATOM 1584 CG ASP A 118 152.743 -3.994 -5.336 1.00 0.00 C ATOM 1585 OD1 ASP A 118 152.830 -3.043 -6.095 1.00 0.00 O ATOM 1586 OD2 ASP A 118 153.652 -4.381 -4.618 1.00 0.00 O ATOM 0 H ASP A 118 148.319 -3.504 -5.624 1.00 0.00 H new ATOM 0 HA ASP A 118 150.516 -2.892 -5.829 1.00 0.00 H new ATOM 0 HB2 ASP A 118 151.120 -4.897 -4.239 1.00 0.00 H new ATOM 0 HB3 ASP A 118 151.528 -5.733 -5.724 1.00 0.00 H new ATOM 1591 N LEU A 119 149.441 -3.704 -8.246 1.00 0.00 N ATOM 1592 CA LEU A 119 149.365 -3.864 -9.695 1.00 0.00 C ATOM 1593 C LEU A 119 148.868 -5.257 -10.064 1.00 0.00 C ATOM 1594 O LEU A 119 149.664 -6.167 -10.276 1.00 0.00 O ATOM 1595 CB LEU A 119 150.729 -3.589 -10.338 1.00 0.00 C ATOM 1596 CG LEU A 119 150.559 -2.618 -11.508 1.00 0.00 C ATOM 1597 CD1 LEU A 119 151.933 -2.248 -12.072 1.00 0.00 C ATOM 1598 CD2 LEU A 119 149.722 -3.280 -12.607 1.00 0.00 C ATOM 0 H LEU A 119 148.672 -3.166 -7.848 1.00 0.00 H new ATOM 0 HA LEU A 119 148.649 -3.138 -10.080 1.00 0.00 H new ATOM 0 HB2 LEU A 119 151.412 -3.169 -9.600 1.00 0.00 H new ATOM 0 HB3 LEU A 119 151.172 -4.521 -10.688 1.00 0.00 H new ATOM 0 HG LEU A 119 150.054 -1.718 -11.158 1.00 0.00 H new ATOM 0 HD11 LEU A 119 151.810 -1.556 -12.905 1.00 0.00 H new ATOM 0 HD12 LEU A 119 152.531 -1.775 -11.293 1.00 0.00 H new ATOM 0 HD13 LEU A 119 152.438 -3.149 -12.420 1.00 0.00 H new ATOM 0 HD21 LEU A 119 149.602 -2.587 -13.440 1.00 0.00 H new ATOM 0 HD22 LEU A 119 150.226 -4.182 -12.955 1.00 0.00 H new ATOM 0 HD23 LEU A 119 148.742 -3.543 -12.209 1.00 0.00 H new ATOM 1604 N ARG A 120 147.535 -5.387 -10.133 1.00 0.00 N ATOM 1605 CA ARG A 120 146.867 -6.649 -10.476 1.00 0.00 C ATOM 1606 C ARG A 120 147.843 -7.816 -10.555 1.00 0.00 C ATOM 1607 O ARG A 120 147.941 -8.498 -11.574 1.00 0.00 O ATOM 1608 CB ARG A 120 146.121 -6.499 -11.806 1.00 0.00 C ATOM 1609 CG ARG A 120 147.096 -6.076 -12.908 1.00 0.00 C ATOM 1610 CD ARG A 120 146.308 -5.670 -14.153 1.00 0.00 C ATOM 1611 NE ARG A 120 147.218 -5.395 -15.257 1.00 0.00 N ATOM 1612 CZ ARG A 120 147.686 -6.376 -16.022 1.00 0.00 C ATOM 1613 NH1 ARG A 120 147.338 -7.611 -15.786 1.00 0.00 N ATOM 1614 NH2 ARG A 120 148.496 -6.104 -17.009 1.00 0.00 N ATOM 0 H ARG A 120 146.890 -4.618 -9.952 1.00 0.00 H new ATOM 0 HA ARG A 120 146.159 -6.871 -9.678 1.00 0.00 H new ATOM 0 HB2 ARG A 120 145.644 -7.442 -12.073 1.00 0.00 H new ATOM 0 HB3 ARG A 120 145.328 -5.758 -11.706 1.00 0.00 H new ATOM 0 HG2 ARG A 120 147.711 -5.244 -12.565 1.00 0.00 H new ATOM 0 HG3 ARG A 120 147.774 -6.896 -13.144 1.00 0.00 H new ATOM 0 HD2 ARG A 120 145.618 -6.466 -14.431 1.00 0.00 H new ATOM 0 HD3 ARG A 120 145.706 -4.787 -13.939 1.00 0.00 H new ATOM 0 HE ARG A 120 147.501 -4.433 -15.446 1.00 0.00 H new ATOM 0 HH11 ARG A 120 146.706 -7.824 -15.014 1.00 0.00 H new ATOM 0 HH12 ARG A 120 147.698 -8.363 -16.374 1.00 0.00 H new ATOM 0 HH21 ARG A 120 148.770 -5.139 -17.193 1.00 0.00 H new ATOM 0 HH22 ARG A 120 148.855 -6.857 -17.596 1.00 0.00 H new ATOM 1866 N ILE A 137 154.699 -0.113 -2.348 1.00 0.00 N ATOM 1867 CA ILE A 137 154.400 -0.056 -0.916 1.00 0.00 C ATOM 1868 C ILE A 137 153.544 -1.245 -0.489 1.00 0.00 C ATOM 1869 O ILE A 137 152.319 -1.188 -0.565 1.00 0.00 O ATOM 1870 CB ILE A 137 153.659 1.248 -0.609 1.00 0.00 C ATOM 1871 CG1 ILE A 137 153.070 1.192 0.802 1.00 0.00 C ATOM 1872 CG2 ILE A 137 152.529 1.439 -1.622 1.00 0.00 C ATOM 1873 CD1 ILE A 137 152.853 2.615 1.319 1.00 0.00 C ATOM 0 HA ILE A 137 155.337 -0.094 -0.361 1.00 0.00 H new ATOM 0 HB ILE A 137 154.358 2.082 -0.674 1.00 0.00 H new ATOM 0 HG12 ILE A 137 152.125 0.649 0.792 1.00 0.00 H new ATOM 0 HG13 ILE A 137 153.742 0.650 1.467 1.00 0.00 H new ATOM 0 HG21 ILE A 137 152.000 2.367 -1.406 1.00 0.00 H new ATOM 0 HG22 ILE A 137 152.946 1.485 -2.628 1.00 0.00 H new ATOM 0 HG23 ILE A 137 151.835 0.601 -1.555 1.00 0.00 H new ATOM 0 HD11 ILE A 137 152.433 2.577 2.324 1.00 0.00 H new ATOM 0 HD12 ILE A 137 153.807 3.143 1.344 1.00 0.00 H new ATOM 0 HD13 ILE A 137 152.164 3.141 0.658 1.00 0.00 H new ATOM 1877 N THR A 138 154.188 -2.322 -0.034 1.00 0.00 N ATOM 1878 CA THR A 138 153.438 -3.500 0.396 1.00 0.00 C ATOM 1879 C THR A 138 153.915 -4.059 1.742 1.00 0.00 C ATOM 1880 O THR A 138 153.181 -4.018 2.730 1.00 0.00 O ATOM 1881 CB THR A 138 153.531 -4.605 -0.653 1.00 0.00 C ATOM 1882 OG1 THR A 138 154.481 -4.246 -1.648 1.00 0.00 O ATOM 1883 CG2 THR A 138 152.165 -4.815 -1.306 1.00 0.00 C ATOM 0 H THR A 138 155.202 -2.402 0.045 1.00 0.00 H new ATOM 0 HA THR A 138 152.406 -3.171 0.517 1.00 0.00 H new ATOM 0 HB THR A 138 153.846 -5.529 -0.169 1.00 0.00 H new ATOM 0 HG1 THR A 138 154.076 -4.340 -2.536 1.00 0.00 H new ATOM 0 HG21 THR A 138 152.237 -5.605 -2.054 1.00 0.00 H new ATOM 0 HG22 THR A 138 151.438 -5.100 -0.545 1.00 0.00 H new ATOM 0 HG23 THR A 138 151.845 -3.890 -1.785 1.00 0.00 H new ATOM 1888 N PRO A 139 155.102 -4.626 1.782 1.00 0.00 N ATOM 1889 CA PRO A 139 155.661 -5.275 3.002 1.00 0.00 C ATOM 1890 C PRO A 139 155.339 -4.537 4.299 1.00 0.00 C ATOM 1891 O PRO A 139 154.390 -4.884 5.002 1.00 0.00 O ATOM 1892 CB PRO A 139 157.181 -5.323 2.738 1.00 0.00 C ATOM 1893 CG PRO A 139 157.402 -4.644 1.421 1.00 0.00 C ATOM 1894 CD PRO A 139 156.072 -4.697 0.683 1.00 0.00 C ATOM 0 HA PRO A 139 155.219 -6.259 3.157 1.00 0.00 H new ATOM 0 HB2 PRO A 139 157.730 -4.817 3.533 1.00 0.00 H new ATOM 0 HB3 PRO A 139 157.538 -6.352 2.709 1.00 0.00 H new ATOM 0 HG2 PRO A 139 157.726 -3.613 1.565 1.00 0.00 H new ATOM 0 HG3 PRO A 139 158.183 -5.147 0.851 1.00 0.00 H new ATOM 0 HD2 PRO A 139 155.960 -3.866 -0.013 1.00 0.00 H new ATOM 0 HD3 PRO A 139 155.964 -5.614 0.104 1.00 0.00 H new ATOM 1902 N GLU A 140 156.148 -3.543 4.622 1.00 0.00 N ATOM 1903 CA GLU A 140 155.957 -2.785 5.856 1.00 0.00 C ATOM 1904 C GLU A 140 155.492 -1.367 5.569 1.00 0.00 C ATOM 1905 O GLU A 140 154.698 -0.800 6.316 1.00 0.00 O ATOM 1906 CB GLU A 140 157.267 -2.741 6.642 1.00 0.00 C ATOM 1907 CG GLU A 140 157.676 -4.162 7.033 1.00 0.00 C ATOM 1908 CD GLU A 140 158.956 -4.128 7.859 1.00 0.00 C ATOM 1909 OE1 GLU A 140 159.563 -3.072 7.931 1.00 0.00 O ATOM 1910 OE2 GLU A 140 159.312 -5.158 8.407 1.00 0.00 O ATOM 0 H GLU A 140 156.939 -3.240 4.054 1.00 0.00 H new ATOM 0 HA GLU A 140 155.187 -3.285 6.443 1.00 0.00 H new ATOM 0 HB2 GLU A 140 158.049 -2.279 6.040 1.00 0.00 H new ATOM 0 HB3 GLU A 140 157.147 -2.127 7.535 1.00 0.00 H new ATOM 0 HG2 GLU A 140 156.877 -4.635 7.604 1.00 0.00 H new ATOM 0 HG3 GLU A 140 157.827 -4.765 6.138 1.00 0.00 H new ATOM 1917 N THR A 141 156.000 -0.795 4.490 1.00 0.00 N ATOM 1918 CA THR A 141 155.632 0.563 4.129 1.00 0.00 C ATOM 1919 C THR A 141 154.124 0.761 4.258 1.00 0.00 C ATOM 1920 O THR A 141 153.667 1.787 4.760 1.00 0.00 O ATOM 1921 CB THR A 141 156.083 0.852 2.696 1.00 0.00 C ATOM 1922 OG1 THR A 141 155.769 -0.262 1.875 1.00 0.00 O ATOM 1923 CG2 THR A 141 157.593 1.095 2.673 1.00 0.00 C ATOM 0 H THR A 141 156.661 -1.244 3.856 1.00 0.00 H new ATOM 0 HA THR A 141 156.127 1.257 4.809 1.00 0.00 H new ATOM 0 HB THR A 141 155.571 1.739 2.323 1.00 0.00 H new ATOM 0 HG1 THR A 141 156.560 -0.520 1.357 1.00 0.00 H new ATOM 0 HG21 THR A 141 157.913 1.301 1.652 1.00 0.00 H new ATOM 0 HG22 THR A 141 157.834 1.948 3.307 1.00 0.00 H new ATOM 0 HG23 THR A 141 158.110 0.210 3.044 1.00 0.00 H new ATOM 1928 N ALA A 142 153.353 -0.215 3.794 1.00 0.00 N ATOM 1929 CA ALA A 142 151.899 -0.115 3.861 1.00 0.00 C ATOM 1930 C ALA A 142 151.392 -0.243 5.299 1.00 0.00 C ATOM 1931 O ALA A 142 150.703 0.643 5.805 1.00 0.00 O ATOM 1932 CB ALA A 142 151.268 -1.208 2.998 1.00 0.00 C ATOM 0 H ALA A 142 153.704 -1.075 3.372 1.00 0.00 H new ATOM 0 HA ALA A 142 151.613 0.868 3.487 1.00 0.00 H new ATOM 0 HB1 ALA A 142 150.182 -1.131 3.050 1.00 0.00 H new ATOM 0 HB2 ALA A 142 151.591 -1.087 1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 142 151.580 -2.186 3.364 1.00 0.00 H new ATOM 1938 N GLU A 143 151.713 -1.362 5.940 1.00 0.00 N ATOM 1939 CA GLU A 143 151.263 -1.615 7.309 1.00 0.00 C ATOM 1940 C GLU A 143 151.960 -0.719 8.338 1.00 0.00 C ATOM 1941 O GLU A 143 151.354 -0.331 9.336 1.00 0.00 O ATOM 1942 CB GLU A 143 151.513 -3.081 7.664 1.00 0.00 C ATOM 1943 CG GLU A 143 150.896 -3.391 9.030 1.00 0.00 C ATOM 1944 CD GLU A 143 151.212 -4.826 9.433 1.00 0.00 C ATOM 1945 OE1 GLU A 143 151.903 -5.493 8.682 1.00 0.00 O ATOM 1946 OE2 GLU A 143 150.759 -5.237 10.488 1.00 0.00 O ATOM 0 H GLU A 143 152.281 -2.107 5.537 1.00 0.00 H new ATOM 0 HA GLU A 143 150.198 -1.384 7.346 1.00 0.00 H new ATOM 0 HB2 GLU A 143 151.079 -3.729 6.902 1.00 0.00 H new ATOM 0 HB3 GLU A 143 152.584 -3.284 7.683 1.00 0.00 H new ATOM 0 HG2 GLU A 143 151.285 -2.701 9.779 1.00 0.00 H new ATOM 0 HG3 GLU A 143 149.817 -3.245 8.992 1.00 0.00 H new ATOM 1953 N LYS A 144 153.236 -0.420 8.113 1.00 0.00 N ATOM 1954 CA LYS A 144 154.000 0.399 9.057 1.00 0.00 C ATOM 1955 C LYS A 144 153.359 1.768 9.272 1.00 0.00 C ATOM 1956 O LYS A 144 153.265 2.247 10.404 1.00 0.00 O ATOM 1957 CB LYS A 144 155.428 0.586 8.543 1.00 0.00 C ATOM 1958 CG LYS A 144 156.258 1.322 9.597 1.00 0.00 C ATOM 1959 CD LYS A 144 157.672 1.559 9.061 1.00 0.00 C ATOM 1960 CE LYS A 144 158.547 2.152 10.168 1.00 0.00 C ATOM 1961 NZ LYS A 144 158.992 3.518 9.772 1.00 0.00 N ATOM 0 H LYS A 144 153.761 -0.728 7.295 1.00 0.00 H new ATOM 0 HA LYS A 144 154.009 -0.124 10.013 1.00 0.00 H new ATOM 0 HB2 LYS A 144 155.876 -0.383 8.323 1.00 0.00 H new ATOM 0 HB3 LYS A 144 155.419 1.152 7.611 1.00 0.00 H new ATOM 0 HG2 LYS A 144 155.788 2.273 9.846 1.00 0.00 H new ATOM 0 HG3 LYS A 144 156.299 0.737 10.516 1.00 0.00 H new ATOM 0 HD2 LYS A 144 158.100 0.621 8.708 1.00 0.00 H new ATOM 0 HD3 LYS A 144 157.640 2.236 8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 144 157.988 2.197 11.103 1.00 0.00 H new ATOM 0 HE3 LYS A 144 159.412 1.513 10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 159.587 3.921 10.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 159.540 3.462 8.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 158.160 4.125 9.625 1.00 0.00 H new ATOM 1975 N LEU A 145 152.929 2.396 8.189 1.00 0.00 N ATOM 1976 CA LEU A 145 152.310 3.712 8.281 1.00 0.00 C ATOM 1977 C LEU A 145 150.972 3.647 9.010 1.00 0.00 C ATOM 1978 O LEU A 145 150.560 4.613 9.649 1.00 0.00 O ATOM 1979 CB LEU A 145 152.105 4.297 6.882 1.00 0.00 C ATOM 1980 CG LEU A 145 153.372 5.036 6.438 1.00 0.00 C ATOM 1981 CD1 LEU A 145 154.602 4.150 6.659 1.00 0.00 C ATOM 1982 CD2 LEU A 145 153.259 5.383 4.953 1.00 0.00 C ATOM 0 H LEU A 145 152.995 2.021 7.243 1.00 0.00 H new ATOM 0 HA LEU A 145 152.980 4.355 8.851 1.00 0.00 H new ATOM 0 HB2 LEU A 145 151.871 3.501 6.175 1.00 0.00 H new ATOM 0 HB3 LEU A 145 151.256 4.981 6.884 1.00 0.00 H new ATOM 0 HG LEU A 145 153.479 5.948 7.026 1.00 0.00 H new ATOM 0 HD11 LEU A 145 155.497 4.684 6.340 1.00 0.00 H new ATOM 0 HD12 LEU A 145 154.685 3.901 7.717 1.00 0.00 H new ATOM 0 HD13 LEU A 145 154.500 3.234 6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 145 154.158 5.909 4.633 1.00 0.00 H new ATOM 0 HD22 LEU A 145 153.148 4.467 4.373 1.00 0.00 H new ATOM 0 HD23 LEU A 145 152.390 6.021 4.794 1.00 0.00 H new ATOM 1988 N ALA A 146 150.293 2.511 8.915 1.00 0.00 N ATOM 1989 CA ALA A 146 148.997 2.352 9.571 1.00 0.00 C ATOM 1990 C ALA A 146 149.145 2.266 11.089 1.00 0.00 C ATOM 1991 O ALA A 146 148.247 2.664 11.832 1.00 0.00 O ATOM 1992 CB ALA A 146 148.310 1.086 9.059 1.00 0.00 C ATOM 0 H ALA A 146 150.612 1.693 8.396 1.00 0.00 H new ATOM 0 HA ALA A 146 148.393 3.228 9.334 1.00 0.00 H new ATOM 0 HB1 ALA A 146 147.344 0.972 9.551 1.00 0.00 H new ATOM 0 HB2 ALA A 146 148.162 1.163 7.982 1.00 0.00 H new ATOM 0 HB3 ALA A 146 148.934 0.219 9.279 1.00 0.00 H new ATOM 1998 N ARG A 147 150.267 1.722 11.543 1.00 0.00 N ATOM 1999 CA ARG A 147 150.504 1.564 12.975 1.00 0.00 C ATOM 2000 C ARG A 147 150.482 2.900 13.717 1.00 0.00 C ATOM 2001 O ARG A 147 150.027 2.966 14.859 1.00 0.00 O ATOM 2002 CB ARG A 147 151.852 0.882 13.214 1.00 0.00 C ATOM 2003 CG ARG A 147 151.813 -0.543 12.659 1.00 0.00 C ATOM 2004 CD ARG A 147 153.078 -1.290 13.086 1.00 0.00 C ATOM 2005 NE ARG A 147 154.267 -0.534 12.708 1.00 0.00 N ATOM 2006 CZ ARG A 147 155.407 -0.671 13.376 1.00 0.00 C ATOM 2007 NH1 ARG A 147 155.480 -1.501 14.381 1.00 0.00 N ATOM 2008 NH2 ARG A 147 156.456 0.023 13.026 1.00 0.00 N ATOM 0 H ARG A 147 151.023 1.385 10.947 1.00 0.00 H new ATOM 0 HA ARG A 147 149.694 0.947 13.365 1.00 0.00 H new ATOM 0 HB2 ARG A 147 152.648 1.449 12.732 1.00 0.00 H new ATOM 0 HB3 ARG A 147 152.076 0.861 14.280 1.00 0.00 H new ATOM 0 HG2 ARG A 147 150.929 -1.064 13.026 1.00 0.00 H new ATOM 0 HG3 ARG A 147 151.741 -0.520 11.572 1.00 0.00 H new ATOM 0 HD2 ARG A 147 153.068 -1.449 14.164 1.00 0.00 H new ATOM 0 HD3 ARG A 147 153.102 -2.275 12.619 1.00 0.00 H new ATOM 0 HE ARG A 147 154.222 0.110 11.918 1.00 0.00 H new ATOM 0 HH11 ARG A 147 154.661 -2.045 14.654 1.00 0.00 H new ATOM 0 HH12 ARG A 147 156.356 -1.606 14.893 1.00 0.00 H new ATOM 0 HH21 ARG A 147 156.400 0.670 12.240 1.00 0.00 H new ATOM 0 HH22 ARG A 147 157.331 -0.082 13.539 1.00 0.00 H new ATOM 2022 N ASP A 148 150.994 3.957 13.088 1.00 0.00 N ATOM 2023 CA ASP A 148 151.037 5.263 13.749 1.00 0.00 C ATOM 2024 C ASP A 148 150.245 6.335 12.999 1.00 0.00 C ATOM 2025 O ASP A 148 149.666 7.226 13.621 1.00 0.00 O ATOM 2026 CB ASP A 148 152.492 5.715 13.891 1.00 0.00 C ATOM 2027 CG ASP A 148 153.220 4.820 14.888 1.00 0.00 C ATOM 2028 OD1 ASP A 148 152.550 4.060 15.571 1.00 0.00 O ATOM 2029 OD2 ASP A 148 154.435 4.906 14.957 1.00 0.00 O ATOM 0 H ASP A 148 151.377 3.939 12.143 1.00 0.00 H new ATOM 0 HA ASP A 148 150.572 5.143 14.727 1.00 0.00 H new ATOM 0 HB2 ASP A 148 152.990 5.675 12.922 1.00 0.00 H new ATOM 0 HB3 ASP A 148 152.529 6.752 14.226 1.00 0.00 H new ATOM 2034 N LEU A 149 150.237 6.275 11.671 1.00 0.00 N ATOM 2035 CA LEU A 149 149.530 7.284 10.883 1.00 0.00 C ATOM 2036 C LEU A 149 148.016 7.198 11.087 1.00 0.00 C ATOM 2037 O LEU A 149 147.283 8.011 10.538 1.00 0.00 O ATOM 2038 CB LEU A 149 149.857 7.115 9.394 1.00 0.00 C ATOM 2039 CG LEU A 149 149.587 8.426 8.647 1.00 0.00 C ATOM 2040 CD1 LEU A 149 150.590 9.494 9.090 1.00 0.00 C ATOM 2041 CD2 LEU A 149 149.733 8.191 7.142 1.00 0.00 C ATOM 0 H LEU A 149 150.703 5.552 11.123 1.00 0.00 H new ATOM 0 HA LEU A 149 149.865 8.263 11.225 1.00 0.00 H new ATOM 0 HB2 LEU A 149 150.901 6.826 9.273 1.00 0.00 H new ATOM 0 HB3 LEU A 149 149.253 6.313 8.969 1.00 0.00 H new ATOM 0 HG LEU A 149 148.576 8.765 8.873 1.00 0.00 H new ATOM 0 HD11 LEU A 149 150.392 10.423 8.555 1.00 0.00 H new ATOM 0 HD12 LEU A 149 150.491 9.664 10.162 1.00 0.00 H new ATOM 0 HD13 LEU A 149 151.602 9.156 8.869 1.00 0.00 H new ATOM 0 HD21 LEU A 149 149.541 9.122 6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 149 150.745 7.849 6.924 1.00 0.00 H new ATOM 0 HD23 LEU A 149 149.017 7.435 6.821 1.00 0.00 H new ATOM 2047 N LYS A 150 147.569 6.208 11.870 1.00 0.00 N ATOM 2048 CA LYS A 150 146.143 5.982 12.160 1.00 0.00 C ATOM 2049 C LYS A 150 145.606 4.880 11.261 1.00 0.00 C ATOM 2050 O LYS A 150 146.085 4.691 10.143 1.00 0.00 O ATOM 2051 CB LYS A 150 145.271 7.241 12.001 1.00 0.00 C ATOM 2052 CG LYS A 150 145.760 8.346 12.946 1.00 0.00 C ATOM 2053 CD LYS A 150 144.786 9.524 12.895 1.00 0.00 C ATOM 2054 CE LYS A 150 145.336 10.675 13.739 1.00 0.00 C ATOM 2055 NZ LYS A 150 145.400 10.253 15.167 1.00 0.00 N ATOM 0 H LYS A 150 148.188 5.536 12.324 1.00 0.00 H new ATOM 0 HA LYS A 150 146.086 5.692 13.209 1.00 0.00 H new ATOM 0 HB2 LYS A 150 145.309 7.591 10.969 1.00 0.00 H new ATOM 0 HB3 LYS A 150 144.230 7.001 12.218 1.00 0.00 H new ATOM 0 HG2 LYS A 150 145.833 7.964 13.964 1.00 0.00 H new ATOM 0 HG3 LYS A 150 146.759 8.672 12.656 1.00 0.00 H new ATOM 0 HD2 LYS A 150 144.645 9.849 11.864 1.00 0.00 H new ATOM 0 HD3 LYS A 150 143.809 9.219 13.269 1.00 0.00 H new ATOM 0 HE2 LYS A 150 146.328 10.958 13.387 1.00 0.00 H new ATOM 0 HE3 LYS A 150 144.699 11.553 13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 146.202 10.724 15.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 144.517 10.518 15.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 145.526 9.222 15.219 1.00 0.00 H new ATOM 2069 N ALA A 151 144.613 4.152 11.759 1.00 0.00 N ATOM 2070 CA ALA A 151 144.017 3.059 10.997 1.00 0.00 C ATOM 2071 C ALA A 151 143.339 2.053 11.931 1.00 0.00 C ATOM 2072 O ALA A 151 143.221 2.281 13.133 1.00 0.00 O ATOM 2073 CB ALA A 151 145.103 2.344 10.190 1.00 0.00 C ATOM 0 H ALA A 151 144.205 4.297 12.682 1.00 0.00 H new ATOM 0 HA ALA A 151 143.267 3.476 10.325 1.00 0.00 H new ATOM 0 HB1 ALA A 151 144.656 1.528 9.622 1.00 0.00 H new ATOM 0 HB2 ALA A 151 145.571 3.050 9.504 1.00 0.00 H new ATOM 0 HB3 ALA A 151 145.856 1.944 10.868 1.00 0.00 H new ATOM 2079 N VAL A 152 142.909 0.945 11.350 1.00 0.00 N ATOM 2080 CA VAL A 152 142.260 -0.136 12.093 1.00 0.00 C ATOM 2081 C VAL A 152 142.671 -1.466 11.468 1.00 0.00 C ATOM 2082 O VAL A 152 143.196 -2.352 12.144 1.00 0.00 O ATOM 2083 CB VAL A 152 140.734 -0.001 12.056 1.00 0.00 C ATOM 2084 CG1 VAL A 152 140.096 -1.317 12.500 1.00 0.00 C ATOM 2085 CG2 VAL A 152 140.292 1.115 13.005 1.00 0.00 C ATOM 0 H VAL A 152 142.997 0.764 10.350 1.00 0.00 H new ATOM 0 HA VAL A 152 142.573 -0.086 13.136 1.00 0.00 H new ATOM 0 HB VAL A 152 140.419 0.238 11.040 1.00 0.00 H new ATOM 0 HG11 VAL A 152 139.010 -1.222 12.474 1.00 0.00 H new ATOM 0 HG12 VAL A 152 140.406 -2.117 11.828 1.00 0.00 H new ATOM 0 HG13 VAL A 152 140.415 -1.552 13.515 1.00 0.00 H new ATOM 0 HG21 VAL A 152 139.206 1.208 12.976 1.00 0.00 H new ATOM 0 HG22 VAL A 152 140.609 0.876 14.020 1.00 0.00 H new ATOM 0 HG23 VAL A 152 140.745 2.057 12.695 1.00 0.00 H new ATOM 2089 N LYS A 153 142.457 -1.575 10.158 1.00 0.00 N ATOM 2090 CA LYS A 153 142.836 -2.773 9.413 1.00 0.00 C ATOM 2091 C LYS A 153 144.206 -2.557 8.784 1.00 0.00 C ATOM 2092 O LYS A 153 144.813 -1.504 8.972 1.00 0.00 O ATOM 2093 CB LYS A 153 141.811 -3.072 8.316 1.00 0.00 C ATOM 2094 CG LYS A 153 140.584 -3.761 8.920 1.00 0.00 C ATOM 2095 CD LYS A 153 140.974 -5.153 9.431 1.00 0.00 C ATOM 2096 CE LYS A 153 139.872 -6.154 9.082 1.00 0.00 C ATOM 2097 NZ LYS A 153 139.970 -7.335 9.986 1.00 0.00 N ATOM 0 H LYS A 153 142.023 -0.847 9.591 1.00 0.00 H new ATOM 0 HA LYS A 153 142.869 -3.620 10.098 1.00 0.00 H new ATOM 0 HB2 LYS A 153 141.513 -2.147 7.823 1.00 0.00 H new ATOM 0 HB3 LYS A 153 142.258 -3.710 7.553 1.00 0.00 H new ATOM 0 HG2 LYS A 153 140.184 -3.162 9.738 1.00 0.00 H new ATOM 0 HG3 LYS A 153 139.796 -3.845 8.171 1.00 0.00 H new ATOM 0 HD2 LYS A 153 141.918 -5.465 8.983 1.00 0.00 H new ATOM 0 HD3 LYS A 153 141.127 -5.126 10.510 1.00 0.00 H new ATOM 0 HE2 LYS A 153 138.894 -5.684 9.184 1.00 0.00 H new ATOM 0 HE3 LYS A 153 139.968 -6.469 8.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 139.517 -8.156 9.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 140.971 -7.550 10.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 139.490 -7.125 10.885 1.00 0.00 H new ATOM 2111 N TYR A 154 144.688 -3.531 8.016 1.00 0.00 N ATOM 2112 CA TYR A 154 145.969 -3.389 7.368 1.00 0.00 C ATOM 2113 C TYR A 154 146.086 -4.501 6.364 1.00 0.00 C ATOM 2114 O TYR A 154 146.477 -5.622 6.688 1.00 0.00 O ATOM 2115 CB TYR A 154 147.101 -3.476 8.394 1.00 0.00 C ATOM 2116 CG TYR A 154 146.534 -3.873 9.736 1.00 0.00 C ATOM 2117 CD1 TYR A 154 145.819 -5.070 9.870 1.00 0.00 C ATOM 2118 CD2 TYR A 154 146.721 -3.043 10.848 1.00 0.00 C ATOM 2119 CE1 TYR A 154 145.292 -5.436 11.114 1.00 0.00 C ATOM 2120 CE2 TYR A 154 146.194 -3.409 12.092 1.00 0.00 C ATOM 2121 CZ TYR A 154 145.479 -4.605 12.225 1.00 0.00 C ATOM 2122 OH TYR A 154 144.960 -4.967 13.452 1.00 0.00 O ATOM 0 H TYR A 154 144.210 -4.414 7.834 1.00 0.00 H new ATOM 0 HA TYR A 154 146.045 -2.418 6.878 1.00 0.00 H new ATOM 0 HB2 TYR A 154 147.844 -4.205 8.071 1.00 0.00 H new ATOM 0 HB3 TYR A 154 147.610 -2.515 8.472 1.00 0.00 H new ATOM 0 HD1 TYR A 154 145.674 -5.711 9.013 1.00 0.00 H new ATOM 0 HD2 TYR A 154 147.272 -2.120 10.746 1.00 0.00 H new ATOM 0 HE1 TYR A 154 144.741 -6.359 11.217 1.00 0.00 H new ATOM 0 HE2 TYR A 154 146.339 -2.768 12.949 1.00 0.00 H new ATOM 0 HH TYR A 154 145.181 -4.281 14.116 1.00 0.00 H new ATOM 2132 N VAL A 155 145.705 -4.185 5.150 1.00 0.00 N ATOM 2133 CA VAL A 155 145.725 -5.156 4.094 1.00 0.00 C ATOM 2134 C VAL A 155 145.412 -4.473 2.776 1.00 0.00 C ATOM 2135 O VAL A 155 145.427 -3.246 2.677 1.00 0.00 O ATOM 2136 CB VAL A 155 144.702 -6.261 4.402 1.00 0.00 C ATOM 2137 CG1 VAL A 155 143.327 -5.878 3.849 1.00 0.00 C ATOM 2138 CG2 VAL A 155 145.156 -7.585 3.779 1.00 0.00 C ATOM 0 H VAL A 155 145.377 -3.260 4.873 1.00 0.00 H new ATOM 0 HA VAL A 155 146.713 -5.611 4.019 1.00 0.00 H new ATOM 0 HB VAL A 155 144.631 -6.378 5.483 1.00 0.00 H new ATOM 0 HG11 VAL A 155 142.611 -6.669 4.074 1.00 0.00 H new ATOM 0 HG12 VAL A 155 142.996 -4.947 4.310 1.00 0.00 H new ATOM 0 HG13 VAL A 155 143.393 -5.745 2.769 1.00 0.00 H new ATOM 0 HG21 VAL A 155 144.425 -8.362 4.003 1.00 0.00 H new ATOM 0 HG22 VAL A 155 145.242 -7.468 2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 155 146.124 -7.868 4.192 1.00 0.00 H new ATOM 2142 N GLU A 156 145.146 -5.273 1.773 1.00 0.00 N ATOM 2143 CA GLU A 156 144.844 -4.753 0.457 1.00 0.00 C ATOM 2144 C GLU A 156 143.718 -5.557 -0.147 1.00 0.00 C ATOM 2145 O GLU A 156 143.042 -6.312 0.550 1.00 0.00 O ATOM 2146 CB GLU A 156 146.073 -4.845 -0.431 1.00 0.00 C ATOM 2147 CG GLU A 156 147.293 -4.335 0.340 1.00 0.00 C ATOM 2148 CD GLU A 156 148.527 -4.369 -0.551 1.00 0.00 C ATOM 2149 OE1 GLU A 156 148.376 -4.642 -1.729 1.00 0.00 O ATOM 2150 OE2 GLU A 156 149.605 -4.113 -0.041 1.00 0.00 O ATOM 0 H GLU A 156 145.132 -6.291 1.841 1.00 0.00 H new ATOM 0 HA GLU A 156 144.546 -3.708 0.539 1.00 0.00 H new ATOM 0 HB2 GLU A 156 146.232 -5.876 -0.746 1.00 0.00 H new ATOM 0 HB3 GLU A 156 145.927 -4.255 -1.336 1.00 0.00 H new ATOM 0 HG2 GLU A 156 147.114 -3.318 0.688 1.00 0.00 H new ATOM 0 HG3 GLU A 156 147.457 -4.950 1.225 1.00 0.00 H new ATOM 2157 N CYS A 157 143.513 -5.418 -1.440 1.00 0.00 N ATOM 2158 CA CYS A 157 142.470 -6.181 -2.078 1.00 0.00 C ATOM 2159 C CYS A 157 142.467 -5.981 -3.573 1.00 0.00 C ATOM 2160 O CYS A 157 142.269 -4.884 -4.084 1.00 0.00 O ATOM 2161 CB CYS A 157 141.114 -5.854 -1.471 1.00 0.00 C ATOM 2162 SG CYS A 157 141.147 -4.188 -0.767 1.00 0.00 S ATOM 0 H CYS A 157 144.042 -4.799 -2.054 1.00 0.00 H new ATOM 0 HA CYS A 157 142.674 -7.236 -1.898 1.00 0.00 H new ATOM 0 HB2 CYS A 157 140.338 -5.922 -2.233 1.00 0.00 H new ATOM 0 HB3 CYS A 157 140.866 -6.581 -0.698 1.00 0.00 H new ATOM 0 HG CYS A 157 142.010 -3.461 -1.413 1.00 0.00 H new ATOM 2168 N SER A 158 142.650 -7.074 -4.262 1.00 0.00 N ATOM 2169 CA SER A 158 142.613 -7.074 -5.698 1.00 0.00 C ATOM 2170 C SER A 158 142.512 -8.497 -6.134 1.00 0.00 C ATOM 2171 O SER A 158 143.510 -9.193 -6.328 1.00 0.00 O ATOM 2172 CB SER A 158 143.856 -6.447 -6.292 1.00 0.00 C ATOM 2173 OG SER A 158 143.742 -6.457 -7.709 1.00 0.00 O ATOM 0 H SER A 158 142.829 -7.987 -3.845 1.00 0.00 H new ATOM 0 HA SER A 158 141.763 -6.485 -6.042 1.00 0.00 H new ATOM 0 HB2 SER A 158 143.973 -5.426 -5.930 1.00 0.00 H new ATOM 0 HB3 SER A 158 144.743 -6.999 -5.981 1.00 0.00 H new ATOM 0 HG SER A 158 144.610 -6.680 -8.105 1.00 0.00 H new ATOM 2179 N ALA A 159 141.283 -8.902 -6.274 1.00 0.00 N ATOM 2180 CA ALA A 159 140.963 -10.254 -6.675 1.00 0.00 C ATOM 2181 C ALA A 159 142.009 -11.205 -6.102 1.00 0.00 C ATOM 2182 O ALA A 159 142.315 -12.245 -6.685 1.00 0.00 O ATOM 2183 CB ALA A 159 140.919 -10.331 -8.198 1.00 0.00 C ATOM 0 H ALA A 159 140.469 -8.309 -6.115 1.00 0.00 H new ATOM 0 HA ALA A 159 139.985 -10.545 -6.291 1.00 0.00 H new ATOM 0 HB1 ALA A 159 140.678 -11.349 -8.504 1.00 0.00 H new ATOM 0 HB2 ALA A 159 140.157 -9.649 -8.575 1.00 0.00 H new ATOM 0 HB3 ALA A 159 141.891 -10.050 -8.605 1.00 0.00 H new ATOM 2189 N LEU A 160 142.552 -10.815 -4.947 1.00 0.00 N ATOM 2190 CA LEU A 160 143.573 -11.604 -4.269 1.00 0.00 C ATOM 2191 C LEU A 160 143.616 -11.257 -2.778 1.00 0.00 C ATOM 2192 O LEU A 160 143.159 -12.038 -1.942 1.00 0.00 O ATOM 2193 CB LEU A 160 144.941 -11.332 -4.898 1.00 0.00 C ATOM 2194 CG LEU A 160 145.973 -12.316 -4.338 1.00 0.00 C ATOM 2195 CD1 LEU A 160 145.799 -13.690 -4.995 1.00 0.00 C ATOM 2196 CD2 LEU A 160 147.381 -11.792 -4.627 1.00 0.00 C ATOM 0 H LEU A 160 142.298 -9.954 -4.463 1.00 0.00 H new ATOM 0 HA LEU A 160 143.325 -12.660 -4.378 1.00 0.00 H new ATOM 0 HB2 LEU A 160 144.880 -11.432 -5.982 1.00 0.00 H new ATOM 0 HB3 LEU A 160 145.251 -10.308 -4.689 1.00 0.00 H new ATOM 0 HG LEU A 160 145.827 -12.413 -3.262 1.00 0.00 H new ATOM 0 HD11 LEU A 160 146.537 -14.383 -4.591 1.00 0.00 H new ATOM 0 HD12 LEU A 160 144.797 -14.067 -4.790 1.00 0.00 H new ATOM 0 HD13 LEU A 160 145.939 -13.599 -6.072 1.00 0.00 H new ATOM 0 HD21 LEU A 160 148.118 -12.490 -4.230 1.00 0.00 H new ATOM 0 HD22 LEU A 160 147.519 -11.693 -5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 160 147.511 -10.819 -4.154 1.00 0.00 H new ATOM 2202 N THR A 161 144.178 -10.090 -2.442 1.00 0.00 N ATOM 2203 CA THR A 161 144.276 -9.684 -1.035 1.00 0.00 C ATOM 2204 C THR A 161 142.897 -9.476 -0.427 1.00 0.00 C ATOM 2205 O THR A 161 142.762 -8.866 0.635 1.00 0.00 O ATOM 2206 CB THR A 161 145.121 -8.418 -0.863 1.00 0.00 C ATOM 2207 OG1 THR A 161 146.289 -8.543 -1.636 1.00 0.00 O ATOM 2208 CG2 THR A 161 145.475 -8.208 0.631 1.00 0.00 C ATOM 0 H THR A 161 144.565 -9.422 -3.109 1.00 0.00 H new ATOM 0 HA THR A 161 144.775 -10.496 -0.506 1.00 0.00 H new ATOM 0 HB THR A 161 144.556 -7.549 -1.200 1.00 0.00 H new ATOM 0 HG1 THR A 161 146.940 -9.097 -1.157 1.00 0.00 H new ATOM 0 HG21 THR A 161 146.076 -7.305 0.739 1.00 0.00 H new ATOM 0 HG22 THR A 161 144.558 -8.106 1.211 1.00 0.00 H new ATOM 0 HG23 THR A 161 146.041 -9.066 0.995 1.00 0.00 H new ATOM 2213 N GLN A 162 141.882 -10.058 -1.054 1.00 0.00 N ATOM 2214 CA GLN A 162 140.544 -10.007 -0.517 1.00 0.00 C ATOM 2215 C GLN A 162 140.509 -11.077 0.549 1.00 0.00 C ATOM 2216 O GLN A 162 139.461 -11.604 0.924 1.00 0.00 O ATOM 2217 CB GLN A 162 139.507 -10.308 -1.600 1.00 0.00 C ATOM 2218 CG GLN A 162 139.792 -11.683 -2.206 1.00 0.00 C ATOM 2219 CD GLN A 162 138.974 -12.747 -1.480 1.00 0.00 C ATOM 2220 OE1 GLN A 162 139.493 -13.814 -1.152 1.00 0.00 O ATOM 2221 NE2 GLN A 162 137.720 -12.515 -1.203 1.00 0.00 N ATOM 0 H GLN A 162 141.968 -10.568 -1.933 1.00 0.00 H new ATOM 0 HA GLN A 162 140.306 -9.019 -0.123 1.00 0.00 H new ATOM 0 HB2 GLN A 162 138.504 -10.286 -1.175 1.00 0.00 H new ATOM 0 HB3 GLN A 162 139.541 -9.542 -2.375 1.00 0.00 H new ATOM 0 HG2 GLN A 162 139.544 -11.681 -3.267 1.00 0.00 H new ATOM 0 HG3 GLN A 162 140.855 -11.912 -2.128 1.00 0.00 H new ATOM 0 HE21 GLN A 162 137.293 -11.630 -1.476 1.00 0.00 H new ATOM 0 HE22 GLN A 162 137.167 -13.219 -0.713 1.00 0.00 H new ATOM 2228 N LYS A 163 141.713 -11.370 1.018 1.00 0.00 N ATOM 2229 CA LYS A 163 141.933 -12.367 2.048 1.00 0.00 C ATOM 2230 C LYS A 163 141.490 -11.790 3.367 1.00 0.00 C ATOM 2231 O LYS A 163 141.456 -12.474 4.390 1.00 0.00 O ATOM 2232 CB LYS A 163 143.415 -12.746 2.108 1.00 0.00 C ATOM 2233 CG LYS A 163 143.590 -14.032 2.919 1.00 0.00 C ATOM 2234 CD LYS A 163 145.078 -14.376 3.015 1.00 0.00 C ATOM 2235 CE LYS A 163 145.239 -15.777 3.609 1.00 0.00 C ATOM 2236 NZ LYS A 163 145.577 -16.741 2.524 1.00 0.00 N ATOM 0 H LYS A 163 142.567 -10.919 0.691 1.00 0.00 H new ATOM 0 HA LYS A 163 141.361 -13.268 1.824 1.00 0.00 H new ATOM 0 HB2 LYS A 163 143.805 -12.885 1.100 1.00 0.00 H new ATOM 0 HB3 LYS A 163 143.988 -11.938 2.563 1.00 0.00 H new ATOM 0 HG2 LYS A 163 143.170 -13.905 3.917 1.00 0.00 H new ATOM 0 HG3 LYS A 163 143.047 -14.850 2.446 1.00 0.00 H new ATOM 0 HD2 LYS A 163 145.537 -14.333 2.027 1.00 0.00 H new ATOM 0 HD3 LYS A 163 145.592 -13.644 3.638 1.00 0.00 H new ATOM 0 HE2 LYS A 163 146.024 -15.775 4.366 1.00 0.00 H new ATOM 0 HE3 LYS A 163 144.318 -16.081 4.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 145.686 -17.693 2.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 144.814 -16.750 1.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 146.467 -16.453 2.069 1.00 0.00 H new ATOM 2250 N GLY A 164 141.103 -10.524 3.318 1.00 0.00 N ATOM 2251 CA GLY A 164 140.602 -9.836 4.495 1.00 0.00 C ATOM 2252 C GLY A 164 139.201 -9.372 4.191 1.00 0.00 C ATOM 2253 O GLY A 164 138.275 -9.659 4.934 1.00 0.00 O ATOM 0 H GLY A 164 141.127 -9.953 2.473 1.00 0.00 H new ATOM 0 HA2 GLY A 164 140.606 -10.502 5.358 1.00 0.00 H new ATOM 0 HA3 GLY A 164 141.240 -8.988 4.744 1.00 0.00 H new ATOM 2257 N LEU A 165 139.061 -8.626 3.102 1.00 0.00 N ATOM 2258 CA LEU A 165 137.757 -8.107 2.698 1.00 0.00 C ATOM 2259 C LEU A 165 136.645 -9.097 3.048 1.00 0.00 C ATOM 2260 O LEU A 165 135.494 -8.707 3.233 1.00 0.00 O ATOM 2261 CB LEU A 165 137.760 -7.848 1.198 1.00 0.00 C ATOM 2262 CG LEU A 165 138.429 -6.497 0.911 1.00 0.00 C ATOM 2263 CD1 LEU A 165 137.534 -5.357 1.409 1.00 0.00 C ATOM 2264 CD2 LEU A 165 139.782 -6.422 1.629 1.00 0.00 C ATOM 0 H LEU A 165 139.830 -8.367 2.484 1.00 0.00 H new ATOM 0 HA LEU A 165 137.570 -7.177 3.234 1.00 0.00 H new ATOM 0 HB2 LEU A 165 138.293 -8.646 0.682 1.00 0.00 H new ATOM 0 HB3 LEU A 165 136.739 -7.848 0.817 1.00 0.00 H new ATOM 0 HG LEU A 165 138.580 -6.401 -0.164 1.00 0.00 H new ATOM 0 HD11 LEU A 165 138.014 -4.401 1.202 1.00 0.00 H new ATOM 0 HD12 LEU A 165 136.573 -5.399 0.897 1.00 0.00 H new ATOM 0 HD13 LEU A 165 137.377 -5.460 2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 165 140.251 -5.461 1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 165 139.630 -6.527 2.703 1.00 0.00 H new ATOM 0 HD23 LEU A 165 140.427 -7.225 1.274 1.00 0.00 H new ATOM 2270 N LYS A 166 137.005 -10.367 3.187 1.00 0.00 N ATOM 2271 CA LYS A 166 136.037 -11.391 3.576 1.00 0.00 C ATOM 2272 C LYS A 166 135.801 -11.285 5.076 1.00 0.00 C ATOM 2273 O LYS A 166 134.669 -11.261 5.557 1.00 0.00 O ATOM 2274 CB LYS A 166 136.572 -12.783 3.232 1.00 0.00 C ATOM 2275 CG LYS A 166 135.546 -13.841 3.644 1.00 0.00 C ATOM 2276 CD LYS A 166 136.095 -15.234 3.332 1.00 0.00 C ATOM 2277 CE LYS A 166 135.032 -16.285 3.654 1.00 0.00 C ATOM 2278 NZ LYS A 166 134.259 -16.606 2.421 1.00 0.00 N ATOM 0 H LYS A 166 137.953 -10.713 3.038 1.00 0.00 H new ATOM 0 HA LYS A 166 135.102 -11.239 3.036 1.00 0.00 H new ATOM 0 HB2 LYS A 166 136.773 -12.853 2.163 1.00 0.00 H new ATOM 0 HB3 LYS A 166 137.517 -12.958 3.746 1.00 0.00 H new ATOM 0 HG2 LYS A 166 135.327 -13.755 4.708 1.00 0.00 H new ATOM 0 HG3 LYS A 166 134.609 -13.680 3.111 1.00 0.00 H new ATOM 0 HD2 LYS A 166 136.378 -15.298 2.281 1.00 0.00 H new ATOM 0 HD3 LYS A 166 136.996 -15.421 3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 166 135.504 -17.186 4.045 1.00 0.00 H new ATOM 0 HE3 LYS A 166 134.362 -15.914 4.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 133.336 -17.007 2.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 134.113 -15.738 1.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 134.787 -17.297 1.850 1.00 0.00 H new ATOM 2292 N ASN A 167 136.912 -11.189 5.792 1.00 0.00 N ATOM 2293 CA ASN A 167 136.897 -11.042 7.235 1.00 0.00 C ATOM 2294 C ASN A 167 136.604 -9.587 7.584 1.00 0.00 C ATOM 2295 O ASN A 167 136.699 -9.182 8.743 1.00 0.00 O ATOM 2296 CB ASN A 167 138.250 -11.454 7.822 1.00 0.00 C ATOM 2297 CG ASN A 167 138.581 -12.890 7.421 1.00 0.00 C ATOM 2298 OD1 ASN A 167 139.624 -13.141 6.819 1.00 0.00 O ATOM 2299 ND2 ASN A 167 137.753 -13.851 7.726 1.00 0.00 N ATOM 0 H ASN A 167 137.848 -11.211 5.386 1.00 0.00 H new ATOM 0 HA ASN A 167 136.124 -11.685 7.656 1.00 0.00 H new ATOM 0 HB2 ASN A 167 139.030 -10.780 7.467 1.00 0.00 H new ATOM 0 HB3 ASN A 167 138.225 -11.368 8.908 1.00 0.00 H new ATOM 0 HD21 ASN A 167 137.970 -14.813 7.465 1.00 0.00 H new ATOM 0 HD22 ASN A 167 136.889 -13.640 8.225 1.00 0.00 H new ATOM 2304 N VAL A 168 136.209 -8.816 6.569 1.00 0.00 N ATOM 2305 CA VAL A 168 135.853 -7.410 6.773 1.00 0.00 C ATOM 2306 C VAL A 168 134.348 -7.271 6.928 1.00 0.00 C ATOM 2307 O VAL A 168 133.864 -6.855 7.981 1.00 0.00 O ATOM 2308 CB VAL A 168 136.302 -6.553 5.597 1.00 0.00 C ATOM 2309 CG1 VAL A 168 135.706 -5.151 5.737 1.00 0.00 C ATOM 2310 CG2 VAL A 168 137.825 -6.458 5.596 1.00 0.00 C ATOM 0 H VAL A 168 136.128 -9.138 5.605 1.00 0.00 H new ATOM 0 HA VAL A 168 136.358 -7.069 7.677 1.00 0.00 H new ATOM 0 HB VAL A 168 135.963 -7.003 4.664 1.00 0.00 H new ATOM 0 HG11 VAL A 168 136.025 -4.534 4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 168 134.618 -5.217 5.746 1.00 0.00 H new ATOM 0 HG13 VAL A 168 136.049 -4.701 6.668 1.00 0.00 H new ATOM 0 HG21 VAL A 168 138.151 -5.845 4.755 1.00 0.00 H new ATOM 0 HG22 VAL A 168 138.162 -6.004 6.528 1.00 0.00 H new ATOM 0 HG23 VAL A 168 138.252 -7.457 5.504 1.00 0.00 H new ATOM 2314 N PHE A 169 133.600 -7.620 5.872 1.00 0.00 N ATOM 2315 CA PHE A 169 132.145 -7.515 5.942 1.00 0.00 C ATOM 2316 C PHE A 169 131.663 -7.940 7.324 1.00 0.00 C ATOM 2317 O PHE A 169 130.808 -7.286 7.920 1.00 0.00 O ATOM 2318 CB PHE A 169 131.494 -8.401 4.877 1.00 0.00 C ATOM 2319 CG PHE A 169 131.353 -7.626 3.588 1.00 0.00 C ATOM 2320 CD1 PHE A 169 132.475 -7.380 2.791 1.00 0.00 C ATOM 2321 CD2 PHE A 169 130.095 -7.156 3.190 1.00 0.00 C ATOM 2322 CE1 PHE A 169 132.343 -6.663 1.596 1.00 0.00 C ATOM 2323 CE2 PHE A 169 129.962 -6.439 1.995 1.00 0.00 C ATOM 2324 CZ PHE A 169 131.086 -6.192 1.198 1.00 0.00 C ATOM 0 H PHE A 169 133.969 -7.967 4.986 1.00 0.00 H new ATOM 0 HA PHE A 169 131.861 -6.478 5.760 1.00 0.00 H new ATOM 0 HB2 PHE A 169 132.099 -9.293 4.712 1.00 0.00 H new ATOM 0 HB3 PHE A 169 130.516 -8.738 5.219 1.00 0.00 H new ATOM 0 HD1 PHE A 169 133.445 -7.744 3.098 1.00 0.00 H new ATOM 0 HD2 PHE A 169 129.228 -7.347 3.805 1.00 0.00 H new ATOM 0 HE1 PHE A 169 133.210 -6.473 0.981 1.00 0.00 H new ATOM 0 HE2 PHE A 169 128.992 -6.076 1.688 1.00 0.00 H new ATOM 0 HZ PHE A 169 130.984 -5.638 0.276 1.00 0.00 H new ATOM 2334 N ASP A 170 132.231 -9.027 7.838 1.00 0.00 N ATOM 2335 CA ASP A 170 131.860 -9.508 9.163 1.00 0.00 C ATOM 2336 C ASP A 170 132.346 -8.538 10.242 1.00 0.00 C ATOM 2337 O ASP A 170 131.651 -8.295 11.230 1.00 0.00 O ATOM 2338 CB ASP A 170 132.446 -10.905 9.403 1.00 0.00 C ATOM 2339 CG ASP A 170 133.968 -10.873 9.300 1.00 0.00 C ATOM 2340 OD1 ASP A 170 134.503 -9.818 9.014 1.00 0.00 O ATOM 2341 OD2 ASP A 170 134.576 -11.913 9.494 1.00 0.00 O ATOM 0 H ASP A 170 132.941 -9.585 7.364 1.00 0.00 H new ATOM 0 HA ASP A 170 130.773 -9.569 9.217 1.00 0.00 H new ATOM 0 HB2 ASP A 170 132.150 -11.265 10.388 1.00 0.00 H new ATOM 0 HB3 ASP A 170 132.041 -11.606 8.673 1.00 0.00 H new ATOM 2346 N GLU A 171 133.537 -7.976 10.041 1.00 0.00 N ATOM 2347 CA GLU A 171 134.099 -7.027 10.996 1.00 0.00 C ATOM 2348 C GLU A 171 133.296 -5.735 10.985 1.00 0.00 C ATOM 2349 O GLU A 171 133.264 -4.999 11.972 1.00 0.00 O ATOM 2350 CB GLU A 171 135.561 -6.731 10.655 1.00 0.00 C ATOM 2351 CG GLU A 171 136.154 -5.819 11.732 1.00 0.00 C ATOM 2352 CD GLU A 171 137.588 -5.446 11.376 1.00 0.00 C ATOM 2353 OE1 GLU A 171 138.435 -6.321 11.428 1.00 0.00 O ATOM 2354 OE2 GLU A 171 137.819 -4.290 11.062 1.00 0.00 O ATOM 0 H GLU A 171 134.127 -8.161 9.230 1.00 0.00 H new ATOM 0 HA GLU A 171 134.051 -7.468 11.991 1.00 0.00 H new ATOM 0 HB2 GLU A 171 136.128 -7.660 10.595 1.00 0.00 H new ATOM 0 HB3 GLU A 171 135.629 -6.252 9.678 1.00 0.00 H new ATOM 0 HG2 GLU A 171 135.549 -4.917 11.828 1.00 0.00 H new ATOM 0 HG3 GLU A 171 136.131 -6.323 12.698 1.00 0.00 H new ATOM 2361 N ALA A 172 132.638 -5.477 9.864 1.00 0.00 N ATOM 2362 CA ALA A 172 131.818 -4.282 9.730 1.00 0.00 C ATOM 2363 C ALA A 172 130.699 -4.325 10.755 1.00 0.00 C ATOM 2364 O ALA A 172 130.264 -3.293 11.268 1.00 0.00 O ATOM 2365 CB ALA A 172 131.227 -4.207 8.324 1.00 0.00 C ATOM 0 H ALA A 172 132.655 -6.076 9.038 1.00 0.00 H new ATOM 0 HA ALA A 172 132.436 -3.400 9.899 1.00 0.00 H new ATOM 0 HB1 ALA A 172 130.615 -3.309 8.234 1.00 0.00 H new ATOM 0 HB2 ALA A 172 132.034 -4.171 7.592 1.00 0.00 H new ATOM 0 HB3 ALA A 172 130.610 -5.087 8.141 1.00 0.00 H new ATOM 2371 N ILE A 173 130.248 -5.537 11.054 1.00 0.00 N ATOM 2372 CA ILE A 173 129.188 -5.730 12.028 1.00 0.00 C ATOM 2373 C ILE A 173 129.627 -5.182 13.377 1.00 0.00 C ATOM 2374 O ILE A 173 128.839 -4.579 14.106 1.00 0.00 O ATOM 2375 CB ILE A 173 128.878 -7.220 12.165 1.00 0.00 C ATOM 2376 CG1 ILE A 173 128.545 -7.793 10.787 1.00 0.00 C ATOM 2377 CG2 ILE A 173 127.682 -7.405 13.101 1.00 0.00 C ATOM 2378 CD1 ILE A 173 128.331 -9.304 10.890 1.00 0.00 C ATOM 0 H ILE A 173 130.601 -6.398 10.635 1.00 0.00 H new ATOM 0 HA ILE A 173 128.295 -5.202 11.693 1.00 0.00 H new ATOM 0 HB ILE A 173 129.743 -7.740 12.576 1.00 0.00 H new ATOM 0 HG12 ILE A 173 127.648 -7.316 10.392 1.00 0.00 H new ATOM 0 HG13 ILE A 173 129.354 -7.578 10.089 1.00 0.00 H new ATOM 0 HG21 ILE A 173 127.459 -8.467 13.200 1.00 0.00 H new ATOM 0 HG22 ILE A 173 127.919 -6.991 14.081 1.00 0.00 H new ATOM 0 HG23 ILE A 173 126.815 -6.889 12.689 1.00 0.00 H new ATOM 0 HD11 ILE A 173 128.094 -9.706 9.905 1.00 0.00 H new ATOM 0 HD12 ILE A 173 129.239 -9.775 11.265 1.00 0.00 H new ATOM 0 HD13 ILE A 173 127.507 -9.509 11.573 1.00 0.00 H new ATOM 2382 N LEU A 174 130.897 -5.401 13.698 1.00 0.00 N ATOM 2383 CA LEU A 174 131.449 -4.929 14.963 1.00 0.00 C ATOM 2384 C LEU A 174 131.449 -3.404 15.015 1.00 0.00 C ATOM 2385 O LEU A 174 131.225 -2.811 16.071 1.00 0.00 O ATOM 2386 CB LEU A 174 132.877 -5.454 15.135 1.00 0.00 C ATOM 2387 CG LEU A 174 132.872 -6.983 15.082 1.00 0.00 C ATOM 2388 CD1 LEU A 174 134.293 -7.507 15.290 1.00 0.00 C ATOM 2389 CD2 LEU A 174 131.965 -7.532 16.189 1.00 0.00 C ATOM 0 H LEU A 174 131.560 -5.899 13.104 1.00 0.00 H new ATOM 0 HA LEU A 174 130.825 -5.304 15.774 1.00 0.00 H new ATOM 0 HB2 LEU A 174 133.519 -5.055 14.350 1.00 0.00 H new ATOM 0 HB3 LEU A 174 133.288 -5.114 16.086 1.00 0.00 H new ATOM 0 HG LEU A 174 132.501 -7.308 14.110 1.00 0.00 H new ATOM 0 HD11 LEU A 174 134.288 -8.596 15.252 1.00 0.00 H new ATOM 0 HD12 LEU A 174 134.942 -7.119 14.505 1.00 0.00 H new ATOM 0 HD13 LEU A 174 134.663 -7.179 16.262 1.00 0.00 H new ATOM 0 HD21 LEU A 174 131.962 -8.621 16.150 1.00 0.00 H new ATOM 0 HD22 LEU A 174 132.337 -7.204 17.160 1.00 0.00 H new ATOM 0 HD23 LEU A 174 130.950 -7.161 16.045 1.00 0.00 H new ATOM 2395 N ALA A 175 131.702 -2.776 13.871 1.00 0.00 N ATOM 2396 CA ALA A 175 131.728 -1.319 13.802 1.00 0.00 C ATOM 2397 C ALA A 175 130.352 -0.742 14.115 1.00 0.00 C ATOM 2398 O ALA A 175 130.239 0.328 14.715 1.00 0.00 O ATOM 2399 CB ALA A 175 132.171 -0.865 12.411 1.00 0.00 C ATOM 0 H ALA A 175 131.890 -3.248 12.987 1.00 0.00 H new ATOM 0 HA ALA A 175 132.439 -0.954 14.543 1.00 0.00 H new ATOM 0 HB1 ALA A 175 132.187 0.224 12.372 1.00 0.00 H new ATOM 0 HB2 ALA A 175 133.169 -1.250 12.203 1.00 0.00 H new ATOM 0 HB3 ALA A 175 131.473 -1.245 11.665 1.00 0.00 H new ATOM 2405 N ALA A 176 129.307 -1.457 13.709 1.00 0.00 N ATOM 2406 CA ALA A 176 127.944 -1.004 13.958 1.00 0.00 C ATOM 2407 C ALA A 176 127.701 -0.860 15.457 1.00 0.00 C ATOM 2408 O ALA A 176 126.882 -0.048 15.889 1.00 0.00 O ATOM 2409 CB ALA A 176 126.945 -2.000 13.366 1.00 0.00 C ATOM 0 H ALA A 176 129.377 -2.344 13.211 1.00 0.00 H new ATOM 0 HA ALA A 176 127.807 -0.033 13.482 1.00 0.00 H new ATOM 0 HB1 ALA A 176 125.929 -1.654 13.557 1.00 0.00 H new ATOM 0 HB2 ALA A 176 127.105 -2.080 12.291 1.00 0.00 H new ATOM 0 HB3 ALA A 176 127.088 -2.977 13.828 1.00 0.00 H new ATOM 2415 N LEU A 177 128.420 -1.652 16.246 1.00 0.00 N ATOM 2416 CA LEU A 177 128.279 -1.605 17.696 1.00 0.00 C ATOM 2417 C LEU A 177 128.569 -0.201 18.216 1.00 0.00 C ATOM 2418 O LEU A 177 127.940 0.259 19.169 1.00 0.00 O ATOM 2419 CB LEU A 177 129.244 -2.599 18.347 1.00 0.00 C ATOM 2420 CG LEU A 177 128.988 -4.001 17.793 1.00 0.00 C ATOM 2421 CD1 LEU A 177 129.914 -5.001 18.485 1.00 0.00 C ATOM 2422 CD2 LEU A 177 127.531 -4.395 18.054 1.00 0.00 C ATOM 0 H LEU A 177 129.102 -2.330 15.908 1.00 0.00 H new ATOM 0 HA LEU A 177 127.254 -1.872 17.951 1.00 0.00 H new ATOM 0 HB2 LEU A 177 130.274 -2.302 18.151 1.00 0.00 H new ATOM 0 HB3 LEU A 177 129.111 -2.595 19.429 1.00 0.00 H new ATOM 0 HG LEU A 177 129.182 -4.007 16.720 1.00 0.00 H new ATOM 0 HD11 LEU A 177 129.731 -6.000 18.090 1.00 0.00 H new ATOM 0 HD12 LEU A 177 130.952 -4.723 18.302 1.00 0.00 H new ATOM 0 HD13 LEU A 177 129.720 -4.994 19.558 1.00 0.00 H new ATOM 0 HD21 LEU A 177 127.348 -5.394 17.659 1.00 0.00 H new ATOM 0 HD22 LEU A 177 127.339 -4.388 19.127 1.00 0.00 H new ATOM 0 HD23 LEU A 177 126.868 -3.683 17.562 1.00 0.00 H new ATOM 2428 N GLU A 178 129.524 0.474 17.585 1.00 0.00 N ATOM 2429 CA GLU A 178 129.886 1.825 17.994 1.00 0.00 C ATOM 2430 C GLU A 178 130.123 1.882 19.501 1.00 0.00 C ATOM 2431 O GLU A 178 131.145 2.395 19.951 1.00 99.99 O ATOM 2432 CB GLU A 178 128.770 2.801 17.614 1.00 0.00 C ATOM 2433 CG GLU A 178 129.211 4.233 17.924 1.00 0.00 C ATOM 2434 CD GLU A 178 128.059 5.198 17.664 1.00 0.00 C ATOM 2435 OE1 GLU A 178 127.000 4.735 17.277 1.00 0.00 O ATOM 2436 OE2 GLU A 178 128.254 6.387 17.858 1.00 0.00 O ATOM 0 H GLU A 178 130.057 0.111 16.795 1.00 0.00 H new ATOM 0 HA GLU A 178 130.806 2.107 17.482 1.00 0.00 H new ATOM 0 HB2 GLU A 178 128.534 2.704 16.554 1.00 0.00 H new ATOM 0 HB3 GLU A 178 127.861 2.562 18.166 1.00 0.00 H new ATOM 0 HG2 GLU A 178 129.532 4.307 18.963 1.00 0.00 H new ATOM 0 HG3 GLU A 178 130.068 4.501 17.306 1.00 0.00 H new