USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1347 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 169 GLN : amide:sc= 0.0345! K(o=0.47!,f=-0.044) USER MOD Set 1.2: A 173 SER OG : rot -59:sc= 0.435 USER MOD Set 2.1: A 81 THR OG1 : rot -130:sc= 0.626 USER MOD Set 2.2: A 146 GLN : amide:sc= 0.79 X(o=1.4,f=1.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 158:sc= 1.19 (180deg=0.873) USER MOD Single : A 3 SER OG : rot -41:sc= 0.622 USER MOD Single : A 5 THR OG1 : rot 23:sc= 0.5 USER MOD Single : A 7 ASN : amide:sc= -0.861 K(o=-0.86,f=-3.8!) USER MOD Single : A 10 HIS : no HD1:sc=-0.00474 X(o=-0.0047,f=-0.0026) USER MOD Single : A 13 HIS : no HD1:sc= -0.0586 X(o=-0.059,f=-0.01) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot -57:sc= 0.554 USER MOD Single : A 25 LYS NZ :NH3+ 140:sc= 0.0247 (180deg=-0.408) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl -130:sc= -0.981 (180deg=-2.63!) USER MOD Single : A 38 GLN : amide:sc= -9.72! C(o=-9.7!,f=-11!) USER MOD Single : A 42 LYS NZ :NH3+ -163:sc= 1.22 (180deg=1.04) USER MOD Single : A 45 LYS NZ :NH3+ 179:sc= 0.489 (180deg=0.475) USER MOD Single : A 46 SER OG : rot -148:sc= 0.972 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -178:sc= -1.59 (180deg=-1.68) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.0813 USER MOD Single : A 61 ASN : amide:sc= 0.499 K(o=0.5,f=-6.9!) USER MOD Single : A 74 THR OG1 : rot -47:sc= 0.791 USER MOD Single : A 75 GLN : amide:sc= 0.167 K(o=0.17,f=-0.35) USER MOD Single : A 76 ASN : amide:sc= 0.548 K(o=0.55,f=-3.4!) USER MOD Single : A 85 LYS NZ :NH3+ 166:sc= -0.0243 (180deg=-0.297) USER MOD Single : A 91 SER OG : rot -116:sc= 1.26 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -70:sc= 0.128 USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 110:sc= 0.718 USER MOD Single : A 112 MET CE :methyl -160:sc= -0.0564 (180deg=-0.966) USER MOD Single : A 115 LYS NZ :NH3+ -166:sc= -0.264 (180deg=-0.495) USER MOD Single : A 126 LYS NZ :NH3+ -167:sc= -0.0188 (180deg=-0.202) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 SER OG : rot 100:sc= -0.873 USER MOD Single : A 142 LYS NZ :NH3+ -166:sc= 0.197 (180deg=0.0183) USER MOD Single : A 145 GLN : amide:sc= -0.13 X(o=-0.13,f=-0.22) USER MOD Single : A 150 SER OG : rot -160:sc= -0.684 USER MOD Single : A 152 GLN : amide:sc= -0.0115 K(o=-0.012,f=-1) USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot 51:sc= 0.147 USER MOD Single : A 168 MET CE :methyl -152:sc= -0.436 (180deg=-0.947) USER MOD Single : A 171 THR OG1 : rot -6:sc= 0.235 USER MOD Single : A 172 THR OG1 : rot 180:sc= 0 USER MOD Single : A 180 GLN : amide:sc= -0.159 K(o=-0.16,f=-0.9) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.568 -15.195 -0.541 1.00 33.65 N ATOM 2 CA MET A 1 29.971 -15.145 -1.013 1.00 33.45 C ATOM 3 C MET A 1 30.929 -15.091 0.169 1.00 33.18 C ATOM 4 O MET A 1 31.662 -16.044 0.432 1.00 33.13 O ATOM 5 CB MET A 1 30.196 -13.932 -1.921 1.00 33.33 C ATOM 6 CG MET A 1 29.522 -14.041 -3.282 1.00 33.70 C ATOM 7 SD MET A 1 27.726 -14.144 -3.178 1.00 34.05 S ATOM 8 CE MET A 1 27.310 -14.340 -4.908 1.00 34.32 C ATOM 0 H1 MET A 1 27.935 -14.863 -1.297 1.00 33.65 H new ATOM 0 H2 MET A 1 28.321 -16.173 -0.288 1.00 33.65 H new ATOM 0 H3 MET A 1 28.461 -14.584 0.294 1.00 33.65 H new ATOM 0 HA MET A 1 30.166 -16.051 -1.587 1.00 33.45 H new ATOM 0 HB2 MET A 1 29.827 -13.040 -1.415 1.00 33.33 H new ATOM 0 HB3 MET A 1 31.267 -13.795 -2.068 1.00 33.33 H new ATOM 0 HG2 MET A 1 29.796 -13.176 -3.886 1.00 33.70 H new ATOM 0 HG3 MET A 1 29.901 -14.923 -3.798 1.00 33.70 H new ATOM 0 HE1 MET A 1 26.228 -14.419 -5.015 1.00 34.32 H new ATOM 0 HE2 MET A 1 27.668 -13.477 -5.468 1.00 34.32 H new ATOM 0 HE3 MET A 1 27.780 -15.244 -5.295 1.00 34.32 H new ATOM 20 N GLY A 2 30.899 -13.976 0.897 1.00 33.09 N ATOM 21 CA GLY A 2 31.858 -13.748 1.965 1.00 32.90 C ATOM 22 C GLY A 2 31.494 -14.462 3.251 1.00 32.89 C ATOM 23 O GLY A 2 31.501 -13.863 4.326 1.00 32.86 O ATOM 0 H GLY A 2 30.224 -13.223 0.765 1.00 33.09 H new ATOM 0 HA2 GLY A 2 32.843 -14.080 1.638 1.00 32.90 H new ATOM 0 HA3 GLY A 2 31.930 -12.678 2.158 1.00 32.90 H new ATOM 27 N SER A 3 31.186 -15.742 3.135 1.00 32.98 N ATOM 28 CA SER A 3 30.831 -16.563 4.278 1.00 33.04 C ATOM 29 C SER A 3 31.227 -18.010 3.995 1.00 32.62 C ATOM 30 O SER A 3 30.704 -18.947 4.597 1.00 32.63 O ATOM 31 CB SER A 3 29.321 -16.458 4.545 1.00 33.70 C ATOM 32 OG SER A 3 28.947 -17.162 5.720 1.00 34.12 O ATOM 0 H SER A 3 31.175 -16.241 2.245 1.00 32.98 H new ATOM 0 HA SER A 3 31.362 -16.215 5.164 1.00 33.04 H new ATOM 0 HB2 SER A 3 29.041 -15.409 4.644 1.00 33.70 H new ATOM 0 HB3 SER A 3 28.772 -16.856 3.692 1.00 33.70 H new ATOM 0 HG SER A 3 29.428 -18.015 5.757 1.00 34.12 H new ATOM 38 N ALA A 4 32.164 -18.181 3.071 1.00 32.32 N ATOM 39 CA ALA A 4 32.533 -19.507 2.604 1.00 31.97 C ATOM 40 C ALA A 4 34.045 -19.678 2.546 1.00 31.64 C ATOM 41 O ALA A 4 34.672 -19.403 1.522 1.00 31.19 O ATOM 42 CB ALA A 4 31.915 -19.772 1.238 1.00 31.74 C ATOM 0 H ALA A 4 32.680 -17.418 2.632 1.00 32.32 H new ATOM 0 HA ALA A 4 32.146 -20.234 3.317 1.00 31.97 H new ATOM 0 HB1 ALA A 4 32.198 -20.768 0.898 1.00 31.74 H new ATOM 0 HB2 ALA A 4 30.829 -19.708 1.311 1.00 31.74 H new ATOM 0 HB3 ALA A 4 32.275 -19.029 0.526 1.00 31.74 H new ATOM 48 N THR A 5 34.612 -20.131 3.663 1.00 31.95 N ATOM 49 CA THR A 5 36.039 -20.453 3.780 1.00 31.80 C ATOM 50 C THR A 5 36.954 -19.326 3.295 1.00 31.31 C ATOM 51 O THR A 5 38.026 -19.583 2.744 1.00 31.16 O ATOM 52 CB THR A 5 36.392 -21.769 3.046 1.00 32.30 C ATOM 53 OG1 THR A 5 35.899 -21.755 1.697 1.00 32.53 O ATOM 54 CG2 THR A 5 35.820 -22.967 3.786 1.00 32.74 C ATOM 0 H THR A 5 34.089 -20.288 4.525 1.00 31.95 H new ATOM 0 HA THR A 5 36.218 -20.582 4.847 1.00 31.80 H new ATOM 0 HB THR A 5 37.479 -21.851 3.021 1.00 32.30 H new ATOM 0 HG1 THR A 5 35.774 -20.828 1.404 1.00 32.53 H new ATOM 0 HG21 THR A 5 36.080 -23.882 3.253 1.00 32.74 H new ATOM 0 HG22 THR A 5 36.234 -23.004 4.794 1.00 32.74 H new ATOM 0 HG23 THR A 5 34.735 -22.876 3.843 1.00 32.74 H new ATOM 62 N VAL A 6 36.531 -18.084 3.528 1.00 31.15 N ATOM 63 CA VAL A 6 37.293 -16.903 3.120 1.00 30.77 C ATOM 64 C VAL A 6 37.454 -16.853 1.601 1.00 30.24 C ATOM 65 O VAL A 6 38.386 -17.431 1.040 1.00 30.59 O ATOM 66 CB VAL A 6 38.686 -16.853 3.790 1.00 31.07 C ATOM 67 CG1 VAL A 6 39.432 -15.587 3.397 1.00 31.29 C ATOM 68 CG2 VAL A 6 38.562 -16.950 5.303 1.00 31.20 C ATOM 0 H VAL A 6 35.654 -17.868 4.003 1.00 31.15 H new ATOM 0 HA VAL A 6 36.724 -16.034 3.450 1.00 30.77 H new ATOM 0 HB VAL A 6 39.259 -17.711 3.437 1.00 31.07 H new ATOM 0 HG11 VAL A 6 40.409 -15.575 3.881 1.00 31.29 H new ATOM 0 HG12 VAL A 6 39.563 -15.563 2.315 1.00 31.29 H new ATOM 0 HG13 VAL A 6 38.860 -14.715 3.713 1.00 31.29 H new ATOM 0 HG21 VAL A 6 39.554 -16.913 5.753 1.00 31.20 H new ATOM 0 HG22 VAL A 6 37.964 -16.117 5.673 1.00 31.20 H new ATOM 0 HG23 VAL A 6 38.078 -17.890 5.569 1.00 31.20 H new ATOM 78 N ASN A 7 36.536 -16.171 0.936 1.00 29.46 N ATOM 79 CA ASN A 7 36.597 -16.035 -0.516 1.00 28.96 C ATOM 80 C ASN A 7 37.434 -14.820 -0.897 1.00 28.50 C ATOM 81 O ASN A 7 37.771 -14.621 -2.065 1.00 28.42 O ATOM 82 CB ASN A 7 35.191 -15.908 -1.114 1.00 28.74 C ATOM 83 CG ASN A 7 34.527 -14.570 -0.824 1.00 28.54 C ATOM 84 OD1 ASN A 7 34.715 -13.975 0.239 1.00 28.57 O ATOM 85 ND2 ASN A 7 33.746 -14.089 -1.775 1.00 28.41 N ATOM 0 H ASN A 7 35.742 -15.704 1.373 1.00 29.46 H new ATOM 0 HA ASN A 7 37.064 -16.933 -0.921 1.00 28.96 H new ATOM 0 HB2 ASN A 7 35.250 -16.049 -2.193 1.00 28.74 H new ATOM 0 HB3 ASN A 7 34.564 -16.709 -0.721 1.00 28.74 H new ATOM 0 HD21 ASN A 7 33.273 -13.195 -1.643 1.00 28.41 H new ATOM 0 HD22 ASN A 7 33.616 -14.612 -2.641 1.00 28.41 H new ATOM 92 N GLY A 8 37.766 -14.016 0.100 1.00 28.28 N ATOM 93 CA GLY A 8 38.514 -12.801 -0.131 1.00 27.93 C ATOM 94 C GLY A 8 38.012 -11.676 0.748 1.00 27.61 C ATOM 95 O GLY A 8 37.271 -11.928 1.702 1.00 27.61 O ATOM 0 H GLY A 8 37.527 -14.187 1.077 1.00 28.28 H new ATOM 0 HA2 GLY A 8 39.571 -12.978 0.068 1.00 27.93 H new ATOM 0 HA3 GLY A 8 38.431 -12.513 -1.179 1.00 27.93 H new ATOM 99 N PRO A 9 38.373 -10.421 0.441 1.00 27.42 N ATOM 100 CA PRO A 9 37.978 -9.258 1.246 1.00 27.20 C ATOM 101 C PRO A 9 36.503 -8.895 1.082 1.00 26.67 C ATOM 102 O PRO A 9 36.027 -7.911 1.651 1.00 26.59 O ATOM 103 CB PRO A 9 38.868 -8.136 0.709 1.00 27.23 C ATOM 104 CG PRO A 9 39.152 -8.527 -0.700 1.00 27.37 C ATOM 105 CD PRO A 9 39.210 -10.033 -0.711 1.00 27.51 C ATOM 0 HA PRO A 9 38.099 -9.448 2.312 1.00 27.20 H new ATOM 0 HB2 PRO A 9 38.364 -7.171 0.759 1.00 27.23 H new ATOM 0 HB3 PRO A 9 39.787 -8.046 1.289 1.00 27.23 H new ATOM 0 HG2 PRO A 9 38.374 -8.162 -1.370 1.00 27.37 H new ATOM 0 HG3 PRO A 9 40.094 -8.098 -1.041 1.00 27.37 H new ATOM 0 HD2 PRO A 9 38.823 -10.442 -1.644 1.00 27.51 H new ATOM 0 HD3 PRO A 9 40.232 -10.396 -0.604 1.00 27.51 H new ATOM 113 N HIS A 10 35.801 -9.705 0.284 1.00 26.41 N ATOM 114 CA HIS A 10 34.365 -9.562 0.048 1.00 25.98 C ATOM 115 C HIS A 10 34.064 -8.385 -0.878 1.00 25.20 C ATOM 116 O HIS A 10 34.545 -7.270 -0.679 1.00 24.97 O ATOM 117 CB HIS A 10 33.590 -9.431 1.366 1.00 26.32 C ATOM 118 CG HIS A 10 32.106 -9.332 1.186 1.00 26.28 C ATOM 119 ND1 HIS A 10 31.401 -8.170 1.386 1.00 26.46 N ATOM 120 CD2 HIS A 10 31.197 -10.264 0.822 1.00 26.19 C ATOM 121 CE1 HIS A 10 30.121 -8.391 1.153 1.00 26.48 C ATOM 122 NE2 HIS A 10 29.968 -9.655 0.810 1.00 26.32 N ATOM 0 H HIS A 10 36.220 -10.486 -0.221 1.00 26.41 H new ATOM 0 HA HIS A 10 34.029 -10.472 -0.449 1.00 25.98 H new ATOM 0 HB2 HIS A 10 33.814 -10.292 1.996 1.00 26.32 H new ATOM 0 HB3 HIS A 10 33.942 -8.547 1.898 1.00 26.32 H new ATOM 0 HD2 HIS A 10 31.401 -11.298 0.584 1.00 26.19 H new ATOM 0 HE1 HIS A 10 29.331 -7.659 1.230 1.00 26.48 H new ATOM 0 HE2 HIS A 10 29.083 -10.105 0.575 1.00 26.32 H new ATOM 131 N ASP A 11 33.258 -8.658 -1.888 1.00 24.90 N ATOM 132 CA ASP A 11 32.866 -7.667 -2.880 1.00 24.25 C ATOM 133 C ASP A 11 31.517 -8.067 -3.459 1.00 23.73 C ATOM 134 O ASP A 11 31.010 -9.144 -3.141 1.00 23.90 O ATOM 135 CB ASP A 11 33.909 -7.590 -4.001 1.00 24.28 C ATOM 136 CG ASP A 11 33.970 -8.861 -4.826 1.00 24.24 C ATOM 137 OD1 ASP A 11 34.603 -9.839 -4.376 1.00 24.02 O ATOM 138 OD2 ASP A 11 33.389 -8.890 -5.932 1.00 24.51 O1- ATOM 0 H ASP A 11 32.853 -9.580 -2.046 1.00 24.90 H new ATOM 0 HA ASP A 11 32.797 -6.687 -2.408 1.00 24.25 H new ATOM 0 HB2 ASP A 11 33.675 -6.748 -4.653 1.00 24.28 H new ATOM 0 HB3 ASP A 11 34.890 -7.395 -3.567 1.00 24.28 H new ATOM 143 N GLY A 12 30.930 -7.218 -4.286 1.00 23.19 N ATOM 144 CA GLY A 12 29.659 -7.562 -4.888 1.00 22.76 C ATOM 145 C GLY A 12 29.000 -6.401 -5.599 1.00 21.82 C ATOM 146 O GLY A 12 27.883 -6.006 -5.263 1.00 21.65 O ATOM 0 H GLY A 12 31.305 -6.307 -4.550 1.00 23.19 H new ATOM 0 HA2 GLY A 12 29.809 -8.376 -5.598 1.00 22.76 H new ATOM 0 HA3 GLY A 12 28.987 -7.934 -4.114 1.00 22.76 H new ATOM 150 N HIS A 13 29.688 -5.849 -6.583 1.00 21.31 N ATOM 151 CA HIS A 13 29.123 -4.794 -7.406 1.00 20.46 C ATOM 152 C HIS A 13 28.722 -5.377 -8.759 1.00 19.83 C ATOM 153 O HIS A 13 29.203 -4.930 -9.801 1.00 19.78 O ATOM 154 CB HIS A 13 30.123 -3.641 -7.576 1.00 20.39 C ATOM 155 CG HIS A 13 29.530 -2.379 -8.135 1.00 20.50 C ATOM 156 ND1 HIS A 13 28.960 -1.403 -7.350 1.00 20.49 N ATOM 157 CD2 HIS A 13 29.431 -1.930 -9.409 1.00 20.77 C ATOM 158 CE1 HIS A 13 28.537 -0.414 -8.111 1.00 20.74 C ATOM 159 NE2 HIS A 13 28.813 -0.709 -9.364 1.00 20.92 N ATOM 0 H HIS A 13 30.641 -6.115 -6.832 1.00 21.31 H new ATOM 0 HA HIS A 13 28.238 -4.387 -6.916 1.00 20.46 H new ATOM 0 HB2 HIS A 13 30.570 -3.419 -6.607 1.00 20.39 H new ATOM 0 HB3 HIS A 13 30.929 -3.970 -8.232 1.00 20.39 H new ATOM 0 HD2 HIS A 13 29.776 -2.441 -10.296 1.00 20.77 H new ATOM 0 HE1 HIS A 13 28.048 0.485 -7.766 1.00 20.74 H new ATOM 0 HE2 HIS A 13 28.601 -0.123 -10.171 1.00 20.92 H new ATOM 168 N ASP A 14 27.870 -6.388 -8.749 1.00 19.48 N ATOM 169 CA ASP A 14 27.455 -7.021 -9.996 1.00 18.98 C ATOM 170 C ASP A 14 26.495 -6.138 -10.802 1.00 18.18 C ATOM 171 O ASP A 14 26.717 -5.950 -12.002 1.00 18.03 O ATOM 172 CB ASP A 14 26.841 -8.407 -9.763 1.00 19.31 C ATOM 173 CG ASP A 14 26.363 -9.050 -11.051 1.00 19.60 C ATOM 174 OD1 ASP A 14 27.207 -9.597 -11.796 1.00 19.89 O ATOM 175 OD2 ASP A 14 25.144 -9.017 -11.323 1.00 19.65 O1- ATOM 0 H ASP A 14 27.455 -6.786 -7.906 1.00 19.48 H new ATOM 0 HA ASP A 14 28.363 -7.151 -10.585 1.00 18.98 H new ATOM 0 HB2 ASP A 14 27.579 -9.054 -9.289 1.00 19.31 H new ATOM 0 HB3 ASP A 14 26.003 -8.319 -9.071 1.00 19.31 H new ATOM 180 N PRO A 15 25.430 -5.569 -10.192 1.00 17.80 N ATOM 181 CA PRO A 15 24.532 -4.662 -10.915 1.00 17.14 C ATOM 182 C PRO A 15 25.271 -3.433 -11.449 1.00 16.68 C ATOM 183 O PRO A 15 25.569 -2.496 -10.704 1.00 16.69 O ATOM 184 CB PRO A 15 23.483 -4.257 -9.871 1.00 17.09 C ATOM 185 CG PRO A 15 24.100 -4.579 -8.552 1.00 17.72 C ATOM 186 CD PRO A 15 25.000 -5.757 -8.792 1.00 18.12 C ATOM 0 HA PRO A 15 24.094 -5.139 -11.792 1.00 17.14 H new ATOM 0 HB2 PRO A 15 23.243 -3.196 -9.945 1.00 17.09 H new ATOM 0 HB3 PRO A 15 22.552 -4.805 -10.015 1.00 17.09 H new ATOM 0 HG2 PRO A 15 24.664 -3.729 -8.167 1.00 17.72 H new ATOM 0 HG3 PRO A 15 23.336 -4.816 -7.811 1.00 17.72 H new ATOM 0 HD2 PRO A 15 25.848 -5.763 -8.107 1.00 18.12 H new ATOM 0 HD3 PRO A 15 24.473 -6.701 -8.655 1.00 18.12 H new ATOM 194 N ALA A 16 25.574 -3.454 -12.740 1.00 16.42 N ATOM 195 CA ALA A 16 26.298 -2.371 -13.384 1.00 16.13 C ATOM 196 C ALA A 16 26.282 -2.532 -14.900 1.00 15.32 C ATOM 197 O ALA A 16 27.141 -3.198 -15.473 1.00 15.30 O ATOM 198 CB ALA A 16 27.735 -2.312 -12.879 1.00 16.58 C ATOM 0 H ALA A 16 25.325 -4.220 -13.366 1.00 16.42 H new ATOM 0 HA ALA A 16 25.798 -1.436 -13.131 1.00 16.13 H new ATOM 0 HB1 ALA A 16 28.261 -1.495 -13.373 1.00 16.58 H new ATOM 0 HB2 ALA A 16 27.736 -2.145 -11.802 1.00 16.58 H new ATOM 0 HB3 ALA A 16 28.238 -3.253 -13.101 1.00 16.58 H new ATOM 204 N ALA A 17 25.293 -1.933 -15.548 1.00 14.80 N ATOM 205 CA ALA A 17 25.242 -1.908 -17.005 1.00 14.13 C ATOM 206 C ALA A 17 26.115 -0.775 -17.534 1.00 13.59 C ATOM 207 O ALA A 17 25.648 0.112 -18.254 1.00 13.72 O ATOM 208 CB ALA A 17 23.806 -1.755 -17.485 1.00 14.36 C ATOM 0 H ALA A 17 24.515 -1.458 -15.090 1.00 14.80 H new ATOM 0 HA ALA A 17 25.626 -2.853 -17.390 1.00 14.13 H new ATOM 0 HB1 ALA A 17 23.786 -1.738 -18.575 1.00 14.36 H new ATOM 0 HB2 ALA A 17 23.210 -2.594 -17.124 1.00 14.36 H new ATOM 0 HB3 ALA A 17 23.391 -0.823 -17.100 1.00 14.36 H new ATOM 214 N GLY A 18 27.386 -0.814 -17.156 1.00 13.17 N ATOM 215 CA GLY A 18 28.309 0.249 -17.477 1.00 12.81 C ATOM 216 C GLY A 18 28.042 1.463 -16.626 1.00 12.32 C ATOM 217 O GLY A 18 28.613 1.625 -15.547 1.00 12.26 O ATOM 0 H GLY A 18 27.797 -1.580 -16.623 1.00 13.17 H new ATOM 0 HA2 GLY A 18 29.332 -0.092 -17.321 1.00 12.81 H new ATOM 0 HA3 GLY A 18 28.217 0.511 -18.531 1.00 12.81 H new ATOM 221 N ALA A 19 27.141 2.288 -17.101 1.00 12.17 N ATOM 222 CA ALA A 19 26.725 3.482 -16.385 1.00 11.91 C ATOM 223 C ALA A 19 25.208 3.531 -16.268 1.00 11.79 C ATOM 224 O ALA A 19 24.655 4.240 -15.425 1.00 11.90 O ATOM 225 CB ALA A 19 27.241 4.730 -17.080 1.00 11.75 C ATOM 0 H ALA A 19 26.671 2.155 -17.996 1.00 12.17 H new ATOM 0 HA ALA A 19 27.150 3.445 -15.382 1.00 11.91 H new ATOM 0 HB1 ALA A 19 26.919 5.613 -16.528 1.00 11.75 H new ATOM 0 HB2 ALA A 19 28.330 4.702 -17.116 1.00 11.75 H new ATOM 0 HB3 ALA A 19 26.845 4.771 -18.095 1.00 11.75 H new ATOM 231 N GLU A 20 24.534 2.758 -17.105 1.00 11.76 N ATOM 232 CA GLU A 20 23.085 2.752 -17.133 1.00 11.81 C ATOM 233 C GLU A 20 22.541 1.796 -16.073 1.00 11.36 C ATOM 234 O GLU A 20 21.853 0.822 -16.367 1.00 11.31 O ATOM 235 CB GLU A 20 22.603 2.375 -18.530 1.00 12.34 C ATOM 236 CG GLU A 20 21.142 2.687 -18.778 1.00 12.69 C ATOM 237 CD GLU A 20 20.766 2.527 -20.231 1.00 13.43 C ATOM 238 OE1 GLU A 20 20.367 1.412 -20.623 1.00 13.77 O1- ATOM 239 OE2 GLU A 20 20.853 3.516 -20.987 1.00 13.82 O ATOM 0 H GLU A 20 24.972 2.126 -17.775 1.00 11.76 H new ATOM 0 HA GLU A 20 22.709 3.748 -16.900 1.00 11.81 H new ATOM 0 HB2 GLU A 20 23.208 2.903 -19.267 1.00 12.34 H new ATOM 0 HB3 GLU A 20 22.769 1.309 -18.686 1.00 12.34 H new ATOM 0 HG2 GLU A 20 20.523 2.028 -18.169 1.00 12.69 H new ATOM 0 HG3 GLU A 20 20.931 3.708 -18.460 1.00 12.69 H new ATOM 246 N LEU A 21 22.874 2.107 -14.834 1.00 11.26 N ATOM 247 CA LEU A 21 22.469 1.313 -13.683 1.00 11.08 C ATOM 248 C LEU A 21 22.536 2.194 -12.439 1.00 10.75 C ATOM 249 O LEU A 21 21.518 2.535 -11.841 1.00 10.51 O ATOM 250 CB LEU A 21 23.400 0.103 -13.526 1.00 11.53 C ATOM 251 CG LEU A 21 22.730 -1.198 -13.060 1.00 11.78 C ATOM 252 CD1 LEU A 21 21.987 -0.996 -11.750 1.00 11.96 C ATOM 253 CD2 LEU A 21 21.790 -1.733 -14.129 1.00 12.13 C ATOM 0 H LEU A 21 23.437 2.923 -14.594 1.00 11.26 H new ATOM 0 HA LEU A 21 21.452 0.947 -13.822 1.00 11.08 H new ATOM 0 HB2 LEU A 21 23.887 -0.084 -14.483 1.00 11.53 H new ATOM 0 HB3 LEU A 21 24.184 0.361 -12.814 1.00 11.53 H new ATOM 0 HG LEU A 21 23.516 -1.934 -12.891 1.00 11.78 H new ATOM 0 HD11 LEU A 21 21.523 -1.935 -11.446 1.00 11.96 H new ATOM 0 HD12 LEU A 21 22.688 -0.672 -10.981 1.00 11.96 H new ATOM 0 HD13 LEU A 21 21.216 -0.237 -11.882 1.00 11.96 H new ATOM 0 HD21 LEU A 21 21.326 -2.655 -13.778 1.00 12.13 H new ATOM 0 HD22 LEU A 21 21.016 -0.994 -14.336 1.00 12.13 H new ATOM 0 HD23 LEU A 21 22.353 -1.934 -15.041 1.00 12.13 H new ATOM 265 N LYS A 22 23.754 2.581 -12.078 1.00 10.97 N ATOM 266 CA LYS A 22 23.991 3.450 -10.928 1.00 10.97 C ATOM 267 C LYS A 22 23.793 4.902 -11.333 1.00 10.51 C ATOM 268 O LYS A 22 24.690 5.740 -11.214 1.00 10.50 O ATOM 269 CB LYS A 22 25.400 3.239 -10.399 1.00 11.77 C ATOM 270 CG LYS A 22 25.701 3.955 -9.091 1.00 12.31 C ATOM 271 CD LYS A 22 27.161 3.798 -8.693 1.00 13.08 C ATOM 272 CE LYS A 22 27.473 4.553 -7.411 1.00 13.66 C ATOM 273 NZ LYS A 22 28.903 4.432 -7.028 1.00 14.10 N1+ ATOM 0 H LYS A 22 24.603 2.303 -12.571 1.00 10.97 H new ATOM 0 HA LYS A 22 23.281 3.202 -10.139 1.00 10.97 H new ATOM 0 HB2 LYS A 22 25.565 2.171 -10.259 1.00 11.77 H new ATOM 0 HB3 LYS A 22 26.111 3.575 -11.154 1.00 11.77 H new ATOM 0 HG2 LYS A 22 25.462 5.014 -9.191 1.00 12.31 H new ATOM 0 HG3 LYS A 22 25.063 3.557 -8.302 1.00 12.31 H new ATOM 0 HD2 LYS A 22 27.391 2.741 -8.559 1.00 13.08 H new ATOM 0 HD3 LYS A 22 27.800 4.164 -9.497 1.00 13.08 H new ATOM 0 HE2 LYS A 22 27.220 5.605 -7.539 1.00 13.66 H new ATOM 0 HE3 LYS A 22 26.848 4.171 -6.604 1.00 13.66 H new ATOM 0 HZ1 LYS A 22 29.073 4.961 -6.149 1.00 14.10 H new ATOM 0 HZ2 LYS A 22 29.139 3.430 -6.880 1.00 14.10 H new ATOM 0 HZ3 LYS A 22 29.500 4.820 -7.786 1.00 14.10 H new ATOM 287 N THR A 23 22.600 5.139 -11.850 1.00 10.33 N ATOM 288 CA THR A 23 22.128 6.445 -12.316 1.00 10.01 C ATOM 289 C THR A 23 23.198 7.233 -13.068 1.00 10.01 C ATOM 290 O THR A 23 23.454 8.403 -12.788 1.00 10.38 O ATOM 291 CB THR A 23 21.501 7.292 -11.170 1.00 10.64 C ATOM 292 OG1 THR A 23 20.971 8.514 -11.696 1.00 10.93 O ATOM 293 CG2 THR A 23 22.501 7.610 -10.062 1.00 11.05 C ATOM 0 H THR A 23 21.902 4.404 -11.964 1.00 10.33 H new ATOM 0 HA THR A 23 21.336 6.230 -13.033 1.00 10.01 H new ATOM 0 HB THR A 23 20.703 6.692 -10.732 1.00 10.64 H new ATOM 0 HG1 THR A 23 21.682 9.008 -12.156 1.00 10.93 H new ATOM 0 HG21 THR A 23 22.011 8.202 -9.289 1.00 11.05 H new ATOM 0 HG22 THR A 23 22.871 6.681 -9.628 1.00 11.05 H new ATOM 0 HG23 THR A 23 23.336 8.174 -10.477 1.00 11.05 H new ATOM 301 N GLY A 24 23.801 6.586 -14.055 1.00 9.82 N ATOM 302 CA GLY A 24 24.733 7.275 -14.916 1.00 10.05 C ATOM 303 C GLY A 24 24.005 8.163 -15.878 1.00 9.39 C ATOM 304 O GLY A 24 24.435 9.276 -16.178 1.00 9.61 O ATOM 0 H GLY A 24 23.661 5.599 -14.273 1.00 9.82 H new ATOM 0 HA2 GLY A 24 25.421 7.869 -14.315 1.00 10.05 H new ATOM 0 HA3 GLY A 24 25.333 6.550 -15.465 1.00 10.05 H new ATOM 308 N LYS A 25 22.875 7.665 -16.342 1.00 8.70 N ATOM 309 CA LYS A 25 22.094 8.362 -17.329 1.00 8.11 C ATOM 310 C LYS A 25 20.712 7.745 -17.417 1.00 7.19 C ATOM 311 O LYS A 25 20.261 7.302 -18.467 1.00 6.94 O ATOM 312 CB LYS A 25 22.827 8.351 -18.669 1.00 8.62 C ATOM 313 CG LYS A 25 23.043 6.954 -19.234 1.00 9.02 C ATOM 314 CD LYS A 25 24.330 6.875 -20.030 1.00 9.74 C ATOM 315 CE LYS A 25 24.440 5.563 -20.794 1.00 10.22 C ATOM 316 NZ LYS A 25 23.355 5.407 -21.801 1.00 10.38 N1+ ATOM 0 H LYS A 25 22.480 6.773 -16.044 1.00 8.70 H new ATOM 0 HA LYS A 25 21.965 9.405 -17.040 1.00 8.11 H new ATOM 0 HB2 LYS A 25 22.260 8.941 -19.389 1.00 8.62 H new ATOM 0 HB3 LYS A 25 23.794 8.839 -18.549 1.00 8.62 H new ATOM 0 HG2 LYS A 25 23.072 6.230 -18.419 1.00 9.02 H new ATOM 0 HG3 LYS A 25 22.201 6.683 -19.871 1.00 9.02 H new ATOM 0 HD2 LYS A 25 24.376 7.709 -20.730 1.00 9.74 H new ATOM 0 HD3 LYS A 25 25.181 6.976 -19.357 1.00 9.74 H new ATOM 0 HE2 LYS A 25 25.407 5.516 -21.294 1.00 10.22 H new ATOM 0 HE3 LYS A 25 24.404 4.731 -20.091 1.00 10.22 H new ATOM 0 HZ1 LYS A 25 23.744 4.986 -22.669 1.00 10.38 H new ATOM 0 HZ2 LYS A 25 22.613 4.787 -21.418 1.00 10.38 H new ATOM 0 HZ3 LYS A 25 22.949 6.339 -22.021 1.00 10.38 H new ATOM 330 N ARG A 26 20.048 7.742 -16.282 1.00 6.90 N ATOM 331 CA ARG A 26 18.713 7.184 -16.164 1.00 6.23 C ATOM 332 C ARG A 26 17.826 8.172 -15.423 1.00 5.83 C ATOM 333 O ARG A 26 18.237 8.754 -14.419 1.00 6.27 O ATOM 334 CB ARG A 26 18.771 5.851 -15.421 1.00 6.68 C ATOM 335 CG ARG A 26 19.651 4.820 -16.104 1.00 7.16 C ATOM 336 CD ARG A 26 19.213 3.404 -15.766 1.00 7.38 C ATOM 337 NE ARG A 26 19.081 3.190 -14.323 1.00 7.54 N ATOM 338 CZ ARG A 26 18.838 2.005 -13.772 1.00 7.99 C ATOM 339 NH1 ARG A 26 18.774 0.918 -14.528 1.00 8.33 N1+ ATOM 340 NH2 ARG A 26 18.675 1.905 -12.464 1.00 8.37 N ATOM 0 H ARG A 26 20.417 8.126 -15.412 1.00 6.90 H new ATOM 0 HA ARG A 26 18.297 7.005 -17.156 1.00 6.23 H new ATOM 0 HB2 ARG A 26 19.142 6.022 -14.410 1.00 6.68 H new ATOM 0 HB3 ARG A 26 17.761 5.451 -15.327 1.00 6.68 H new ATOM 0 HG2 ARG A 26 19.614 4.966 -17.184 1.00 7.16 H new ATOM 0 HG3 ARG A 26 20.687 4.964 -15.798 1.00 7.16 H new ATOM 0 HD2 ARG A 26 18.259 3.196 -16.250 1.00 7.38 H new ATOM 0 HD3 ARG A 26 19.936 2.696 -16.171 1.00 7.38 H new ATOM 0 HE ARG A 26 19.181 3.996 -13.706 1.00 7.54 H new ATOM 0 HH11 ARG A 26 18.911 0.989 -15.536 1.00 8.33 H new ATOM 0 HH12 ARG A 26 18.587 0.010 -14.102 1.00 8.33 H new ATOM 0 HH21 ARG A 26 18.736 2.737 -11.877 1.00 8.37 H new ATOM 0 HH22 ARG A 26 18.489 0.996 -12.041 1.00 8.37 H new ATOM 354 N ILE A 27 16.620 8.362 -15.948 1.00 5.15 N ATOM 355 CA ILE A 27 15.706 9.408 -15.488 1.00 4.81 C ATOM 356 C ILE A 27 15.552 9.453 -13.986 1.00 5.34 C ATOM 357 O ILE A 27 15.227 8.458 -13.338 1.00 5.76 O ATOM 358 CB ILE A 27 14.305 9.245 -16.100 1.00 4.32 C ATOM 359 CG1 ILE A 27 14.370 9.292 -17.619 1.00 4.09 C ATOM 360 CG2 ILE A 27 13.370 10.316 -15.575 1.00 4.22 C ATOM 361 CD1 ILE A 27 14.771 10.630 -18.184 1.00 4.18 C ATOM 0 H ILE A 27 16.245 7.794 -16.708 1.00 5.15 H new ATOM 0 HA ILE A 27 16.164 10.340 -15.820 1.00 4.81 H new ATOM 0 HB ILE A 27 13.916 8.270 -15.806 1.00 4.32 H new ATOM 0 HG12 ILE A 27 15.078 8.539 -17.964 1.00 4.09 H new ATOM 0 HG13 ILE A 27 13.394 9.019 -18.021 1.00 4.09 H new ATOM 0 HG21 ILE A 27 12.383 10.186 -16.018 1.00 4.22 H new ATOM 0 HG22 ILE A 27 13.295 10.234 -14.491 1.00 4.22 H new ATOM 0 HG23 ILE A 27 13.759 11.300 -15.838 1.00 4.22 H new ATOM 0 HD11 ILE A 27 14.792 10.574 -19.272 1.00 4.18 H new ATOM 0 HD12 ILE A 27 14.051 11.387 -17.873 1.00 4.18 H new ATOM 0 HD13 ILE A 27 15.761 10.899 -17.815 1.00 4.18 H new ATOM 373 N LEU A 28 15.783 10.639 -13.463 1.00 5.52 N ATOM 374 CA LEU A 28 15.569 10.940 -12.068 1.00 6.20 C ATOM 375 C LEU A 28 14.448 11.966 -11.926 1.00 6.05 C ATOM 376 O LEU A 28 13.670 11.917 -10.978 1.00 6.59 O ATOM 377 CB LEU A 28 16.864 11.486 -11.481 1.00 6.86 C ATOM 378 CG LEU A 28 17.907 10.435 -11.087 1.00 7.51 C ATOM 379 CD1 LEU A 28 19.157 11.110 -10.545 1.00 8.22 C ATOM 380 CD2 LEU A 28 17.340 9.468 -10.058 1.00 7.71 C ATOM 0 H LEU A 28 16.130 11.431 -14.005 1.00 5.52 H new ATOM 0 HA LEU A 28 15.279 10.037 -11.532 1.00 6.20 H new ATOM 0 HB2 LEU A 28 17.314 12.164 -12.207 1.00 6.86 H new ATOM 0 HB3 LEU A 28 16.621 12.079 -10.599 1.00 6.86 H new ATOM 0 HG LEU A 28 18.173 9.867 -11.978 1.00 7.51 H new ATOM 0 HD11 LEU A 28 19.890 10.351 -10.269 1.00 8.22 H new ATOM 0 HD12 LEU A 28 19.580 11.761 -11.310 1.00 8.22 H new ATOM 0 HD13 LEU A 28 18.899 11.702 -9.667 1.00 8.22 H new ATOM 0 HD21 LEU A 28 18.099 8.731 -9.794 1.00 7.71 H new ATOM 0 HD22 LEU A 28 17.043 10.019 -9.166 1.00 7.71 H new ATOM 0 HD23 LEU A 28 16.471 8.960 -10.476 1.00 7.71 H new ATOM 392 N TYR A 29 14.366 12.888 -12.888 1.00 5.47 N ATOM 393 CA TYR A 29 13.416 13.992 -12.809 1.00 5.43 C ATOM 394 C TYR A 29 13.331 14.741 -14.145 1.00 4.86 C ATOM 395 O TYR A 29 13.955 14.347 -15.131 1.00 4.58 O ATOM 396 CB TYR A 29 13.836 14.952 -11.703 1.00 6.20 C ATOM 397 CG TYR A 29 15.072 15.755 -12.049 1.00 6.41 C ATOM 398 CD1 TYR A 29 16.327 15.165 -12.081 1.00 6.76 C ATOM 399 CD2 TYR A 29 14.978 17.109 -12.326 1.00 6.48 C ATOM 400 CE1 TYR A 29 17.455 15.907 -12.378 1.00 7.24 C ATOM 401 CE2 TYR A 29 16.097 17.861 -12.620 1.00 6.91 C ATOM 402 CZ TYR A 29 17.350 17.200 -12.723 1.00 7.33 C ATOM 403 OH TYR A 29 18.455 18.005 -12.932 1.00 7.99 O ATOM 0 H TYR A 29 14.946 12.889 -13.727 1.00 5.47 H new ATOM 0 HA TYR A 29 12.431 13.583 -12.584 1.00 5.43 H new ATOM 0 HB2 TYR A 29 13.014 15.636 -11.492 1.00 6.20 H new ATOM 0 HB3 TYR A 29 14.022 14.386 -10.790 1.00 6.20 H new ATOM 0 HD1 TYR A 29 16.424 14.110 -11.871 1.00 6.76 H new ATOM 0 HD2 TYR A 29 14.009 17.586 -12.312 1.00 6.48 H new ATOM 0 HE1 TYR A 29 18.429 15.442 -12.332 1.00 7.24 H new ATOM 0 HE2 TYR A 29 16.022 18.928 -12.768 1.00 6.91 H new ATOM 0 HH TYR A 29 18.161 18.908 -13.175 1.00 7.99 H new ATOM 413 N TRP A 30 12.563 15.832 -14.149 1.00 4.95 N ATOM 414 CA TRP A 30 12.245 16.582 -15.364 1.00 4.73 C ATOM 415 C TRP A 30 12.609 18.056 -15.227 1.00 5.18 C ATOM 416 O TRP A 30 12.629 18.600 -14.120 1.00 5.61 O ATOM 417 CB TRP A 30 10.751 16.465 -15.643 1.00 4.74 C ATOM 418 CG TRP A 30 10.413 15.400 -16.631 1.00 4.48 C ATOM 419 CD1 TRP A 30 10.043 15.584 -17.928 1.00 4.66 C ATOM 420 CD2 TRP A 30 10.415 13.988 -16.412 1.00 4.33 C ATOM 421 NE1 TRP A 30 9.807 14.374 -18.527 1.00 4.65 N ATOM 422 CE2 TRP A 30 10.027 13.380 -17.616 1.00 4.37 C ATOM 423 CE3 TRP A 30 10.705 13.176 -15.313 1.00 4.46 C ATOM 424 CZ2 TRP A 30 9.918 12.005 -17.754 1.00 4.41 C ATOM 425 CZ3 TRP A 30 10.598 11.807 -15.453 1.00 4.49 C ATOM 426 CH2 TRP A 30 10.207 11.234 -16.667 1.00 4.40 C ATOM 0 H TRP A 30 12.142 16.221 -13.305 1.00 4.95 H new ATOM 0 HA TRP A 30 12.828 16.162 -16.184 1.00 4.73 H new ATOM 0 HB2 TRP A 30 10.229 16.261 -14.708 1.00 4.74 H new ATOM 0 HB3 TRP A 30 10.382 17.422 -16.012 1.00 4.74 H new ATOM 0 HD1 TRP A 30 9.949 16.544 -18.414 1.00 4.66 H new ATOM 0 HE1 TRP A 30 9.515 14.238 -19.495 1.00 4.65 H new ATOM 0 HE3 TRP A 30 11.007 13.611 -14.372 1.00 4.46 H new ATOM 0 HZ2 TRP A 30 9.615 11.560 -18.690 1.00 4.41 H new ATOM 0 HZ3 TRP A 30 10.820 11.168 -14.611 1.00 4.49 H new ATOM 0 HH2 TRP A 30 10.132 10.159 -16.745 1.00 4.40 H new ATOM 437 N ARG A 31 12.880 18.695 -16.363 1.00 5.31 N ATOM 438 CA ARG A 31 13.274 20.092 -16.400 1.00 5.89 C ATOM 439 C ARG A 31 12.982 20.693 -17.776 1.00 6.18 C ATOM 440 O ARG A 31 13.080 19.998 -18.788 1.00 6.15 O ATOM 441 CB ARG A 31 14.767 20.237 -16.080 1.00 6.39 C ATOM 442 CG ARG A 31 15.682 19.629 -17.133 1.00 6.58 C ATOM 443 CD ARG A 31 17.145 19.860 -16.800 1.00 7.25 C ATOM 444 NE ARG A 31 18.030 19.423 -17.880 1.00 7.68 N ATOM 445 CZ ARG A 31 19.356 19.548 -17.853 1.00 8.49 C ATOM 446 NH1 ARG A 31 19.955 20.070 -16.790 1.00 8.90 N1+ ATOM 447 NH2 ARG A 31 20.080 19.152 -18.889 1.00 9.06 N ATOM 0 H ARG A 31 12.831 18.254 -17.282 1.00 5.31 H new ATOM 0 HA ARG A 31 12.696 20.629 -15.648 1.00 5.89 H new ATOM 0 HB2 ARG A 31 15.005 21.295 -15.972 1.00 6.39 H new ATOM 0 HB3 ARG A 31 14.971 19.765 -15.119 1.00 6.39 H new ATOM 0 HG2 ARG A 31 15.490 18.559 -17.209 1.00 6.58 H new ATOM 0 HG3 ARG A 31 15.457 20.063 -18.107 1.00 6.58 H new ATOM 0 HD2 ARG A 31 17.309 20.920 -16.604 1.00 7.25 H new ATOM 0 HD3 ARG A 31 17.397 19.324 -15.885 1.00 7.25 H new ATOM 0 HE ARG A 31 17.606 18.997 -18.704 1.00 7.68 H new ATOM 0 HH11 ARG A 31 19.400 20.377 -15.991 1.00 8.90 H new ATOM 0 HH12 ARG A 31 20.970 20.165 -16.772 1.00 8.90 H new ATOM 0 HH21 ARG A 31 19.622 18.751 -19.708 1.00 9.06 H new ATOM 0 HH22 ARG A 31 21.095 19.248 -18.868 1.00 9.06 H new ATOM 461 N ASP A 32 12.618 21.965 -17.824 1.00 6.64 N ATOM 462 CA ASP A 32 12.475 22.653 -19.106 1.00 7.19 C ATOM 463 C ASP A 32 13.854 23.135 -19.563 1.00 7.82 C ATOM 464 O ASP A 32 14.632 23.662 -18.767 1.00 8.07 O ATOM 465 CB ASP A 32 11.513 23.852 -18.986 1.00 7.56 C ATOM 466 CG ASP A 32 10.965 24.322 -20.322 1.00 7.94 C ATOM 467 OD1 ASP A 32 11.760 24.679 -21.207 1.00 8.31 O1- ATOM 468 OD2 ASP A 32 9.738 24.309 -20.514 1.00 8.10 O ATOM 0 H ASP A 32 12.418 22.539 -17.005 1.00 6.64 H new ATOM 0 HA ASP A 32 12.058 21.960 -19.837 1.00 7.19 H new ATOM 0 HB2 ASP A 32 10.681 23.577 -18.337 1.00 7.56 H new ATOM 0 HB3 ASP A 32 12.034 24.679 -18.504 1.00 7.56 H new ATOM 473 N PRO A 33 14.187 22.918 -20.846 1.00 8.28 N ATOM 474 CA PRO A 33 15.436 23.409 -21.449 1.00 9.11 C ATOM 475 C PRO A 33 15.550 24.927 -21.360 1.00 9.74 C ATOM 476 O PRO A 33 16.640 25.497 -21.436 1.00 10.41 O ATOM 477 CB PRO A 33 15.325 22.981 -22.915 1.00 9.60 C ATOM 478 CG PRO A 33 14.339 21.866 -22.921 1.00 8.98 C ATOM 479 CD PRO A 33 13.378 22.153 -21.805 1.00 8.23 C ATOM 0 HA PRO A 33 16.315 23.012 -20.941 1.00 9.11 H new ATOM 0 HB2 PRO A 33 14.990 23.807 -23.542 1.00 9.60 H new ATOM 0 HB3 PRO A 33 16.290 22.656 -23.305 1.00 9.60 H new ATOM 0 HG2 PRO A 33 13.820 21.810 -23.878 1.00 8.98 H new ATOM 0 HG3 PRO A 33 14.835 20.907 -22.771 1.00 8.98 H new ATOM 0 HD2 PRO A 33 12.518 22.726 -22.153 1.00 8.23 H new ATOM 0 HD3 PRO A 33 12.991 21.235 -21.362 1.00 8.23 H new ATOM 487 N MET A 34 14.395 25.567 -21.218 1.00 9.60 N ATOM 488 CA MET A 34 14.302 27.014 -21.088 1.00 10.19 C ATOM 489 C MET A 34 14.717 27.453 -19.700 1.00 9.99 C ATOM 490 O MET A 34 15.077 28.609 -19.486 1.00 10.53 O ATOM 491 CB MET A 34 12.855 27.466 -21.335 1.00 10.40 C ATOM 492 CG MET A 34 12.577 27.947 -22.749 1.00 10.85 C ATOM 493 SD MET A 34 11.594 26.800 -23.736 1.00 10.55 S ATOM 494 CE MET A 34 12.752 25.463 -23.992 1.00 10.30 C ATOM 0 H MET A 34 13.492 25.093 -21.190 1.00 9.60 H new ATOM 0 HA MET A 34 14.968 27.466 -21.823 1.00 10.19 H new ATOM 0 HB2 MET A 34 12.185 26.636 -21.109 1.00 10.40 H new ATOM 0 HB3 MET A 34 12.615 28.269 -20.638 1.00 10.40 H new ATOM 0 HG2 MET A 34 12.059 28.905 -22.700 1.00 10.85 H new ATOM 0 HG3 MET A 34 13.526 28.124 -23.255 1.00 10.85 H new ATOM 0 HE1 MET A 34 12.788 25.211 -25.052 1.00 10.30 H new ATOM 0 HE2 MET A 34 13.743 25.771 -23.658 1.00 10.30 H new ATOM 0 HE3 MET A 34 12.432 24.590 -23.423 1.00 10.30 H new ATOM 504 N VAL A 35 14.640 26.533 -18.751 1.00 9.32 N ATOM 505 CA VAL A 35 14.731 26.890 -17.342 1.00 9.27 C ATOM 506 C VAL A 35 15.790 26.042 -16.602 1.00 9.25 C ATOM 507 O VAL A 35 15.546 25.509 -15.513 1.00 8.98 O ATOM 508 CB VAL A 35 13.333 26.728 -16.701 1.00 8.70 C ATOM 509 CG1 VAL A 35 12.284 27.430 -17.551 1.00 8.84 C ATOM 510 CG2 VAL A 35 12.980 25.267 -16.539 1.00 7.95 C ATOM 0 H VAL A 35 14.515 25.536 -18.929 1.00 9.32 H new ATOM 0 HA VAL A 35 15.056 27.927 -17.256 1.00 9.27 H new ATOM 0 HB VAL A 35 13.355 27.185 -15.712 1.00 8.70 H new ATOM 0 HG11 VAL A 35 11.303 27.310 -17.091 1.00 8.84 H new ATOM 0 HG12 VAL A 35 12.524 28.491 -17.622 1.00 8.84 H new ATOM 0 HG13 VAL A 35 12.272 26.993 -18.549 1.00 8.84 H new ATOM 0 HG21 VAL A 35 11.992 25.179 -16.086 1.00 7.95 H new ATOM 0 HG22 VAL A 35 12.976 24.783 -17.516 1.00 7.95 H new ATOM 0 HG23 VAL A 35 13.717 24.783 -15.898 1.00 7.95 H new ATOM 520 N PRO A 36 17.011 25.967 -17.163 1.00 9.74 N ATOM 521 CA PRO A 36 18.072 25.087 -16.662 1.00 9.85 C ATOM 522 C PRO A 36 18.479 25.436 -15.232 1.00 10.22 C ATOM 523 O PRO A 36 18.923 26.551 -14.952 1.00 10.95 O ATOM 524 CB PRO A 36 19.224 25.342 -17.639 1.00 10.65 C ATOM 525 CG PRO A 36 18.965 26.706 -18.151 1.00 11.10 C ATOM 526 CD PRO A 36 17.481 26.778 -18.293 1.00 10.41 C ATOM 0 HA PRO A 36 17.762 24.043 -16.617 1.00 9.85 H new ATOM 0 HB2 PRO A 36 20.191 25.280 -17.140 1.00 10.65 H new ATOM 0 HB3 PRO A 36 19.233 24.608 -18.445 1.00 10.65 H new ATOM 0 HG2 PRO A 36 19.335 27.465 -17.462 1.00 11.10 H new ATOM 0 HG3 PRO A 36 19.463 26.872 -19.106 1.00 11.10 H new ATOM 0 HD2 PRO A 36 17.118 27.804 -18.234 1.00 10.41 H new ATOM 0 HD3 PRO A 36 17.145 26.375 -19.248 1.00 10.41 H new ATOM 534 N GLY A 37 18.314 24.478 -14.332 1.00 9.82 N ATOM 535 CA GLY A 37 18.571 24.722 -12.929 1.00 10.31 C ATOM 536 C GLY A 37 17.386 24.327 -12.073 1.00 9.86 C ATOM 537 O GLY A 37 17.541 23.930 -10.918 1.00 10.21 O ATOM 0 H GLY A 37 18.005 23.531 -14.551 1.00 9.82 H new ATOM 0 HA2 GLY A 37 19.451 24.160 -12.616 1.00 10.31 H new ATOM 0 HA3 GLY A 37 18.796 25.778 -12.777 1.00 10.31 H new ATOM 541 N GLN A 38 16.194 24.444 -12.644 1.00 9.21 N ATOM 542 CA GLN A 38 14.981 23.995 -11.977 1.00 8.88 C ATOM 543 C GLN A 38 14.956 22.467 -11.921 1.00 8.38 C ATOM 544 O GLN A 38 15.354 21.790 -12.866 1.00 8.00 O ATOM 545 CB GLN A 38 13.748 24.600 -12.681 1.00 8.51 C ATOM 546 CG GLN A 38 12.613 23.633 -12.994 1.00 8.11 C ATOM 547 CD GLN A 38 12.745 23.038 -14.374 1.00 8.18 C ATOM 548 OE1 GLN A 38 11.768 22.719 -15.044 1.00 8.47 O ATOM 549 NE2 GLN A 38 13.966 22.889 -14.803 1.00 8.21 N ATOM 0 H GLN A 38 16.042 24.847 -13.569 1.00 9.21 H new ATOM 0 HA GLN A 38 14.960 24.346 -10.945 1.00 8.88 H new ATOM 0 HB2 GLN A 38 13.354 25.400 -12.055 1.00 8.51 H new ATOM 0 HB3 GLN A 38 14.076 25.058 -13.614 1.00 8.51 H new ATOM 0 HG2 GLN A 38 12.603 22.833 -12.253 1.00 8.11 H new ATOM 0 HG3 GLN A 38 11.659 24.154 -12.913 1.00 8.11 H new ATOM 0 HE21 GLN A 38 14.751 23.167 -14.214 1.00 8.21 H new ATOM 0 HE22 GLN A 38 14.137 22.494 -15.728 1.00 8.21 H new ATOM 558 N ARG A 39 14.579 21.934 -10.775 1.00 8.53 N ATOM 559 CA ARG A 39 14.588 20.508 -10.552 1.00 8.21 C ATOM 560 C ARG A 39 13.228 20.029 -10.084 1.00 8.04 C ATOM 561 O ARG A 39 12.884 20.150 -8.906 1.00 8.70 O ATOM 562 CB ARG A 39 15.639 20.201 -9.513 1.00 8.96 C ATOM 563 CG ARG A 39 15.776 18.733 -9.216 1.00 8.86 C ATOM 564 CD ARG A 39 17.093 18.463 -8.550 1.00 9.10 C ATOM 565 NE ARG A 39 17.304 19.319 -7.384 1.00 10.02 N ATOM 566 CZ ARG A 39 18.478 19.486 -6.779 1.00 10.60 C ATOM 567 NH1 ARG A 39 19.546 18.809 -7.184 1.00 10.42 N1+ ATOM 568 NH2 ARG A 39 18.582 20.332 -5.761 1.00 11.51 N ATOM 0 H ARG A 39 14.259 22.480 -9.975 1.00 8.53 H new ATOM 0 HA ARG A 39 14.817 19.990 -11.483 1.00 8.21 H new ATOM 0 HB2 ARG A 39 16.600 20.586 -9.854 1.00 8.96 H new ATOM 0 HB3 ARG A 39 15.393 20.729 -8.592 1.00 8.96 H new ATOM 0 HG2 ARG A 39 14.960 18.407 -8.571 1.00 8.86 H new ATOM 0 HG3 ARG A 39 15.702 18.159 -10.139 1.00 8.86 H new ATOM 0 HD2 ARG A 39 17.137 17.418 -8.245 1.00 9.10 H new ATOM 0 HD3 ARG A 39 17.900 18.620 -9.266 1.00 9.10 H new ATOM 0 HE ARG A 39 16.499 19.821 -7.009 1.00 10.02 H new ATOM 0 HH11 ARG A 39 19.470 18.156 -7.964 1.00 10.42 H new ATOM 0 HH12 ARG A 39 20.442 18.942 -6.716 1.00 10.42 H new ATOM 0 HH21 ARG A 39 17.764 20.852 -5.444 1.00 11.51 H new ATOM 0 HH22 ARG A 39 19.480 20.462 -5.296 1.00 11.51 H new ATOM 582 N PHE A 40 12.452 19.496 -11.013 1.00 7.31 N ATOM 583 CA PHE A 40 11.116 19.019 -10.705 1.00 7.34 C ATOM 584 C PHE A 40 11.163 17.649 -10.067 1.00 7.47 C ATOM 585 O PHE A 40 11.880 16.767 -10.524 1.00 7.06 O ATOM 586 CB PHE A 40 10.249 18.983 -11.958 1.00 6.76 C ATOM 587 CG PHE A 40 9.550 20.278 -12.214 1.00 6.92 C ATOM 588 CD1 PHE A 40 10.177 21.306 -12.901 1.00 6.93 C ATOM 589 CD2 PHE A 40 8.262 20.473 -11.751 1.00 7.27 C ATOM 590 CE1 PHE A 40 9.521 22.502 -13.119 1.00 7.26 C ATOM 591 CE2 PHE A 40 7.607 21.667 -11.965 1.00 7.50 C ATOM 592 CZ PHE A 40 8.237 22.683 -12.651 1.00 7.49 C ATOM 0 H PHE A 40 12.726 19.383 -11.989 1.00 7.31 H new ATOM 0 HA PHE A 40 10.672 19.716 -9.995 1.00 7.34 H new ATOM 0 HB2 PHE A 40 10.871 18.735 -12.818 1.00 6.76 H new ATOM 0 HB3 PHE A 40 9.509 18.189 -11.860 1.00 6.76 H new ATOM 0 HD1 PHE A 40 11.184 21.171 -13.268 1.00 6.93 H new ATOM 0 HD2 PHE A 40 7.763 19.680 -11.215 1.00 7.27 H new ATOM 0 HE1 PHE A 40 10.015 23.297 -13.657 1.00 7.26 H new ATOM 0 HE2 PHE A 40 6.602 21.806 -11.596 1.00 7.50 H new ATOM 0 HZ PHE A 40 7.726 23.619 -12.822 1.00 7.49 H new ATOM 602 N ASP A 41 10.375 17.486 -9.016 1.00 8.18 N ATOM 603 CA ASP A 41 10.318 16.237 -8.264 1.00 8.62 C ATOM 604 C ASP A 41 9.764 15.120 -9.134 1.00 8.07 C ATOM 605 O ASP A 41 10.032 13.944 -8.901 1.00 8.18 O ATOM 606 CB ASP A 41 9.422 16.419 -7.036 1.00 9.62 C ATOM 607 CG ASP A 41 9.818 17.613 -6.191 1.00 10.23 C ATOM 608 OD1 ASP A 41 9.319 18.727 -6.462 1.00 10.61 O ATOM 609 OD2 ASP A 41 10.622 17.451 -5.252 1.00 10.48 O1- ATOM 0 H ASP A 41 9.756 18.214 -8.658 1.00 8.18 H new ATOM 0 HA ASP A 41 11.327 15.971 -7.948 1.00 8.62 H new ATOM 0 HB2 ASP A 41 8.388 16.536 -7.361 1.00 9.62 H new ATOM 0 HB3 ASP A 41 9.464 15.517 -6.425 1.00 9.62 H new ATOM 614 N LYS A 42 8.977 15.499 -10.134 1.00 7.60 N ATOM 615 CA LYS A 42 8.282 14.533 -10.964 1.00 7.23 C ATOM 616 C LYS A 42 7.755 15.199 -12.235 1.00 6.69 C ATOM 617 O LYS A 42 7.404 16.381 -12.241 1.00 6.78 O ATOM 618 CB LYS A 42 7.131 13.916 -10.154 1.00 8.14 C ATOM 619 CG LYS A 42 6.212 14.939 -9.500 1.00 8.90 C ATOM 620 CD LYS A 42 5.300 14.296 -8.460 1.00 9.77 C ATOM 621 CE LYS A 42 4.346 13.277 -9.071 1.00 10.52 C ATOM 622 NZ LYS A 42 3.282 13.917 -9.891 1.00 10.91 N1+ ATOM 0 H LYS A 42 8.806 16.472 -10.387 1.00 7.60 H new ATOM 0 HA LYS A 42 8.973 13.746 -11.265 1.00 7.23 H new ATOM 0 HB2 LYS A 42 6.539 13.280 -10.812 1.00 8.14 H new ATOM 0 HB3 LYS A 42 7.550 13.273 -9.380 1.00 8.14 H new ATOM 0 HG2 LYS A 42 6.812 15.717 -9.027 1.00 8.90 H new ATOM 0 HG3 LYS A 42 5.606 15.425 -10.265 1.00 8.90 H new ATOM 0 HD2 LYS A 42 5.909 13.808 -7.699 1.00 9.77 H new ATOM 0 HD3 LYS A 42 4.724 15.073 -7.957 1.00 9.77 H new ATOM 0 HE2 LYS A 42 4.911 12.581 -9.692 1.00 10.52 H new ATOM 0 HE3 LYS A 42 3.885 12.692 -8.275 1.00 10.52 H new ATOM 0 HZ1 LYS A 42 2.507 13.240 -10.044 1.00 10.91 H new ATOM 0 HZ2 LYS A 42 2.917 14.754 -9.394 1.00 10.91 H new ATOM 0 HZ3 LYS A 42 3.677 14.205 -10.809 1.00 10.91 H new ATOM 636 N PRO A 43 7.724 14.410 -13.332 1.00 6.27 N ATOM 637 CA PRO A 43 7.337 14.852 -14.685 1.00 6.04 C ATOM 638 C PRO A 43 6.002 15.580 -14.739 1.00 6.80 C ATOM 639 O PRO A 43 4.994 15.071 -14.256 1.00 7.51 O ATOM 640 CB PRO A 43 7.238 13.545 -15.488 1.00 6.00 C ATOM 641 CG PRO A 43 7.237 12.460 -14.462 1.00 6.35 C ATOM 642 CD PRO A 43 8.076 12.987 -13.336 1.00 6.19 C ATOM 0 HA PRO A 43 8.063 15.569 -15.069 1.00 6.04 H new ATOM 0 HB2 PRO A 43 6.330 13.520 -16.090 1.00 6.00 H new ATOM 0 HB3 PRO A 43 8.078 13.439 -16.174 1.00 6.00 H new ATOM 0 HG2 PRO A 43 6.224 12.235 -14.127 1.00 6.35 H new ATOM 0 HG3 PRO A 43 7.653 11.536 -14.865 1.00 6.35 H new ATOM 0 HD2 PRO A 43 7.836 12.505 -12.388 1.00 6.19 H new ATOM 0 HD3 PRO A 43 9.140 12.831 -13.513 1.00 6.19 H new ATOM 650 N GLY A 44 5.999 16.752 -15.359 1.00 6.81 N ATOM 651 CA GLY A 44 4.772 17.508 -15.538 1.00 7.59 C ATOM 652 C GLY A 44 4.907 18.514 -16.660 1.00 7.56 C ATOM 653 O GLY A 44 5.793 18.383 -17.507 1.00 7.08 O ATOM 0 H GLY A 44 6.832 17.197 -15.745 1.00 6.81 H new ATOM 0 HA2 GLY A 44 3.950 16.826 -15.755 1.00 7.59 H new ATOM 0 HA3 GLY A 44 4.522 18.024 -14.611 1.00 7.59 H new ATOM 657 N LYS A 45 4.027 19.504 -16.690 1.00 8.20 N ATOM 658 CA LYS A 45 4.150 20.603 -17.631 1.00 8.37 C ATOM 659 C LYS A 45 4.968 21.726 -17.014 1.00 8.15 C ATOM 660 O LYS A 45 4.984 21.908 -15.796 1.00 8.27 O ATOM 661 CB LYS A 45 2.775 21.131 -18.005 1.00 9.30 C ATOM 662 CG LYS A 45 2.824 22.141 -19.139 1.00 9.65 C ATOM 663 CD LYS A 45 1.458 22.670 -19.467 1.00 10.42 C ATOM 664 CE LYS A 45 0.845 23.450 -18.309 1.00 11.07 C ATOM 665 NZ LYS A 45 1.648 24.653 -17.945 1.00 11.68 N1+ ATOM 0 H LYS A 45 3.219 19.567 -16.071 1.00 8.20 H new ATOM 0 HA LYS A 45 4.651 20.238 -18.527 1.00 8.37 H new ATOM 0 HB2 LYS A 45 2.136 20.297 -18.294 1.00 9.30 H new ATOM 0 HB3 LYS A 45 2.318 21.594 -17.131 1.00 9.30 H new ATOM 0 HG2 LYS A 45 3.478 22.968 -18.863 1.00 9.65 H new ATOM 0 HG3 LYS A 45 3.256 21.674 -20.024 1.00 9.65 H new ATOM 0 HD2 LYS A 45 1.522 23.315 -20.343 1.00 10.42 H new ATOM 0 HD3 LYS A 45 0.803 21.839 -19.730 1.00 10.42 H new ATOM 0 HE2 LYS A 45 -0.165 23.759 -18.577 1.00 11.07 H new ATOM 0 HE3 LYS A 45 0.759 22.797 -17.440 1.00 11.07 H new ATOM 0 HZ1 LYS A 45 1.182 25.159 -17.165 1.00 11.68 H new ATOM 0 HZ2 LYS A 45 2.600 24.358 -17.647 1.00 11.68 H new ATOM 0 HZ3 LYS A 45 1.723 25.283 -18.769 1.00 11.68 H new ATOM 679 N SER A 46 5.654 22.462 -17.874 1.00 8.03 N ATOM 680 CA SER A 46 6.432 23.610 -17.465 1.00 7.98 C ATOM 681 C SER A 46 5.516 24.701 -16.935 1.00 8.64 C ATOM 682 O SER A 46 4.470 24.981 -17.526 1.00 9.20 O ATOM 683 CB SER A 46 7.245 24.127 -18.650 1.00 8.03 C ATOM 684 OG SER A 46 8.129 25.167 -18.270 1.00 8.36 O ATOM 0 H SER A 46 5.684 22.276 -18.876 1.00 8.03 H new ATOM 0 HA SER A 46 7.115 23.316 -16.668 1.00 7.98 H new ATOM 0 HB2 SER A 46 7.815 23.306 -19.085 1.00 8.03 H new ATOM 0 HB3 SER A 46 6.569 24.490 -19.424 1.00 8.03 H new ATOM 0 HG SER A 46 8.235 25.795 -19.015 1.00 8.36 H new ATOM 690 N PRO A 47 5.878 25.312 -15.806 1.00 8.70 N ATOM 691 CA PRO A 47 5.111 26.412 -15.239 1.00 9.38 C ATOM 692 C PRO A 47 5.318 27.701 -16.020 1.00 9.63 C ATOM 693 O PRO A 47 4.457 28.579 -16.055 1.00 10.25 O ATOM 694 CB PRO A 47 5.665 26.533 -13.819 1.00 9.45 C ATOM 695 CG PRO A 47 7.059 26.023 -13.912 1.00 8.81 C ATOM 696 CD PRO A 47 7.049 24.962 -14.981 1.00 8.26 C ATOM 0 HA PRO A 47 4.036 26.233 -15.266 1.00 9.38 H new ATOM 0 HB2 PRO A 47 5.644 27.566 -13.473 1.00 9.45 H new ATOM 0 HB3 PRO A 47 5.076 25.948 -13.113 1.00 9.45 H new ATOM 0 HG2 PRO A 47 7.751 26.826 -14.167 1.00 8.81 H new ATOM 0 HG3 PRO A 47 7.387 25.611 -12.958 1.00 8.81 H new ATOM 0 HD2 PRO A 47 7.969 24.973 -15.566 1.00 8.26 H new ATOM 0 HD3 PRO A 47 6.955 23.964 -14.554 1.00 8.26 H new ATOM 704 N TYR A 48 6.472 27.779 -16.674 1.00 9.26 N ATOM 705 CA TYR A 48 6.900 28.976 -17.354 1.00 9.61 C ATOM 706 C TYR A 48 6.167 29.113 -18.672 1.00 9.96 C ATOM 707 O TYR A 48 5.828 30.219 -19.091 1.00 10.49 O ATOM 708 CB TYR A 48 8.402 28.910 -17.567 1.00 9.34 C ATOM 709 CG TYR A 48 9.183 28.842 -16.271 1.00 9.17 C ATOM 710 CD1 TYR A 48 9.482 29.994 -15.557 1.00 9.63 C ATOM 711 CD2 TYR A 48 9.608 27.624 -15.756 1.00 8.69 C ATOM 712 CE1 TYR A 48 10.187 29.934 -14.370 1.00 9.70 C ATOM 713 CE2 TYR A 48 10.311 27.555 -14.571 1.00 8.75 C ATOM 714 CZ TYR A 48 10.600 28.712 -13.883 1.00 9.30 C ATOM 715 OH TYR A 48 11.296 28.645 -12.699 1.00 9.57 O ATOM 0 H TYR A 48 7.133 27.005 -16.742 1.00 9.26 H new ATOM 0 HA TYR A 48 6.667 29.853 -16.750 1.00 9.61 H new ATOM 0 HB2 TYR A 48 8.639 28.036 -18.173 1.00 9.34 H new ATOM 0 HB3 TYR A 48 8.722 29.786 -18.132 1.00 9.34 H new ATOM 0 HD1 TYR A 48 9.159 30.953 -15.935 1.00 9.63 H new ATOM 0 HD2 TYR A 48 9.384 26.714 -16.293 1.00 8.69 H new ATOM 0 HE1 TYR A 48 10.413 30.840 -13.827 1.00 9.70 H new ATOM 0 HE2 TYR A 48 10.633 26.599 -14.185 1.00 8.75 H new ATOM 0 HH TYR A 48 11.511 27.710 -12.498 1.00 9.57 H new ATOM 725 N MET A 49 5.955 27.988 -19.341 1.00 9.74 N ATOM 726 CA MET A 49 5.126 27.967 -20.522 1.00 10.23 C ATOM 727 C MET A 49 4.498 26.582 -20.720 1.00 10.20 C ATOM 728 O MET A 49 4.949 25.602 -20.131 1.00 9.87 O ATOM 729 CB MET A 49 5.926 28.376 -21.732 1.00 10.28 C ATOM 730 CG MET A 49 6.879 27.324 -22.206 1.00 10.38 C ATOM 731 SD MET A 49 8.163 26.878 -21.028 1.00 10.09 S ATOM 732 CE MET A 49 8.959 28.445 -20.759 1.00 9.55 C ATOM 0 H MET A 49 6.348 27.083 -19.081 1.00 9.74 H new ATOM 0 HA MET A 49 4.317 28.685 -20.390 1.00 10.23 H new ATOM 0 HB2 MET A 49 5.241 28.625 -22.542 1.00 10.28 H new ATOM 0 HB3 MET A 49 6.485 29.282 -21.498 1.00 10.28 H new ATOM 0 HG2 MET A 49 6.312 26.428 -22.459 1.00 10.38 H new ATOM 0 HG3 MET A 49 7.353 27.671 -23.124 1.00 10.38 H new ATOM 0 HE1 MET A 49 9.799 28.314 -20.076 1.00 9.55 H new ATOM 0 HE2 MET A 49 9.321 28.837 -21.709 1.00 9.55 H new ATOM 0 HE3 MET A 49 8.245 29.146 -20.326 1.00 9.55 H new ATOM 742 N ASP A 50 3.484 26.498 -21.570 1.00 10.69 N ATOM 743 CA ASP A 50 2.669 25.284 -21.688 1.00 10.83 C ATOM 744 C ASP A 50 3.284 24.216 -22.588 1.00 10.64 C ATOM 745 O ASP A 50 2.880 24.016 -23.731 1.00 11.23 O ATOM 746 CB ASP A 50 1.273 25.641 -22.172 1.00 11.76 C ATOM 747 CG ASP A 50 1.280 26.518 -23.411 1.00 12.21 C ATOM 748 OD1 ASP A 50 1.596 27.720 -23.297 1.00 12.33 O1- ATOM 749 OD2 ASP A 50 0.965 26.009 -24.510 1.00 12.54 O ATOM 0 H ASP A 50 3.201 27.255 -22.192 1.00 10.69 H new ATOM 0 HA ASP A 50 2.621 24.847 -20.691 1.00 10.83 H new ATOM 0 HB2 ASP A 50 0.723 24.724 -22.386 1.00 11.76 H new ATOM 0 HB3 ASP A 50 0.738 26.155 -21.373 1.00 11.76 H new ATOM 754 N MET A 51 4.266 23.540 -22.045 1.00 9.87 N ATOM 755 CA MET A 51 4.869 22.372 -22.685 1.00 9.64 C ATOM 756 C MET A 51 5.211 21.372 -21.606 1.00 8.84 C ATOM 757 O MET A 51 5.635 21.763 -20.517 1.00 8.36 O ATOM 758 CB MET A 51 6.140 22.726 -23.476 1.00 9.70 C ATOM 759 CG MET A 51 7.244 23.301 -22.629 1.00 9.43 C ATOM 760 SD MET A 51 8.724 23.678 -23.573 1.00 9.38 S ATOM 761 CE MET A 51 9.776 22.299 -23.166 1.00 9.04 C ATOM 0 H MET A 51 4.679 23.777 -21.143 1.00 9.87 H new ATOM 0 HA MET A 51 4.154 21.962 -23.398 1.00 9.64 H new ATOM 0 HB2 MET A 51 6.507 21.829 -23.975 1.00 9.70 H new ATOM 0 HB3 MET A 51 5.883 23.442 -24.256 1.00 9.70 H new ATOM 0 HG2 MET A 51 6.887 24.210 -22.144 1.00 9.43 H new ATOM 0 HG3 MET A 51 7.494 22.594 -21.838 1.00 9.43 H new ATOM 0 HE1 MET A 51 10.730 22.404 -23.684 1.00 9.04 H new ATOM 0 HE2 MET A 51 9.948 22.278 -22.090 1.00 9.04 H new ATOM 0 HE3 MET A 51 9.295 21.371 -23.475 1.00 9.04 H new ATOM 771 N PRO A 52 5.012 20.081 -21.865 1.00 8.77 N ATOM 772 CA PRO A 52 5.464 19.051 -20.948 1.00 8.04 C ATOM 773 C PRO A 52 6.979 19.112 -20.822 1.00 7.35 C ATOM 774 O PRO A 52 7.685 19.232 -21.825 1.00 7.56 O ATOM 775 CB PRO A 52 5.011 17.739 -21.598 1.00 8.35 C ATOM 776 CG PRO A 52 4.750 18.077 -23.027 1.00 9.16 C ATOM 777 CD PRO A 52 4.344 19.525 -23.050 1.00 9.51 C ATOM 0 HA PRO A 52 5.062 19.161 -19.941 1.00 8.04 H new ATOM 0 HB2 PRO A 52 5.779 16.971 -21.510 1.00 8.35 H new ATOM 0 HB3 PRO A 52 4.114 17.350 -21.116 1.00 8.35 H new ATOM 0 HG2 PRO A 52 5.640 17.913 -23.634 1.00 9.16 H new ATOM 0 HG3 PRO A 52 3.963 17.446 -23.438 1.00 9.16 H new ATOM 0 HD2 PRO A 52 4.670 20.020 -23.965 1.00 9.51 H new ATOM 0 HD3 PRO A 52 3.262 19.640 -22.993 1.00 9.51 H new ATOM 785 N LEU A 53 7.466 19.058 -19.592 1.00 6.71 N ATOM 786 CA LEU A 53 8.885 19.235 -19.318 1.00 6.20 C ATOM 787 C LEU A 53 9.725 18.189 -20.038 1.00 5.97 C ATOM 788 O LEU A 53 9.225 17.134 -20.430 1.00 6.05 O ATOM 789 CB LEU A 53 9.133 19.188 -17.810 1.00 5.79 C ATOM 790 CG LEU A 53 8.484 20.329 -17.031 1.00 6.23 C ATOM 791 CD1 LEU A 53 8.351 19.973 -15.565 1.00 6.10 C ATOM 792 CD2 LEU A 53 9.297 21.600 -17.192 1.00 6.57 C ATOM 0 H LEU A 53 6.896 18.892 -18.763 1.00 6.71 H new ATOM 0 HA LEU A 53 9.188 20.211 -19.696 1.00 6.20 H new ATOM 0 HB2 LEU A 53 8.760 18.240 -17.422 1.00 5.79 H new ATOM 0 HB3 LEU A 53 10.208 19.206 -17.630 1.00 5.79 H new ATOM 0 HG LEU A 53 7.485 20.495 -17.433 1.00 6.23 H new ATOM 0 HD11 LEU A 53 7.886 20.801 -15.030 1.00 6.10 H new ATOM 0 HD12 LEU A 53 7.733 19.081 -15.462 1.00 6.10 H new ATOM 0 HD13 LEU A 53 9.339 19.780 -15.146 1.00 6.10 H new ATOM 0 HD21 LEU A 53 8.825 22.407 -16.632 1.00 6.57 H new ATOM 0 HD22 LEU A 53 10.306 21.437 -16.813 1.00 6.57 H new ATOM 0 HD23 LEU A 53 9.345 21.870 -18.247 1.00 6.57 H new ATOM 804 N ILE A 54 11.002 18.482 -20.199 1.00 5.92 N ATOM 805 CA ILE A 54 11.890 17.607 -20.934 1.00 5.98 C ATOM 806 C ILE A 54 12.618 16.697 -19.972 1.00 5.33 C ATOM 807 O ILE A 54 13.116 17.139 -18.933 1.00 5.16 O ATOM 808 CB ILE A 54 12.909 18.411 -21.764 1.00 6.77 C ATOM 809 CG1 ILE A 54 12.187 19.223 -22.841 1.00 7.56 C ATOM 810 CG2 ILE A 54 13.959 17.503 -22.394 1.00 7.04 C ATOM 811 CD1 ILE A 54 11.424 18.374 -23.834 1.00 7.89 C ATOM 0 H ILE A 54 11.446 19.322 -19.829 1.00 5.92 H new ATOM 0 HA ILE A 54 11.289 17.012 -21.622 1.00 5.98 H new ATOM 0 HB ILE A 54 13.427 19.094 -21.090 1.00 6.77 H new ATOM 0 HG12 ILE A 54 11.495 19.914 -22.360 1.00 7.56 H new ATOM 0 HG13 ILE A 54 12.918 19.827 -23.379 1.00 7.56 H new ATOM 0 HG21 ILE A 54 14.661 18.105 -22.972 1.00 7.04 H new ATOM 0 HG22 ILE A 54 14.497 16.971 -21.610 1.00 7.04 H new ATOM 0 HG23 ILE A 54 13.471 16.784 -23.051 1.00 7.04 H new ATOM 0 HD11 ILE A 54 10.938 19.019 -24.567 1.00 7.89 H new ATOM 0 HD12 ILE A 54 12.114 17.701 -24.343 1.00 7.89 H new ATOM 0 HD13 ILE A 54 10.669 17.789 -23.308 1.00 7.89 H new ATOM 823 N PRO A 55 12.653 15.407 -20.274 1.00 5.13 N ATOM 824 CA PRO A 55 13.306 14.451 -19.416 1.00 4.65 C ATOM 825 C PRO A 55 14.823 14.445 -19.584 1.00 5.10 C ATOM 826 O PRO A 55 15.355 14.602 -20.681 1.00 5.77 O ATOM 827 CB PRO A 55 12.660 13.133 -19.828 1.00 4.51 C ATOM 828 CG PRO A 55 12.316 13.310 -21.267 1.00 5.22 C ATOM 829 CD PRO A 55 12.036 14.775 -21.459 1.00 5.58 C ATOM 0 HA PRO A 55 13.179 14.674 -18.357 1.00 4.65 H new ATOM 0 HB2 PRO A 55 13.343 12.296 -19.685 1.00 4.51 H new ATOM 0 HB3 PRO A 55 11.772 12.925 -19.232 1.00 4.51 H new ATOM 0 HG2 PRO A 55 13.137 12.985 -21.906 1.00 5.22 H new ATOM 0 HG3 PRO A 55 11.446 12.710 -21.535 1.00 5.22 H new ATOM 0 HD2 PRO A 55 12.473 15.148 -22.385 1.00 5.58 H new ATOM 0 HD3 PRO A 55 10.966 14.975 -21.508 1.00 5.58 H new ATOM 837 N VAL A 56 15.498 14.282 -18.464 1.00 5.00 N ATOM 838 CA VAL A 56 16.952 14.340 -18.382 1.00 5.69 C ATOM 839 C VAL A 56 17.646 13.188 -19.110 1.00 5.96 C ATOM 840 O VAL A 56 17.077 12.125 -19.321 1.00 5.52 O ATOM 841 CB VAL A 56 17.389 14.329 -16.919 1.00 5.77 C ATOM 842 CG1 VAL A 56 16.863 15.554 -16.183 1.00 5.82 C ATOM 843 CG2 VAL A 56 16.900 13.054 -16.284 1.00 5.28 C ATOM 0 H VAL A 56 15.048 14.102 -17.567 1.00 5.00 H new ATOM 0 HA VAL A 56 17.250 15.266 -18.875 1.00 5.69 H new ATOM 0 HB VAL A 56 18.477 14.369 -16.859 1.00 5.77 H new ATOM 0 HG11 VAL A 56 17.189 15.521 -15.143 1.00 5.82 H new ATOM 0 HG12 VAL A 56 17.250 16.457 -16.656 1.00 5.82 H new ATOM 0 HG13 VAL A 56 15.774 15.562 -16.222 1.00 5.82 H new ATOM 0 HG21 VAL A 56 17.204 13.029 -15.237 1.00 5.28 H new ATOM 0 HG22 VAL A 56 15.813 13.010 -16.348 1.00 5.28 H new ATOM 0 HG23 VAL A 56 17.329 12.199 -16.807 1.00 5.28 H new ATOM 853 N TYR A 57 18.905 13.458 -19.422 1.00 6.83 N ATOM 854 CA TYR A 57 19.843 12.588 -20.161 1.00 7.44 C ATOM 855 C TYR A 57 19.196 11.519 -21.035 1.00 7.10 C ATOM 856 O TYR A 57 19.026 11.737 -22.235 1.00 7.48 O ATOM 857 CB TYR A 57 20.852 11.954 -19.203 1.00 7.84 C ATOM 858 CG TYR A 57 20.438 12.004 -17.749 1.00 7.40 C ATOM 859 CD1 TYR A 57 20.719 13.108 -16.964 1.00 7.77 C ATOM 860 CD2 TYR A 57 19.749 10.947 -17.171 1.00 6.79 C ATOM 861 CE1 TYR A 57 20.331 13.159 -15.645 1.00 7.62 C ATOM 862 CE2 TYR A 57 19.349 10.992 -15.850 1.00 6.66 C ATOM 863 CZ TYR A 57 19.718 12.089 -15.070 1.00 7.11 C ATOM 864 OH TYR A 57 19.254 12.154 -13.772 1.00 7.23 O ATOM 0 H TYR A 57 19.337 14.342 -19.155 1.00 6.83 H new ATOM 0 HA TYR A 57 20.348 13.254 -20.861 1.00 7.44 H new ATOM 0 HB2 TYR A 57 21.006 10.914 -19.490 1.00 7.84 H new ATOM 0 HB3 TYR A 57 21.811 12.461 -19.314 1.00 7.84 H new ATOM 0 HD1 TYR A 57 21.252 13.944 -17.394 1.00 7.77 H new ATOM 0 HD2 TYR A 57 19.522 10.074 -17.765 1.00 6.79 H new ATOM 0 HE1 TYR A 57 20.514 14.051 -15.064 1.00 7.62 H new ATOM 0 HE2 TYR A 57 18.760 10.191 -15.427 1.00 6.66 H new ATOM 0 HH TYR A 57 18.844 11.298 -13.528 1.00 7.23 H new ATOM 874 N GLU A 58 18.868 10.371 -20.450 1.00 6.59 N ATOM 875 CA GLU A 58 18.312 9.251 -21.205 1.00 6.41 C ATOM 876 C GLU A 58 17.134 9.719 -22.046 1.00 6.15 C ATOM 877 O GLU A 58 16.938 9.325 -23.201 1.00 6.62 O ATOM 878 CB GLU A 58 17.867 8.153 -20.245 1.00 5.89 C ATOM 879 CG GLU A 58 16.370 8.080 -20.023 1.00 5.18 C ATOM 880 CD GLU A 58 15.965 6.820 -19.300 1.00 5.25 C ATOM 881 OE1 GLU A 58 16.016 6.800 -18.049 1.00 5.25 O ATOM 882 OE2 GLU A 58 15.594 5.848 -19.988 1.00 5.61 O1- ATOM 0 H GLU A 58 18.978 10.191 -19.452 1.00 6.59 H new ATOM 0 HA GLU A 58 19.080 8.854 -21.870 1.00 6.41 H new ATOM 0 HB2 GLU A 58 18.212 7.192 -20.627 1.00 5.89 H new ATOM 0 HB3 GLU A 58 18.357 8.308 -19.284 1.00 5.89 H new ATOM 0 HG2 GLU A 58 16.046 8.948 -19.448 1.00 5.18 H new ATOM 0 HG3 GLU A 58 15.859 8.126 -20.984 1.00 5.18 H new ATOM 889 N GLU A 59 16.399 10.627 -21.407 1.00 5.59 N ATOM 890 CA GLU A 59 15.319 11.385 -21.999 1.00 5.52 C ATOM 891 C GLU A 59 14.249 10.465 -22.516 1.00 5.43 C ATOM 892 O GLU A 59 13.645 10.698 -23.559 1.00 6.06 O ATOM 893 CB GLU A 59 15.874 12.300 -23.105 1.00 6.40 C ATOM 894 CG GLU A 59 14.919 13.389 -23.575 1.00 6.94 C ATOM 895 CD GLU A 59 15.512 14.250 -24.671 1.00 7.89 C ATOM 896 OE1 GLU A 59 16.424 15.051 -24.379 1.00 8.58 O1- ATOM 897 OE2 GLU A 59 15.077 14.124 -25.834 1.00 8.12 O ATOM 0 H GLU A 59 16.552 10.857 -20.425 1.00 5.59 H new ATOM 0 HA GLU A 59 14.859 12.016 -21.238 1.00 5.52 H new ATOM 0 HB2 GLU A 59 16.788 12.770 -22.743 1.00 6.40 H new ATOM 0 HB3 GLU A 59 16.150 11.685 -23.961 1.00 6.40 H new ATOM 0 HG2 GLU A 59 13.999 12.929 -23.937 1.00 6.94 H new ATOM 0 HG3 GLU A 59 14.648 14.020 -22.728 1.00 6.94 H new ATOM 904 N GLU A 60 13.995 9.446 -21.735 1.00 4.88 N ATOM 905 CA GLU A 60 13.114 8.387 -22.149 1.00 5.05 C ATOM 906 C GLU A 60 12.618 7.562 -20.971 1.00 5.18 C ATOM 907 O GLU A 60 12.654 6.324 -20.963 1.00 5.82 O ATOM 908 CB GLU A 60 13.806 7.534 -23.204 1.00 5.91 C ATOM 909 CG GLU A 60 12.876 6.760 -24.115 1.00 6.37 C ATOM 910 CD GLU A 60 13.584 6.289 -25.366 1.00 7.13 C ATOM 911 OE1 GLU A 60 13.777 7.102 -26.289 1.00 7.41 O1- ATOM 912 OE2 GLU A 60 13.937 5.094 -25.434 1.00 7.64 O ATOM 0 H GLU A 60 14.390 9.328 -20.802 1.00 4.88 H new ATOM 0 HA GLU A 60 12.222 8.828 -22.594 1.00 5.05 H new ATOM 0 HB2 GLU A 60 14.435 8.180 -23.816 1.00 5.91 H new ATOM 0 HB3 GLU A 60 14.468 6.828 -22.702 1.00 5.91 H new ATOM 0 HG2 GLU A 60 12.473 5.901 -23.579 1.00 6.37 H new ATOM 0 HG3 GLU A 60 12.030 7.389 -24.391 1.00 6.37 H new ATOM 919 N ASN A 61 12.149 8.319 -19.997 1.00 4.82 N ATOM 920 CA ASN A 61 11.280 7.865 -18.910 1.00 5.21 C ATOM 921 C ASN A 61 11.964 6.973 -17.883 1.00 4.96 C ATOM 922 O ASN A 61 11.889 7.232 -16.681 1.00 5.37 O ATOM 923 CB ASN A 61 10.083 7.151 -19.516 1.00 5.66 C ATOM 924 CG ASN A 61 9.190 6.467 -18.495 1.00 6.39 C ATOM 925 OD1 ASN A 61 9.378 5.293 -18.170 1.00 6.60 O ATOM 926 ND2 ASN A 61 8.203 7.190 -17.989 1.00 7.02 N ATOM 0 H ASN A 61 12.369 9.313 -19.933 1.00 4.82 H new ATOM 0 HA ASN A 61 10.976 8.752 -18.354 1.00 5.21 H new ATOM 0 HB2 ASN A 61 9.489 7.872 -20.078 1.00 5.66 H new ATOM 0 HB3 ASN A 61 10.439 6.407 -20.228 1.00 5.66 H new ATOM 0 HD21 ASN A 61 7.567 6.778 -17.306 1.00 7.02 H new ATOM 0 HD22 ASN A 61 8.078 8.159 -18.282 1.00 7.02 H new ATOM 933 N ALA A 62 12.593 5.924 -18.358 1.00 4.60 N ATOM 934 CA ALA A 62 13.209 4.935 -17.495 1.00 4.73 C ATOM 935 C ALA A 62 14.139 4.028 -18.255 1.00 4.93 C ATOM 936 O ALA A 62 15.228 3.706 -17.773 1.00 5.41 O ATOM 937 CB ALA A 62 12.120 4.114 -16.873 1.00 4.86 C ATOM 0 H ALA A 62 12.694 5.729 -19.354 1.00 4.60 H new ATOM 0 HA ALA A 62 13.798 5.452 -16.738 1.00 4.73 H new ATOM 0 HB1 ALA A 62 12.560 3.362 -16.218 1.00 4.86 H new ATOM 0 HB2 ALA A 62 11.463 4.761 -16.292 1.00 4.86 H new ATOM 0 HB3 ALA A 62 11.544 3.621 -17.656 1.00 4.86 H new ATOM 943 N ASP A 63 13.704 3.622 -19.438 1.00 4.87 N ATOM 944 CA ASP A 63 14.390 2.584 -20.180 1.00 5.36 C ATOM 945 C ASP A 63 13.581 2.218 -21.410 1.00 5.66 C ATOM 946 O ASP A 63 12.894 1.194 -21.446 1.00 6.14 O ATOM 947 CB ASP A 63 14.541 1.369 -19.286 1.00 5.84 C ATOM 948 CG ASP A 63 15.687 0.467 -19.699 1.00 6.49 C ATOM 949 OD1 ASP A 63 15.480 -0.408 -20.563 1.00 7.01 O ATOM 950 OD2 ASP A 63 16.799 0.622 -19.157 1.00 6.76 O1- ATOM 0 H ASP A 63 12.878 3.998 -19.903 1.00 4.87 H new ATOM 0 HA ASP A 63 15.372 2.937 -20.495 1.00 5.36 H new ATOM 0 HB2 ASP A 63 14.697 1.698 -18.259 1.00 5.84 H new ATOM 0 HB3 ASP A 63 13.613 0.797 -19.300 1.00 5.84 H new ATOM 955 N GLY A 64 13.609 3.098 -22.387 1.00 5.66 N ATOM 956 CA GLY A 64 12.860 2.884 -23.612 1.00 6.25 C ATOM 957 C GLY A 64 11.468 3.466 -23.537 1.00 6.54 C ATOM 958 O GLY A 64 10.806 3.638 -24.561 1.00 7.20 O ATOM 0 H GLY A 64 14.141 3.968 -22.360 1.00 5.66 H new ATOM 0 HA2 GLY A 64 13.396 3.334 -24.447 1.00 6.25 H new ATOM 0 HA3 GLY A 64 12.795 1.815 -23.814 1.00 6.25 H new ATOM 962 N ALA A 65 11.023 3.731 -22.311 1.00 6.34 N ATOM 963 CA ALA A 65 9.773 4.446 -22.053 1.00 6.92 C ATOM 964 C ALA A 65 8.531 3.604 -22.350 1.00 7.26 C ATOM 965 O ALA A 65 7.415 4.024 -22.049 1.00 7.82 O ATOM 966 CB ALA A 65 9.734 5.744 -22.848 1.00 7.42 C ATOM 0 H ALA A 65 11.520 3.455 -21.464 1.00 6.34 H new ATOM 0 HA ALA A 65 9.753 4.669 -20.986 1.00 6.92 H new ATOM 0 HB1 ALA A 65 8.799 6.266 -22.647 1.00 7.42 H new ATOM 0 HB2 ALA A 65 10.572 6.376 -22.555 1.00 7.42 H new ATOM 0 HB3 ALA A 65 9.803 5.521 -23.913 1.00 7.42 H new ATOM 972 N ALA A 66 8.715 2.422 -22.921 1.00 7.17 N ATOM 973 CA ALA A 66 7.578 1.586 -23.287 1.00 7.77 C ATOM 974 C ALA A 66 7.518 0.325 -22.442 1.00 7.57 C ATOM 975 O ALA A 66 6.440 -0.118 -22.059 1.00 8.11 O ATOM 976 CB ALA A 66 7.616 1.229 -24.762 1.00 8.65 C ATOM 0 H ALA A 66 9.628 2.023 -23.139 1.00 7.17 H new ATOM 0 HA ALA A 66 6.676 2.166 -23.093 1.00 7.77 H new ATOM 0 HB1 ALA A 66 6.757 0.605 -25.008 1.00 8.65 H new ATOM 0 HB2 ALA A 66 7.584 2.141 -25.358 1.00 8.65 H new ATOM 0 HB3 ALA A 66 8.534 0.684 -24.981 1.00 8.65 H new ATOM 982 N VAL A 67 8.673 -0.262 -22.169 1.00 6.98 N ATOM 983 CA VAL A 67 8.732 -1.448 -21.329 1.00 6.95 C ATOM 984 C VAL A 67 9.207 -1.084 -19.930 1.00 6.91 C ATOM 985 O VAL A 67 8.601 -1.468 -18.931 1.00 7.31 O ATOM 986 CB VAL A 67 9.664 -2.531 -21.935 1.00 6.72 C ATOM 987 CG1 VAL A 67 11.115 -2.078 -22.029 1.00 6.95 C ATOM 988 CG2 VAL A 67 9.557 -3.830 -21.151 1.00 6.89 C ATOM 0 H VAL A 67 9.577 0.061 -22.514 1.00 6.98 H new ATOM 0 HA VAL A 67 7.724 -1.860 -21.273 1.00 6.95 H new ATOM 0 HB VAL A 67 9.323 -2.702 -22.956 1.00 6.72 H new ATOM 0 HG11 VAL A 67 11.718 -2.877 -22.460 1.00 6.95 H new ATOM 0 HG12 VAL A 67 11.180 -1.193 -22.662 1.00 6.95 H new ATOM 0 HG13 VAL A 67 11.487 -1.840 -21.033 1.00 6.95 H new ATOM 0 HG21 VAL A 67 10.218 -4.576 -21.592 1.00 6.89 H new ATOM 0 HG22 VAL A 67 9.847 -3.655 -20.115 1.00 6.89 H new ATOM 0 HG23 VAL A 67 8.529 -4.191 -21.184 1.00 6.89 H new ATOM 998 N ARG A 68 10.283 -0.314 -19.914 1.00 6.66 N ATOM 999 CA ARG A 68 11.009 0.097 -18.707 1.00 6.87 C ATOM 1000 C ARG A 68 11.333 -1.058 -17.765 1.00 7.21 C ATOM 1001 O ARG A 68 11.088 -2.226 -18.068 1.00 7.68 O ATOM 1002 CB ARG A 68 10.344 1.254 -17.944 1.00 7.41 C ATOM 1003 CG ARG A 68 8.986 0.923 -17.379 1.00 7.79 C ATOM 1004 CD ARG A 68 8.700 1.685 -16.094 1.00 8.65 C ATOM 1005 NE ARG A 68 8.939 3.127 -16.223 1.00 8.94 N ATOM 1006 CZ ARG A 68 9.042 3.953 -15.178 1.00 9.70 C ATOM 1007 NH1 ARG A 68 8.920 3.487 -13.946 1.00 10.21 N1+ ATOM 1008 NH2 ARG A 68 9.271 5.246 -15.366 1.00 10.14 N ATOM 0 H ARG A 68 10.696 0.059 -20.769 1.00 6.66 H new ATOM 0 HA ARG A 68 11.956 0.474 -19.093 1.00 6.87 H new ATOM 0 HB2 ARG A 68 10.999 1.561 -17.129 1.00 7.41 H new ATOM 0 HB3 ARG A 68 10.248 2.108 -18.614 1.00 7.41 H new ATOM 0 HG2 ARG A 68 8.219 1.158 -18.118 1.00 7.79 H new ATOM 0 HG3 ARG A 68 8.925 -0.148 -17.186 1.00 7.79 H new ATOM 0 HD2 ARG A 68 7.664 1.518 -15.801 1.00 8.65 H new ATOM 0 HD3 ARG A 68 9.325 1.288 -15.295 1.00 8.65 H new ATOM 0 HE ARG A 68 9.031 3.519 -17.160 1.00 8.94 H new ATOM 0 HH11 ARG A 68 8.747 2.494 -13.791 1.00 10.21 H new ATOM 0 HH12 ARG A 68 8.999 4.121 -13.151 1.00 10.21 H new ATOM 0 HH21 ARG A 68 9.369 5.614 -16.312 1.00 10.14 H new ATOM 0 HH22 ARG A 68 9.349 5.872 -14.564 1.00 10.14 H new ATOM 1022 N ILE A 69 11.928 -0.726 -16.644 1.00 7.25 N ATOM 1023 CA ILE A 69 12.274 -1.720 -15.642 1.00 7.89 C ATOM 1024 C ILE A 69 11.031 -2.209 -14.918 1.00 8.72 C ATOM 1025 O ILE A 69 10.004 -1.531 -14.877 1.00 8.86 O ATOM 1026 CB ILE A 69 13.277 -1.142 -14.620 1.00 7.93 C ATOM 1027 CG1 ILE A 69 14.392 -0.402 -15.371 1.00 7.29 C ATOM 1028 CG2 ILE A 69 13.859 -2.224 -13.734 1.00 8.79 C ATOM 1029 CD1 ILE A 69 15.590 -0.040 -14.520 1.00 7.43 C ATOM 0 H ILE A 69 12.186 0.229 -16.397 1.00 7.25 H new ATOM 0 HA ILE A 69 12.739 -2.562 -16.155 1.00 7.89 H new ATOM 0 HB ILE A 69 12.747 -0.446 -13.970 1.00 7.93 H new ATOM 0 HG12 ILE A 69 14.727 -1.023 -16.202 1.00 7.29 H new ATOM 0 HG13 ILE A 69 13.979 0.510 -15.801 1.00 7.29 H new ATOM 0 HG21 ILE A 69 14.560 -1.778 -13.028 1.00 8.79 H new ATOM 0 HG22 ILE A 69 13.056 -2.716 -13.186 1.00 8.79 H new ATOM 0 HG23 ILE A 69 14.380 -2.957 -14.350 1.00 8.79 H new ATOM 0 HD11 ILE A 69 16.327 0.479 -15.132 1.00 7.43 H new ATOM 0 HD12 ILE A 69 15.274 0.609 -13.704 1.00 7.43 H new ATOM 0 HD13 ILE A 69 16.033 -0.948 -14.111 1.00 7.43 H new ATOM 1041 N ASP A 70 11.133 -3.406 -14.383 1.00 9.49 N ATOM 1042 CA ASP A 70 10.097 -3.965 -13.540 1.00 10.50 C ATOM 1043 C ASP A 70 10.147 -3.292 -12.181 1.00 10.98 C ATOM 1044 O ASP A 70 9.126 -2.931 -11.599 1.00 11.84 O ATOM 1045 CB ASP A 70 10.316 -5.465 -13.389 1.00 11.29 C ATOM 1046 CG ASP A 70 9.303 -6.119 -12.466 1.00 12.36 C ATOM 1047 OD1 ASP A 70 8.240 -6.559 -12.953 1.00 12.66 O1- ATOM 1048 OD2 ASP A 70 9.565 -6.198 -11.247 1.00 13.02 O ATOM 0 H ASP A 70 11.936 -4.020 -14.520 1.00 9.49 H new ATOM 0 HA ASP A 70 9.120 -3.795 -13.992 1.00 10.50 H new ATOM 0 HB2 ASP A 70 10.263 -5.936 -14.371 1.00 11.29 H new ATOM 0 HB3 ASP A 70 11.320 -5.644 -13.004 1.00 11.29 H new ATOM 1053 N GLY A 71 11.372 -3.149 -11.696 1.00 10.56 N ATOM 1054 CA GLY A 71 11.643 -2.462 -10.458 1.00 11.12 C ATOM 1055 C GLY A 71 11.186 -1.032 -10.462 1.00 11.32 C ATOM 1056 O GLY A 71 10.694 -0.528 -9.456 1.00 12.13 O ATOM 0 H GLY A 71 12.205 -3.511 -12.159 1.00 10.56 H new ATOM 0 HA2 GLY A 71 11.152 -2.991 -9.641 1.00 11.12 H new ATOM 0 HA3 GLY A 71 12.714 -2.494 -10.260 1.00 11.12 H new ATOM 1060 N ARG A 72 11.357 -0.374 -11.591 1.00 10.73 N ATOM 1061 CA ARG A 72 10.982 1.019 -11.697 1.00 11.04 C ATOM 1062 C ARG A 72 9.515 1.130 -12.024 1.00 10.55 C ATOM 1063 O ARG A 72 9.077 0.825 -13.132 1.00 9.83 O ATOM 1064 CB ARG A 72 11.822 1.731 -12.744 1.00 11.16 C ATOM 1065 CG ARG A 72 13.297 1.745 -12.398 1.00 10.42 C ATOM 1066 CD ARG A 72 14.045 2.785 -13.216 1.00 10.89 C ATOM 1067 NE ARG A 72 13.513 4.132 -12.998 1.00 11.31 N ATOM 1068 CZ ARG A 72 13.910 5.217 -13.665 1.00 11.83 C ATOM 1069 NH1 ARG A 72 14.844 5.129 -14.607 1.00 12.00 N1+ ATOM 1070 NH2 ARG A 72 13.363 6.389 -13.384 1.00 12.38 N ATOM 0 H ARG A 72 11.750 -0.778 -12.441 1.00 10.73 H new ATOM 0 HA ARG A 72 11.168 1.503 -10.738 1.00 11.04 H new ATOM 0 HB2 ARG A 72 11.684 1.243 -13.709 1.00 11.16 H new ATOM 0 HB3 ARG A 72 11.468 2.756 -12.852 1.00 11.16 H new ATOM 0 HG2 ARG A 72 13.422 1.956 -11.336 1.00 10.42 H new ATOM 0 HG3 ARG A 72 13.725 0.759 -12.580 1.00 10.42 H new ATOM 0 HD2 ARG A 72 15.102 2.764 -12.951 1.00 10.89 H new ATOM 0 HD3 ARG A 72 13.976 2.534 -14.274 1.00 10.89 H new ATOM 0 HE ARG A 72 12.790 4.248 -12.288 1.00 11.31 H new ATOM 0 HH11 ARG A 72 15.264 4.226 -14.826 1.00 12.00 H new ATOM 0 HH12 ARG A 72 15.140 5.965 -15.111 1.00 12.00 H new ATOM 0 HH21 ARG A 72 12.645 6.457 -12.663 1.00 12.38 H new ATOM 0 HH22 ARG A 72 13.660 7.224 -13.888 1.00 12.38 H new ATOM 1084 N VAL A 73 8.767 1.586 -11.050 1.00 11.11 N ATOM 1085 CA VAL A 73 7.325 1.602 -11.138 1.00 10.97 C ATOM 1086 C VAL A 73 6.812 3.003 -11.433 1.00 10.92 C ATOM 1087 O VAL A 73 7.334 3.989 -10.917 1.00 11.44 O ATOM 1088 CB VAL A 73 6.685 1.085 -9.842 1.00 11.58 C ATOM 1089 CG1 VAL A 73 5.166 1.115 -9.939 1.00 11.61 C ATOM 1090 CG2 VAL A 73 7.186 -0.321 -9.521 1.00 11.56 C ATOM 0 H VAL A 73 9.138 1.956 -10.175 1.00 11.11 H new ATOM 0 HA VAL A 73 7.044 0.941 -11.958 1.00 10.97 H new ATOM 0 HB VAL A 73 6.980 1.745 -9.026 1.00 11.58 H new ATOM 0 HG11 VAL A 73 4.735 0.744 -9.009 1.00 11.61 H new ATOM 0 HG12 VAL A 73 4.833 2.138 -10.111 1.00 11.61 H new ATOM 0 HG13 VAL A 73 4.842 0.484 -10.766 1.00 11.61 H new ATOM 0 HG21 VAL A 73 6.722 -0.671 -8.599 1.00 11.56 H new ATOM 0 HG22 VAL A 73 6.926 -0.995 -10.337 1.00 11.56 H new ATOM 0 HG23 VAL A 73 8.269 -0.302 -9.397 1.00 11.56 H new ATOM 1100 N THR A 74 5.807 3.074 -12.285 1.00 10.48 N ATOM 1101 CA THR A 74 5.148 4.317 -12.591 1.00 10.58 C ATOM 1102 C THR A 74 3.664 4.073 -12.790 1.00 10.71 C ATOM 1103 O THR A 74 2.977 4.776 -13.535 1.00 10.65 O ATOM 1104 CB THR A 74 5.762 4.988 -13.841 1.00 10.38 C ATOM 1105 OG1 THR A 74 5.146 6.261 -14.095 1.00 10.63 O ATOM 1106 CG2 THR A 74 5.602 4.092 -15.059 1.00 9.98 C ATOM 0 H THR A 74 5.429 2.268 -12.782 1.00 10.48 H new ATOM 0 HA THR A 74 5.290 4.998 -11.752 1.00 10.58 H new ATOM 0 HB THR A 74 6.823 5.145 -13.648 1.00 10.38 H new ATOM 0 HG1 THR A 74 4.172 6.171 -14.035 1.00 10.63 H new ATOM 0 HG21 THR A 74 6.040 4.580 -15.930 1.00 9.98 H new ATOM 0 HG22 THR A 74 6.109 3.143 -14.882 1.00 9.98 H new ATOM 0 HG23 THR A 74 4.543 3.909 -15.240 1.00 9.98 H new ATOM 1114 N GLN A 75 3.179 3.083 -12.079 1.00 11.10 N ATOM 1115 CA GLN A 75 1.797 2.673 -12.186 1.00 11.47 C ATOM 1116 C GLN A 75 1.082 2.987 -10.885 1.00 11.19 C ATOM 1117 O GLN A 75 1.018 2.151 -9.982 1.00 11.49 O ATOM 1118 CB GLN A 75 1.686 1.184 -12.515 1.00 12.23 C ATOM 1119 CG GLN A 75 0.347 0.812 -13.119 1.00 12.99 C ATOM 1120 CD GLN A 75 0.197 1.315 -14.541 1.00 13.67 C ATOM 1121 OE1 GLN A 75 -0.270 2.428 -14.772 1.00 13.95 O ATOM 1122 NE2 GLN A 75 0.592 0.500 -15.506 1.00 14.09 N ATOM 0 H GLN A 75 3.728 2.540 -11.412 1.00 11.10 H new ATOM 0 HA GLN A 75 1.328 3.223 -13.001 1.00 11.47 H new ATOM 0 HB2 GLN A 75 2.481 0.910 -13.209 1.00 12.23 H new ATOM 0 HB3 GLN A 75 1.843 0.603 -11.606 1.00 12.23 H new ATOM 0 HG2 GLN A 75 0.234 -0.272 -13.106 1.00 12.99 H new ATOM 0 HG3 GLN A 75 -0.453 1.224 -12.504 1.00 12.99 H new ATOM 0 HE21 GLN A 75 0.975 -0.417 -15.275 1.00 14.09 H new ATOM 0 HE22 GLN A 75 0.514 0.789 -16.481 1.00 14.09 H new ATOM 1131 N ASN A 76 0.578 4.201 -10.780 1.00 10.79 N ATOM 1132 CA ASN A 76 -0.144 4.618 -9.589 1.00 10.66 C ATOM 1133 C ASN A 76 -1.497 3.935 -9.489 1.00 11.04 C ATOM 1134 O ASN A 76 -2.490 4.358 -10.079 1.00 11.22 O ATOM 1135 CB ASN A 76 -0.290 6.140 -9.516 1.00 10.19 C ATOM 1136 CG ASN A 76 -0.672 6.788 -10.836 1.00 9.94 C ATOM 1137 OD1 ASN A 76 0.192 7.144 -11.635 1.00 10.12 O ATOM 1138 ND2 ASN A 76 -1.962 6.969 -11.065 1.00 9.78 N ATOM 0 H ASN A 76 0.654 4.917 -11.503 1.00 10.79 H new ATOM 0 HA ASN A 76 0.451 4.305 -8.731 1.00 10.66 H new ATOM 0 HB2 ASN A 76 -1.045 6.387 -8.770 1.00 10.19 H new ATOM 0 HB3 ASN A 76 0.651 6.569 -9.171 1.00 10.19 H new ATOM 0 HD21 ASN A 76 -2.269 7.417 -11.928 1.00 9.78 H new ATOM 0 HD22 ASN A 76 -2.650 6.660 -10.378 1.00 9.78 H new ATOM 1145 N LEU A 77 -1.510 2.851 -8.745 1.00 11.36 N ATOM 1146 CA LEU A 77 -2.735 2.121 -8.461 1.00 11.92 C ATOM 1147 C LEU A 77 -3.267 2.536 -7.098 1.00 11.78 C ATOM 1148 O LEU A 77 -4.394 2.215 -6.724 1.00 12.15 O ATOM 1149 CB LEU A 77 -2.471 0.618 -8.481 1.00 12.58 C ATOM 1150 CG LEU A 77 -1.771 0.097 -9.736 1.00 13.28 C ATOM 1151 CD1 LEU A 77 -1.416 -1.370 -9.571 1.00 13.59 C ATOM 1152 CD2 LEU A 77 -2.649 0.302 -10.962 1.00 13.71 C ATOM 0 H LEU A 77 -0.676 2.448 -8.319 1.00 11.36 H new ATOM 0 HA LEU A 77 -3.475 2.354 -9.226 1.00 11.92 H new ATOM 0 HB2 LEU A 77 -1.865 0.360 -7.613 1.00 12.58 H new ATOM 0 HB3 LEU A 77 -3.422 0.097 -8.372 1.00 12.58 H new ATOM 0 HG LEU A 77 -0.849 0.661 -9.879 1.00 13.28 H new ATOM 0 HD11 LEU A 77 -0.918 -1.727 -10.472 1.00 13.59 H new ATOM 0 HD12 LEU A 77 -0.750 -1.489 -8.717 1.00 13.59 H new ATOM 0 HD13 LEU A 77 -2.325 -1.948 -9.405 1.00 13.59 H new ATOM 0 HD21 LEU A 77 -2.134 -0.075 -11.846 1.00 13.71 H new ATOM 0 HD22 LEU A 77 -3.588 -0.237 -10.832 1.00 13.71 H new ATOM 0 HD23 LEU A 77 -2.855 1.365 -11.088 1.00 13.71 H new ATOM 1164 N GLY A 78 -2.424 3.238 -6.365 1.00 11.41 N ATOM 1165 CA GLY A 78 -2.771 3.725 -5.050 1.00 11.44 C ATOM 1166 C GLY A 78 -1.532 4.153 -4.307 1.00 10.55 C ATOM 1167 O GLY A 78 -1.398 3.913 -3.104 1.00 10.48 O ATOM 0 H GLY A 78 -1.481 3.485 -6.667 1.00 11.41 H new ATOM 0 HA2 GLY A 78 -3.460 4.565 -5.136 1.00 11.44 H new ATOM 0 HA3 GLY A 78 -3.288 2.945 -4.491 1.00 11.44 H new ATOM 1171 N VAL A 79 -0.634 4.797 -5.050 1.00 9.99 N ATOM 1172 CA VAL A 79 0.685 5.176 -4.558 1.00 9.16 C ATOM 1173 C VAL A 79 1.520 3.947 -4.214 1.00 8.69 C ATOM 1174 O VAL A 79 1.257 3.243 -3.237 1.00 8.93 O ATOM 1175 CB VAL A 79 0.602 6.111 -3.336 1.00 9.21 C ATOM 1176 CG1 VAL A 79 1.994 6.457 -2.834 1.00 8.66 C ATOM 1177 CG2 VAL A 79 -0.165 7.373 -3.691 1.00 9.75 C ATOM 0 H VAL A 79 -0.805 5.072 -6.017 1.00 9.99 H new ATOM 0 HA VAL A 79 1.173 5.721 -5.366 1.00 9.16 H new ATOM 0 HB VAL A 79 0.069 5.593 -2.538 1.00 9.21 H new ATOM 0 HG11 VAL A 79 1.916 7.118 -1.971 1.00 8.66 H new ATOM 0 HG12 VAL A 79 2.514 5.544 -2.546 1.00 8.66 H new ATOM 0 HG13 VAL A 79 2.552 6.958 -3.625 1.00 8.66 H new ATOM 0 HG21 VAL A 79 -0.216 8.025 -2.819 1.00 9.75 H new ATOM 0 HG22 VAL A 79 0.344 7.892 -4.503 1.00 9.75 H new ATOM 0 HG23 VAL A 79 -1.174 7.109 -4.006 1.00 9.75 H new ATOM 1187 N ARG A 80 2.525 3.687 -5.032 1.00 8.26 N ATOM 1188 CA ARG A 80 3.401 2.551 -4.815 1.00 8.04 C ATOM 1189 C ARG A 80 4.493 2.927 -3.829 1.00 7.16 C ATOM 1190 O ARG A 80 5.157 3.956 -3.970 1.00 6.61 O ATOM 1191 CB ARG A 80 4.028 2.086 -6.125 1.00 8.39 C ATOM 1192 CG ARG A 80 4.877 0.827 -5.989 1.00 8.96 C ATOM 1193 CD ARG A 80 4.064 -0.363 -5.505 1.00 9.63 C ATOM 1194 NE ARG A 80 4.915 -1.518 -5.234 1.00 10.25 N ATOM 1195 CZ ARG A 80 4.599 -2.502 -4.395 1.00 10.94 C ATOM 1196 NH1 ARG A 80 3.422 -2.512 -3.782 1.00 11.11 N1+ ATOM 1197 NH2 ARG A 80 5.461 -3.487 -4.180 1.00 11.64 N ATOM 0 H ARG A 80 2.754 4.248 -5.853 1.00 8.26 H new ATOM 0 HA ARG A 80 2.807 1.732 -4.409 1.00 8.04 H new ATOM 0 HB2 ARG A 80 3.236 1.902 -6.851 1.00 8.39 H new ATOM 0 HB3 ARG A 80 4.647 2.889 -6.526 1.00 8.39 H new ATOM 0 HG2 ARG A 80 5.328 0.589 -6.952 1.00 8.96 H new ATOM 0 HG3 ARG A 80 5.694 1.015 -5.292 1.00 8.96 H new ATOM 0 HD2 ARG A 80 3.521 -0.090 -4.600 1.00 9.63 H new ATOM 0 HD3 ARG A 80 3.320 -0.626 -6.257 1.00 9.63 H new ATOM 0 HE ARG A 80 5.810 -1.575 -5.719 1.00 10.25 H new ATOM 0 HH11 ARG A 80 2.752 -1.762 -3.952 1.00 11.11 H new ATOM 0 HH12 ARG A 80 3.187 -3.270 -3.141 1.00 11.11 H new ATOM 0 HH21 ARG A 80 6.363 -3.489 -4.657 1.00 11.64 H new ATOM 0 HH22 ARG A 80 5.222 -4.243 -3.538 1.00 11.64 H new ATOM 1211 N THR A 81 4.671 2.082 -2.840 1.00 7.24 N ATOM 1212 CA THR A 81 5.616 2.326 -1.775 1.00 6.59 C ATOM 1213 C THR A 81 6.445 1.083 -1.531 1.00 6.82 C ATOM 1214 O THR A 81 5.951 -0.036 -1.668 1.00 7.73 O ATOM 1215 CB THR A 81 4.906 2.712 -0.460 1.00 6.98 C ATOM 1216 OG1 THR A 81 3.986 1.681 -0.079 1.00 8.00 O ATOM 1217 CG2 THR A 81 4.161 4.029 -0.591 1.00 7.05 C ATOM 0 H THR A 81 4.162 1.202 -2.751 1.00 7.24 H new ATOM 0 HA THR A 81 6.251 3.156 -2.084 1.00 6.59 H new ATOM 0 HB THR A 81 5.672 2.829 0.306 1.00 6.98 H new ATOM 0 HG1 THR A 81 3.113 2.079 0.121 1.00 8.00 H new ATOM 0 HG21 THR A 81 3.674 4.267 0.355 1.00 7.05 H new ATOM 0 HG22 THR A 81 4.865 4.821 -0.847 1.00 7.05 H new ATOM 0 HG23 THR A 81 3.409 3.945 -1.375 1.00 7.05 H new ATOM 1225 N ALA A 82 7.699 1.280 -1.190 1.00 6.18 N ATOM 1226 CA ALA A 82 8.565 0.181 -0.836 1.00 6.65 C ATOM 1227 C ALA A 82 8.943 0.307 0.629 1.00 6.65 C ATOM 1228 O ALA A 82 9.382 1.370 1.070 1.00 5.88 O ATOM 1229 CB ALA A 82 9.798 0.170 -1.730 1.00 6.36 C ATOM 0 H ALA A 82 8.143 2.198 -1.151 1.00 6.18 H new ATOM 0 HA ALA A 82 8.046 -0.766 -0.986 1.00 6.65 H new ATOM 0 HB1 ALA A 82 10.442 -0.664 -1.451 1.00 6.36 H new ATOM 0 HB2 ALA A 82 9.492 0.061 -2.770 1.00 6.36 H new ATOM 0 HB3 ALA A 82 10.344 1.106 -1.609 1.00 6.36 H new ATOM 1235 N GLU A 83 8.734 -0.752 1.389 1.00 7.70 N ATOM 1236 CA GLU A 83 9.026 -0.727 2.805 1.00 8.10 C ATOM 1237 C GLU A 83 10.524 -0.877 3.029 1.00 7.90 C ATOM 1238 O GLU A 83 11.174 -1.703 2.392 1.00 8.21 O ATOM 1239 CB GLU A 83 8.248 -1.823 3.537 1.00 9.47 C ATOM 1240 CG GLU A 83 8.333 -1.738 5.051 1.00 10.14 C ATOM 1241 CD GLU A 83 7.547 -2.838 5.735 1.00 11.52 C ATOM 1242 OE1 GLU A 83 8.059 -3.971 5.837 1.00 12.15 O ATOM 1243 OE2 GLU A 83 6.412 -2.574 6.181 1.00 12.06 O1- ATOM 0 H GLU A 83 8.363 -1.639 1.047 1.00 7.70 H new ATOM 0 HA GLU A 83 8.710 0.233 3.213 1.00 8.10 H new ATOM 0 HB2 GLU A 83 7.201 -1.771 3.239 1.00 9.47 H new ATOM 0 HB3 GLU A 83 8.623 -2.795 3.217 1.00 9.47 H new ATOM 0 HG2 GLU A 83 9.377 -1.797 5.358 1.00 10.14 H new ATOM 0 HG3 GLU A 83 7.958 -0.769 5.380 1.00 10.14 H new ATOM 1250 N VAL A 84 11.054 -0.060 3.917 1.00 7.58 N ATOM 1251 CA VAL A 84 12.478 -0.040 4.214 1.00 7.50 C ATOM 1252 C VAL A 84 12.981 -1.377 4.728 1.00 8.74 C ATOM 1253 O VAL A 84 12.419 -1.961 5.659 1.00 9.71 O ATOM 1254 CB VAL A 84 12.804 1.065 5.233 1.00 7.28 C ATOM 1255 CG1 VAL A 84 14.260 1.004 5.660 1.00 7.49 C ATOM 1256 CG2 VAL A 84 12.480 2.424 4.643 1.00 6.28 C ATOM 0 H VAL A 84 10.509 0.613 4.457 1.00 7.58 H new ATOM 0 HA VAL A 84 12.991 0.167 3.275 1.00 7.50 H new ATOM 0 HB VAL A 84 12.190 0.907 6.120 1.00 7.28 H new ATOM 0 HG11 VAL A 84 14.461 1.797 6.380 1.00 7.49 H new ATOM 0 HG12 VAL A 84 14.464 0.036 6.119 1.00 7.49 H new ATOM 0 HG13 VAL A 84 14.901 1.135 4.788 1.00 7.49 H new ATOM 0 HG21 VAL A 84 12.713 3.201 5.370 1.00 6.28 H new ATOM 0 HG22 VAL A 84 13.073 2.580 3.742 1.00 6.28 H new ATOM 0 HG23 VAL A 84 11.420 2.468 4.392 1.00 6.28 H new ATOM 1266 N LYS A 85 14.048 -1.843 4.095 1.00 8.82 N ATOM 1267 CA LYS A 85 14.707 -3.091 4.464 1.00 10.03 C ATOM 1268 C LYS A 85 16.202 -2.872 4.480 1.00 10.02 C ATOM 1269 O LYS A 85 16.713 -2.073 3.709 1.00 9.25 O ATOM 1270 CB LYS A 85 14.419 -4.193 3.443 1.00 10.75 C ATOM 1271 CG LYS A 85 12.967 -4.310 3.048 1.00 10.58 C ATOM 1272 CD LYS A 85 12.106 -4.716 4.223 1.00 11.03 C ATOM 1273 CE LYS A 85 10.664 -4.341 3.973 1.00 10.50 C ATOM 1274 NZ LYS A 85 10.150 -4.916 2.701 1.00 11.02 N1+ ATOM 0 H LYS A 85 14.484 -1.365 3.307 1.00 8.82 H new ATOM 0 HA LYS A 85 14.331 -3.392 5.442 1.00 10.03 H new ATOM 0 HB2 LYS A 85 15.013 -4.007 2.548 1.00 10.75 H new ATOM 0 HB3 LYS A 85 14.750 -5.147 3.853 1.00 10.75 H new ATOM 0 HG2 LYS A 85 12.618 -3.356 2.652 1.00 10.58 H new ATOM 0 HG3 LYS A 85 12.864 -5.044 2.249 1.00 10.58 H new ATOM 0 HD2 LYS A 85 12.186 -5.791 4.387 1.00 11.03 H new ATOM 0 HD3 LYS A 85 12.463 -4.228 5.130 1.00 11.03 H new ATOM 0 HE2 LYS A 85 10.050 -4.690 4.803 1.00 10.50 H new ATOM 0 HE3 LYS A 85 10.572 -3.255 3.943 1.00 10.50 H new ATOM 0 HZ1 LYS A 85 9.113 -4.841 2.680 1.00 11.02 H new ATOM 0 HZ2 LYS A 85 10.551 -4.393 1.897 1.00 11.02 H new ATOM 0 HZ3 LYS A 85 10.426 -5.917 2.636 1.00 11.02 H new ATOM 1288 N LEU A 86 16.909 -3.574 5.338 1.00 10.96 N ATOM 1289 CA LEU A 86 18.362 -3.580 5.250 1.00 11.21 C ATOM 1290 C LEU A 86 18.799 -4.525 4.138 1.00 11.85 C ATOM 1291 O LEU A 86 18.140 -5.536 3.877 1.00 12.43 O ATOM 1292 CB LEU A 86 19.046 -3.942 6.574 1.00 12.08 C ATOM 1293 CG LEU A 86 19.023 -2.845 7.646 1.00 11.90 C ATOM 1294 CD1 LEU A 86 17.684 -2.807 8.364 1.00 11.97 C ATOM 1295 CD2 LEU A 86 20.169 -3.034 8.631 1.00 12.76 C ATOM 0 H LEU A 86 16.517 -4.139 6.092 1.00 10.96 H new ATOM 0 HA LEU A 86 18.679 -2.563 5.019 1.00 11.21 H new ATOM 0 HB2 LEU A 86 18.567 -4.833 6.979 1.00 12.08 H new ATOM 0 HB3 LEU A 86 20.084 -4.204 6.368 1.00 12.08 H new ATOM 0 HG LEU A 86 19.157 -1.884 7.150 1.00 11.90 H new ATOM 0 HD11 LEU A 86 17.698 -2.020 9.118 1.00 11.97 H new ATOM 0 HD12 LEU A 86 16.891 -2.606 7.644 1.00 11.97 H new ATOM 0 HD13 LEU A 86 17.502 -3.768 8.846 1.00 11.97 H new ATOM 0 HD21 LEU A 86 20.136 -2.246 9.384 1.00 12.76 H new ATOM 0 HD22 LEU A 86 20.074 -4.005 9.117 1.00 12.76 H new ATOM 0 HD23 LEU A 86 21.119 -2.986 8.098 1.00 12.76 H new ATOM 1307 N GLY A 87 19.904 -4.201 3.485 1.00 11.89 N ATOM 1308 CA GLY A 87 20.373 -5.022 2.385 1.00 12.65 C ATOM 1309 C GLY A 87 21.758 -4.638 1.916 1.00 12.97 C ATOM 1310 O GLY A 87 21.980 -4.410 0.727 1.00 13.25 O ATOM 0 H GLY A 87 20.484 -3.388 3.694 1.00 11.89 H new ATOM 0 HA2 GLY A 87 20.376 -6.067 2.693 1.00 12.65 H new ATOM 0 HA3 GLY A 87 19.676 -4.937 1.551 1.00 12.65 H new ATOM 1314 N ARG A 88 22.695 -4.555 2.847 1.00 13.08 N ATOM 1315 CA ARG A 88 24.062 -4.186 2.513 1.00 13.46 C ATOM 1316 C ARG A 88 24.724 -5.278 1.669 1.00 14.71 C ATOM 1317 O ARG A 88 24.464 -6.469 1.863 1.00 15.30 O ATOM 1318 CB ARG A 88 24.878 -3.922 3.777 1.00 13.18 C ATOM 1319 CG ARG A 88 25.504 -5.164 4.384 1.00 13.67 C ATOM 1320 CD ARG A 88 26.288 -4.835 5.630 1.00 14.20 C ATOM 1321 NE ARG A 88 26.983 -6.005 6.163 1.00 14.90 N ATOM 1322 CZ ARG A 88 27.415 -6.111 7.417 1.00 15.63 C ATOM 1323 NH1 ARG A 88 27.189 -5.138 8.288 1.00 15.77 N1+ ATOM 1324 NH2 ARG A 88 28.066 -7.196 7.803 1.00 16.35 N ATOM 0 H ARG A 88 22.535 -4.738 3.838 1.00 13.08 H new ATOM 0 HA ARG A 88 24.031 -3.267 1.928 1.00 13.46 H new ATOM 0 HB2 ARG A 88 25.668 -3.208 3.544 1.00 13.18 H new ATOM 0 HB3 ARG A 88 24.234 -3.453 4.521 1.00 13.18 H new ATOM 0 HG2 ARG A 88 24.723 -5.886 4.624 1.00 13.67 H new ATOM 0 HG3 ARG A 88 26.161 -5.636 3.653 1.00 13.67 H new ATOM 0 HD2 ARG A 88 27.013 -4.053 5.406 1.00 14.20 H new ATOM 0 HD3 ARG A 88 25.614 -4.437 6.388 1.00 14.20 H new ATOM 0 HE ARG A 88 27.147 -6.791 5.533 1.00 14.90 H new ATOM 0 HH11 ARG A 88 26.681 -4.302 7.998 1.00 15.77 H new ATOM 0 HH12 ARG A 88 27.523 -5.225 9.248 1.00 15.77 H new ATOM 0 HH21 ARG A 88 28.237 -7.951 7.139 1.00 16.35 H new ATOM 0 HH22 ARG A 88 28.397 -7.277 8.764 1.00 16.35 H new ATOM 1338 N LEU A 89 25.562 -4.868 0.728 1.00 15.20 N ATOM 1339 CA LEU A 89 26.312 -5.812 -0.091 1.00 16.46 C ATOM 1340 C LEU A 89 27.597 -5.141 -0.575 1.00 16.93 C ATOM 1341 O LEU A 89 27.625 -4.539 -1.647 1.00 16.94 O ATOM 1342 CB LEU A 89 25.449 -6.253 -1.282 1.00 16.92 C ATOM 1343 CG LEU A 89 25.744 -7.649 -1.845 1.00 17.63 C ATOM 1344 CD1 LEU A 89 27.159 -7.740 -2.390 1.00 18.22 C ATOM 1345 CD2 LEU A 89 25.517 -8.713 -0.782 1.00 17.91 C ATOM 0 H LEU A 89 25.741 -3.887 0.512 1.00 15.20 H new ATOM 0 HA LEU A 89 26.572 -6.694 0.494 1.00 16.46 H new ATOM 0 HB2 LEU A 89 24.402 -6.219 -0.979 1.00 16.92 H new ATOM 0 HB3 LEU A 89 25.573 -5.526 -2.084 1.00 16.92 H new ATOM 0 HG LEU A 89 25.055 -7.825 -2.671 1.00 17.63 H new ATOM 0 HD11 LEU A 89 27.335 -8.742 -2.781 1.00 18.22 H new ATOM 0 HD12 LEU A 89 27.289 -7.011 -3.190 1.00 18.22 H new ATOM 0 HD13 LEU A 89 27.871 -7.532 -1.591 1.00 18.22 H new ATOM 0 HD21 LEU A 89 25.731 -9.697 -1.200 1.00 17.91 H new ATOM 0 HD22 LEU A 89 26.177 -8.527 0.065 1.00 17.91 H new ATOM 0 HD23 LEU A 89 24.480 -8.679 -0.449 1.00 17.91 H new ATOM 1357 N GLY A 90 28.645 -5.216 0.235 1.00 17.39 N ATOM 1358 CA GLY A 90 29.868 -4.494 -0.070 1.00 17.91 C ATOM 1359 C GLY A 90 29.765 -3.104 0.503 1.00 17.35 C ATOM 1360 O GLY A 90 30.697 -2.300 0.463 1.00 17.38 O ATOM 0 H GLY A 90 28.672 -5.762 1.096 1.00 17.39 H new ATOM 0 HA2 GLY A 90 30.728 -5.014 0.352 1.00 17.91 H new ATOM 0 HA3 GLY A 90 30.020 -4.448 -1.148 1.00 17.91 H new ATOM 1364 N SER A 91 28.584 -2.847 1.017 1.00 16.99 N ATOM 1365 CA SER A 91 28.249 -1.627 1.698 1.00 16.48 C ATOM 1366 C SER A 91 28.035 -1.957 3.166 1.00 15.54 C ATOM 1367 O SER A 91 27.760 -3.098 3.518 1.00 15.66 O ATOM 1368 CB SER A 91 26.960 -1.078 1.088 1.00 16.77 C ATOM 1369 OG SER A 91 27.065 -0.980 -0.323 1.00 17.11 O ATOM 0 H SER A 91 27.807 -3.507 0.968 1.00 16.99 H new ATOM 0 HA SER A 91 29.040 -0.883 1.600 1.00 16.48 H new ATOM 0 HB2 SER A 91 26.125 -1.728 1.349 1.00 16.77 H new ATOM 0 HB3 SER A 91 26.744 -0.096 1.509 1.00 16.77 H new ATOM 0 HG SER A 91 26.996 -0.040 -0.592 1.00 17.11 H new ATOM 1375 N THR A 92 28.189 -0.958 4.010 1.00 14.73 N ATOM 1376 CA THR A 92 27.911 -1.087 5.423 1.00 13.85 C ATOM 1377 C THR A 92 26.409 -1.175 5.628 1.00 13.26 C ATOM 1378 O THR A 92 25.640 -0.718 4.781 1.00 13.32 O ATOM 1379 CB THR A 92 28.471 0.129 6.181 1.00 13.23 C ATOM 1380 OG1 THR A 92 29.840 0.342 5.810 1.00 13.97 O ATOM 1381 CG2 THR A 92 28.378 -0.044 7.687 1.00 12.68 C ATOM 0 H THR A 92 28.512 -0.031 3.733 1.00 14.73 H new ATOM 0 HA THR A 92 28.386 -1.990 5.807 1.00 13.85 H new ATOM 0 HB THR A 92 27.866 0.993 5.906 1.00 13.23 H new ATOM 0 HG1 THR A 92 30.193 1.118 6.293 1.00 13.97 H new ATOM 0 HG21 THR A 92 28.785 0.839 8.180 1.00 12.68 H new ATOM 0 HG22 THR A 92 27.334 -0.172 7.975 1.00 12.68 H new ATOM 0 HG23 THR A 92 28.948 -0.923 7.988 1.00 12.68 H new ATOM 1389 N GLU A 93 26.017 -1.738 6.764 1.00 12.87 N ATOM 1390 CA GLU A 93 24.630 -2.139 7.006 1.00 12.37 C ATOM 1391 C GLU A 93 23.687 -0.961 6.896 1.00 11.13 C ATOM 1392 O GLU A 93 23.503 -0.204 7.848 1.00 10.78 O ATOM 1393 CB GLU A 93 24.464 -2.815 8.367 1.00 13.03 C ATOM 1394 CG GLU A 93 23.673 -4.110 8.309 1.00 13.80 C ATOM 1395 CD GLU A 93 23.516 -4.757 9.669 1.00 14.57 C ATOM 1396 OE1 GLU A 93 22.957 -4.111 10.583 1.00 14.92 O1- ATOM 1397 OE2 GLU A 93 23.955 -5.914 9.834 1.00 14.94 O ATOM 0 H GLU A 93 26.646 -1.931 7.543 1.00 12.87 H new ATOM 0 HA GLU A 93 24.374 -2.863 6.232 1.00 12.37 H new ATOM 0 HB2 GLU A 93 25.450 -3.019 8.785 1.00 13.03 H new ATOM 0 HB3 GLU A 93 23.966 -2.125 9.048 1.00 13.03 H new ATOM 0 HG2 GLU A 93 22.687 -3.911 7.889 1.00 13.80 H new ATOM 0 HG3 GLU A 93 24.172 -4.806 7.635 1.00 13.80 H new ATOM 1404 N ARG A 94 23.077 -0.829 5.738 1.00 10.57 N ATOM 1405 CA ARG A 94 22.217 0.293 5.454 1.00 9.39 C ATOM 1406 C ARG A 94 20.790 -0.181 5.250 1.00 8.96 C ATOM 1407 O ARG A 94 20.527 -1.384 5.216 1.00 9.64 O ATOM 1408 CB ARG A 94 22.712 1.012 4.202 1.00 9.13 C ATOM 1409 CG ARG A 94 23.083 2.473 4.410 1.00 9.07 C ATOM 1410 CD ARG A 94 24.175 2.669 5.456 1.00 9.14 C ATOM 1411 NE ARG A 94 23.665 2.660 6.828 1.00 9.49 N ATOM 1412 CZ ARG A 94 24.438 2.810 7.905 1.00 9.84 C ATOM 1413 NH1 ARG A 94 25.746 2.976 7.767 1.00 9.96 N1+ ATOM 1414 NH2 ARG A 94 23.904 2.800 9.118 1.00 10.27 N ATOM 0 H ARG A 94 23.164 -1.496 4.971 1.00 10.57 H new ATOM 0 HA ARG A 94 22.239 0.983 6.298 1.00 9.39 H new ATOM 0 HB2 ARG A 94 23.583 0.482 3.816 1.00 9.13 H new ATOM 0 HB3 ARG A 94 21.938 0.954 3.437 1.00 9.13 H new ATOM 0 HG2 ARG A 94 23.416 2.896 3.462 1.00 9.07 H new ATOM 0 HG3 ARG A 94 22.195 3.028 4.712 1.00 9.07 H new ATOM 0 HD2 ARG A 94 24.920 1.881 5.347 1.00 9.14 H new ATOM 0 HD3 ARG A 94 24.682 3.616 5.270 1.00 9.14 H new ATOM 0 HE ARG A 94 22.663 2.532 6.968 1.00 9.49 H new ATOM 0 HH11 ARG A 94 26.163 2.989 6.836 1.00 9.96 H new ATOM 0 HH12 ARG A 94 26.335 3.091 8.592 1.00 9.96 H new ATOM 0 HH21 ARG A 94 22.898 2.677 9.231 1.00 10.27 H new ATOM 0 HH22 ARG A 94 24.499 2.915 9.938 1.00 10.27 H new ATOM 1428 N LEU A 95 19.883 0.760 5.107 1.00 7.97 N ATOM 1429 CA LEU A 95 18.504 0.440 4.798 1.00 7.54 C ATOM 1430 C LEU A 95 18.216 0.865 3.358 1.00 6.99 C ATOM 1431 O LEU A 95 18.276 2.041 3.006 1.00 6.27 O ATOM 1432 CB LEU A 95 17.530 1.080 5.818 1.00 6.93 C ATOM 1433 CG LEU A 95 17.580 2.605 6.004 1.00 7.79 C ATOM 1434 CD1 LEU A 95 16.373 3.095 6.773 1.00 8.88 C ATOM 1435 CD2 LEU A 95 18.830 3.038 6.753 1.00 7.89 C ATOM 0 H LEU A 95 20.075 1.757 5.200 1.00 7.97 H new ATOM 0 HA LEU A 95 18.346 -0.635 4.881 1.00 7.54 H new ATOM 0 HB2 LEU A 95 16.515 0.813 5.524 1.00 6.93 H new ATOM 0 HB3 LEU A 95 17.712 0.619 6.789 1.00 6.93 H new ATOM 0 HG LEU A 95 17.589 3.040 5.005 1.00 7.79 H new ATOM 0 HD11 LEU A 95 16.432 4.177 6.892 1.00 8.88 H new ATOM 0 HD12 LEU A 95 15.465 2.838 6.227 1.00 8.88 H new ATOM 0 HD13 LEU A 95 16.351 2.623 7.755 1.00 8.88 H new ATOM 0 HD21 LEU A 95 18.830 4.122 6.865 1.00 7.89 H new ATOM 0 HD22 LEU A 95 18.844 2.571 7.738 1.00 7.89 H new ATOM 0 HD23 LEU A 95 19.714 2.731 6.194 1.00 7.89 H new ATOM 1447 N LEU A 96 17.954 -0.136 2.527 1.00 7.59 N ATOM 1448 CA LEU A 96 17.938 0.015 1.079 1.00 7.52 C ATOM 1449 C LEU A 96 16.534 0.279 0.556 1.00 6.76 C ATOM 1450 O LEU A 96 15.587 -0.439 0.879 1.00 6.96 O ATOM 1451 CB LEU A 96 18.494 -1.258 0.417 1.00 8.83 C ATOM 1452 CG LEU A 96 20.024 -1.382 0.343 1.00 9.65 C ATOM 1453 CD1 LEU A 96 20.624 -0.234 -0.454 1.00 9.37 C ATOM 1454 CD2 LEU A 96 20.640 -1.449 1.735 1.00 9.78 C ATOM 0 H LEU A 96 17.745 -1.083 2.843 1.00 7.59 H new ATOM 0 HA LEU A 96 18.562 0.873 0.829 1.00 7.52 H new ATOM 0 HB2 LEU A 96 18.108 -2.121 0.960 1.00 8.83 H new ATOM 0 HB3 LEU A 96 18.098 -1.316 -0.597 1.00 8.83 H new ATOM 0 HG LEU A 96 20.256 -2.314 -0.172 1.00 9.65 H new ATOM 0 HD11 LEU A 96 21.708 -0.345 -0.492 1.00 9.37 H new ATOM 0 HD12 LEU A 96 20.223 -0.246 -1.467 1.00 9.37 H new ATOM 0 HD13 LEU A 96 20.372 0.712 0.025 1.00 9.37 H new ATOM 0 HD21 LEU A 96 21.723 -1.536 1.650 1.00 9.78 H new ATOM 0 HD22 LEU A 96 20.391 -0.543 2.287 1.00 9.78 H new ATOM 0 HD23 LEU A 96 20.247 -2.316 2.266 1.00 9.78 H new ATOM 1466 N VAL A 97 16.435 1.299 -0.279 1.00 6.13 N ATOM 1467 CA VAL A 97 15.180 1.703 -0.898 1.00 5.45 C ATOM 1468 C VAL A 97 15.438 2.012 -2.359 1.00 5.86 C ATOM 1469 O VAL A 97 16.573 2.286 -2.725 1.00 6.40 O ATOM 1470 CB VAL A 97 14.601 2.969 -0.232 1.00 4.23 C ATOM 1471 CG1 VAL A 97 14.333 2.746 1.249 1.00 4.19 C ATOM 1472 CG2 VAL A 97 15.546 4.140 -0.447 1.00 4.01 C ATOM 0 H VAL A 97 17.230 1.877 -0.550 1.00 6.13 H new ATOM 0 HA VAL A 97 14.464 0.889 -0.781 1.00 5.45 H new ATOM 0 HB VAL A 97 13.643 3.198 -0.699 1.00 4.23 H new ATOM 0 HG11 VAL A 97 13.926 3.658 1.686 1.00 4.19 H new ATOM 0 HG12 VAL A 97 13.616 1.934 1.371 1.00 4.19 H new ATOM 0 HG13 VAL A 97 15.264 2.487 1.752 1.00 4.19 H new ATOM 0 HG21 VAL A 97 15.133 5.032 0.025 1.00 4.01 H new ATOM 0 HG22 VAL A 97 16.516 3.911 -0.005 1.00 4.01 H new ATOM 0 HG23 VAL A 97 15.668 4.318 -1.515 1.00 4.01 H new ATOM 1482 N PRO A 98 14.416 1.950 -3.222 1.00 5.92 N ATOM 1483 CA PRO A 98 14.548 2.408 -4.606 1.00 6.55 C ATOM 1484 C PRO A 98 15.099 3.834 -4.672 1.00 6.22 C ATOM 1485 O PRO A 98 14.584 4.719 -3.990 1.00 5.29 O ATOM 1486 CB PRO A 98 13.112 2.350 -5.134 1.00 6.53 C ATOM 1487 CG PRO A 98 12.450 1.306 -4.306 1.00 6.39 C ATOM 1488 CD PRO A 98 13.070 1.417 -2.938 1.00 5.71 C ATOM 0 HA PRO A 98 15.244 1.803 -5.187 1.00 6.55 H new ATOM 0 HB2 PRO A 98 12.613 3.313 -5.031 1.00 6.53 H new ATOM 0 HB3 PRO A 98 13.089 2.090 -6.192 1.00 6.53 H new ATOM 0 HG2 PRO A 98 11.373 1.466 -4.262 1.00 6.39 H new ATOM 0 HG3 PRO A 98 12.608 0.313 -4.728 1.00 6.39 H new ATOM 0 HD2 PRO A 98 12.501 2.084 -2.291 1.00 5.71 H new ATOM 0 HD3 PRO A 98 13.117 0.450 -2.437 1.00 5.71 H new ATOM 1496 N SER A 99 16.137 4.070 -5.468 1.00 7.21 N ATOM 1497 CA SER A 99 16.752 5.398 -5.534 1.00 7.37 C ATOM 1498 C SER A 99 15.768 6.436 -6.078 1.00 7.21 C ATOM 1499 O SER A 99 15.881 7.631 -5.808 1.00 7.21 O ATOM 1500 CB SER A 99 18.013 5.353 -6.398 1.00 8.73 C ATOM 1501 OG SER A 99 17.767 4.703 -7.636 1.00 9.29 O ATOM 0 H SER A 99 16.569 3.370 -6.071 1.00 7.21 H new ATOM 0 HA SER A 99 17.027 5.696 -4.522 1.00 7.37 H new ATOM 0 HB2 SER A 99 18.367 6.367 -6.581 1.00 8.73 H new ATOM 0 HB3 SER A 99 18.805 4.831 -5.862 1.00 8.73 H new ATOM 0 HG SER A 99 17.632 3.745 -7.481 1.00 9.29 H new ATOM 1507 N GLU A 100 14.781 5.947 -6.810 1.00 7.31 N ATOM 1508 CA GLU A 100 13.786 6.759 -7.447 1.00 7.41 C ATOM 1509 C GLU A 100 12.726 7.223 -6.431 1.00 6.33 C ATOM 1510 O GLU A 100 11.791 7.948 -6.762 1.00 6.56 O ATOM 1511 CB GLU A 100 13.208 5.875 -8.547 1.00 8.22 C ATOM 1512 CG GLU A 100 12.025 6.442 -9.259 1.00 9.47 C ATOM 1513 CD GLU A 100 11.602 5.587 -10.438 1.00 10.34 C ATOM 1514 OE1 GLU A 100 11.362 4.376 -10.246 1.00 10.86 O ATOM 1515 OE2 GLU A 100 11.523 6.115 -11.565 1.00 10.65 O1- ATOM 0 H GLU A 100 14.656 4.948 -6.975 1.00 7.31 H new ATOM 0 HA GLU A 100 14.193 7.680 -7.864 1.00 7.41 H new ATOM 0 HB2 GLU A 100 13.991 5.674 -9.279 1.00 8.22 H new ATOM 0 HB3 GLU A 100 12.925 4.917 -8.111 1.00 8.22 H new ATOM 0 HG2 GLU A 100 11.193 6.533 -8.561 1.00 9.47 H new ATOM 0 HG3 GLU A 100 12.260 7.448 -9.608 1.00 9.47 H new ATOM 1522 N ALA A 101 12.909 6.816 -5.177 1.00 5.34 N ATOM 1523 CA ALA A 101 11.926 7.071 -4.130 1.00 4.45 C ATOM 1524 C ALA A 101 12.335 8.216 -3.208 1.00 4.45 C ATOM 1525 O ALA A 101 11.601 8.559 -2.279 1.00 4.62 O ATOM 1526 CB ALA A 101 11.705 5.811 -3.313 1.00 3.75 C ATOM 0 H ALA A 101 13.734 6.306 -4.861 1.00 5.34 H new ATOM 0 HA ALA A 101 11.000 7.367 -4.624 1.00 4.45 H new ATOM 0 HB1 ALA A 101 10.970 6.008 -2.533 1.00 3.75 H new ATOM 0 HB2 ALA A 101 11.340 5.015 -3.963 1.00 3.75 H new ATOM 0 HB3 ALA A 101 12.646 5.504 -2.856 1.00 3.75 H new ATOM 1532 N LEU A 102 13.504 8.803 -3.440 1.00 4.73 N ATOM 1533 CA LEU A 102 13.956 9.893 -2.593 1.00 5.07 C ATOM 1534 C LEU A 102 14.077 11.203 -3.356 1.00 6.33 C ATOM 1535 O LEU A 102 14.242 11.224 -4.575 1.00 6.97 O ATOM 1536 CB LEU A 102 15.263 9.541 -1.874 1.00 4.90 C ATOM 1537 CG LEU A 102 16.418 9.053 -2.756 1.00 5.36 C ATOM 1538 CD1 LEU A 102 17.153 10.210 -3.408 1.00 6.64 C ATOM 1539 CD2 LEU A 102 17.375 8.230 -1.923 1.00 4.98 C ATOM 0 H LEU A 102 14.143 8.547 -4.193 1.00 4.73 H new ATOM 0 HA LEU A 102 13.189 10.040 -1.833 1.00 5.07 H new ATOM 0 HB2 LEU A 102 15.600 10.422 -1.327 1.00 4.90 H new ATOM 0 HB3 LEU A 102 15.049 8.769 -1.135 1.00 4.90 H new ATOM 0 HG LEU A 102 16.001 8.438 -3.554 1.00 5.36 H new ATOM 0 HD11 LEU A 102 17.964 9.824 -4.025 1.00 6.64 H new ATOM 0 HD12 LEU A 102 16.461 10.776 -4.031 1.00 6.64 H new ATOM 0 HD13 LEU A 102 17.562 10.862 -2.636 1.00 6.64 H new ATOM 0 HD21 LEU A 102 18.197 7.883 -2.549 1.00 4.98 H new ATOM 0 HD22 LEU A 102 17.771 8.842 -1.112 1.00 4.98 H new ATOM 0 HD23 LEU A 102 16.849 7.371 -1.506 1.00 4.98 H new ATOM 1551 N ILE A 103 14.002 12.293 -2.619 1.00 6.87 N ATOM 1552 CA ILE A 103 14.131 13.623 -3.182 1.00 8.18 C ATOM 1553 C ILE A 103 15.525 14.166 -2.917 1.00 8.75 C ATOM 1554 O ILE A 103 15.958 14.226 -1.768 1.00 8.67 O ATOM 1555 CB ILE A 103 13.111 14.601 -2.558 1.00 8.80 C ATOM 1556 CG1 ILE A 103 11.671 14.115 -2.760 1.00 8.52 C ATOM 1557 CG2 ILE A 103 13.298 16.005 -3.114 1.00 10.20 C ATOM 1558 CD1 ILE A 103 11.331 13.763 -4.195 1.00 8.14 C ATOM 0 H ILE A 103 13.850 12.282 -1.611 1.00 6.87 H new ATOM 0 HA ILE A 103 13.945 13.542 -4.253 1.00 8.18 H new ATOM 0 HB ILE A 103 13.297 14.634 -1.484 1.00 8.80 H new ATOM 0 HG12 ILE A 103 11.503 13.239 -2.133 1.00 8.52 H new ATOM 0 HG13 ILE A 103 10.986 14.890 -2.415 1.00 8.52 H new ATOM 0 HG21 ILE A 103 12.569 16.676 -2.660 1.00 10.20 H new ATOM 0 HG22 ILE A 103 14.305 16.355 -2.886 1.00 10.20 H new ATOM 0 HG23 ILE A 103 13.155 15.991 -4.194 1.00 10.20 H new ATOM 0 HD11 ILE A 103 10.295 13.428 -4.252 1.00 8.14 H new ATOM 0 HD12 ILE A 103 11.464 14.642 -4.826 1.00 8.14 H new ATOM 0 HD13 ILE A 103 11.989 12.966 -4.540 1.00 8.14 H new ATOM 1570 N ARG A 104 16.233 14.560 -3.955 1.00 9.50 N ATOM 1571 CA ARG A 104 17.504 15.225 -3.751 1.00 10.25 C ATOM 1572 C ARG A 104 17.329 16.727 -3.802 1.00 11.48 C ATOM 1573 O ARG A 104 16.783 17.266 -4.765 1.00 12.12 O ATOM 1574 CB ARG A 104 18.569 14.764 -4.747 1.00 10.50 C ATOM 1575 CG ARG A 104 19.189 13.431 -4.377 1.00 9.82 C ATOM 1576 CD ARG A 104 19.978 13.536 -3.082 1.00 9.98 C ATOM 1577 NE ARG A 104 21.229 14.270 -3.254 1.00 10.43 N ATOM 1578 CZ ARG A 104 22.094 14.511 -2.270 1.00 10.83 C ATOM 1579 NH1 ARG A 104 21.831 14.100 -1.033 1.00 10.83 N1+ ATOM 1580 NH2 ARG A 104 23.215 15.175 -2.521 1.00 11.42 N ATOM 0 H ARG A 104 15.958 14.435 -4.929 1.00 9.50 H new ATOM 0 HA ARG A 104 17.860 14.946 -2.759 1.00 10.25 H new ATOM 0 HB2 ARG A 104 18.123 14.688 -5.738 1.00 10.50 H new ATOM 0 HB3 ARG A 104 19.353 15.519 -4.807 1.00 10.50 H new ATOM 0 HG2 ARG A 104 18.407 12.680 -4.270 1.00 9.82 H new ATOM 0 HG3 ARG A 104 19.845 13.096 -5.180 1.00 9.82 H new ATOM 0 HD2 ARG A 104 19.369 14.033 -2.327 1.00 9.98 H new ATOM 0 HD3 ARG A 104 20.195 12.535 -2.709 1.00 9.98 H new ATOM 0 HE ARG A 104 21.454 14.620 -4.185 1.00 10.43 H new ATOM 0 HH11 ARG A 104 20.965 13.599 -0.835 1.00 10.83 H new ATOM 0 HH12 ARG A 104 22.495 14.286 -0.282 1.00 10.83 H new ATOM 0 HH21 ARG A 104 23.414 15.501 -3.467 1.00 11.42 H new ATOM 0 HH22 ARG A 104 23.878 15.360 -1.768 1.00 11.42 H new ATOM 1594 N THR A 105 17.777 17.396 -2.756 1.00 11.91 N ATOM 1595 CA THR A 105 17.688 18.837 -2.692 1.00 13.15 C ATOM 1596 C THR A 105 18.847 19.410 -1.881 1.00 13.72 C ATOM 1597 O THR A 105 19.213 18.868 -0.837 1.00 13.20 O ATOM 1598 CB THR A 105 16.329 19.287 -2.106 1.00 13.31 C ATOM 1599 OG1 THR A 105 16.298 20.708 -1.938 1.00 14.61 O ATOM 1600 CG2 THR A 105 16.045 18.606 -0.774 1.00 12.61 C ATOM 0 H THR A 105 18.206 16.961 -1.939 1.00 11.91 H new ATOM 0 HA THR A 105 17.756 19.225 -3.708 1.00 13.15 H new ATOM 0 HB THR A 105 15.555 18.993 -2.814 1.00 13.31 H new ATOM 0 HG1 THR A 105 15.431 20.975 -1.568 1.00 14.61 H new ATOM 0 HG21 THR A 105 15.083 18.945 -0.390 1.00 12.61 H new ATOM 0 HG22 THR A 105 16.019 17.526 -0.916 1.00 12.61 H new ATOM 0 HG23 THR A 105 16.830 18.860 -0.061 1.00 12.61 H new ATOM 1608 N GLY A 106 19.430 20.497 -2.380 1.00 14.84 N ATOM 1609 CA GLY A 106 20.557 21.128 -1.717 1.00 15.52 C ATOM 1610 C GLY A 106 21.659 20.145 -1.367 1.00 14.91 C ATOM 1611 O GLY A 106 22.282 19.559 -2.252 1.00 14.86 O ATOM 0 H GLY A 106 19.137 20.956 -3.242 1.00 14.84 H new ATOM 0 HA2 GLY A 106 20.963 21.907 -2.362 1.00 15.52 H new ATOM 0 HA3 GLY A 106 20.210 21.617 -0.807 1.00 15.52 H new ATOM 1615 N ALA A 107 21.890 19.951 -0.078 1.00 14.57 N ATOM 1616 CA ALA A 107 22.931 19.044 0.377 1.00 14.09 C ATOM 1617 C ALA A 107 22.355 17.918 1.225 1.00 12.88 C ATOM 1618 O ALA A 107 23.001 17.429 2.155 1.00 12.64 O ATOM 1619 CB ALA A 107 23.994 19.812 1.148 1.00 14.99 C ATOM 0 H ALA A 107 21.371 20.409 0.671 1.00 14.57 H new ATOM 0 HA ALA A 107 23.393 18.589 -0.499 1.00 14.09 H new ATOM 0 HB1 ALA A 107 24.769 19.123 1.484 1.00 14.99 H new ATOM 0 HB2 ALA A 107 24.437 20.569 0.501 1.00 14.99 H new ATOM 0 HB3 ALA A 107 23.539 20.295 2.012 1.00 14.99 H new ATOM 1625 N ARG A 108 21.141 17.500 0.895 1.00 12.19 N ATOM 1626 CA ARG A 108 20.461 16.462 1.655 1.00 11.09 C ATOM 1627 C ARG A 108 19.359 15.799 0.830 1.00 10.26 C ATOM 1628 O ARG A 108 19.144 16.141 -0.335 1.00 10.63 O ATOM 1629 CB ARG A 108 19.909 17.047 2.962 1.00 11.48 C ATOM 1630 CG ARG A 108 19.344 18.449 2.812 1.00 12.49 C ATOM 1631 CD ARG A 108 17.877 18.436 2.424 1.00 12.62 C ATOM 1632 NE ARG A 108 17.381 19.775 2.103 1.00 13.67 N ATOM 1633 CZ ARG A 108 16.289 20.323 2.645 1.00 14.22 C ATOM 1634 NH1 ARG A 108 15.666 19.732 3.659 1.00 13.92 N1+ ATOM 1635 NH2 ARG A 108 15.849 21.494 2.205 1.00 15.20 N ATOM 0 H ARG A 108 20.607 17.864 0.106 1.00 12.19 H new ATOM 0 HA ARG A 108 21.183 15.684 1.903 1.00 11.09 H new ATOM 0 HB2 ARG A 108 19.128 16.389 3.343 1.00 11.48 H new ATOM 0 HB3 ARG A 108 20.704 17.063 3.707 1.00 11.48 H new ATOM 0 HG2 ARG A 108 19.465 18.990 3.750 1.00 12.49 H new ATOM 0 HG3 ARG A 108 19.913 18.990 2.056 1.00 12.49 H new ATOM 0 HD2 ARG A 108 17.736 17.782 1.564 1.00 12.62 H new ATOM 0 HD3 ARG A 108 17.290 18.019 3.242 1.00 12.62 H new ATOM 0 HE ARG A 108 17.903 20.326 1.421 1.00 13.67 H new ATOM 0 HH11 ARG A 108 16.020 18.851 4.032 1.00 13.92 H new ATOM 0 HH12 ARG A 108 14.833 20.159 4.065 1.00 13.92 H new ATOM 0 HH21 ARG A 108 16.344 21.975 1.454 1.00 15.20 H new ATOM 0 HH22 ARG A 108 15.016 21.913 2.618 1.00 15.20 H new ATOM 1649 N THR A 109 18.670 14.850 1.442 1.00 9.26 N ATOM 1650 CA THR A 109 17.669 14.054 0.749 1.00 8.38 C ATOM 1651 C THR A 109 16.379 14.003 1.557 1.00 8.15 C ATOM 1652 O THR A 109 16.406 14.139 2.778 1.00 8.42 O ATOM 1653 CB THR A 109 18.200 12.622 0.531 1.00 7.38 C ATOM 1654 OG1 THR A 109 19.537 12.678 0.015 1.00 7.95 O ATOM 1655 CG2 THR A 109 17.315 11.844 -0.427 1.00 6.64 C ATOM 0 H THR A 109 18.787 14.610 2.427 1.00 9.26 H new ATOM 0 HA THR A 109 17.462 14.516 -0.216 1.00 8.38 H new ATOM 0 HB THR A 109 18.194 12.107 1.492 1.00 7.38 H new ATOM 0 HG1 THR A 109 20.165 12.369 0.701 1.00 7.95 H new ATOM 0 HG21 THR A 109 17.717 10.839 -0.559 1.00 6.64 H new ATOM 0 HG22 THR A 109 16.306 11.781 -0.020 1.00 6.64 H new ATOM 0 HG23 THR A 109 17.286 12.353 -1.391 1.00 6.64 H new ATOM 1663 N ILE A 110 15.253 13.831 0.876 1.00 7.89 N ATOM 1664 CA ILE A 110 13.965 13.712 1.546 1.00 7.87 C ATOM 1665 C ILE A 110 13.249 12.439 1.096 1.00 6.75 C ATOM 1666 O ILE A 110 13.384 12.017 -0.048 1.00 6.24 O ATOM 1667 CB ILE A 110 13.039 14.916 1.260 1.00 9.02 C ATOM 1668 CG1 ILE A 110 13.757 16.255 1.486 1.00 10.20 C ATOM 1669 CG2 ILE A 110 11.795 14.834 2.125 1.00 9.31 C ATOM 1670 CD1 ILE A 110 14.167 16.506 2.923 1.00 10.55 C ATOM 0 H ILE A 110 15.206 13.771 -0.141 1.00 7.89 H new ATOM 0 HA ILE A 110 14.174 13.680 2.615 1.00 7.87 H new ATOM 0 HB ILE A 110 12.752 14.871 0.209 1.00 9.02 H new ATOM 0 HG12 ILE A 110 14.645 16.289 0.855 1.00 10.20 H new ATOM 0 HG13 ILE A 110 13.104 17.064 1.160 1.00 10.20 H new ATOM 0 HG21 ILE A 110 11.149 15.687 1.916 1.00 9.31 H new ATOM 0 HG22 ILE A 110 11.259 13.911 1.905 1.00 9.31 H new ATOM 0 HG23 ILE A 110 12.082 14.845 3.177 1.00 9.31 H new ATOM 0 HD11 ILE A 110 14.667 17.472 2.995 1.00 10.55 H new ATOM 0 HD12 ILE A 110 13.282 16.507 3.559 1.00 10.55 H new ATOM 0 HD13 ILE A 110 14.848 15.720 3.250 1.00 10.55 H new ATOM 1682 N ALA A 111 12.506 11.836 2.005 1.00 6.58 N ATOM 1683 CA ALA A 111 11.686 10.672 1.699 1.00 5.74 C ATOM 1684 C ALA A 111 10.236 10.953 2.047 1.00 6.51 C ATOM 1685 O ALA A 111 9.951 11.547 3.080 1.00 7.39 O ATOM 1686 CB ALA A 111 12.171 9.463 2.479 1.00 5.00 C ATOM 0 H ALA A 111 12.452 12.137 2.978 1.00 6.58 H new ATOM 0 HA ALA A 111 11.768 10.461 0.633 1.00 5.74 H new ATOM 0 HB1 ALA A 111 11.548 8.601 2.239 1.00 5.00 H new ATOM 0 HB2 ALA A 111 13.206 9.248 2.211 1.00 5.00 H new ATOM 0 HB3 ALA A 111 12.108 9.670 3.547 1.00 5.00 H new ATOM 1692 N MET A 112 9.323 10.550 1.186 1.00 6.37 N ATOM 1693 CA MET A 112 7.907 10.673 1.495 1.00 7.19 C ATOM 1694 C MET A 112 7.431 9.374 2.132 1.00 6.90 C ATOM 1695 O MET A 112 7.185 8.385 1.438 1.00 6.29 O ATOM 1696 CB MET A 112 7.099 10.961 0.227 1.00 7.48 C ATOM 1697 CG MET A 112 7.520 12.231 -0.494 1.00 8.19 C ATOM 1698 SD MET A 112 6.339 12.743 -1.758 1.00 8.85 S ATOM 1699 CE MET A 112 6.195 11.246 -2.730 1.00 8.24 C ATOM 0 H MET A 112 9.530 10.139 0.276 1.00 6.37 H new ATOM 0 HA MET A 112 7.759 11.504 2.185 1.00 7.19 H new ATOM 0 HB2 MET A 112 7.199 10.117 -0.455 1.00 7.48 H new ATOM 0 HB3 MET A 112 6.044 11.036 0.489 1.00 7.48 H new ATOM 0 HG2 MET A 112 7.637 13.034 0.233 1.00 8.19 H new ATOM 0 HG3 MET A 112 8.495 12.075 -0.956 1.00 8.19 H new ATOM 0 HE1 MET A 112 5.802 11.489 -3.717 1.00 8.24 H new ATOM 0 HE2 MET A 112 7.177 10.784 -2.834 1.00 8.24 H new ATOM 0 HE3 MET A 112 5.519 10.552 -2.231 1.00 8.24 H new ATOM 1709 N VAL A 113 7.328 9.378 3.455 1.00 7.60 N ATOM 1710 CA VAL A 113 6.985 8.181 4.196 1.00 7.75 C ATOM 1711 C VAL A 113 5.480 7.953 4.183 1.00 8.59 C ATOM 1712 O VAL A 113 4.692 8.869 4.431 1.00 9.48 O ATOM 1713 CB VAL A 113 7.504 8.245 5.657 1.00 8.42 C ATOM 1714 CG1 VAL A 113 6.765 9.290 6.478 1.00 9.69 C ATOM 1715 CG2 VAL A 113 7.410 6.882 6.319 1.00 8.72 C ATOM 0 H VAL A 113 7.479 10.203 4.035 1.00 7.60 H new ATOM 0 HA VAL A 113 7.474 7.341 3.702 1.00 7.75 H new ATOM 0 HB VAL A 113 8.551 8.544 5.616 1.00 8.42 H new ATOM 0 HG11 VAL A 113 7.160 9.301 7.494 1.00 9.69 H new ATOM 0 HG12 VAL A 113 6.902 10.272 6.025 1.00 9.69 H new ATOM 0 HG13 VAL A 113 5.703 9.047 6.505 1.00 9.69 H new ATOM 0 HG21 VAL A 113 7.779 6.948 7.343 1.00 8.72 H new ATOM 0 HG22 VAL A 113 6.371 6.553 6.328 1.00 8.72 H new ATOM 0 HG23 VAL A 113 8.013 6.165 5.762 1.00 8.72 H new ATOM 1725 N ALA A 114 5.091 6.729 3.874 1.00 8.43 N ATOM 1726 CA ALA A 114 3.691 6.367 3.826 1.00 9.31 C ATOM 1727 C ALA A 114 3.207 5.947 5.197 1.00 10.44 C ATOM 1728 O ALA A 114 3.312 4.779 5.579 1.00 10.70 O ATOM 1729 CB ALA A 114 3.459 5.260 2.809 1.00 8.96 C ATOM 0 H ALA A 114 5.731 5.967 3.652 1.00 8.43 H new ATOM 0 HA ALA A 114 3.118 7.240 3.513 1.00 9.31 H new ATOM 0 HB1 ALA A 114 2.400 5.002 2.788 1.00 8.96 H new ATOM 0 HB2 ALA A 114 3.769 5.602 1.822 1.00 8.96 H new ATOM 0 HB3 ALA A 114 4.041 4.382 3.088 1.00 8.96 H new ATOM 1735 N LYS A 115 2.699 6.909 5.947 1.00 11.26 N ATOM 1736 CA LYS A 115 2.125 6.625 7.247 1.00 12.43 C ATOM 1737 C LYS A 115 0.812 5.879 7.083 1.00 13.26 C ATOM 1738 O LYS A 115 0.107 6.057 6.088 1.00 13.19 O ATOM 1739 CB LYS A 115 1.881 7.913 8.036 1.00 13.13 C ATOM 1740 CG LYS A 115 3.127 8.496 8.678 1.00 13.19 C ATOM 1741 CD LYS A 115 2.777 9.676 9.570 1.00 14.08 C ATOM 1742 CE LYS A 115 3.952 10.109 10.430 1.00 14.36 C ATOM 1743 NZ LYS A 115 5.073 10.636 9.612 1.00 14.88 N1+ ATOM 0 H LYS A 115 2.673 7.892 5.677 1.00 11.26 H new ATOM 0 HA LYS A 115 2.834 6.008 7.799 1.00 12.43 H new ATOM 0 HB2 LYS A 115 1.448 8.658 7.369 1.00 13.13 H new ATOM 0 HB3 LYS A 115 1.144 7.715 8.814 1.00 13.13 H new ATOM 0 HG2 LYS A 115 3.631 7.728 9.265 1.00 13.19 H new ATOM 0 HG3 LYS A 115 3.825 8.815 7.904 1.00 13.19 H new ATOM 0 HD2 LYS A 115 2.452 10.513 8.952 1.00 14.08 H new ATOM 0 HD3 LYS A 115 1.937 9.409 10.212 1.00 14.08 H new ATOM 0 HE2 LYS A 115 3.624 10.875 11.133 1.00 14.36 H new ATOM 0 HE3 LYS A 115 4.301 9.262 11.021 1.00 14.36 H new ATOM 0 HZ1 LYS A 115 5.931 10.697 10.197 1.00 14.88 H new ATOM 0 HZ2 LYS A 115 5.246 9.998 8.809 1.00 14.88 H new ATOM 0 HZ3 LYS A 115 4.828 11.582 9.256 1.00 14.88 H new ATOM 1757 N GLY A 116 0.478 5.062 8.071 1.00 14.15 N ATOM 1758 CA GLY A 116 -0.788 4.359 8.062 1.00 15.10 C ATOM 1759 C GLY A 116 -1.939 5.284 8.403 1.00 16.02 C ATOM 1760 O GLY A 116 -3.072 4.843 8.588 1.00 16.92 O ATOM 0 H GLY A 116 1.065 4.873 8.883 1.00 14.15 H new ATOM 0 HA2 GLY A 116 -0.953 3.918 7.079 1.00 15.10 H new ATOM 0 HA3 GLY A 116 -0.755 3.538 8.778 1.00 15.10 H new ATOM 1764 N GLU A 117 -1.630 6.572 8.484 1.00 15.88 N ATOM 1765 CA GLU A 117 -2.613 7.589 8.800 1.00 16.82 C ATOM 1766 C GLU A 117 -3.179 8.216 7.528 1.00 16.56 C ATOM 1767 O GLU A 117 -3.879 9.231 7.566 1.00 17.25 O ATOM 1768 CB GLU A 117 -1.992 8.665 9.684 1.00 17.04 C ATOM 1769 CG GLU A 117 -1.395 8.098 10.956 1.00 17.42 C ATOM 1770 CD GLU A 117 -0.901 9.171 11.905 1.00 17.95 C ATOM 1771 OE1 GLU A 117 -1.728 9.766 12.625 1.00 18.56 O ATOM 1772 OE2 GLU A 117 0.324 9.424 11.938 1.00 17.82 O1- ATOM 0 H GLU A 117 -0.690 6.936 8.332 1.00 15.88 H new ATOM 0 HA GLU A 117 -3.432 7.114 9.340 1.00 16.82 H new ATOM 0 HB2 GLU A 117 -1.216 9.188 9.124 1.00 17.04 H new ATOM 0 HB3 GLU A 117 -2.752 9.403 9.941 1.00 17.04 H new ATOM 0 HG2 GLU A 117 -2.144 7.489 11.463 1.00 17.42 H new ATOM 0 HG3 GLU A 117 -0.567 7.437 10.700 1.00 17.42 H new ATOM 1779 N GLY A 118 -2.860 7.588 6.396 1.00 15.62 N ATOM 1780 CA GLY A 118 -3.423 7.988 5.120 1.00 15.41 C ATOM 1781 C GLY A 118 -2.688 9.141 4.467 1.00 14.71 C ATOM 1782 O GLY A 118 -3.186 9.730 3.505 1.00 14.71 O ATOM 0 H GLY A 118 -2.214 6.801 6.344 1.00 15.62 H new ATOM 0 HA2 GLY A 118 -3.414 7.133 4.444 1.00 15.41 H new ATOM 0 HA3 GLY A 118 -4.466 8.269 5.265 1.00 15.41 H new ATOM 1786 N GLY A 119 -1.500 9.453 4.964 1.00 14.19 N ATOM 1787 CA GLY A 119 -0.773 10.595 4.462 1.00 13.68 C ATOM 1788 C GLY A 119 0.703 10.315 4.304 1.00 12.53 C ATOM 1789 O GLY A 119 1.232 9.372 4.897 1.00 12.20 O ATOM 0 H GLY A 119 -1.029 8.935 5.705 1.00 14.19 H new ATOM 0 HA2 GLY A 119 -1.189 10.892 3.499 1.00 13.68 H new ATOM 0 HA3 GLY A 119 -0.910 11.436 5.141 1.00 13.68 H new ATOM 1793 N PHE A 120 1.362 11.139 3.511 1.00 12.03 N ATOM 1794 CA PHE A 120 2.780 10.978 3.235 1.00 10.94 C ATOM 1795 C PHE A 120 3.553 12.146 3.808 1.00 11.32 C ATOM 1796 O PHE A 120 3.361 13.296 3.403 1.00 11.97 O ATOM 1797 CB PHE A 120 3.011 10.907 1.728 1.00 10.11 C ATOM 1798 CG PHE A 120 2.137 9.912 1.029 1.00 9.82 C ATOM 1799 CD1 PHE A 120 2.268 8.560 1.286 1.00 9.56 C ATOM 1800 CD2 PHE A 120 1.183 10.329 0.120 1.00 9.99 C ATOM 1801 CE1 PHE A 120 1.459 7.640 0.653 1.00 9.49 C ATOM 1802 CE2 PHE A 120 0.370 9.415 -0.516 1.00 9.89 C ATOM 1803 CZ PHE A 120 0.509 8.067 -0.249 1.00 9.66 C ATOM 0 H PHE A 120 0.933 11.936 3.041 1.00 12.03 H new ATOM 0 HA PHE A 120 3.126 10.054 3.698 1.00 10.94 H new ATOM 0 HB2 PHE A 120 2.840 11.893 1.297 1.00 10.11 H new ATOM 0 HB3 PHE A 120 4.055 10.654 1.541 1.00 10.11 H new ATOM 0 HD1 PHE A 120 3.013 8.220 1.991 1.00 9.56 H new ATOM 0 HD2 PHE A 120 1.073 11.382 -0.094 1.00 9.99 H new ATOM 0 HE1 PHE A 120 1.570 6.587 0.864 1.00 9.49 H new ATOM 0 HE2 PHE A 120 -0.374 9.753 -1.222 1.00 9.89 H new ATOM 0 HZ PHE A 120 -0.126 7.349 -0.746 1.00 9.66 H new ATOM 1813 N ASP A 121 4.422 11.852 4.755 1.00 11.05 N ATOM 1814 CA ASP A 121 5.195 12.888 5.409 1.00 11.56 C ATOM 1815 C ASP A 121 6.632 12.854 4.930 1.00 10.58 C ATOM 1816 O ASP A 121 7.191 11.780 4.726 1.00 9.55 O ATOM 1817 CB ASP A 121 5.136 12.749 6.928 1.00 12.35 C ATOM 1818 CG ASP A 121 3.809 13.187 7.509 1.00 13.39 C ATOM 1819 OD1 ASP A 121 3.478 14.386 7.420 1.00 13.91 O1- ATOM 1820 OD2 ASP A 121 3.096 12.332 8.071 1.00 13.79 O ATOM 0 H ASP A 121 4.610 10.906 5.088 1.00 11.05 H new ATOM 0 HA ASP A 121 4.758 13.851 5.145 1.00 11.56 H new ATOM 0 HB2 ASP A 121 5.321 11.710 7.200 1.00 12.35 H new ATOM 0 HB3 ASP A 121 5.935 13.342 7.373 1.00 12.35 H new ATOM 1825 N PRO A 122 7.262 14.011 4.751 1.00 10.99 N ATOM 1826 CA PRO A 122 8.631 14.072 4.279 1.00 10.31 C ATOM 1827 C PRO A 122 9.651 13.897 5.402 1.00 10.40 C ATOM 1828 O PRO A 122 9.599 14.568 6.435 1.00 11.44 O ATOM 1829 CB PRO A 122 8.716 15.453 3.650 1.00 11.13 C ATOM 1830 CG PRO A 122 7.701 16.287 4.363 1.00 12.35 C ATOM 1831 CD PRO A 122 6.694 15.347 4.985 1.00 12.29 C ATOM 0 HA PRO A 122 8.868 13.266 3.585 1.00 10.31 H new ATOM 0 HB2 PRO A 122 9.716 15.873 3.762 1.00 11.13 H new ATOM 0 HB3 PRO A 122 8.506 15.410 2.581 1.00 11.13 H new ATOM 0 HG2 PRO A 122 8.178 16.899 5.129 1.00 12.35 H new ATOM 0 HG3 PRO A 122 7.210 16.970 3.669 1.00 12.35 H new ATOM 0 HD2 PRO A 122 6.567 15.546 6.049 1.00 12.29 H new ATOM 0 HD3 PRO A 122 5.713 15.450 4.522 1.00 12.29 H new ATOM 1839 N VAL A 123 10.555 12.962 5.199 1.00 9.36 N ATOM 1840 CA VAL A 123 11.614 12.680 6.154 1.00 9.43 C ATOM 1841 C VAL A 123 12.950 13.043 5.542 1.00 9.05 C ATOM 1842 O VAL A 123 13.282 12.566 4.461 1.00 8.18 O ATOM 1843 CB VAL A 123 11.664 11.188 6.547 1.00 8.79 C ATOM 1844 CG1 VAL A 123 12.391 11.006 7.867 1.00 7.90 C ATOM 1845 CG2 VAL A 123 10.272 10.585 6.593 1.00 9.39 C ATOM 0 H VAL A 123 10.579 12.373 4.367 1.00 9.36 H new ATOM 0 HA VAL A 123 11.408 13.270 7.047 1.00 9.43 H new ATOM 0 HB VAL A 123 12.224 10.654 5.779 1.00 8.79 H new ATOM 0 HG11 VAL A 123 12.415 9.948 8.126 1.00 7.90 H new ATOM 0 HG12 VAL A 123 13.410 11.381 7.776 1.00 7.90 H new ATOM 0 HG13 VAL A 123 11.870 11.559 8.649 1.00 7.90 H new ATOM 0 HG21 VAL A 123 10.340 9.534 6.873 1.00 9.39 H new ATOM 0 HG22 VAL A 123 9.669 11.118 7.328 1.00 9.39 H new ATOM 0 HG23 VAL A 123 9.806 10.670 5.611 1.00 9.39 H new ATOM 1855 N GLU A 124 13.704 13.893 6.207 1.00 9.85 N ATOM 1856 CA GLU A 124 15.040 14.210 5.749 1.00 9.72 C ATOM 1857 C GLU A 124 15.950 13.022 6.007 1.00 8.90 C ATOM 1858 O GLU A 124 16.016 12.500 7.122 1.00 9.21 O ATOM 1859 CB GLU A 124 15.577 15.458 6.439 1.00 10.96 C ATOM 1860 CG GLU A 124 16.877 15.958 5.832 1.00 11.07 C ATOM 1861 CD GLU A 124 17.286 17.303 6.377 1.00 12.34 C ATOM 1862 OE1 GLU A 124 16.701 18.323 5.955 1.00 12.93 O1- ATOM 1863 OE2 GLU A 124 18.194 17.341 7.234 1.00 12.83 O ATOM 0 H GLU A 124 13.418 14.373 7.060 1.00 9.85 H new ATOM 0 HA GLU A 124 15.007 14.418 4.679 1.00 9.72 H new ATOM 0 HB2 GLU A 124 14.828 16.248 6.383 1.00 10.96 H new ATOM 0 HB3 GLU A 124 15.735 15.243 7.496 1.00 10.96 H new ATOM 0 HG2 GLU A 124 17.668 15.234 6.027 1.00 11.07 H new ATOM 0 HG3 GLU A 124 16.767 16.026 4.750 1.00 11.07 H new ATOM 1870 N VAL A 125 16.631 12.590 4.965 1.00 8.03 N ATOM 1871 CA VAL A 125 17.431 11.386 5.023 1.00 7.30 C ATOM 1872 C VAL A 125 18.789 11.585 4.368 1.00 7.38 C ATOM 1873 O VAL A 125 18.961 12.408 3.468 1.00 7.84 O ATOM 1874 CB VAL A 125 16.680 10.188 4.379 1.00 6.19 C ATOM 1875 CG1 VAL A 125 15.682 10.661 3.346 1.00 6.15 C ATOM 1876 CG2 VAL A 125 17.614 9.200 3.742 1.00 5.62 C ATOM 0 H VAL A 125 16.645 13.061 4.060 1.00 8.03 H new ATOM 0 HA VAL A 125 17.601 11.158 6.075 1.00 7.30 H new ATOM 0 HB VAL A 125 16.156 9.687 5.193 1.00 6.19 H new ATOM 0 HG11 VAL A 125 15.172 9.801 2.912 1.00 6.15 H new ATOM 0 HG12 VAL A 125 14.951 11.316 3.820 1.00 6.15 H new ATOM 0 HG13 VAL A 125 16.203 11.208 2.560 1.00 6.15 H new ATOM 0 HG21 VAL A 125 17.038 8.383 3.307 1.00 5.62 H new ATOM 0 HG22 VAL A 125 18.189 9.695 2.960 1.00 5.62 H new ATOM 0 HG23 VAL A 125 18.294 8.803 4.496 1.00 5.62 H new ATOM 1886 N LYS A 126 19.743 10.823 4.860 1.00 7.21 N ATOM 1887 CA LYS A 126 21.092 10.819 4.347 1.00 7.44 C ATOM 1888 C LYS A 126 21.219 9.764 3.261 1.00 6.77 C ATOM 1889 O LYS A 126 20.851 8.605 3.468 1.00 6.29 O ATOM 1890 CB LYS A 126 22.056 10.515 5.481 1.00 8.03 C ATOM 1891 CG LYS A 126 23.495 10.433 5.020 1.00 8.46 C ATOM 1892 CD LYS A 126 24.452 10.241 6.177 1.00 9.06 C ATOM 1893 CE LYS A 126 24.495 11.452 7.099 1.00 9.72 C ATOM 1894 NZ LYS A 126 25.012 12.664 6.404 1.00 10.39 N1+ ATOM 0 H LYS A 126 19.599 10.180 5.639 1.00 7.21 H new ATOM 0 HA LYS A 126 21.329 11.795 3.923 1.00 7.44 H new ATOM 0 HB2 LYS A 126 21.967 11.288 6.245 1.00 8.03 H new ATOM 0 HB3 LYS A 126 21.774 9.571 5.948 1.00 8.03 H new ATOM 0 HG2 LYS A 126 23.604 9.606 4.318 1.00 8.46 H new ATOM 0 HG3 LYS A 126 23.756 11.344 4.482 1.00 8.46 H new ATOM 0 HD2 LYS A 126 24.155 9.362 6.749 1.00 9.06 H new ATOM 0 HD3 LYS A 126 25.452 10.046 5.790 1.00 9.06 H new ATOM 0 HE2 LYS A 126 23.494 11.652 7.481 1.00 9.72 H new ATOM 0 HE3 LYS A 126 25.126 11.230 7.959 1.00 9.72 H new ATOM 0 HZ1 LYS A 126 25.233 13.399 7.106 1.00 10.39 H new ATOM 0 HZ2 LYS A 126 25.874 12.420 5.875 1.00 10.39 H new ATOM 0 HZ3 LYS A 126 24.291 13.021 5.745 1.00 10.39 H new ATOM 1908 N ALA A 127 21.767 10.150 2.124 1.00 7.04 N ATOM 1909 CA ALA A 127 21.753 9.288 0.960 1.00 6.78 C ATOM 1910 C ALA A 127 23.139 8.929 0.506 1.00 7.69 C ATOM 1911 O ALA A 127 23.913 9.743 -0.004 1.00 8.30 O ATOM 1912 CB ALA A 127 20.928 9.888 -0.171 1.00 6.34 C ATOM 0 H ALA A 127 22.225 11.050 1.983 1.00 7.04 H new ATOM 0 HA ALA A 127 21.269 8.358 1.259 1.00 6.78 H new ATOM 0 HB1 ALA A 127 20.940 9.214 -1.027 1.00 6.34 H new ATOM 0 HB2 ALA A 127 19.901 10.030 0.164 1.00 6.34 H new ATOM 0 HB3 ALA A 127 21.352 10.850 -0.460 1.00 6.34 H new ATOM 1918 N GLY A 128 23.397 7.674 0.727 1.00 8.00 N ATOM 1919 CA GLY A 128 24.538 6.990 0.256 1.00 8.94 C ATOM 1920 C GLY A 128 24.277 6.389 -1.096 1.00 9.46 C ATOM 1921 O GLY A 128 23.174 6.474 -1.642 1.00 10.10 O ATOM 0 H GLY A 128 22.775 7.078 1.272 1.00 8.00 H new ATOM 0 HA2 GLY A 128 25.382 7.678 0.197 1.00 8.94 H new ATOM 0 HA3 GLY A 128 24.815 6.206 0.961 1.00 8.94 H new ATOM 1925 N ALA A 129 25.326 5.842 -1.612 1.00 9.37 N ATOM 1926 CA ALA A 129 25.472 5.397 -2.998 1.00 10.27 C ATOM 1927 C ALA A 129 24.279 4.609 -3.543 1.00 10.12 C ATOM 1928 O ALA A 129 23.474 4.062 -2.806 1.00 9.18 O ATOM 1929 CB ALA A 129 26.681 4.498 -3.057 1.00 10.61 C ATOM 0 H ALA A 129 26.168 5.674 -1.061 1.00 9.37 H new ATOM 0 HA ALA A 129 25.558 6.294 -3.611 1.00 10.27 H new ATOM 0 HB1 ALA A 129 26.823 4.145 -4.079 1.00 10.61 H new ATOM 0 HB2 ALA A 129 27.563 5.054 -2.739 1.00 10.61 H new ATOM 0 HB3 ALA A 129 26.532 3.644 -2.396 1.00 10.61 H new ATOM 1935 N THR A 130 24.207 4.532 -4.860 1.00 11.12 N ATOM 1936 CA THR A 130 23.134 3.839 -5.535 1.00 11.19 C ATOM 1937 C THR A 130 23.634 2.478 -5.973 1.00 12.15 C ATOM 1938 O THR A 130 24.771 2.350 -6.431 1.00 13.17 O ATOM 1939 CB THR A 130 22.659 4.625 -6.771 1.00 11.72 C ATOM 1940 OG1 THR A 130 22.499 6.009 -6.439 1.00 11.18 O ATOM 1941 CG2 THR A 130 21.348 4.074 -7.308 1.00 11.68 C ATOM 0 H THR A 130 24.893 4.950 -5.488 1.00 11.12 H new ATOM 0 HA THR A 130 22.294 3.738 -4.848 1.00 11.19 H new ATOM 0 HB THR A 130 23.417 4.519 -7.547 1.00 11.72 H new ATOM 0 HG1 THR A 130 22.198 6.503 -7.230 1.00 11.18 H new ATOM 0 HG21 THR A 130 21.041 4.651 -8.180 1.00 11.68 H new ATOM 0 HG22 THR A 130 21.481 3.030 -7.592 1.00 11.68 H new ATOM 0 HG23 THR A 130 20.581 4.145 -6.537 1.00 11.68 H new ATOM 1949 N ALA A 131 22.803 1.471 -5.826 1.00 11.92 N ATOM 1950 CA ALA A 131 23.208 0.125 -6.126 1.00 12.91 C ATOM 1951 C ALA A 131 22.030 -0.720 -6.601 1.00 12.98 C ATOM 1952 O ALA A 131 21.106 -1.003 -5.836 1.00 12.19 O ATOM 1953 CB ALA A 131 23.856 -0.479 -4.898 1.00 12.87 C ATOM 0 H ALA A 131 21.841 1.564 -5.499 1.00 11.92 H new ATOM 0 HA ALA A 131 23.930 0.144 -6.943 1.00 12.91 H new ATOM 0 HB1 ALA A 131 24.167 -1.501 -5.116 1.00 12.87 H new ATOM 0 HB2 ALA A 131 24.727 0.113 -4.618 1.00 12.87 H new ATOM 0 HB3 ALA A 131 23.141 -0.485 -4.075 1.00 12.87 H new ATOM 1959 N GLY A 132 22.062 -1.098 -7.873 1.00 14.01 N ATOM 1960 CA GLY A 132 21.016 -1.942 -8.425 1.00 14.34 C ATOM 1961 C GLY A 132 19.684 -1.228 -8.538 1.00 13.47 C ATOM 1962 O GLY A 132 18.629 -1.834 -8.362 1.00 13.23 O ATOM 0 H GLY A 132 22.794 -0.836 -8.534 1.00 14.01 H new ATOM 0 HA2 GLY A 132 21.320 -2.292 -9.411 1.00 14.34 H new ATOM 0 HA3 GLY A 132 20.898 -2.825 -7.796 1.00 14.34 H new ATOM 1966 N GLY A 133 19.732 0.068 -8.823 1.00 13.12 N ATOM 1967 CA GLY A 133 18.515 0.849 -8.940 1.00 12.40 C ATOM 1968 C GLY A 133 17.964 1.257 -7.590 1.00 10.98 C ATOM 1969 O GLY A 133 16.907 1.881 -7.497 1.00 10.30 O ATOM 0 H GLY A 133 20.593 0.593 -8.975 1.00 13.12 H new ATOM 0 HA2 GLY A 133 18.714 1.741 -9.534 1.00 12.40 H new ATOM 0 HA3 GLY A 133 17.764 0.270 -9.477 1.00 12.40 H new ATOM 1973 N GLN A 134 18.684 0.903 -6.538 1.00 10.62 N ATOM 1974 CA GLN A 134 18.281 1.260 -5.194 1.00 9.33 C ATOM 1975 C GLN A 134 19.309 2.188 -4.585 1.00 8.96 C ATOM 1976 O GLN A 134 20.458 2.186 -5.000 1.00 9.81 O ATOM 1977 CB GLN A 134 18.100 0.017 -4.322 1.00 9.38 C ATOM 1978 CG GLN A 134 16.984 -0.900 -4.798 1.00 9.89 C ATOM 1979 CD GLN A 134 16.825 -2.128 -3.927 1.00 10.08 C ATOM 1980 OE1 GLN A 134 17.440 -3.164 -4.178 1.00 10.39 O ATOM 1981 NE2 GLN A 134 16.000 -2.020 -2.896 1.00 10.17 N ATOM 0 H GLN A 134 19.551 0.368 -6.592 1.00 10.62 H new ATOM 0 HA GLN A 134 17.320 1.771 -5.245 1.00 9.33 H new ATOM 0 HB2 GLN A 134 19.035 -0.542 -4.302 1.00 9.38 H new ATOM 0 HB3 GLN A 134 17.892 0.328 -3.298 1.00 9.38 H new ATOM 0 HG2 GLN A 134 16.045 -0.346 -4.812 1.00 9.89 H new ATOM 0 HG3 GLN A 134 17.187 -1.210 -5.823 1.00 9.89 H new ATOM 0 HE21 GLN A 134 15.510 -1.142 -2.725 1.00 10.17 H new ATOM 0 HE22 GLN A 134 15.855 -2.815 -2.274 1.00 10.17 H new ATOM 1990 N SER A 135 18.915 2.971 -3.613 1.00 7.82 N ATOM 1991 CA SER A 135 19.835 3.881 -2.982 1.00 7.56 C ATOM 1992 C SER A 135 20.242 3.388 -1.604 1.00 7.12 C ATOM 1993 O SER A 135 19.480 2.692 -0.928 1.00 6.78 O ATOM 1994 CB SER A 135 19.224 5.275 -2.904 1.00 6.91 C ATOM 1995 OG SER A 135 17.869 5.199 -2.498 1.00 6.85 O ATOM 0 H SER A 135 17.965 2.996 -3.242 1.00 7.82 H new ATOM 0 HA SER A 135 20.738 3.930 -3.590 1.00 7.56 H new ATOM 0 HB2 SER A 135 19.787 5.887 -2.200 1.00 6.91 H new ATOM 0 HB3 SER A 135 19.292 5.764 -3.876 1.00 6.91 H new ATOM 0 HG SER A 135 17.802 5.404 -1.542 1.00 6.85 H new ATOM 2001 N GLU A 136 21.440 3.744 -1.197 1.00 7.39 N ATOM 2002 CA GLU A 136 21.910 3.450 0.138 1.00 7.25 C ATOM 2003 C GLU A 136 21.436 4.535 1.098 1.00 6.42 C ATOM 2004 O GLU A 136 21.980 5.620 1.140 1.00 6.54 O ATOM 2005 CB GLU A 136 23.446 3.353 0.142 1.00 8.31 C ATOM 2006 CG GLU A 136 23.976 2.010 -0.323 1.00 9.31 C ATOM 2007 CD GLU A 136 25.463 1.869 -0.093 1.00 10.29 C ATOM 2008 OE1 GLU A 136 25.926 2.166 1.026 1.00 10.69 O ATOM 2009 OE2 GLU A 136 26.182 1.444 -1.022 1.00 10.79 O1- ATOM 0 H GLU A 136 22.113 4.243 -1.779 1.00 7.39 H new ATOM 0 HA GLU A 136 21.504 2.493 0.465 1.00 7.25 H new ATOM 0 HB2 GLU A 136 23.852 4.135 -0.500 1.00 8.31 H new ATOM 0 HB3 GLU A 136 23.810 3.547 1.151 1.00 8.31 H new ATOM 0 HG2 GLU A 136 23.452 1.213 0.204 1.00 9.31 H new ATOM 0 HG3 GLU A 136 23.761 1.885 -1.384 1.00 9.31 H new ATOM 2016 N ILE A 137 20.390 4.262 1.841 1.00 5.86 N ATOM 2017 CA ILE A 137 19.927 5.214 2.837 1.00 5.49 C ATOM 2018 C ILE A 137 20.721 5.040 4.107 1.00 6.25 C ATOM 2019 O ILE A 137 20.652 4.009 4.763 1.00 6.73 O ATOM 2020 CB ILE A 137 18.415 5.087 3.107 1.00 4.93 C ATOM 2021 CG1 ILE A 137 17.636 5.551 1.877 1.00 4.16 C ATOM 2022 CG2 ILE A 137 18.004 5.882 4.343 1.00 5.24 C ATOM 2023 CD1 ILE A 137 18.032 6.933 1.386 1.00 4.21 C ATOM 0 H ILE A 137 19.846 3.402 1.781 1.00 5.86 H new ATOM 0 HA ILE A 137 20.087 6.219 2.446 1.00 5.49 H new ATOM 0 HB ILE A 137 18.182 4.040 3.303 1.00 4.93 H new ATOM 0 HG12 ILE A 137 17.786 4.833 1.071 1.00 4.16 H new ATOM 0 HG13 ILE A 137 16.571 5.550 2.111 1.00 4.16 H new ATOM 0 HG21 ILE A 137 16.932 5.772 4.506 1.00 5.24 H new ATOM 0 HG22 ILE A 137 18.544 5.508 5.213 1.00 5.24 H new ATOM 0 HG23 ILE A 137 18.242 6.935 4.194 1.00 5.24 H new ATOM 0 HD11 ILE A 137 17.436 7.193 0.511 1.00 4.21 H new ATOM 0 HD12 ILE A 137 17.855 7.664 2.175 1.00 4.21 H new ATOM 0 HD13 ILE A 137 19.089 6.935 1.119 1.00 4.21 H new ATOM 2035 N LEU A 138 21.508 6.050 4.419 1.00 6.60 N ATOM 2036 CA LEU A 138 22.430 5.985 5.535 1.00 7.40 C ATOM 2037 C LEU A 138 21.713 6.315 6.829 1.00 7.59 C ATOM 2038 O LEU A 138 21.848 5.606 7.827 1.00 8.21 O ATOM 2039 CB LEU A 138 23.602 6.948 5.312 1.00 7.87 C ATOM 2040 CG LEU A 138 24.713 6.473 4.356 1.00 8.31 C ATOM 2041 CD1 LEU A 138 24.174 5.594 3.248 1.00 7.93 C ATOM 2042 CD2 LEU A 138 25.439 7.668 3.759 1.00 8.79 C ATOM 0 H LEU A 138 21.527 6.934 3.910 1.00 6.60 H new ATOM 0 HA LEU A 138 22.823 4.971 5.605 1.00 7.40 H new ATOM 0 HB2 LEU A 138 23.203 7.888 4.930 1.00 7.87 H new ATOM 0 HB3 LEU A 138 24.055 7.164 6.280 1.00 7.87 H new ATOM 0 HG LEU A 138 25.411 5.875 4.943 1.00 8.31 H new ATOM 0 HD11 LEU A 138 24.993 5.283 2.599 1.00 7.93 H new ATOM 0 HD12 LEU A 138 23.700 4.713 3.681 1.00 7.93 H new ATOM 0 HD13 LEU A 138 23.441 6.152 2.665 1.00 7.93 H new ATOM 0 HD21 LEU A 138 26.222 7.319 3.085 1.00 8.79 H new ATOM 0 HD22 LEU A 138 24.731 8.284 3.205 1.00 8.79 H new ATOM 0 HD23 LEU A 138 25.886 8.259 4.559 1.00 8.79 H new ATOM 2054 N GLU A 139 20.943 7.393 6.811 1.00 7.31 N ATOM 2055 CA GLU A 139 20.221 7.813 7.981 1.00 7.84 C ATOM 2056 C GLU A 139 18.922 8.469 7.555 1.00 7.45 C ATOM 2057 O GLU A 139 18.801 8.891 6.418 1.00 6.77 O ATOM 2058 CB GLU A 139 21.086 8.777 8.782 1.00 8.66 C ATOM 2059 CG GLU A 139 20.393 9.338 9.990 1.00 9.21 C ATOM 2060 CD GLU A 139 20.046 8.272 11.008 1.00 9.98 C ATOM 2061 OE1 GLU A 139 18.967 7.661 10.886 1.00 10.44 O ATOM 2062 OE2 GLU A 139 20.852 8.045 11.940 1.00 10.28 O1- ATOM 0 H GLU A 139 20.808 7.987 5.993 1.00 7.31 H new ATOM 0 HA GLU A 139 19.984 6.956 8.611 1.00 7.84 H new ATOM 0 HB2 GLU A 139 21.993 8.262 9.099 1.00 8.66 H new ATOM 0 HB3 GLU A 139 21.395 9.598 8.136 1.00 8.66 H new ATOM 0 HG2 GLU A 139 21.033 10.087 10.457 1.00 9.21 H new ATOM 0 HG3 GLU A 139 19.482 9.848 9.678 1.00 9.21 H new ATOM 2069 N GLY A 140 17.956 8.550 8.450 1.00 8.06 N ATOM 2070 CA GLY A 140 16.712 9.201 8.114 1.00 8.05 C ATOM 2071 C GLY A 140 15.512 8.365 8.478 1.00 8.05 C ATOM 2072 O GLY A 140 14.686 8.760 9.303 1.00 8.87 O ATOM 0 H GLY A 140 18.009 8.179 9.399 1.00 8.06 H new ATOM 0 HA2 GLY A 140 16.655 10.159 8.631 1.00 8.05 H new ATOM 0 HA3 GLY A 140 16.693 9.414 7.045 1.00 8.05 H new ATOM 2076 N LEU A 141 15.433 7.197 7.868 1.00 7.34 N ATOM 2077 CA LEU A 141 14.286 6.319 8.024 1.00 7.46 C ATOM 2078 C LEU A 141 14.621 5.076 8.833 1.00 8.16 C ATOM 2079 O LEU A 141 15.707 4.959 9.407 1.00 8.50 O ATOM 2080 CB LEU A 141 13.773 5.916 6.649 1.00 6.40 C ATOM 2081 CG LEU A 141 13.019 7.005 5.905 1.00 6.03 C ATOM 2082 CD1 LEU A 141 13.017 6.710 4.420 1.00 5.58 C ATOM 2083 CD2 LEU A 141 11.596 7.103 6.434 1.00 6.58 C ATOM 0 H LEU A 141 16.159 6.830 7.252 1.00 7.34 H new ATOM 0 HA LEU A 141 13.517 6.865 8.571 1.00 7.46 H new ATOM 0 HB2 LEU A 141 14.619 5.599 6.040 1.00 6.40 H new ATOM 0 HB3 LEU A 141 13.118 5.052 6.760 1.00 6.40 H new ATOM 0 HG LEU A 141 13.516 7.961 6.067 1.00 6.03 H new ATOM 0 HD11 LEU A 141 12.474 7.495 3.894 1.00 5.58 H new ATOM 0 HD12 LEU A 141 14.043 6.671 4.055 1.00 5.58 H new ATOM 0 HD13 LEU A 141 12.532 5.751 4.240 1.00 5.58 H new ATOM 0 HD21 LEU A 141 11.061 7.886 5.896 1.00 6.58 H new ATOM 0 HD22 LEU A 141 11.087 6.150 6.289 1.00 6.58 H new ATOM 0 HD23 LEU A 141 11.619 7.344 7.497 1.00 6.58 H new ATOM 2095 N LYS A 142 13.679 4.144 8.854 1.00 8.54 N ATOM 2096 CA LYS A 142 13.831 2.894 9.573 1.00 9.51 C ATOM 2097 C LYS A 142 13.137 1.780 8.822 1.00 9.48 C ATOM 2098 O LYS A 142 12.201 2.013 8.057 1.00 8.97 O ATOM 2099 CB LYS A 142 13.210 3.031 10.961 1.00 10.71 C ATOM 2100 CG LYS A 142 13.261 1.758 11.791 1.00 11.83 C ATOM 2101 CD LYS A 142 12.667 1.959 13.174 1.00 12.89 C ATOM 2102 CE LYS A 142 12.410 0.629 13.864 1.00 13.50 C ATOM 2103 NZ LYS A 142 11.337 -0.148 13.185 1.00 14.15 N1+ ATOM 0 H LYS A 142 12.786 4.237 8.370 1.00 8.54 H new ATOM 0 HA LYS A 142 14.891 2.659 9.664 1.00 9.51 H new ATOM 0 HB2 LYS A 142 13.725 3.825 11.501 1.00 10.71 H new ATOM 0 HB3 LYS A 142 12.170 3.341 10.854 1.00 10.71 H new ATOM 0 HG2 LYS A 142 12.719 0.966 11.275 1.00 11.83 H new ATOM 0 HG3 LYS A 142 14.295 1.427 11.885 1.00 11.83 H new ATOM 0 HD2 LYS A 142 13.345 2.560 13.780 1.00 12.89 H new ATOM 0 HD3 LYS A 142 11.733 2.516 13.094 1.00 12.89 H new ATOM 0 HE2 LYS A 142 13.329 0.043 13.878 1.00 13.50 H new ATOM 0 HE3 LYS A 142 12.129 0.806 14.902 1.00 13.50 H new ATOM 0 HZ1 LYS A 142 11.025 -0.924 13.804 1.00 14.15 H new ATOM 0 HZ2 LYS A 142 10.531 0.477 12.981 1.00 14.15 H new ATOM 0 HZ3 LYS A 142 11.704 -0.541 12.295 1.00 14.15 H new ATOM 2117 N ALA A 143 13.617 0.572 9.047 1.00 10.19 N ATOM 2118 CA ALA A 143 13.049 -0.610 8.437 1.00 10.49 C ATOM 2119 C ALA A 143 11.677 -0.869 9.012 1.00 11.20 C ATOM 2120 O ALA A 143 11.499 -0.879 10.234 1.00 12.12 O ATOM 2121 CB ALA A 143 13.944 -1.811 8.646 1.00 11.37 C ATOM 0 H ALA A 143 14.412 0.385 9.658 1.00 10.19 H new ATOM 0 HA ALA A 143 12.962 -0.441 7.364 1.00 10.49 H new ATOM 0 HB1 ALA A 143 13.494 -2.686 8.178 1.00 11.37 H new ATOM 0 HB2 ALA A 143 14.919 -1.621 8.197 1.00 11.37 H new ATOM 0 HB3 ALA A 143 14.065 -1.993 9.714 1.00 11.37 H new ATOM 2127 N GLY A 144 10.721 -1.082 8.133 1.00 10.88 N ATOM 2128 CA GLY A 144 9.347 -1.172 8.549 1.00 11.54 C ATOM 2129 C GLY A 144 8.578 0.073 8.171 1.00 10.82 C ATOM 2130 O GLY A 144 7.378 0.167 8.417 1.00 11.32 O ATOM 0 H GLY A 144 10.874 -1.195 7.131 1.00 10.88 H new ATOM 0 HA2 GLY A 144 8.882 -2.044 8.089 1.00 11.54 H new ATOM 0 HA3 GLY A 144 9.300 -1.318 9.628 1.00 11.54 H new ATOM 2134 N GLN A 145 9.274 1.035 7.564 1.00 9.74 N ATOM 2135 CA GLN A 145 8.633 2.252 7.107 1.00 9.10 C ATOM 2136 C GLN A 145 8.452 2.196 5.604 1.00 8.05 C ATOM 2137 O GLN A 145 9.334 1.733 4.889 1.00 7.35 O ATOM 2138 CB GLN A 145 9.423 3.516 7.483 1.00 8.76 C ATOM 2139 CG GLN A 145 9.558 3.760 8.980 1.00 9.88 C ATOM 2140 CD GLN A 145 8.216 3.878 9.678 1.00 10.75 C ATOM 2141 OE1 GLN A 145 7.662 2.889 10.154 1.00 11.13 O ATOM 2142 NE2 GLN A 145 7.689 5.090 9.755 1.00 11.24 N ATOM 0 H GLN A 145 10.276 0.989 7.382 1.00 9.74 H new ATOM 0 HA GLN A 145 7.666 2.315 7.606 1.00 9.10 H new ATOM 0 HB2 GLN A 145 10.420 3.447 7.048 1.00 8.76 H new ATOM 0 HB3 GLN A 145 8.937 4.380 7.030 1.00 8.76 H new ATOM 0 HG2 GLN A 145 10.125 2.943 9.427 1.00 9.88 H new ATOM 0 HG3 GLN A 145 10.130 4.673 9.145 1.00 9.88 H new ATOM 0 HE21 GLN A 145 8.179 5.886 9.348 1.00 11.24 H new ATOM 0 HE22 GLN A 145 6.793 5.228 10.222 1.00 11.24 H new ATOM 2151 N GLN A 146 7.323 2.648 5.133 1.00 8.12 N ATOM 2152 CA GLN A 146 7.053 2.689 3.710 1.00 7.34 C ATOM 2153 C GLN A 146 7.482 4.025 3.117 1.00 6.41 C ATOM 2154 O GLN A 146 7.288 5.075 3.723 1.00 6.79 O ATOM 2155 CB GLN A 146 5.562 2.489 3.478 1.00 8.14 C ATOM 2156 CG GLN A 146 5.117 1.057 3.644 1.00 9.01 C ATOM 2157 CD GLN A 146 3.612 0.907 3.569 1.00 9.89 C ATOM 2158 OE1 GLN A 146 2.921 0.938 4.586 1.00 10.17 O ATOM 2159 NE2 GLN A 146 3.089 0.769 2.364 1.00 10.49 N ATOM 0 H GLN A 146 6.563 2.998 5.716 1.00 8.12 H new ATOM 0 HA GLN A 146 7.619 1.895 3.223 1.00 7.34 H new ATOM 0 HB2 GLN A 146 5.006 3.118 4.174 1.00 8.14 H new ATOM 0 HB3 GLN A 146 5.310 2.826 2.473 1.00 8.14 H new ATOM 0 HG2 GLN A 146 5.579 0.444 2.870 1.00 9.01 H new ATOM 0 HG3 GLN A 146 5.470 0.679 4.604 1.00 9.01 H new ATOM 0 HE21 GLN A 146 3.696 0.748 1.544 1.00 10.49 H new ATOM 0 HE22 GLN A 146 2.079 0.684 2.253 1.00 10.49 H new ATOM 2168 N VAL A 147 8.085 3.976 1.942 1.00 5.45 N ATOM 2169 CA VAL A 147 8.447 5.191 1.221 1.00 4.76 C ATOM 2170 C VAL A 147 7.865 5.151 -0.179 1.00 4.67 C ATOM 2171 O VAL A 147 7.882 4.108 -0.837 1.00 4.76 O ATOM 2172 CB VAL A 147 9.979 5.413 1.145 1.00 3.89 C ATOM 2173 CG1 VAL A 147 10.564 5.521 2.538 1.00 4.21 C ATOM 2174 CG2 VAL A 147 10.672 4.305 0.360 1.00 3.49 C ATOM 0 H VAL A 147 8.336 3.110 1.464 1.00 5.45 H new ATOM 0 HA VAL A 147 8.030 6.029 1.780 1.00 4.76 H new ATOM 0 HB VAL A 147 10.152 6.349 0.613 1.00 3.89 H new ATOM 0 HG11 VAL A 147 11.641 5.677 2.469 1.00 4.21 H new ATOM 0 HG12 VAL A 147 10.108 6.362 3.060 1.00 4.21 H new ATOM 0 HG13 VAL A 147 10.365 4.602 3.089 1.00 4.21 H new ATOM 0 HG21 VAL A 147 11.745 4.497 0.329 1.00 3.49 H new ATOM 0 HG22 VAL A 147 10.489 3.346 0.845 1.00 3.49 H new ATOM 0 HG23 VAL A 147 10.279 4.279 -0.656 1.00 3.49 H new ATOM 2184 N VAL A 148 7.319 6.274 -0.611 1.00 4.95 N ATOM 2185 CA VAL A 148 6.689 6.371 -1.918 1.00 5.28 C ATOM 2186 C VAL A 148 7.719 6.255 -3.029 1.00 4.93 C ATOM 2187 O VAL A 148 8.560 7.134 -3.202 1.00 4.74 O ATOM 2188 CB VAL A 148 5.922 7.697 -2.075 1.00 6.08 C ATOM 2189 CG1 VAL A 148 5.259 7.780 -3.441 1.00 6.56 C ATOM 2190 CG2 VAL A 148 4.894 7.858 -0.966 1.00 6.56 C ATOM 0 H VAL A 148 7.299 7.139 -0.071 1.00 4.95 H new ATOM 0 HA VAL A 148 5.983 5.544 -1.994 1.00 5.28 H new ATOM 0 HB VAL A 148 6.638 8.515 -1.997 1.00 6.08 H new ATOM 0 HG11 VAL A 148 4.723 8.725 -3.529 1.00 6.56 H new ATOM 0 HG12 VAL A 148 6.020 7.721 -4.219 1.00 6.56 H new ATOM 0 HG13 VAL A 148 4.558 6.954 -3.556 1.00 6.56 H new ATOM 0 HG21 VAL A 148 4.363 8.801 -1.096 1.00 6.56 H new ATOM 0 HG22 VAL A 148 4.183 7.033 -1.007 1.00 6.56 H new ATOM 0 HG23 VAL A 148 5.398 7.855 0.000 1.00 6.56 H new ATOM 2200 N VAL A 149 7.641 5.170 -3.781 1.00 5.25 N ATOM 2201 CA VAL A 149 8.583 4.923 -4.858 1.00 5.51 C ATOM 2202 C VAL A 149 7.926 5.216 -6.203 1.00 6.47 C ATOM 2203 O VAL A 149 8.553 5.128 -7.256 1.00 6.99 O ATOM 2204 CB VAL A 149 9.138 3.477 -4.796 1.00 5.65 C ATOM 2205 CG1 VAL A 149 9.476 3.120 -3.364 1.00 5.29 C ATOM 2206 CG2 VAL A 149 8.175 2.450 -5.361 1.00 6.22 C ATOM 0 H VAL A 149 6.933 4.445 -3.665 1.00 5.25 H new ATOM 0 HA VAL A 149 9.433 5.595 -4.740 1.00 5.51 H new ATOM 0 HB VAL A 149 10.034 3.454 -5.417 1.00 5.65 H new ATOM 0 HG11 VAL A 149 9.866 2.103 -3.325 1.00 5.29 H new ATOM 0 HG12 VAL A 149 10.228 3.812 -2.984 1.00 5.29 H new ATOM 0 HG13 VAL A 149 8.578 3.188 -2.750 1.00 5.29 H new ATOM 0 HG21 VAL A 149 8.619 1.457 -5.290 1.00 6.22 H new ATOM 0 HG22 VAL A 149 7.245 2.473 -4.793 1.00 6.22 H new ATOM 0 HG23 VAL A 149 7.968 2.681 -6.406 1.00 6.22 H new ATOM 2216 N SER A 150 6.647 5.566 -6.141 1.00 6.89 N ATOM 2217 CA SER A 150 5.910 6.044 -7.296 1.00 7.82 C ATOM 2218 C SER A 150 4.658 6.774 -6.830 1.00 8.09 C ATOM 2219 O SER A 150 3.754 6.154 -6.264 1.00 8.72 O ATOM 2220 CB SER A 150 5.541 4.895 -8.247 1.00 8.62 C ATOM 2221 OG SER A 150 4.794 5.352 -9.361 1.00 9.06 O ATOM 0 H SER A 150 6.094 5.525 -5.285 1.00 6.89 H new ATOM 0 HA SER A 150 6.548 6.731 -7.852 1.00 7.82 H new ATOM 0 HB2 SER A 150 6.450 4.406 -8.596 1.00 8.62 H new ATOM 0 HB3 SER A 150 4.964 4.146 -7.705 1.00 8.62 H new ATOM 0 HG SER A 150 4.314 4.599 -9.764 1.00 9.06 H new ATOM 2227 N GLY A 151 4.612 8.083 -7.033 1.00 7.84 N ATOM 2228 CA GLY A 151 3.455 8.851 -6.613 1.00 8.31 C ATOM 2229 C GLY A 151 2.304 8.726 -7.590 1.00 8.50 C ATOM 2230 O GLY A 151 1.998 7.628 -8.063 1.00 8.43 O ATOM 0 H GLY A 151 5.351 8.626 -7.479 1.00 7.84 H new ATOM 0 HA2 GLY A 151 3.133 8.512 -5.628 1.00 8.31 H new ATOM 0 HA3 GLY A 151 3.733 9.900 -6.513 1.00 8.31 H new ATOM 2234 N GLN A 152 1.662 9.845 -7.884 1.00 8.97 N ATOM 2235 CA GLN A 152 0.612 9.872 -8.887 1.00 9.41 C ATOM 2236 C GLN A 152 1.107 10.584 -10.139 1.00 9.73 C ATOM 2237 O GLN A 152 1.531 11.742 -10.095 1.00 9.97 O ATOM 2238 CB GLN A 152 -0.658 10.544 -8.349 1.00 10.01 C ATOM 2239 CG GLN A 152 -0.457 11.967 -7.855 1.00 10.63 C ATOM 2240 CD GLN A 152 -1.763 12.657 -7.516 1.00 11.38 C ATOM 2241 OE1 GLN A 152 -2.804 12.377 -8.113 1.00 11.71 O ATOM 2242 NE2 GLN A 152 -1.720 13.568 -6.560 1.00 11.84 N ATOM 0 H GLN A 152 1.850 10.745 -7.443 1.00 8.97 H new ATOM 0 HA GLN A 152 0.357 8.843 -9.141 1.00 9.41 H new ATOM 0 HB2 GLN A 152 -1.412 10.549 -9.136 1.00 10.01 H new ATOM 0 HB3 GLN A 152 -1.054 9.942 -7.532 1.00 10.01 H new ATOM 0 HG2 GLN A 152 0.182 11.954 -6.972 1.00 10.63 H new ATOM 0 HG3 GLN A 152 0.066 12.542 -8.619 1.00 10.63 H new ATOM 0 HE21 GLN A 152 -0.839 13.772 -6.089 1.00 11.84 H new ATOM 0 HE22 GLN A 152 -2.568 14.067 -6.293 1.00 11.84 H new ATOM 2251 N PHE A 153 1.088 9.869 -11.247 1.00 9.95 N ATOM 2252 CA PHE A 153 1.526 10.417 -12.516 1.00 10.47 C ATOM 2253 C PHE A 153 0.328 10.591 -13.434 1.00 10.93 C ATOM 2254 O PHE A 153 -0.193 9.613 -13.975 1.00 11.34 O ATOM 2255 CB PHE A 153 2.557 9.490 -13.170 1.00 10.62 C ATOM 2256 CG PHE A 153 3.813 9.309 -12.362 1.00 11.04 C ATOM 2257 CD1 PHE A 153 3.885 8.332 -11.385 1.00 11.27 C ATOM 2258 CD2 PHE A 153 4.921 10.113 -12.582 1.00 11.41 C ATOM 2259 CE1 PHE A 153 5.037 8.159 -10.640 1.00 11.87 C ATOM 2260 CE2 PHE A 153 6.073 9.945 -11.841 1.00 12.02 C ATOM 2261 CZ PHE A 153 6.135 8.978 -10.870 1.00 12.24 C ATOM 0 H PHE A 153 0.772 8.900 -11.294 1.00 9.95 H new ATOM 0 HA PHE A 153 1.993 11.386 -12.342 1.00 10.47 H new ATOM 0 HB2 PHE A 153 2.100 8.515 -13.336 1.00 10.62 H new ATOM 0 HB3 PHE A 153 2.821 9.890 -14.149 1.00 10.62 H new ATOM 0 HD1 PHE A 153 3.031 7.697 -11.202 1.00 11.27 H new ATOM 0 HD2 PHE A 153 4.882 10.879 -13.342 1.00 11.41 H new ATOM 0 HE1 PHE A 153 5.083 7.390 -9.883 1.00 11.87 H new ATOM 0 HE2 PHE A 153 6.929 10.577 -12.026 1.00 12.02 H new ATOM 0 HZ PHE A 153 7.035 8.854 -10.286 1.00 12.24 H new ATOM 2271 N LEU A 154 -0.122 11.828 -13.600 1.00 11.05 N ATOM 2272 CA LEU A 154 -1.277 12.106 -14.443 1.00 11.63 C ATOM 2273 C LEU A 154 -0.869 12.121 -15.910 1.00 11.39 C ATOM 2274 O LEU A 154 -0.959 13.142 -16.593 1.00 11.57 O ATOM 2275 CB LEU A 154 -1.965 13.427 -14.063 1.00 12.16 C ATOM 2276 CG LEU A 154 -2.727 13.422 -12.731 1.00 12.68 C ATOM 2277 CD1 LEU A 154 -1.772 13.367 -11.546 1.00 13.16 C ATOM 2278 CD2 LEU A 154 -3.627 14.643 -12.635 1.00 13.04 C ATOM 0 H LEU A 154 0.293 12.651 -13.164 1.00 11.05 H new ATOM 0 HA LEU A 154 -2.000 11.306 -14.281 1.00 11.63 H new ATOM 0 HB2 LEU A 154 -1.209 14.211 -14.025 1.00 12.16 H new ATOM 0 HB3 LEU A 154 -2.661 13.694 -14.858 1.00 12.16 H new ATOM 0 HG LEU A 154 -3.346 12.525 -12.700 1.00 12.68 H new ATOM 0 HD11 LEU A 154 -2.344 13.365 -10.618 1.00 13.16 H new ATOM 0 HD12 LEU A 154 -1.171 12.459 -11.605 1.00 13.16 H new ATOM 0 HD13 LEU A 154 -1.116 14.238 -11.566 1.00 13.16 H new ATOM 0 HD21 LEU A 154 -4.162 14.627 -11.685 1.00 13.04 H new ATOM 0 HD22 LEU A 154 -3.021 15.547 -12.695 1.00 13.04 H new ATOM 0 HD23 LEU A 154 -4.344 14.632 -13.456 1.00 13.04 H new ATOM 2290 N ILE A 155 -0.418 10.973 -16.380 1.00 11.17 N ATOM 2291 CA ILE A 155 -0.042 10.795 -17.768 1.00 11.08 C ATOM 2292 C ILE A 155 -0.686 9.528 -18.317 1.00 10.31 C ATOM 2293 O ILE A 155 -0.060 8.768 -19.054 1.00 9.93 O ATOM 2294 CB ILE A 155 1.494 10.717 -17.940 1.00 11.39 C ATOM 2295 CG1 ILE A 155 2.091 9.680 -16.979 1.00 11.61 C ATOM 2296 CG2 ILE A 155 2.126 12.086 -17.723 1.00 11.66 C ATOM 2297 CD1 ILE A 155 3.596 9.540 -17.088 1.00 11.95 C ATOM 0 H ILE A 155 -0.302 10.137 -15.808 1.00 11.17 H new ATOM 0 HA ILE A 155 -0.397 11.663 -18.324 1.00 11.08 H new ATOM 0 HB ILE A 155 1.713 10.400 -18.960 1.00 11.39 H new ATOM 0 HG12 ILE A 155 1.834 9.956 -15.956 1.00 11.61 H new ATOM 0 HG13 ILE A 155 1.630 8.711 -17.173 1.00 11.61 H new ATOM 0 HG21 ILE A 155 3.206 12.012 -17.848 1.00 11.66 H new ATOM 0 HG22 ILE A 155 1.724 12.792 -18.450 1.00 11.66 H new ATOM 0 HG23 ILE A 155 1.900 12.435 -16.715 1.00 11.66 H new ATOM 0 HD11 ILE A 155 3.944 8.789 -16.378 1.00 11.95 H new ATOM 0 HD12 ILE A 155 3.861 9.233 -18.100 1.00 11.95 H new ATOM 0 HD13 ILE A 155 4.068 10.497 -16.864 1.00 11.95 H new ATOM 2309 N ASP A 156 -1.947 9.308 -17.946 1.00 10.31 N ATOM 2310 CA ASP A 156 -2.655 8.086 -18.323 1.00 9.81 C ATOM 2311 C ASP A 156 -2.686 7.916 -19.832 1.00 9.63 C ATOM 2312 O ASP A 156 -2.629 6.786 -20.316 1.00 9.09 O ATOM 2313 CB ASP A 156 -4.082 8.060 -17.769 1.00 10.26 C ATOM 2314 CG ASP A 156 -4.128 8.021 -16.256 1.00 10.68 C ATOM 2315 OD1 ASP A 156 -4.033 9.094 -15.623 1.00 10.64 O1- ATOM 2316 OD2 ASP A 156 -4.249 6.912 -15.690 1.00 11.22 O ATOM 0 H ASP A 156 -2.498 9.959 -17.386 1.00 10.31 H new ATOM 0 HA ASP A 156 -2.104 7.254 -17.883 1.00 9.81 H new ATOM 0 HB2 ASP A 156 -4.619 8.941 -18.121 1.00 10.26 H new ATOM 0 HB3 ASP A 156 -4.604 7.189 -18.166 1.00 10.26 H new ATOM 2321 N SER A 157 -2.778 9.000 -20.580 1.00 10.26 N ATOM 2322 CA SER A 157 -2.798 8.896 -22.029 1.00 10.38 C ATOM 2323 C SER A 157 -1.523 8.212 -22.512 1.00 9.63 C ATOM 2324 O SER A 157 -1.568 7.133 -23.121 1.00 9.37 O ATOM 2325 CB SER A 157 -2.946 10.282 -22.657 1.00 11.42 C ATOM 2326 OG SER A 157 -4.053 10.975 -22.095 1.00 11.90 O ATOM 0 H SER A 157 -2.839 9.951 -20.216 1.00 10.26 H new ATOM 0 HA SER A 157 -3.653 8.294 -22.336 1.00 10.38 H new ATOM 0 HB2 SER A 157 -2.033 10.857 -22.500 1.00 11.42 H new ATOM 0 HB3 SER A 157 -3.080 10.186 -23.734 1.00 11.42 H new ATOM 0 HG SER A 157 -4.129 11.860 -22.509 1.00 11.90 H new ATOM 2332 N GLU A 158 -0.395 8.821 -22.163 1.00 9.47 N ATOM 2333 CA GLU A 158 0.922 8.301 -22.506 1.00 9.00 C ATOM 2334 C GLU A 158 1.088 6.879 -21.978 1.00 8.03 C ATOM 2335 O GLU A 158 1.606 5.998 -22.660 1.00 7.69 O ATOM 2336 CB GLU A 158 1.999 9.203 -21.897 1.00 9.38 C ATOM 2337 CG GLU A 158 3.396 8.929 -22.421 1.00 10.19 C ATOM 2338 CD GLU A 158 3.536 9.281 -23.886 1.00 10.79 C ATOM 2339 OE1 GLU A 158 3.820 10.459 -24.193 1.00 11.17 O1- ATOM 2340 OE2 GLU A 158 3.357 8.389 -24.738 1.00 11.06 O ATOM 0 H GLU A 158 -0.369 9.692 -21.633 1.00 9.47 H new ATOM 0 HA GLU A 158 1.024 8.285 -23.591 1.00 9.00 H new ATOM 0 HB2 GLU A 158 1.744 10.244 -22.097 1.00 9.38 H new ATOM 0 HB3 GLU A 158 1.996 9.077 -20.814 1.00 9.38 H new ATOM 0 HG2 GLU A 158 4.119 9.502 -21.841 1.00 10.19 H new ATOM 0 HG3 GLU A 158 3.636 7.875 -22.278 1.00 10.19 H new ATOM 2347 N ALA A 159 0.617 6.673 -20.753 1.00 7.82 N ATOM 2348 CA ALA A 159 0.726 5.390 -20.073 1.00 7.20 C ATOM 2349 C ALA A 159 -0.051 4.301 -20.797 1.00 7.12 C ATOM 2350 O ALA A 159 0.351 3.137 -20.798 1.00 6.81 O ATOM 2351 CB ALA A 159 0.230 5.520 -18.643 1.00 7.44 C ATOM 0 H ALA A 159 0.148 7.393 -20.204 1.00 7.82 H new ATOM 0 HA ALA A 159 1.777 5.101 -20.071 1.00 7.20 H new ATOM 0 HB1 ALA A 159 0.314 4.557 -18.140 1.00 7.44 H new ATOM 0 HB2 ALA A 159 0.832 6.259 -18.115 1.00 7.44 H new ATOM 0 HB3 ALA A 159 -0.813 5.837 -18.647 1.00 7.44 H new ATOM 2357 N SER A 160 -1.166 4.678 -21.399 1.00 7.72 N ATOM 2358 CA SER A 160 -1.974 3.745 -22.166 1.00 8.04 C ATOM 2359 C SER A 160 -1.274 3.414 -23.481 1.00 7.99 C ATOM 2360 O SER A 160 -1.296 2.279 -23.956 1.00 8.08 O ATOM 2361 CB SER A 160 -3.354 4.354 -22.427 1.00 8.99 C ATOM 2362 OG SER A 160 -4.238 3.411 -23.016 1.00 9.64 O ATOM 0 H SER A 160 -1.534 5.629 -21.371 1.00 7.72 H new ATOM 0 HA SER A 160 -2.101 2.822 -21.600 1.00 8.04 H new ATOM 0 HB2 SER A 160 -3.777 4.714 -21.489 1.00 8.99 H new ATOM 0 HB3 SER A 160 -3.253 5.218 -23.083 1.00 8.99 H new ATOM 0 HG SER A 160 -5.110 3.831 -23.168 1.00 9.64 H new ATOM 2368 N LEU A 161 -0.635 4.437 -24.045 1.00 8.10 N ATOM 2369 CA LEU A 161 0.051 4.333 -25.324 1.00 8.40 C ATOM 2370 C LEU A 161 1.319 3.500 -25.201 1.00 7.89 C ATOM 2371 O LEU A 161 1.668 2.741 -26.102 1.00 8.18 O ATOM 2372 CB LEU A 161 0.403 5.730 -25.834 1.00 9.04 C ATOM 2373 CG LEU A 161 -0.776 6.689 -25.995 1.00 9.80 C ATOM 2374 CD1 LEU A 161 -0.297 8.035 -26.509 1.00 10.57 C ATOM 2375 CD2 LEU A 161 -1.825 6.101 -26.927 1.00 10.37 C ATOM 0 H LEU A 161 -0.580 5.364 -23.623 1.00 8.10 H new ATOM 0 HA LEU A 161 -0.616 3.839 -26.030 1.00 8.40 H new ATOM 0 HB2 LEU A 161 1.122 6.178 -25.148 1.00 9.04 H new ATOM 0 HB3 LEU A 161 0.902 5.631 -26.798 1.00 9.04 H new ATOM 0 HG LEU A 161 -1.235 6.836 -25.018 1.00 9.80 H new ATOM 0 HD11 LEU A 161 -1.148 8.707 -26.618 1.00 10.57 H new ATOM 0 HD12 LEU A 161 0.414 8.462 -25.802 1.00 10.57 H new ATOM 0 HD13 LEU A 161 0.188 7.903 -27.476 1.00 10.57 H new ATOM 0 HD21 LEU A 161 -2.655 6.800 -27.027 1.00 10.37 H new ATOM 0 HD22 LEU A 161 -1.382 5.921 -27.906 1.00 10.37 H new ATOM 0 HD23 LEU A 161 -2.191 5.160 -26.516 1.00 10.37 H new ATOM 2387 N ARG A 162 2.024 3.676 -24.089 1.00 7.38 N ATOM 2388 CA ARG A 162 3.248 2.944 -23.829 1.00 7.17 C ATOM 2389 C ARG A 162 2.937 1.545 -23.321 1.00 6.87 C ATOM 2390 O ARG A 162 3.624 0.587 -23.672 1.00 6.95 O ATOM 2391 CB ARG A 162 4.096 3.697 -22.807 1.00 7.15 C ATOM 2392 CG ARG A 162 3.528 3.741 -21.406 1.00 7.34 C ATOM 2393 CD ARG A 162 4.313 4.711 -20.538 1.00 7.40 C ATOM 2394 NE ARG A 162 3.842 4.736 -19.155 1.00 7.84 N ATOM 2395 CZ ARG A 162 4.079 5.744 -18.315 1.00 8.24 C ATOM 2396 NH1 ARG A 162 4.809 6.783 -18.709 1.00 8.25 N1+ ATOM 2397 NH2 ARG A 162 3.598 5.703 -17.078 1.00 8.90 N ATOM 0 H ARG A 162 1.761 4.327 -23.349 1.00 7.38 H new ATOM 0 HA ARG A 162 3.806 2.856 -24.761 1.00 7.17 H new ATOM 0 HB2 ARG A 162 5.083 3.236 -22.767 1.00 7.15 H new ATOM 0 HB3 ARG A 162 4.236 4.720 -23.157 1.00 7.15 H new ATOM 0 HG2 ARG A 162 2.481 4.043 -21.442 1.00 7.34 H new ATOM 0 HG3 ARG A 162 3.558 2.745 -20.965 1.00 7.34 H new ATOM 0 HD2 ARG A 162 5.367 4.435 -20.554 1.00 7.40 H new ATOM 0 HD3 ARG A 162 4.239 5.713 -20.961 1.00 7.40 H new ATOM 0 HE ARG A 162 3.303 3.940 -18.814 1.00 7.84 H new ATOM 0 HH11 ARG A 162 5.189 6.810 -19.655 1.00 8.25 H new ATOM 0 HH12 ARG A 162 4.989 7.553 -18.065 1.00 8.25 H new ATOM 0 HH21 ARG A 162 3.048 4.901 -16.771 1.00 8.90 H new ATOM 0 HH22 ARG A 162 3.779 6.474 -16.435 1.00 8.90 H new ATOM 2411 N GLY A 163 1.923 1.428 -22.483 1.00 6.89 N ATOM 2412 CA GLY A 163 1.627 0.155 -21.877 1.00 7.01 C ATOM 2413 C GLY A 163 2.455 -0.085 -20.630 1.00 6.68 C ATOM 2414 O GLY A 163 1.907 -0.287 -19.547 1.00 7.15 O ATOM 0 H GLY A 163 1.302 2.191 -22.213 1.00 6.89 H new ATOM 0 HA2 GLY A 163 0.568 0.112 -21.623 1.00 7.01 H new ATOM 0 HA3 GLY A 163 1.815 -0.642 -22.596 1.00 7.01 H new ATOM 2418 N THR A 164 3.778 -0.033 -20.788 1.00 6.17 N ATOM 2419 CA THR A 164 4.726 -0.310 -19.706 1.00 6.16 C ATOM 2420 C THR A 164 4.335 -1.558 -18.923 1.00 6.65 C ATOM 2421 O THR A 164 3.948 -1.476 -17.758 1.00 7.09 O ATOM 2422 CB THR A 164 4.912 0.897 -18.755 1.00 6.38 C ATOM 2423 OG1 THR A 164 3.681 1.610 -18.583 1.00 6.86 O ATOM 2424 CG2 THR A 164 5.980 1.837 -19.292 1.00 6.23 C ATOM 0 H THR A 164 4.225 0.203 -21.674 1.00 6.17 H new ATOM 0 HA THR A 164 5.688 -0.494 -20.184 1.00 6.16 H new ATOM 0 HB THR A 164 5.229 0.513 -17.785 1.00 6.38 H new ATOM 0 HG1 THR A 164 2.971 0.981 -18.337 1.00 6.86 H new ATOM 0 HG21 THR A 164 6.098 2.680 -18.611 1.00 6.23 H new ATOM 0 HG22 THR A 164 6.926 1.303 -19.376 1.00 6.23 H new ATOM 0 HG23 THR A 164 5.682 2.203 -20.275 1.00 6.23 H new ATOM 2432 N VAL A 165 4.428 -2.703 -19.612 1.00 6.89 N ATOM 2433 CA VAL A 165 4.068 -4.031 -19.084 1.00 7.69 C ATOM 2434 C VAL A 165 2.703 -4.048 -18.392 1.00 7.93 C ATOM 2435 O VAL A 165 2.472 -4.834 -17.473 1.00 8.39 O ATOM 2436 CB VAL A 165 5.157 -4.648 -18.161 1.00 8.39 C ATOM 2437 CG1 VAL A 165 6.475 -4.769 -18.908 1.00 9.20 C ATOM 2438 CG2 VAL A 165 5.351 -3.866 -16.867 1.00 8.56 C ATOM 0 H VAL A 165 4.763 -2.735 -20.575 1.00 6.89 H new ATOM 0 HA VAL A 165 4.000 -4.665 -19.968 1.00 7.69 H new ATOM 0 HB VAL A 165 4.805 -5.640 -17.879 1.00 8.39 H new ATOM 0 HG11 VAL A 165 7.228 -5.202 -18.250 1.00 9.20 H new ATOM 0 HG12 VAL A 165 6.342 -5.411 -19.779 1.00 9.20 H new ATOM 0 HG13 VAL A 165 6.802 -3.781 -19.232 1.00 9.20 H new ATOM 0 HG21 VAL A 165 6.123 -4.345 -16.265 1.00 8.56 H new ATOM 0 HG22 VAL A 165 5.654 -2.845 -17.101 1.00 8.56 H new ATOM 0 HG23 VAL A 165 4.415 -3.848 -16.309 1.00 8.56 H new ATOM 2448 N ALA A 166 1.799 -3.190 -18.870 1.00 7.88 N ATOM 2449 CA ALA A 166 0.419 -3.147 -18.392 1.00 8.33 C ATOM 2450 C ALA A 166 0.351 -2.886 -16.888 1.00 8.94 C ATOM 2451 O ALA A 166 1.231 -2.234 -16.320 1.00 9.11 O ATOM 2452 CB ALA A 166 -0.301 -4.444 -18.752 1.00 8.31 C ATOM 0 H ALA A 166 2.005 -2.507 -19.599 1.00 7.88 H new ATOM 0 HA ALA A 166 -0.084 -2.316 -18.886 1.00 8.33 H new ATOM 0 HB1 ALA A 166 -1.329 -4.402 -18.391 1.00 8.31 H new ATOM 0 HB2 ALA A 166 -0.301 -4.572 -19.835 1.00 8.31 H new ATOM 0 HB3 ALA A 166 0.212 -5.286 -18.288 1.00 8.31 H new ATOM 2458 N ARG A 167 -0.705 -3.374 -16.247 1.00 9.50 N ATOM 2459 CA ARG A 167 -0.853 -3.231 -14.805 1.00 10.31 C ATOM 2460 C ARG A 167 0.215 -4.058 -14.102 1.00 10.80 C ATOM 2461 O ARG A 167 0.750 -3.668 -13.064 1.00 11.13 O ATOM 2462 CB ARG A 167 -2.266 -3.663 -14.383 1.00 10.89 C ATOM 2463 CG ARG A 167 -2.692 -3.145 -13.017 1.00 11.67 C ATOM 2464 CD ARG A 167 -2.082 -3.951 -11.888 1.00 12.28 C ATOM 2465 NE ARG A 167 -2.815 -5.189 -11.632 1.00 13.07 N ATOM 2466 CZ ARG A 167 -2.434 -6.117 -10.754 1.00 13.78 C ATOM 2467 NH1 ARG A 167 -1.301 -5.974 -10.075 1.00 13.81 N1+ ATOM 2468 NH2 ARG A 167 -3.180 -7.196 -10.564 1.00 14.58 N ATOM 0 H ARG A 167 -1.470 -3.871 -16.703 1.00 9.50 H new ATOM 0 HA ARG A 167 -0.721 -2.188 -14.518 1.00 10.31 H new ATOM 0 HB2 ARG A 167 -2.979 -3.315 -15.130 1.00 10.89 H new ATOM 0 HB3 ARG A 167 -2.315 -4.752 -14.378 1.00 10.89 H new ATOM 0 HG2 ARG A 167 -2.397 -2.101 -12.917 1.00 11.67 H new ATOM 0 HG3 ARG A 167 -3.779 -3.178 -12.940 1.00 11.67 H new ATOM 0 HD2 ARG A 167 -1.046 -4.188 -12.132 1.00 12.28 H new ATOM 0 HD3 ARG A 167 -2.065 -3.347 -10.981 1.00 12.28 H new ATOM 0 HE ARG A 167 -3.673 -5.354 -12.159 1.00 13.07 H new ATOM 0 HH11 ARG A 167 -0.717 -5.151 -10.224 1.00 13.81 H new ATOM 0 HH12 ARG A 167 -1.015 -6.687 -9.405 1.00 13.81 H new ATOM 0 HH21 ARG A 167 -4.046 -7.316 -11.090 1.00 14.58 H new ATOM 0 HH22 ARG A 167 -2.888 -7.906 -9.892 1.00 14.58 H new ATOM 2482 N MET A 168 0.523 -5.191 -14.699 1.00 11.01 N ATOM 2483 CA MET A 168 1.514 -6.121 -14.168 1.00 11.55 C ATOM 2484 C MET A 168 1.992 -7.079 -15.254 1.00 11.86 C ATOM 2485 O MET A 168 1.378 -7.181 -16.319 1.00 11.94 O ATOM 2486 CB MET A 168 0.949 -6.903 -12.971 1.00 11.57 C ATOM 2487 CG MET A 168 -0.473 -7.424 -13.147 1.00 11.64 C ATOM 2488 SD MET A 168 -0.657 -8.618 -14.485 1.00 11.27 S ATOM 2489 CE MET A 168 -1.671 -7.682 -15.628 1.00 10.38 C ATOM 0 H MET A 168 0.094 -5.500 -15.571 1.00 11.01 H new ATOM 0 HA MET A 168 2.368 -5.539 -13.822 1.00 11.55 H new ATOM 0 HB2 MET A 168 1.606 -7.749 -12.768 1.00 11.57 H new ATOM 0 HB3 MET A 168 0.977 -6.259 -12.092 1.00 11.57 H new ATOM 0 HG2 MET A 168 -0.798 -7.886 -12.215 1.00 11.64 H new ATOM 0 HG3 MET A 168 -1.138 -6.580 -13.333 1.00 11.64 H new ATOM 0 HE1 MET A 168 -2.272 -8.367 -16.226 1.00 10.38 H new ATOM 0 HE2 MET A 168 -2.328 -7.015 -15.070 1.00 10.38 H new ATOM 0 HE3 MET A 168 -1.030 -7.093 -16.285 1.00 10.38 H new ATOM 2499 N GLN A 169 3.088 -7.776 -14.987 1.00 12.22 N ATOM 2500 CA GLN A 169 3.649 -8.715 -15.950 1.00 12.70 C ATOM 2501 C GLN A 169 3.660 -10.132 -15.379 1.00 12.99 C ATOM 2502 O GLN A 169 3.748 -11.122 -16.105 1.00 13.33 O ATOM 2503 CB GLN A 169 5.069 -8.291 -16.331 1.00 13.10 C ATOM 2504 CG GLN A 169 5.733 -9.214 -17.343 1.00 13.81 C ATOM 2505 CD GLN A 169 4.968 -9.298 -18.650 1.00 14.46 C ATOM 2506 OE1 GLN A 169 4.348 -8.331 -19.088 1.00 14.64 O ATOM 2507 NE2 GLN A 169 4.985 -10.469 -19.270 1.00 14.99 N ATOM 0 H GLN A 169 3.607 -7.709 -14.111 1.00 12.22 H new ATOM 0 HA GLN A 169 3.024 -8.708 -16.843 1.00 12.70 H new ATOM 0 HB2 GLN A 169 5.040 -7.281 -16.739 1.00 13.10 H new ATOM 0 HB3 GLN A 169 5.681 -8.254 -15.430 1.00 13.10 H new ATOM 0 HG2 GLN A 169 6.745 -8.861 -17.541 1.00 13.81 H new ATOM 0 HG3 GLN A 169 5.822 -10.212 -16.914 1.00 13.81 H new ATOM 0 HE21 GLN A 169 5.512 -11.248 -18.875 1.00 14.99 H new ATOM 0 HE22 GLN A 169 4.471 -10.591 -20.143 1.00 14.99 H new ATOM 2516 N GLU A 170 3.544 -10.179 -14.050 1.00 13.03 N ATOM 2517 CA GLU A 170 3.511 -11.414 -13.268 1.00 13.47 C ATOM 2518 C GLU A 170 2.629 -12.467 -13.922 1.00 13.57 C ATOM 2519 O GLU A 170 3.094 -13.534 -14.303 1.00 13.95 O ATOM 2520 CB GLU A 170 2.998 -11.111 -11.854 1.00 14.04 C ATOM 2521 CG GLU A 170 3.908 -10.198 -11.040 1.00 14.40 C ATOM 2522 CD GLU A 170 3.803 -8.737 -11.436 1.00 14.65 C ATOM 2523 OE1 GLU A 170 4.502 -8.310 -12.382 1.00 15.01 O1- ATOM 2524 OE2 GLU A 170 3.016 -8.007 -10.802 1.00 14.64 O ATOM 0 H GLU A 170 3.469 -9.339 -13.476 1.00 13.03 H new ATOM 0 HA GLU A 170 4.525 -11.812 -13.219 1.00 13.47 H new ATOM 0 HB2 GLU A 170 2.013 -10.651 -11.928 1.00 14.04 H new ATOM 0 HB3 GLU A 170 2.871 -12.051 -11.317 1.00 14.04 H new ATOM 0 HG2 GLU A 170 3.661 -10.299 -9.983 1.00 14.40 H new ATOM 0 HG3 GLU A 170 4.941 -10.526 -11.159 1.00 14.40 H new ATOM 2531 N THR A 171 1.340 -12.158 -14.024 1.00 13.39 N ATOM 2532 CA THR A 171 0.358 -13.116 -14.505 1.00 13.67 C ATOM 2533 C THR A 171 0.232 -13.074 -16.021 1.00 13.64 C ATOM 2534 O THR A 171 -0.631 -13.737 -16.596 1.00 13.80 O ATOM 2535 CB THR A 171 -1.018 -12.864 -13.869 1.00 13.90 C ATOM 2536 OG1 THR A 171 -1.425 -11.510 -14.094 1.00 13.68 O ATOM 2537 CG2 THR A 171 -0.985 -13.143 -12.373 1.00 14.25 C ATOM 0 H THR A 171 0.953 -11.247 -13.778 1.00 13.39 H new ATOM 0 HA THR A 171 0.710 -14.105 -14.213 1.00 13.67 H new ATOM 0 HB THR A 171 -1.734 -13.541 -14.335 1.00 13.90 H new ATOM 0 HG1 THR A 171 -0.695 -11.016 -14.522 1.00 13.68 H new ATOM 0 HG21 THR A 171 -1.971 -12.957 -11.946 1.00 14.25 H new ATOM 0 HG22 THR A 171 -0.706 -14.183 -12.203 1.00 14.25 H new ATOM 0 HG23 THR A 171 -0.254 -12.489 -11.897 1.00 14.25 H new ATOM 2545 N THR A 172 1.075 -12.272 -16.656 1.00 13.61 N ATOM 2546 CA THR A 172 1.148 -12.221 -18.101 1.00 13.78 C ATOM 2547 C THR A 172 2.195 -13.221 -18.586 1.00 14.39 C ATOM 2548 O THR A 172 2.050 -13.845 -19.638 1.00 14.89 O ATOM 2549 CB THR A 172 1.516 -10.805 -18.574 1.00 13.53 C ATOM 2550 OG1 THR A 172 0.759 -9.835 -17.833 1.00 13.57 O ATOM 2551 CG2 THR A 172 1.233 -10.640 -20.054 1.00 13.88 C ATOM 0 H THR A 172 1.723 -11.643 -16.182 1.00 13.61 H new ATOM 0 HA THR A 172 0.174 -12.478 -18.516 1.00 13.78 H new ATOM 0 HB THR A 172 2.582 -10.652 -18.403 1.00 13.53 H new ATOM 0 HG1 THR A 172 0.997 -8.934 -18.136 1.00 13.57 H new ATOM 0 HG21 THR A 172 1.501 -9.630 -20.365 1.00 13.88 H new ATOM 0 HG22 THR A 172 1.821 -11.363 -20.620 1.00 13.88 H new ATOM 0 HG23 THR A 172 0.173 -10.808 -20.243 1.00 13.88 H new ATOM 2559 N SER A 173 3.249 -13.358 -17.797 1.00 14.50 N ATOM 2560 CA SER A 173 4.260 -14.369 -18.026 1.00 15.21 C ATOM 2561 C SER A 173 3.789 -15.697 -17.432 1.00 15.64 C ATOM 2562 O SER A 173 3.033 -16.429 -18.076 1.00 15.85 O ATOM 2563 CB SER A 173 5.581 -13.925 -17.392 1.00 15.46 C ATOM 2564 OG SER A 173 5.997 -12.665 -17.895 1.00 15.55 O ATOM 0 H SER A 173 3.424 -12.771 -16.982 1.00 14.50 H new ATOM 0 HA SER A 173 4.420 -14.502 -19.096 1.00 15.21 H new ATOM 0 HB2 SER A 173 5.466 -13.867 -16.310 1.00 15.46 H new ATOM 0 HB3 SER A 173 6.351 -14.670 -17.591 1.00 15.46 H new ATOM 0 HG SER A 173 6.108 -12.721 -18.867 1.00 15.55 H new ATOM 2570 N GLY A 174 4.205 -15.998 -16.207 1.00 15.94 N ATOM 2571 CA GLY A 174 3.827 -17.250 -15.582 1.00 16.51 C ATOM 2572 C GLY A 174 4.544 -18.447 -16.187 1.00 16.95 C ATOM 2573 O GLY A 174 5.403 -19.047 -15.547 1.00 17.54 O ATOM 0 H GLY A 174 4.798 -15.396 -15.636 1.00 15.94 H new ATOM 0 HA2 GLY A 174 4.047 -17.200 -14.516 1.00 16.51 H new ATOM 0 HA3 GLY A 174 2.750 -17.389 -15.679 1.00 16.51 H new ATOM 2577 N LEU A 175 4.187 -18.784 -17.426 1.00 16.81 N ATOM 2578 CA LEU A 175 4.748 -19.939 -18.126 1.00 17.34 C ATOM 2579 C LEU A 175 4.458 -21.235 -17.371 1.00 17.70 C ATOM 2580 O LEU A 175 5.182 -22.222 -17.500 1.00 17.85 O ATOM 2581 CB LEU A 175 6.253 -19.762 -18.336 1.00 17.29 C ATOM 2582 CG LEU A 175 6.672 -18.944 -19.568 1.00 17.29 C ATOM 2583 CD1 LEU A 175 6.156 -19.589 -20.843 1.00 17.42 C ATOM 2584 CD2 LEU A 175 6.184 -17.507 -19.465 1.00 17.14 C ATOM 0 H LEU A 175 3.501 -18.264 -17.973 1.00 16.81 H new ATOM 0 HA LEU A 175 4.268 -20.006 -19.103 1.00 17.34 H new ATOM 0 HB2 LEU A 175 6.669 -19.284 -17.449 1.00 17.29 H new ATOM 0 HB3 LEU A 175 6.708 -20.750 -18.409 1.00 17.29 H new ATOM 0 HG LEU A 175 7.761 -18.930 -19.603 1.00 17.29 H new ATOM 0 HD11 LEU A 175 6.464 -18.994 -21.702 1.00 17.42 H new ATOM 0 HD12 LEU A 175 6.565 -20.595 -20.933 1.00 17.42 H new ATOM 0 HD13 LEU A 175 5.068 -19.642 -20.809 1.00 17.42 H new ATOM 0 HD21 LEU A 175 6.495 -16.953 -20.350 1.00 17.14 H new ATOM 0 HD22 LEU A 175 5.096 -17.496 -19.394 1.00 17.14 H new ATOM 0 HD23 LEU A 175 6.610 -17.041 -18.577 1.00 17.14 H new ATOM 2596 N GLU A 176 3.392 -21.218 -16.583 1.00 17.97 N ATOM 2597 CA GLU A 176 2.968 -22.387 -15.829 1.00 18.46 C ATOM 2598 C GLU A 176 1.466 -22.325 -15.569 1.00 18.48 C ATOM 2599 O GLU A 176 1.008 -22.385 -14.428 1.00 18.35 O ATOM 2600 CB GLU A 176 3.747 -22.505 -14.514 1.00 18.91 C ATOM 2601 CG GLU A 176 3.734 -21.240 -13.669 1.00 19.00 C ATOM 2602 CD GLU A 176 4.467 -21.416 -12.359 1.00 19.35 C ATOM 2603 OE1 GLU A 176 3.853 -21.908 -11.387 1.00 19.40 O1- ATOM 2604 OE2 GLU A 176 5.660 -21.061 -12.294 1.00 19.67 O ATOM 0 H GLU A 176 2.800 -20.398 -16.449 1.00 17.97 H new ATOM 0 HA GLU A 176 3.182 -23.277 -16.420 1.00 18.46 H new ATOM 0 HB2 GLU A 176 3.329 -23.324 -13.929 1.00 18.91 H new ATOM 0 HB3 GLU A 176 4.781 -22.768 -14.739 1.00 18.91 H new ATOM 0 HG2 GLU A 176 4.191 -20.426 -14.231 1.00 19.00 H new ATOM 0 HG3 GLU A 176 2.702 -20.950 -13.469 1.00 19.00 H new ATOM 2611 N VAL A 177 0.704 -22.193 -16.641 1.00 18.75 N ATOM 2612 CA VAL A 177 -0.747 -22.148 -16.542 1.00 18.92 C ATOM 2613 C VAL A 177 -1.373 -23.129 -17.538 1.00 19.38 C ATOM 2614 O VAL A 177 -2.589 -23.333 -17.569 1.00 19.52 O ATOM 2615 CB VAL A 177 -1.275 -20.710 -16.783 1.00 18.88 C ATOM 2616 CG1 VAL A 177 -1.102 -20.295 -18.236 1.00 19.38 C ATOM 2617 CG2 VAL A 177 -2.726 -20.577 -16.342 1.00 18.51 C ATOM 0 H VAL A 177 1.065 -22.115 -17.592 1.00 18.75 H new ATOM 0 HA VAL A 177 -1.034 -22.444 -15.533 1.00 18.92 H new ATOM 0 HB VAL A 177 -0.678 -20.032 -16.173 1.00 18.88 H new ATOM 0 HG11 VAL A 177 -1.482 -19.282 -18.373 1.00 19.38 H new ATOM 0 HG12 VAL A 177 -0.045 -20.325 -18.500 1.00 19.38 H new ATOM 0 HG13 VAL A 177 -1.656 -20.980 -18.878 1.00 19.38 H new ATOM 0 HG21 VAL A 177 -3.069 -19.558 -16.523 1.00 18.51 H new ATOM 0 HG22 VAL A 177 -3.344 -21.274 -16.908 1.00 18.51 H new ATOM 0 HG23 VAL A 177 -2.805 -20.803 -15.279 1.00 18.51 H new ATOM 2627 N LEU A 178 -0.519 -23.758 -18.332 1.00 19.73 N ATOM 2628 CA LEU A 178 -0.960 -24.708 -19.343 1.00 20.29 C ATOM 2629 C LEU A 178 -0.276 -26.049 -19.122 1.00 20.67 C ATOM 2630 O LEU A 178 0.204 -26.332 -18.021 1.00 20.64 O ATOM 2631 CB LEU A 178 -0.630 -24.188 -20.745 1.00 20.68 C ATOM 2632 CG LEU A 178 -1.225 -22.828 -21.107 1.00 20.91 C ATOM 2633 CD1 LEU A 178 -0.770 -22.413 -22.495 1.00 20.95 C ATOM 2634 CD2 LEU A 178 -2.743 -22.866 -21.034 1.00 21.15 C ATOM 0 H LEU A 178 0.492 -23.626 -18.295 1.00 19.73 H new ATOM 0 HA LEU A 178 -2.040 -24.832 -19.258 1.00 20.29 H new ATOM 0 HB2 LEU A 178 0.454 -24.127 -20.844 1.00 20.68 H new ATOM 0 HB3 LEU A 178 -0.976 -24.920 -21.474 1.00 20.68 H new ATOM 0 HG LEU A 178 -0.870 -22.092 -20.386 1.00 20.91 H new ATOM 0 HD11 LEU A 178 -1.199 -21.443 -22.744 1.00 20.95 H new ATOM 0 HD12 LEU A 178 0.318 -22.345 -22.516 1.00 20.95 H new ATOM 0 HD13 LEU A 178 -1.101 -23.154 -23.223 1.00 20.95 H new ATOM 0 HD21 LEU A 178 -3.144 -21.887 -21.296 1.00 21.15 H new ATOM 0 HD22 LEU A 178 -3.122 -23.612 -21.732 1.00 21.15 H new ATOM 0 HD23 LEU A 178 -3.052 -23.126 -20.022 1.00 21.15 H new ATOM 2646 N PHE A 179 -0.234 -26.872 -20.157 1.00 21.16 N ATOM 2647 CA PHE A 179 0.497 -28.128 -20.091 1.00 21.69 C ATOM 2648 C PHE A 179 1.955 -27.894 -20.455 1.00 22.01 C ATOM 2649 O PHE A 179 2.859 -28.512 -19.893 1.00 22.11 O ATOM 2650 CB PHE A 179 -0.113 -29.168 -21.035 1.00 22.17 C ATOM 2651 CG PHE A 179 -1.552 -29.484 -20.739 1.00 22.45 C ATOM 2652 CD1 PHE A 179 -1.896 -30.197 -19.603 1.00 22.88 C ATOM 2653 CD2 PHE A 179 -2.557 -29.075 -21.601 1.00 22.38 C ATOM 2654 CE1 PHE A 179 -3.218 -30.495 -19.331 1.00 23.25 C ATOM 2655 CE2 PHE A 179 -3.878 -29.368 -21.334 1.00 22.75 C ATOM 2656 CZ PHE A 179 -4.210 -30.080 -20.197 1.00 23.19 C ATOM 0 H PHE A 179 -0.695 -26.695 -21.049 1.00 21.16 H new ATOM 0 HA PHE A 179 0.432 -28.510 -19.072 1.00 21.69 H new ATOM 0 HB2 PHE A 179 -0.033 -28.806 -22.060 1.00 22.17 H new ATOM 0 HB3 PHE A 179 0.471 -30.086 -20.975 1.00 22.17 H new ATOM 0 HD1 PHE A 179 -1.124 -30.524 -18.923 1.00 22.88 H new ATOM 0 HD2 PHE A 179 -2.303 -28.520 -22.492 1.00 22.38 H new ATOM 0 HE1 PHE A 179 -3.475 -31.052 -18.442 1.00 23.25 H new ATOM 0 HE2 PHE A 179 -4.652 -29.041 -22.013 1.00 22.75 H new ATOM 0 HZ PHE A 179 -5.244 -30.311 -19.986 1.00 23.19 H new ATOM 2666 N GLN A 180 2.171 -26.983 -21.397 1.00 22.29 N ATOM 2667 CA GLN A 180 3.509 -26.649 -21.857 1.00 22.74 C ATOM 2668 C GLN A 180 4.205 -25.756 -20.840 1.00 22.89 C ATOM 2669 O GLN A 180 3.850 -24.561 -20.756 1.00 22.88 O ATOM 2670 CB GLN A 180 3.451 -25.949 -23.217 1.00 23.08 C ATOM 2671 CG GLN A 180 4.809 -25.809 -23.888 1.00 23.17 C ATOM 2672 CD GLN A 180 5.402 -27.149 -24.276 1.00 23.36 C ATOM 2673 OE1 GLN A 180 4.677 -28.098 -24.583 1.00 23.45 O ATOM 2674 NE2 GLN A 180 6.721 -27.241 -24.263 1.00 23.52 N ATOM 2675 OXT GLN A 180 5.089 -26.250 -20.113 1.00 23.12 O ATOM 0 H GLN A 180 1.427 -26.460 -21.859 1.00 22.29 H new ATOM 0 HA GLN A 180 4.077 -27.573 -21.966 1.00 22.74 H new ATOM 0 HB2 GLN A 180 2.785 -26.507 -23.876 1.00 23.08 H new ATOM 0 HB3 GLN A 180 3.015 -24.958 -23.088 1.00 23.08 H new ATOM 0 HG2 GLN A 180 4.709 -25.187 -24.778 1.00 23.17 H new ATOM 0 HG3 GLN A 180 5.493 -25.293 -23.214 1.00 23.17 H new ATOM 0 HE21 GLN A 180 7.286 -26.433 -24.003 1.00 23.52 H new ATOM 0 HE22 GLN A 180 7.173 -28.120 -24.513 1.00 23.52 H new TER 2684 GLN A 180 HETATM 2685 AG AG A 200 9.860 25.565 -22.363 1.00 9.75 AG