USER MOD reduce.3.24.130724 H: found=0, std=0, add=1410, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1410 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: B 57 MET CE :methyl 168:sc= -0.872 (180deg=-1.21) USER MOD Set 1.2: B 68 CYS SG : rot 180:sc= -2.41! USER MOD Set 2.1: B 41 SER OG : rot 180:sc= 0.281 USER MOD Set 2.2: B 42 HIS : no HD1:sc= -8.08! C(o=-7.8!,f=-9.7!) USER MOD Set 3.1: A 57 MET CE :methyl 168:sc= -0.994 (180deg=-1.31) USER MOD Set 3.2: A 68 CYS SG : rot 180:sc= -2.8! USER MOD Set 4.1: A 41 SER OG : rot 180:sc= 0.167 USER MOD Set 4.2: A 42 HIS : no HD1:sc= -8.38! C(o=-8.2!,f=-9.8!) USER MOD Single : A 1 SER N :NH3+ 144:sc= 0.201 (180deg=0.0135) USER MOD Single : A 1 SER OG : rot 180:sc= 0.1 USER MOD Single : A 5 LYS NZ :NH3+ 159:sc= -0.0662 (180deg=-0.461) USER MOD Single : A 7 MET CE :methyl -137:sc= -0.258 (180deg=-1.28) USER MOD Single : A 15 HIS : no HE2:sc= -1.12 K(o=-1.1,f=-2) USER MOD Single : A 16 GLN : amide:sc= -3.39! C(o=-3.4!,f=-2.3!) USER MOD Single : A 17 TYR OH : rot 177:sc= -3.53! USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -116:sc= -0.586 (180deg=-1.93!) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -140:sc= -0.611 (180deg=-2.6!) USER MOD Single : A 29 LYS NZ :NH3+ 138:sc= -0.619 (180deg=-2.78!) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0195 USER MOD Single : A 33 LYS NZ :NH3+ 160:sc= -0.474 (180deg=-1.12) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 38 ASN : amide:sc= -0.254 X(o=-0.25,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -132:sc= -1.94 (180deg=-4.29!) USER MOD Single : A 50 GLN : amide:sc= -0.0295 K(o=-0.029,f=-0.95) USER MOD Single : A 55 LYS NZ :NH3+ 164:sc= -0.0288 (180deg=-0.492) USER MOD Single : A 59 THR OG1 : rot 77:sc= 0.0173 USER MOD Single : A 71 GLN : amide:sc=-0.00051 K(o=-0.00051,f=-1.8!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -61:sc= 0.589 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 78:sc= -0.648 USER MOD Single : A 82 THR OG1 : rot -69:sc= 0.33 USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 HIS : no HD1:sc= -3.86! C(o=-3.9!,f=-1.7!) USER MOD Single : B 1 SER N :NH3+ 139:sc= 0.202 (180deg=0.0102) USER MOD Single : B 1 SER OG : rot 180:sc= 0.133 USER MOD Single : B 5 LYS NZ :NH3+ 161:sc= -0.0578 (180deg=-0.407) USER MOD Single : B 7 MET CE :methyl -139:sc= -0.283 (180deg=-1.32) USER MOD Single : B 15 HIS : no HE2:sc= -1.36 K(o=-1.4,f=-2) USER MOD Single : B 16 GLN : amide:sc= -3.51! C(o=-3.5!,f=-2.2!) USER MOD Single : B 17 TYR OH : rot 175:sc= -3.82! USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ -119:sc= -0.831 (180deg=-2.51!) USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -140:sc= -0.632 (180deg=-2.75!) USER MOD Single : B 29 LYS NZ :NH3+ 144:sc= -0.532 (180deg=-2.59!) USER MOD Single : B 30 SER OG : rot 180:sc= -0.0463 USER MOD Single : B 33 LYS NZ :NH3+ 154:sc= -0.339 (180deg=-0.939) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 38 ASN : amide:sc= -0.287 X(o=-0.29,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -128:sc= -1.11 (180deg=-3.17!) USER MOD Single : B 50 GLN : amide:sc=-0.00371 K(o=-0.0037,f=-0.65) USER MOD Single : B 55 LYS NZ :NH3+ 163:sc= -0.0848 (180deg=-0.529) USER MOD Single : B 59 THR OG1 : rot 76:sc= 0.0123 USER MOD Single : B 71 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 74 MET CE :methyl 179:sc= 0 (180deg=-0.000657) USER MOD Single : B 78 SER OG : rot -54:sc= 0.53 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 75:sc= -0.523 USER MOD Single : B 82 THR OG1 : rot -70:sc= 0.312 USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 90 HIS : no HD1:sc= -3.86! C(o=-3.9!,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 66.844 12.937 -10.784 1.00 0.00 N ATOM 2 CA SER A 1 67.886 11.911 -11.072 1.00 0.00 C ATOM 3 C SER A 1 67.324 10.508 -10.814 1.00 0.00 C ATOM 4 O SER A 1 66.597 10.279 -9.868 1.00 0.00 O ATOM 5 CB SER A 1 69.101 12.151 -10.172 1.00 0.00 C ATOM 6 OG SER A 1 69.350 13.547 -10.088 1.00 0.00 O ATOM 0 H1 SER A 1 67.291 13.779 -10.368 1.00 0.00 H new ATOM 0 H2 SER A 1 66.364 13.202 -11.668 1.00 0.00 H new ATOM 0 H3 SER A 1 66.149 12.548 -10.115 1.00 0.00 H new ATOM 0 HA SER A 1 68.186 11.988 -12.117 1.00 0.00 H new ATOM 0 HB2 SER A 1 68.920 11.741 -9.178 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.974 11.637 -10.574 1.00 0.00 H new ATOM 0 HG SER A 1 70.126 13.707 -9.511 1.00 0.00 H new ATOM 14 N GLU A 2 67.640 9.575 -11.671 1.00 0.00 N ATOM 15 CA GLU A 2 67.126 8.185 -11.514 1.00 0.00 C ATOM 16 C GLU A 2 67.631 7.558 -10.212 1.00 0.00 C ATOM 17 O GLU A 2 66.935 6.794 -9.573 1.00 0.00 O ATOM 18 CB GLU A 2 67.583 7.346 -12.713 1.00 0.00 C ATOM 19 CG GLU A 2 66.829 7.814 -13.964 1.00 0.00 C ATOM 20 CD GLU A 2 67.268 6.990 -15.178 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.233 6.254 -15.055 1.00 0.00 O ATOM 22 OE2 GLU A 2 66.624 7.105 -16.207 1.00 0.00 O ATOM 0 H GLU A 2 68.240 9.719 -12.483 1.00 0.00 H new ATOM 0 HA GLU A 2 66.037 8.212 -11.473 1.00 0.00 H new ATOM 0 HB2 GLU A 2 68.658 7.452 -12.859 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.389 6.289 -12.529 1.00 0.00 H new ATOM 0 HG2 GLU A 2 65.755 7.709 -13.812 1.00 0.00 H new ATOM 0 HG3 GLU A 2 67.024 8.872 -14.142 1.00 0.00 H new ATOM 29 N LEU A 3 68.829 7.873 -9.805 1.00 0.00 N ATOM 30 CA LEU A 3 69.373 7.300 -8.543 1.00 0.00 C ATOM 31 C LEU A 3 68.629 7.902 -7.353 1.00 0.00 C ATOM 32 O LEU A 3 68.402 7.253 -6.353 1.00 0.00 O ATOM 33 CB LEU A 3 70.860 7.652 -8.444 1.00 0.00 C ATOM 34 CG LEU A 3 71.476 7.068 -7.165 1.00 0.00 C ATOM 35 CD1 LEU A 3 71.363 5.533 -7.175 1.00 0.00 C ATOM 36 CD2 LEU A 3 72.954 7.482 -7.097 1.00 0.00 C ATOM 0 H LEU A 3 69.459 8.507 -10.296 1.00 0.00 H new ATOM 0 HA LEU A 3 69.246 6.217 -8.539 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.388 7.266 -9.316 1.00 0.00 H new ATOM 0 HB3 LEU A 3 70.983 8.735 -8.450 1.00 0.00 H new ATOM 0 HG LEU A 3 70.942 7.448 -6.294 1.00 0.00 H new ATOM 0 HD11 LEU A 3 71.803 5.130 -6.263 1.00 0.00 H new ATOM 0 HD12 LEU A 3 70.313 5.246 -7.229 1.00 0.00 H new ATOM 0 HD13 LEU A 3 71.893 5.135 -8.040 1.00 0.00 H new ATOM 0 HD21 LEU A 3 73.405 7.074 -6.193 1.00 0.00 H new ATOM 0 HD22 LEU A 3 73.480 7.097 -7.970 1.00 0.00 H new ATOM 0 HD23 LEU A 3 73.027 8.569 -7.080 1.00 0.00 H new ATOM 48 N GLU A 4 68.247 9.143 -7.458 1.00 0.00 N ATOM 49 CA GLU A 4 67.520 9.788 -6.338 1.00 0.00 C ATOM 50 C GLU A 4 66.206 9.046 -6.093 1.00 0.00 C ATOM 51 O GLU A 4 65.821 8.801 -4.966 1.00 0.00 O ATOM 52 CB GLU A 4 67.251 11.251 -6.701 1.00 0.00 C ATOM 53 CG GLU A 4 66.574 11.956 -5.526 1.00 0.00 C ATOM 54 CD GLU A 4 66.315 13.421 -5.890 1.00 0.00 C ATOM 55 OE1 GLU A 4 66.834 13.860 -6.901 1.00 0.00 O ATOM 56 OE2 GLU A 4 65.612 14.080 -5.140 1.00 0.00 O ATOM 0 H GLU A 4 68.408 9.736 -8.272 1.00 0.00 H new ATOM 0 HA GLU A 4 68.117 9.749 -5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 4 68.187 11.752 -6.949 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.616 11.306 -7.585 1.00 0.00 H new ATOM 0 HG2 GLU A 4 65.635 11.459 -5.282 1.00 0.00 H new ATOM 0 HG3 GLU A 4 67.206 11.897 -4.640 1.00 0.00 H new ATOM 63 N LYS A 5 65.517 8.674 -7.136 1.00 0.00 N ATOM 64 CA LYS A 5 64.230 7.939 -6.955 1.00 0.00 C ATOM 65 C LYS A 5 64.493 6.634 -6.208 1.00 0.00 C ATOM 66 O LYS A 5 63.731 6.232 -5.354 1.00 0.00 O ATOM 67 CB LYS A 5 63.608 7.622 -8.323 1.00 0.00 C ATOM 68 CG LYS A 5 62.240 6.956 -8.120 1.00 0.00 C ATOM 69 CD LYS A 5 61.602 6.676 -9.485 1.00 0.00 C ATOM 70 CE LYS A 5 60.208 6.071 -9.291 1.00 0.00 C ATOM 71 NZ LYS A 5 59.312 7.094 -8.681 1.00 0.00 N ATOM 0 H LYS A 5 65.787 8.846 -8.104 1.00 0.00 H new ATOM 0 HA LYS A 5 63.542 8.561 -6.383 1.00 0.00 H new ATOM 0 HB2 LYS A 5 63.496 8.537 -8.905 1.00 0.00 H new ATOM 0 HB3 LYS A 5 64.265 6.962 -8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.355 6.026 -7.563 1.00 0.00 H new ATOM 0 HG3 LYS A 5 61.592 7.604 -7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 5 61.531 7.599 -10.060 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.229 5.992 -10.057 1.00 0.00 H new ATOM 0 HE2 LYS A 5 59.805 5.741 -10.248 1.00 0.00 H new ATOM 0 HE3 LYS A 5 60.266 5.192 -8.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 58.320 6.842 -8.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 59.474 7.129 -7.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 59.516 8.026 -9.096 1.00 0.00 H new ATOM 85 N ALA A 6 65.566 5.972 -6.521 1.00 0.00 N ATOM 86 CA ALA A 6 65.875 4.692 -5.824 1.00 0.00 C ATOM 87 C ALA A 6 66.026 4.939 -4.320 1.00 0.00 C ATOM 88 O ALA A 6 65.432 4.260 -3.505 1.00 0.00 O ATOM 89 CB ALA A 6 67.178 4.121 -6.377 1.00 0.00 C ATOM 0 H ALA A 6 66.244 6.258 -7.228 1.00 0.00 H new ATOM 0 HA ALA A 6 65.061 3.986 -5.990 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.409 3.184 -5.870 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.070 3.938 -7.446 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.987 4.832 -6.210 1.00 0.00 H new ATOM 95 N MET A 7 66.832 5.896 -3.949 1.00 0.00 N ATOM 96 CA MET A 7 67.041 6.187 -2.502 1.00 0.00 C ATOM 97 C MET A 7 65.700 6.563 -1.866 1.00 0.00 C ATOM 98 O MET A 7 65.312 6.041 -0.841 1.00 0.00 O ATOM 99 CB MET A 7 68.020 7.352 -2.384 1.00 0.00 C ATOM 100 CG MET A 7 68.466 7.517 -0.935 1.00 0.00 C ATOM 101 SD MET A 7 69.400 9.062 -0.761 1.00 0.00 S ATOM 102 CE MET A 7 70.822 8.607 -1.787 1.00 0.00 C ATOM 0 H MET A 7 67.357 6.492 -4.589 1.00 0.00 H new ATOM 0 HA MET A 7 67.443 5.313 -1.989 1.00 0.00 H new ATOM 0 HB2 MET A 7 68.886 7.175 -3.021 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.549 8.270 -2.734 1.00 0.00 H new ATOM 0 HG2 MET A 7 67.598 7.528 -0.275 1.00 0.00 H new ATOM 0 HG3 MET A 7 69.084 6.671 -0.635 1.00 0.00 H new ATOM 0 HE1 MET A 7 71.741 8.928 -1.297 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.842 7.526 -1.923 1.00 0.00 H new ATOM 0 HE3 MET A 7 70.740 9.093 -2.759 1.00 0.00 H new ATOM 112 N VAL A 8 65.000 7.481 -2.470 1.00 0.00 N ATOM 113 CA VAL A 8 63.692 7.920 -1.913 1.00 0.00 C ATOM 114 C VAL A 8 62.761 6.711 -1.796 1.00 0.00 C ATOM 115 O VAL A 8 61.999 6.592 -0.857 1.00 0.00 O ATOM 116 CB VAL A 8 63.077 8.968 -2.843 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.657 9.310 -2.377 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.948 10.228 -2.815 1.00 0.00 C ATOM 0 H VAL A 8 65.280 7.949 -3.332 1.00 0.00 H new ATOM 0 HA VAL A 8 63.835 8.357 -0.925 1.00 0.00 H new ATOM 0 HB VAL A 8 63.029 8.574 -3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.225 10.057 -3.044 1.00 0.00 H new ATOM 0 HG12 VAL A 8 61.042 8.410 -2.393 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.693 9.707 -1.362 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.519 10.982 -3.475 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.991 10.618 -1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.955 9.982 -3.152 1.00 0.00 H new ATOM 128 N ALA A 9 62.811 5.815 -2.742 1.00 0.00 N ATOM 129 CA ALA A 9 61.929 4.615 -2.682 1.00 0.00 C ATOM 130 C ALA A 9 62.229 3.815 -1.406 1.00 0.00 C ATOM 131 O ALA A 9 61.334 3.315 -0.750 1.00 0.00 O ATOM 132 CB ALA A 9 62.194 3.737 -3.909 1.00 0.00 C ATOM 0 H ALA A 9 63.425 5.862 -3.555 1.00 0.00 H new ATOM 0 HA ALA A 9 60.885 4.929 -2.671 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.552 2.857 -3.872 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.980 4.304 -4.815 1.00 0.00 H new ATOM 0 HB3 ALA A 9 63.238 3.425 -3.914 1.00 0.00 H new ATOM 138 N LEU A 10 63.477 3.668 -1.064 1.00 0.00 N ATOM 139 CA LEU A 10 63.836 2.878 0.149 1.00 0.00 C ATOM 140 C LEU A 10 63.209 3.493 1.404 1.00 0.00 C ATOM 141 O LEU A 10 62.605 2.803 2.201 1.00 0.00 O ATOM 142 CB LEU A 10 65.362 2.856 0.305 1.00 0.00 C ATOM 143 CG LEU A 10 65.992 2.101 -0.876 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.518 2.228 -0.808 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.593 0.611 -0.833 1.00 0.00 C ATOM 0 H LEU A 10 64.268 4.062 -1.573 1.00 0.00 H new ATOM 0 HA LEU A 10 63.455 1.864 0.030 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.748 3.875 0.345 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.634 2.374 1.244 1.00 0.00 H new ATOM 0 HG LEU A 10 65.629 2.535 -1.808 1.00 0.00 H new ATOM 0 HD11 LEU A 10 67.965 1.693 -1.645 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.798 3.280 -0.859 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.877 1.802 0.129 1.00 0.00 H new ATOM 0 HD21 LEU A 10 66.046 0.088 -1.675 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.942 0.168 0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.508 0.523 -0.893 1.00 0.00 H new ATOM 157 N ILE A 11 63.337 4.777 1.598 1.00 0.00 N ATOM 158 CA ILE A 11 62.738 5.391 2.819 1.00 0.00 C ATOM 159 C ILE A 11 61.228 5.160 2.812 1.00 0.00 C ATOM 160 O ILE A 11 60.654 4.723 3.789 1.00 0.00 O ATOM 161 CB ILE A 11 63.003 6.900 2.825 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.507 7.157 2.896 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.338 7.544 4.047 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.788 8.638 2.621 1.00 0.00 C ATOM 0 H ILE A 11 63.823 5.421 0.974 1.00 0.00 H new ATOM 0 HA ILE A 11 63.185 4.935 3.703 1.00 0.00 H new ATOM 0 HB ILE A 11 62.592 7.331 1.912 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.888 6.881 3.879 1.00 0.00 H new ATOM 0 HG13 ILE A 11 65.027 6.536 2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.531 8.617 4.043 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.263 7.369 4.011 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.746 7.105 4.957 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.861 8.820 2.672 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.422 8.899 1.628 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.280 9.249 3.367 1.00 0.00 H new ATOM 176 N ASP A 12 60.577 5.471 1.727 1.00 0.00 N ATOM 177 CA ASP A 12 59.103 5.291 1.676 1.00 0.00 C ATOM 178 C ASP A 12 58.768 3.819 1.910 1.00 0.00 C ATOM 179 O ASP A 12 57.851 3.487 2.636 1.00 0.00 O ATOM 180 CB ASP A 12 58.576 5.741 0.306 1.00 0.00 C ATOM 181 CG ASP A 12 57.051 5.620 0.272 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.503 5.019 1.182 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.457 6.131 -0.663 1.00 0.00 O ATOM 0 H ASP A 12 61.001 5.841 0.876 1.00 0.00 H new ATOM 0 HA ASP A 12 58.631 5.895 2.451 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.873 6.772 0.113 1.00 0.00 H new ATOM 0 HB3 ASP A 12 59.016 5.130 -0.482 1.00 0.00 H new ATOM 188 N VAL A 13 59.504 2.934 1.303 1.00 0.00 N ATOM 189 CA VAL A 13 59.226 1.484 1.494 1.00 0.00 C ATOM 190 C VAL A 13 59.613 1.042 2.918 1.00 0.00 C ATOM 191 O VAL A 13 58.932 0.245 3.530 1.00 0.00 O ATOM 192 CB VAL A 13 60.003 0.669 0.453 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.919 -0.824 0.796 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.396 0.909 -0.937 1.00 0.00 C ATOM 0 H VAL A 13 60.285 3.150 0.684 1.00 0.00 H new ATOM 0 HA VAL A 13 58.158 1.308 1.361 1.00 0.00 H new ATOM 0 HB VAL A 13 61.048 0.981 0.456 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.472 -1.400 0.054 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.349 -0.995 1.783 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.876 -1.139 0.795 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.946 0.331 -1.679 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.351 0.598 -0.936 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.459 1.969 -1.183 1.00 0.00 H new ATOM 204 N PHE A 14 60.712 1.529 3.438 1.00 0.00 N ATOM 205 CA PHE A 14 61.142 1.104 4.808 1.00 0.00 C ATOM 206 C PHE A 14 60.154 1.615 5.862 1.00 0.00 C ATOM 207 O PHE A 14 59.613 0.852 6.639 1.00 0.00 O ATOM 208 CB PHE A 14 62.536 1.681 5.094 1.00 0.00 C ATOM 209 CG PHE A 14 63.026 1.274 6.477 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.720 2.068 7.592 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.801 0.114 6.642 1.00 0.00 C ATOM 212 CE1 PHE A 14 63.182 1.702 8.865 1.00 0.00 C ATOM 213 CE2 PHE A 14 64.264 -0.247 7.918 1.00 0.00 C ATOM 214 CZ PHE A 14 63.953 0.546 9.026 1.00 0.00 C ATOM 0 H PHE A 14 61.328 2.199 2.977 1.00 0.00 H new ATOM 0 HA PHE A 14 61.168 0.015 4.853 1.00 0.00 H new ATOM 0 HB2 PHE A 14 63.239 1.331 4.338 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.505 2.768 5.022 1.00 0.00 H new ATOM 0 HD1 PHE A 14 62.128 2.963 7.470 1.00 0.00 H new ATOM 0 HD2 PHE A 14 64.041 -0.501 5.787 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.942 2.314 9.722 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.861 -1.138 8.043 1.00 0.00 H new ATOM 0 HZ PHE A 14 64.308 0.266 10.007 1.00 0.00 H new ATOM 224 N HIS A 15 59.951 2.902 5.928 1.00 0.00 N ATOM 225 CA HIS A 15 59.048 3.470 6.971 1.00 0.00 C ATOM 226 C HIS A 15 57.629 2.915 6.844 1.00 0.00 C ATOM 227 O HIS A 15 56.995 2.616 7.838 1.00 0.00 O ATOM 228 CB HIS A 15 59.017 4.992 6.822 1.00 0.00 C ATOM 229 CG HIS A 15 60.310 5.568 7.332 1.00 0.00 C ATOM 230 ND1 HIS A 15 61.486 5.535 6.593 1.00 0.00 N ATOM 231 CD2 HIS A 15 60.629 6.176 8.520 1.00 0.00 C ATOM 232 CE1 HIS A 15 62.450 6.105 7.342 1.00 0.00 C ATOM 233 NE2 HIS A 15 61.978 6.510 8.523 1.00 0.00 N ATOM 0 H HIS A 15 60.373 3.588 5.302 1.00 0.00 H new ATOM 0 HA HIS A 15 59.431 3.190 7.952 1.00 0.00 H new ATOM 0 HB2 HIS A 15 58.872 5.264 5.776 1.00 0.00 H new ATOM 0 HB3 HIS A 15 58.176 5.406 7.379 1.00 0.00 H new ATOM 0 HD1 HIS A 15 61.599 5.150 5.655 1.00 0.00 H new ATOM 0 HD2 HIS A 15 59.938 6.366 9.328 1.00 0.00 H new ATOM 0 HE1 HIS A 15 63.476 6.220 7.026 1.00 0.00 H new ATOM 242 N GLN A 16 57.109 2.757 5.663 1.00 0.00 N ATOM 243 CA GLN A 16 55.731 2.206 5.548 1.00 0.00 C ATOM 244 C GLN A 16 55.730 0.732 5.953 1.00 0.00 C ATOM 245 O GLN A 16 54.821 0.257 6.605 1.00 0.00 O ATOM 246 CB GLN A 16 55.229 2.354 4.110 1.00 0.00 C ATOM 247 CG GLN A 16 54.972 3.834 3.817 1.00 0.00 C ATOM 248 CD GLN A 16 54.413 3.985 2.401 1.00 0.00 C ATOM 249 OE1 GLN A 16 53.807 4.987 2.080 1.00 0.00 O ATOM 250 NE2 GLN A 16 54.602 3.030 1.532 1.00 0.00 N ATOM 0 H GLN A 16 57.570 2.982 4.781 1.00 0.00 H new ATOM 0 HA GLN A 16 55.067 2.759 6.212 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.965 1.955 3.412 1.00 0.00 H new ATOM 0 HB3 GLN A 16 54.314 1.779 3.971 1.00 0.00 H new ATOM 0 HG2 GLN A 16 54.268 4.242 4.542 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.897 4.401 3.916 1.00 0.00 H new ATOM 0 HE21 GLN A 16 55.111 2.188 1.802 1.00 0.00 H new ATOM 0 HE22 GLN A 16 54.241 3.125 0.583 1.00 0.00 H new ATOM 259 N TYR A 17 56.738 0.004 5.566 1.00 0.00 N ATOM 260 CA TYR A 17 56.788 -1.437 5.935 1.00 0.00 C ATOM 261 C TYR A 17 57.182 -1.597 7.410 1.00 0.00 C ATOM 262 O TYR A 17 56.585 -2.360 8.141 1.00 0.00 O ATOM 263 CB TYR A 17 57.804 -2.181 5.069 1.00 0.00 C ATOM 264 CG TYR A 17 57.630 -3.654 5.317 1.00 0.00 C ATOM 265 CD1 TYR A 17 58.286 -4.271 6.387 1.00 0.00 C ATOM 266 CD2 TYR A 17 56.779 -4.396 4.494 1.00 0.00 C ATOM 267 CE1 TYR A 17 58.095 -5.635 6.629 1.00 0.00 C ATOM 268 CE2 TYR A 17 56.581 -5.759 4.738 1.00 0.00 C ATOM 269 CZ TYR A 17 57.241 -6.380 5.805 1.00 0.00 C ATOM 270 OH TYR A 17 57.043 -7.723 6.051 1.00 0.00 O ATOM 0 H TYR A 17 57.526 0.342 5.013 1.00 0.00 H new ATOM 0 HA TYR A 17 55.796 -1.858 5.772 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.649 -1.950 4.015 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.818 -1.869 5.318 1.00 0.00 H new ATOM 0 HD1 TYR A 17 58.939 -3.695 7.026 1.00 0.00 H new ATOM 0 HD2 TYR A 17 56.274 -3.917 3.669 1.00 0.00 H new ATOM 0 HE1 TYR A 17 58.606 -6.114 7.451 1.00 0.00 H new ATOM 0 HE2 TYR A 17 55.920 -6.331 4.104 1.00 0.00 H new ATOM 0 HH TYR A 17 56.385 -8.078 5.417 1.00 0.00 H new ATOM 280 N SER A 18 58.194 -0.895 7.850 1.00 0.00 N ATOM 281 CA SER A 18 58.634 -1.023 9.273 1.00 0.00 C ATOM 282 C SER A 18 57.632 -0.336 10.207 1.00 0.00 C ATOM 283 O SER A 18 57.586 -0.616 11.389 1.00 0.00 O ATOM 284 CB SER A 18 60.012 -0.379 9.450 1.00 0.00 C ATOM 285 OG SER A 18 60.460 -0.595 10.782 1.00 0.00 O ATOM 0 H SER A 18 58.735 -0.239 7.287 1.00 0.00 H new ATOM 0 HA SER A 18 58.688 -2.082 9.525 1.00 0.00 H new ATOM 0 HB2 SER A 18 60.721 -0.807 8.741 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.957 0.689 9.240 1.00 0.00 H new ATOM 0 HG SER A 18 61.343 -0.186 10.901 1.00 0.00 H new ATOM 291 N GLY A 19 56.849 0.577 9.699 1.00 0.00 N ATOM 292 CA GLY A 19 55.869 1.297 10.570 1.00 0.00 C ATOM 293 C GLY A 19 54.550 0.524 10.651 1.00 0.00 C ATOM 294 O GLY A 19 53.512 1.086 10.937 1.00 0.00 O ATOM 0 H GLY A 19 56.844 0.857 8.718 1.00 0.00 H new ATOM 0 HA2 GLY A 19 56.286 1.422 11.569 1.00 0.00 H new ATOM 0 HA3 GLY A 19 55.687 2.296 10.174 1.00 0.00 H new ATOM 298 N ARG A 20 54.574 -0.759 10.410 1.00 0.00 N ATOM 299 CA ARG A 20 53.314 -1.554 10.486 1.00 0.00 C ATOM 300 C ARG A 20 53.038 -1.953 11.942 1.00 0.00 C ATOM 301 O ARG A 20 51.914 -1.897 12.404 1.00 0.00 O ATOM 302 CB ARG A 20 53.460 -2.815 9.635 1.00 0.00 C ATOM 303 CG ARG A 20 53.485 -2.436 8.151 1.00 0.00 C ATOM 304 CD ARG A 20 53.597 -3.701 7.286 1.00 0.00 C ATOM 305 NE ARG A 20 54.867 -4.433 7.592 1.00 0.00 N ATOM 306 CZ ARG A 20 54.896 -5.398 8.482 1.00 0.00 C ATOM 307 NH1 ARG A 20 53.815 -5.743 9.128 1.00 0.00 N ATOM 308 NH2 ARG A 20 56.015 -6.022 8.721 1.00 0.00 N ATOM 0 H ARG A 20 55.409 -1.290 10.164 1.00 0.00 H new ATOM 0 HA ARG A 20 52.485 -0.952 10.114 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.377 -3.341 9.901 1.00 0.00 H new ATOM 0 HB3 ARG A 20 52.633 -3.496 9.832 1.00 0.00 H new ATOM 0 HG2 ARG A 20 52.579 -1.888 7.892 1.00 0.00 H new ATOM 0 HG3 ARG A 20 54.327 -1.773 7.951 1.00 0.00 H new ATOM 0 HD2 ARG A 20 52.742 -4.351 7.470 1.00 0.00 H new ATOM 0 HD3 ARG A 20 53.571 -3.431 6.230 1.00 0.00 H new ATOM 0 HE ARG A 20 55.724 -4.178 7.101 1.00 0.00 H new ATOM 0 HH11 ARG A 20 52.935 -5.261 8.944 1.00 0.00 H new ATOM 0 HH12 ARG A 20 53.850 -6.494 9.817 1.00 0.00 H new ATOM 0 HH21 ARG A 20 56.863 -5.760 8.218 1.00 0.00 H new ATOM 0 HH22 ARG A 20 56.043 -6.772 9.411 1.00 0.00 H new ATOM 322 N GLU A 21 54.058 -2.352 12.663 1.00 0.00 N ATOM 323 CA GLU A 21 53.867 -2.759 14.090 1.00 0.00 C ATOM 324 C GLU A 21 55.226 -3.100 14.715 1.00 0.00 C ATOM 325 O GLU A 21 56.126 -3.550 14.037 1.00 0.00 O ATOM 326 CB GLU A 21 52.981 -4.009 14.155 1.00 0.00 C ATOM 327 CG GLU A 21 52.722 -4.380 15.616 1.00 0.00 C ATOM 328 CD GLU A 21 51.730 -5.542 15.676 1.00 0.00 C ATOM 329 OE1 GLU A 21 51.224 -5.919 14.631 1.00 0.00 O ATOM 330 OE2 GLU A 21 51.488 -6.032 16.767 1.00 0.00 O ATOM 0 H GLU A 21 55.018 -2.413 12.323 1.00 0.00 H new ATOM 0 HA GLU A 21 53.399 -1.937 14.631 1.00 0.00 H new ATOM 0 HB2 GLU A 21 52.036 -3.824 13.643 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.466 -4.838 13.639 1.00 0.00 H new ATOM 0 HG2 GLU A 21 53.656 -4.659 16.103 1.00 0.00 H new ATOM 0 HG3 GLU A 21 52.325 -3.520 16.156 1.00 0.00 H new ATOM 337 N GLY A 22 55.377 -2.932 16.007 1.00 0.00 N ATOM 338 CA GLY A 22 56.677 -3.299 16.658 1.00 0.00 C ATOM 339 C GLY A 22 57.637 -2.107 16.715 1.00 0.00 C ATOM 340 O GLY A 22 58.692 -2.132 16.116 1.00 0.00 O ATOM 0 H GLY A 22 54.664 -2.560 16.635 1.00 0.00 H new ATOM 0 HA2 GLY A 22 56.488 -3.663 17.668 1.00 0.00 H new ATOM 0 HA3 GLY A 22 57.143 -4.116 16.106 1.00 0.00 H new ATOM 344 N ASP A 23 57.297 -1.075 17.444 1.00 0.00 N ATOM 345 CA ASP A 23 58.216 0.100 17.549 1.00 0.00 C ATOM 346 C ASP A 23 58.549 0.612 16.151 1.00 0.00 C ATOM 347 O ASP A 23 59.384 0.064 15.459 1.00 0.00 O ATOM 348 CB ASP A 23 59.508 -0.308 18.270 1.00 0.00 C ATOM 349 CG ASP A 23 59.202 -0.609 19.738 1.00 0.00 C ATOM 350 OD1 ASP A 23 58.190 -0.131 20.224 1.00 0.00 O ATOM 351 OD2 ASP A 23 59.986 -1.314 20.353 1.00 0.00 O ATOM 0 H ASP A 23 56.426 -0.994 17.969 1.00 0.00 H new ATOM 0 HA ASP A 23 57.725 0.889 18.119 1.00 0.00 H new ATOM 0 HB2 ASP A 23 59.942 -1.186 17.791 1.00 0.00 H new ATOM 0 HB3 ASP A 23 60.245 0.492 18.198 1.00 0.00 H new ATOM 356 N LYS A 24 57.898 1.657 15.728 1.00 0.00 N ATOM 357 CA LYS A 24 58.169 2.203 14.373 1.00 0.00 C ATOM 358 C LYS A 24 59.671 2.471 14.228 1.00 0.00 C ATOM 359 O LYS A 24 60.308 2.964 15.134 1.00 0.00 O ATOM 360 CB LYS A 24 57.403 3.519 14.199 1.00 0.00 C ATOM 361 CG LYS A 24 55.895 3.255 14.251 1.00 0.00 C ATOM 362 CD LYS A 24 55.127 4.580 14.116 1.00 0.00 C ATOM 363 CE LYS A 24 55.443 5.253 12.766 1.00 0.00 C ATOM 364 NZ LYS A 24 56.581 6.204 12.930 1.00 0.00 N ATOM 0 H LYS A 24 57.189 2.157 16.264 1.00 0.00 H new ATOM 0 HA LYS A 24 57.849 1.487 13.616 1.00 0.00 H new ATOM 0 HB2 LYS A 24 57.685 4.221 14.984 1.00 0.00 H new ATOM 0 HB3 LYS A 24 57.668 3.981 13.248 1.00 0.00 H new ATOM 0 HG2 LYS A 24 55.608 2.575 13.449 1.00 0.00 H new ATOM 0 HG3 LYS A 24 55.634 2.768 15.191 1.00 0.00 H new ATOM 0 HD2 LYS A 24 54.056 4.396 14.195 1.00 0.00 H new ATOM 0 HD3 LYS A 24 55.397 5.248 14.934 1.00 0.00 H new ATOM 0 HE2 LYS A 24 55.693 4.497 12.022 1.00 0.00 H new ATOM 0 HE3 LYS A 24 54.564 5.783 12.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 56.254 7.173 12.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 56.945 6.145 13.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 57.338 5.958 12.261 1.00 0.00 H new ATOM 378 N HIS A 25 60.233 2.129 13.093 1.00 0.00 N ATOM 379 CA HIS A 25 61.694 2.337 12.859 1.00 0.00 C ATOM 380 C HIS A 25 62.503 1.262 13.605 1.00 0.00 C ATOM 381 O HIS A 25 63.521 1.539 14.207 1.00 0.00 O ATOM 382 CB HIS A 25 62.091 3.741 13.340 1.00 0.00 C ATOM 383 CG HIS A 25 63.296 4.236 12.576 1.00 0.00 C ATOM 384 ND1 HIS A 25 63.194 4.842 11.329 1.00 0.00 N ATOM 385 CD2 HIS A 25 64.640 4.208 12.869 1.00 0.00 C ATOM 386 CE1 HIS A 25 64.443 5.143 10.921 1.00 0.00 C ATOM 387 NE2 HIS A 25 65.355 4.778 11.822 1.00 0.00 N ATOM 0 H HIS A 25 59.733 1.709 12.310 1.00 0.00 H new ATOM 0 HA HIS A 25 61.910 2.252 11.794 1.00 0.00 H new ATOM 0 HB2 HIS A 25 61.257 4.429 13.202 1.00 0.00 H new ATOM 0 HB3 HIS A 25 62.313 3.718 14.407 1.00 0.00 H new ATOM 0 HD2 HIS A 25 65.073 3.805 13.773 1.00 0.00 H new ATOM 0 HE1 HIS A 25 64.676 5.621 9.981 1.00 0.00 H new ATOM 0 HE2 HIS A 25 66.366 4.893 11.757 1.00 0.00 H new ATOM 396 N LYS A 26 62.052 0.036 13.554 1.00 0.00 N ATOM 397 CA LYS A 26 62.777 -1.075 14.242 1.00 0.00 C ATOM 398 C LYS A 26 62.305 -2.399 13.625 1.00 0.00 C ATOM 399 O LYS A 26 61.123 -2.676 13.593 1.00 0.00 O ATOM 400 CB LYS A 26 62.441 -1.042 15.741 1.00 0.00 C ATOM 401 CG LYS A 26 63.505 -1.803 16.549 1.00 0.00 C ATOM 402 CD LYS A 26 64.745 -0.921 16.775 1.00 0.00 C ATOM 403 CE LYS A 26 65.637 -1.557 17.842 1.00 0.00 C ATOM 404 NZ LYS A 26 66.760 -0.629 18.162 1.00 0.00 N ATOM 0 H LYS A 26 61.205 -0.246 13.061 1.00 0.00 H new ATOM 0 HA LYS A 26 63.855 -0.971 14.121 1.00 0.00 H new ATOM 0 HB2 LYS A 26 62.385 -0.009 16.084 1.00 0.00 H new ATOM 0 HB3 LYS A 26 61.461 -1.487 15.910 1.00 0.00 H new ATOM 0 HG2 LYS A 26 63.090 -2.110 17.509 1.00 0.00 H new ATOM 0 HG3 LYS A 26 63.790 -2.712 16.020 1.00 0.00 H new ATOM 0 HD2 LYS A 26 65.299 -0.808 15.843 1.00 0.00 H new ATOM 0 HD3 LYS A 26 64.441 0.078 17.088 1.00 0.00 H new ATOM 0 HE2 LYS A 26 65.056 -1.767 18.740 1.00 0.00 H new ATOM 0 HE3 LYS A 26 66.028 -2.510 17.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 67.369 -1.058 18.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 67.318 -0.450 17.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 66.377 0.270 18.519 1.00 0.00 H new ATOM 418 N LEU A 27 63.200 -3.216 13.116 1.00 0.00 N ATOM 419 CA LEU A 27 62.757 -4.507 12.485 1.00 0.00 C ATOM 420 C LEU A 27 62.859 -5.660 13.491 1.00 0.00 C ATOM 421 O LEU A 27 63.932 -6.022 13.937 1.00 0.00 O ATOM 422 CB LEU A 27 63.644 -4.813 11.264 1.00 0.00 C ATOM 423 CG LEU A 27 63.165 -4.016 10.036 1.00 0.00 C ATOM 424 CD1 LEU A 27 61.798 -4.537 9.540 1.00 0.00 C ATOM 425 CD2 LEU A 27 63.058 -2.533 10.406 1.00 0.00 C ATOM 0 H LEU A 27 64.206 -3.049 13.109 1.00 0.00 H new ATOM 0 HA LEU A 27 61.718 -4.405 12.172 1.00 0.00 H new ATOM 0 HB2 LEU A 27 64.680 -4.560 11.487 1.00 0.00 H new ATOM 0 HB3 LEU A 27 63.616 -5.881 11.045 1.00 0.00 H new ATOM 0 HG LEU A 27 63.888 -4.143 9.230 1.00 0.00 H new ATOM 0 HD11 LEU A 27 61.481 -3.958 8.672 1.00 0.00 H new ATOM 0 HD12 LEU A 27 61.888 -5.587 9.263 1.00 0.00 H new ATOM 0 HD13 LEU A 27 61.059 -4.434 10.335 1.00 0.00 H new ATOM 0 HD21 LEU A 27 62.719 -1.965 9.539 1.00 0.00 H new ATOM 0 HD22 LEU A 27 62.344 -2.412 11.221 1.00 0.00 H new ATOM 0 HD23 LEU A 27 64.034 -2.165 10.721 1.00 0.00 H new ATOM 437 N LYS A 28 61.735 -6.243 13.842 1.00 0.00 N ATOM 438 CA LYS A 28 61.730 -7.381 14.812 1.00 0.00 C ATOM 439 C LYS A 28 61.772 -8.707 14.039 1.00 0.00 C ATOM 440 O LYS A 28 61.584 -8.741 12.839 1.00 0.00 O ATOM 441 CB LYS A 28 60.463 -7.330 15.679 1.00 0.00 C ATOM 442 CG LYS A 28 60.503 -6.090 16.582 1.00 0.00 C ATOM 443 CD LYS A 28 59.242 -6.036 17.453 1.00 0.00 C ATOM 444 CE LYS A 28 59.300 -4.805 18.358 1.00 0.00 C ATOM 445 NZ LYS A 28 58.073 -4.757 19.200 1.00 0.00 N ATOM 0 H LYS A 28 60.815 -5.975 13.493 1.00 0.00 H new ATOM 0 HA LYS A 28 62.604 -7.305 15.459 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.577 -7.301 15.044 1.00 0.00 H new ATOM 0 HB3 LYS A 28 60.390 -8.232 16.287 1.00 0.00 H new ATOM 0 HG2 LYS A 28 61.391 -6.118 17.214 1.00 0.00 H new ATOM 0 HG3 LYS A 28 60.574 -5.189 15.973 1.00 0.00 H new ATOM 0 HD2 LYS A 28 58.353 -5.996 16.823 1.00 0.00 H new ATOM 0 HD3 LYS A 28 59.165 -6.941 18.056 1.00 0.00 H new ATOM 0 HE2 LYS A 28 60.187 -4.845 18.990 1.00 0.00 H new ATOM 0 HE3 LYS A 28 59.378 -3.900 17.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 57.742 -3.774 19.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 57.330 -5.340 18.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 58.289 -5.123 20.149 1.00 0.00 H new ATOM 459 N LYS A 29 62.043 -9.794 14.714 1.00 0.00 N ATOM 460 CA LYS A 29 62.130 -11.115 14.018 1.00 0.00 C ATOM 461 C LYS A 29 60.841 -11.388 13.224 1.00 0.00 C ATOM 462 O LYS A 29 60.882 -11.900 12.123 1.00 0.00 O ATOM 463 CB LYS A 29 62.300 -12.222 15.070 1.00 0.00 C ATOM 464 CG LYS A 29 63.686 -12.127 15.723 1.00 0.00 C ATOM 465 CD LYS A 29 63.817 -13.209 16.802 1.00 0.00 C ATOM 466 CE LYS A 29 65.164 -13.071 17.518 1.00 0.00 C ATOM 467 NZ LYS A 29 66.252 -13.585 16.641 1.00 0.00 N ATOM 0 H LYS A 29 62.208 -9.825 15.720 1.00 0.00 H new ATOM 0 HA LYS A 29 62.978 -11.099 13.334 1.00 0.00 H new ATOM 0 HB2 LYS A 29 61.525 -12.132 15.831 1.00 0.00 H new ATOM 0 HB3 LYS A 29 62.177 -13.199 14.603 1.00 0.00 H new ATOM 0 HG2 LYS A 29 64.464 -12.253 14.970 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.825 -11.140 16.164 1.00 0.00 H new ATOM 0 HD2 LYS A 29 63.002 -13.119 17.521 1.00 0.00 H new ATOM 0 HD3 LYS A 29 63.735 -14.197 16.350 1.00 0.00 H new ATOM 0 HE2 LYS A 29 65.348 -12.026 17.769 1.00 0.00 H new ATOM 0 HE3 LYS A 29 65.147 -13.626 18.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 67.071 -12.947 16.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 66.533 -14.535 16.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 65.913 -13.632 15.659 1.00 0.00 H new ATOM 481 N SER A 30 59.698 -11.055 13.769 1.00 0.00 N ATOM 482 CA SER A 30 58.412 -11.305 13.042 1.00 0.00 C ATOM 483 C SER A 30 58.316 -10.395 11.813 1.00 0.00 C ATOM 484 O SER A 30 57.770 -10.766 10.792 1.00 0.00 O ATOM 485 CB SER A 30 57.236 -11.007 13.973 1.00 0.00 C ATOM 486 OG SER A 30 57.162 -9.605 14.197 1.00 0.00 O ATOM 0 H SER A 30 59.598 -10.620 14.686 1.00 0.00 H new ATOM 0 HA SER A 30 58.383 -12.347 12.724 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.307 -11.367 13.531 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.363 -11.533 14.919 1.00 0.00 H new ATOM 0 HG SER A 30 56.409 -9.408 14.792 1.00 0.00 H new ATOM 492 N GLU A 31 58.843 -9.210 11.907 1.00 0.00 N ATOM 493 CA GLU A 31 58.787 -8.277 10.747 1.00 0.00 C ATOM 494 C GLU A 31 59.711 -8.803 9.647 1.00 0.00 C ATOM 495 O GLU A 31 59.473 -8.610 8.470 1.00 0.00 O ATOM 496 CB GLU A 31 59.250 -6.883 11.174 1.00 0.00 C ATOM 497 CG GLU A 31 58.219 -6.263 12.121 1.00 0.00 C ATOM 498 CD GLU A 31 58.686 -4.868 12.535 1.00 0.00 C ATOM 499 OE1 GLU A 31 59.446 -4.280 11.789 1.00 0.00 O ATOM 500 OE2 GLU A 31 58.267 -4.409 13.583 1.00 0.00 O ATOM 0 H GLU A 31 59.311 -8.845 12.736 1.00 0.00 H new ATOM 0 HA GLU A 31 57.763 -8.213 10.380 1.00 0.00 H new ATOM 0 HB2 GLU A 31 60.219 -6.947 11.668 1.00 0.00 H new ATOM 0 HB3 GLU A 31 59.380 -6.248 10.297 1.00 0.00 H new ATOM 0 HG2 GLU A 31 57.248 -6.203 11.630 1.00 0.00 H new ATOM 0 HG3 GLU A 31 58.093 -6.893 13.002 1.00 0.00 H new ATOM 507 N LEU A 32 60.755 -9.479 10.032 1.00 0.00 N ATOM 508 CA LEU A 32 61.698 -10.043 9.023 1.00 0.00 C ATOM 509 C LEU A 32 61.034 -11.202 8.281 1.00 0.00 C ATOM 510 O LEU A 32 61.189 -11.362 7.087 1.00 0.00 O ATOM 511 CB LEU A 32 62.956 -10.576 9.712 1.00 0.00 C ATOM 512 CG LEU A 32 63.800 -9.432 10.285 1.00 0.00 C ATOM 513 CD1 LEU A 32 65.002 -10.040 11.014 1.00 0.00 C ATOM 514 CD2 LEU A 32 64.289 -8.500 9.156 1.00 0.00 C ATOM 0 H LEU A 32 60.999 -9.667 11.004 1.00 0.00 H new ATOM 0 HA LEU A 32 61.964 -9.249 8.325 1.00 0.00 H new ATOM 0 HB2 LEU A 32 62.674 -11.260 10.513 1.00 0.00 H new ATOM 0 HB3 LEU A 32 63.550 -11.148 8.999 1.00 0.00 H new ATOM 0 HG LEU A 32 63.197 -8.841 10.974 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.617 -9.242 11.430 1.00 0.00 H new ATOM 0 HD12 LEU A 32 64.651 -10.685 11.819 1.00 0.00 H new ATOM 0 HD13 LEU A 32 65.595 -10.626 10.312 1.00 0.00 H new ATOM 0 HD21 LEU A 32 64.886 -7.694 9.583 1.00 0.00 H new ATOM 0 HD22 LEU A 32 64.897 -9.069 8.452 1.00 0.00 H new ATOM 0 HD23 LEU A 32 63.430 -8.078 8.635 1.00 0.00 H new ATOM 526 N LYS A 33 60.297 -12.016 8.985 1.00 0.00 N ATOM 527 CA LYS A 33 59.628 -13.173 8.334 1.00 0.00 C ATOM 528 C LYS A 33 58.605 -12.668 7.314 1.00 0.00 C ATOM 529 O LYS A 33 58.506 -13.174 6.214 1.00 0.00 O ATOM 530 CB LYS A 33 58.942 -14.014 9.411 1.00 0.00 C ATOM 531 CG LYS A 33 58.281 -15.235 8.776 1.00 0.00 C ATOM 532 CD LYS A 33 57.847 -16.212 9.878 1.00 0.00 C ATOM 533 CE LYS A 33 56.802 -15.555 10.787 1.00 0.00 C ATOM 534 NZ LYS A 33 55.838 -14.779 9.960 1.00 0.00 N ATOM 0 H LYS A 33 60.130 -11.928 9.987 1.00 0.00 H new ATOM 0 HA LYS A 33 60.361 -13.787 7.811 1.00 0.00 H new ATOM 0 HB2 LYS A 33 59.671 -14.331 10.156 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.195 -13.415 9.931 1.00 0.00 H new ATOM 0 HG2 LYS A 33 57.417 -14.929 8.186 1.00 0.00 H new ATOM 0 HG3 LYS A 33 58.976 -15.725 8.094 1.00 0.00 H new ATOM 0 HD2 LYS A 33 57.434 -17.116 9.431 1.00 0.00 H new ATOM 0 HD3 LYS A 33 58.713 -16.515 10.467 1.00 0.00 H new ATOM 0 HE2 LYS A 33 56.274 -16.317 11.361 1.00 0.00 H new ATOM 0 HE3 LYS A 33 57.292 -14.898 11.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 54.964 -14.621 10.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 56.258 -13.862 9.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 55.617 -15.311 9.094 1.00 0.00 H new ATOM 548 N GLU A 34 57.853 -11.663 7.664 1.00 0.00 N ATOM 549 CA GLU A 34 56.855 -11.116 6.705 1.00 0.00 C ATOM 550 C GLU A 34 57.581 -10.435 5.542 1.00 0.00 C ATOM 551 O GLU A 34 57.239 -10.616 4.389 1.00 0.00 O ATOM 552 CB GLU A 34 55.969 -10.091 7.417 1.00 0.00 C ATOM 553 CG GLU A 34 54.994 -10.810 8.354 1.00 0.00 C ATOM 554 CD GLU A 34 54.114 -9.779 9.062 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.311 -8.598 8.827 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.248 -10.188 9.818 1.00 0.00 O ATOM 0 H GLU A 34 57.886 -11.198 8.571 1.00 0.00 H new ATOM 0 HA GLU A 34 56.238 -11.930 6.324 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.587 -9.395 7.984 1.00 0.00 H new ATOM 0 HB3 GLU A 34 55.417 -9.503 6.684 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.374 -11.505 7.788 1.00 0.00 H new ATOM 0 HG3 GLU A 34 55.545 -11.399 9.087 1.00 0.00 H new ATOM 563 N LEU A 35 58.573 -9.645 5.837 1.00 0.00 N ATOM 564 CA LEU A 35 59.313 -8.940 4.751 1.00 0.00 C ATOM 565 C LEU A 35 59.937 -9.974 3.806 1.00 0.00 C ATOM 566 O LEU A 35 59.809 -9.889 2.601 1.00 0.00 O ATOM 567 CB LEU A 35 60.422 -8.073 5.373 1.00 0.00 C ATOM 568 CG LEU A 35 61.214 -7.325 4.281 1.00 0.00 C ATOM 569 CD1 LEU A 35 60.345 -6.236 3.638 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.445 -6.672 4.915 1.00 0.00 C ATOM 0 H LEU A 35 58.905 -9.456 6.783 1.00 0.00 H new ATOM 0 HA LEU A 35 58.627 -8.306 4.190 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.982 -7.355 6.065 1.00 0.00 H new ATOM 0 HB3 LEU A 35 61.098 -8.701 5.952 1.00 0.00 H new ATOM 0 HG LEU A 35 61.515 -8.037 3.513 1.00 0.00 H new ATOM 0 HD11 LEU A 35 60.920 -5.718 2.870 1.00 0.00 H new ATOM 0 HD12 LEU A 35 59.464 -6.693 3.186 1.00 0.00 H new ATOM 0 HD13 LEU A 35 60.033 -5.522 4.400 1.00 0.00 H new ATOM 0 HD21 LEU A 35 63.010 -6.141 4.149 1.00 0.00 H new ATOM 0 HD22 LEU A 35 62.128 -5.969 5.685 1.00 0.00 H new ATOM 0 HD23 LEU A 35 63.075 -7.441 5.363 1.00 0.00 H new ATOM 582 N ILE A 36 60.630 -10.934 4.354 1.00 0.00 N ATOM 583 CA ILE A 36 61.290 -11.976 3.513 1.00 0.00 C ATOM 584 C ILE A 36 60.236 -12.740 2.694 1.00 0.00 C ATOM 585 O ILE A 36 60.370 -12.914 1.497 1.00 0.00 O ATOM 586 CB ILE A 36 62.035 -12.944 4.446 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.231 -12.220 5.075 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.536 -14.161 3.660 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.736 -13.007 6.290 1.00 0.00 C ATOM 0 H ILE A 36 60.769 -11.043 5.359 1.00 0.00 H new ATOM 0 HA ILE A 36 61.989 -11.510 2.819 1.00 0.00 H new ATOM 0 HB ILE A 36 61.352 -13.282 5.225 1.00 0.00 H new ATOM 0 HG12 ILE A 36 64.030 -12.114 4.341 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.940 -11.214 5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.062 -14.838 4.334 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.688 -14.680 3.213 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.215 -13.832 2.874 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.586 -12.487 6.732 1.00 0.00 H new ATOM 0 HD12 ILE A 36 62.937 -13.090 7.027 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.044 -14.004 5.975 1.00 0.00 H new ATOM 601 N ASN A 37 59.201 -13.205 3.340 1.00 0.00 N ATOM 602 CA ASN A 37 58.137 -13.977 2.627 1.00 0.00 C ATOM 603 C ASN A 37 57.459 -13.103 1.563 1.00 0.00 C ATOM 604 O ASN A 37 57.152 -13.557 0.478 1.00 0.00 O ATOM 605 CB ASN A 37 57.087 -14.446 3.642 1.00 0.00 C ATOM 606 CG ASN A 37 55.995 -15.241 2.921 1.00 0.00 C ATOM 607 OD1 ASN A 37 55.013 -14.680 2.477 1.00 0.00 O ATOM 608 ND2 ASN A 37 56.118 -16.537 2.797 1.00 0.00 N ATOM 0 H ASN A 37 59.044 -13.083 4.340 1.00 0.00 H new ATOM 0 HA ASN A 37 58.594 -14.836 2.136 1.00 0.00 H new ATOM 0 HB2 ASN A 37 57.557 -15.065 4.407 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.650 -13.587 4.151 1.00 0.00 H new ATOM 0 HD21 ASN A 37 55.390 -17.076 2.328 1.00 0.00 H new ATOM 0 HD22 ASN A 37 56.942 -17.009 3.169 1.00 0.00 H new ATOM 615 N ASN A 38 57.204 -11.859 1.874 1.00 0.00 N ATOM 616 CA ASN A 38 56.527 -10.956 0.892 1.00 0.00 C ATOM 617 C ASN A 38 57.549 -10.327 -0.059 1.00 0.00 C ATOM 618 O ASN A 38 57.251 -10.025 -1.196 1.00 0.00 O ATOM 619 CB ASN A 38 55.812 -9.838 1.657 1.00 0.00 C ATOM 620 CG ASN A 38 55.031 -8.961 0.674 1.00 0.00 C ATOM 621 OD1 ASN A 38 55.120 -7.750 0.719 1.00 0.00 O ATOM 622 ND2 ASN A 38 54.267 -9.525 -0.221 1.00 0.00 N ATOM 0 H ASN A 38 57.436 -11.427 2.768 1.00 0.00 H new ATOM 0 HA ASN A 38 55.815 -11.541 0.309 1.00 0.00 H new ATOM 0 HB2 ASN A 38 55.135 -10.265 2.396 1.00 0.00 H new ATOM 0 HB3 ASN A 38 56.538 -9.234 2.201 1.00 0.00 H new ATOM 0 HD21 ASN A 38 53.745 -8.949 -0.882 1.00 0.00 H new ATOM 0 HD22 ASN A 38 54.192 -10.541 -0.260 1.00 0.00 H new ATOM 629 N GLU A 39 58.743 -10.100 0.411 1.00 0.00 N ATOM 630 CA GLU A 39 59.778 -9.450 -0.459 1.00 0.00 C ATOM 631 C GLU A 39 60.494 -10.482 -1.332 1.00 0.00 C ATOM 632 O GLU A 39 60.257 -10.569 -2.522 1.00 0.00 O ATOM 633 CB GLU A 39 60.817 -8.728 0.405 1.00 0.00 C ATOM 634 CG GLU A 39 61.732 -7.875 -0.489 1.00 0.00 C ATOM 635 CD GLU A 39 60.922 -6.762 -1.160 1.00 0.00 C ATOM 636 OE1 GLU A 39 59.968 -6.300 -0.554 1.00 0.00 O ATOM 637 OE2 GLU A 39 61.268 -6.390 -2.271 1.00 0.00 O ATOM 0 H GLU A 39 59.052 -10.333 1.355 1.00 0.00 H new ATOM 0 HA GLU A 39 59.266 -8.735 -1.103 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.318 -8.096 1.139 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.410 -9.454 0.961 1.00 0.00 H new ATOM 0 HG2 GLU A 39 62.535 -7.442 0.107 1.00 0.00 H new ATOM 0 HG3 GLU A 39 62.200 -8.502 -1.247 1.00 0.00 H new ATOM 644 N LEU A 40 61.396 -11.237 -0.770 1.00 0.00 N ATOM 645 CA LEU A 40 62.142 -12.226 -1.596 1.00 0.00 C ATOM 646 C LEU A 40 61.211 -13.378 -1.983 1.00 0.00 C ATOM 647 O LEU A 40 60.545 -13.957 -1.145 1.00 0.00 O ATOM 648 CB LEU A 40 63.326 -12.776 -0.795 1.00 0.00 C ATOM 649 CG LEU A 40 64.181 -11.623 -0.247 1.00 0.00 C ATOM 650 CD1 LEU A 40 65.314 -12.195 0.612 1.00 0.00 C ATOM 651 CD2 LEU A 40 64.775 -10.809 -1.410 1.00 0.00 C ATOM 0 H LEU A 40 61.648 -11.213 0.218 1.00 0.00 H new ATOM 0 HA LEU A 40 62.510 -11.737 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 40 62.963 -13.391 0.028 1.00 0.00 H new ATOM 0 HB3 LEU A 40 63.935 -13.420 -1.429 1.00 0.00 H new ATOM 0 HG LEU A 40 63.555 -10.969 0.360 1.00 0.00 H new ATOM 0 HD11 LEU A 40 65.922 -11.379 1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 40 64.891 -12.761 1.442 1.00 0.00 H new ATOM 0 HD13 LEU A 40 65.936 -12.852 0.004 1.00 0.00 H new ATOM 0 HD21 LEU A 40 65.379 -9.994 -1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 40 65.399 -11.457 -2.026 1.00 0.00 H new ATOM 0 HD23 LEU A 40 63.968 -10.399 -2.017 1.00 0.00 H new ATOM 663 N SER A 41 61.165 -13.719 -3.250 1.00 0.00 N ATOM 664 CA SER A 41 60.284 -14.840 -3.712 1.00 0.00 C ATOM 665 C SER A 41 61.152 -15.948 -4.305 1.00 0.00 C ATOM 666 O SER A 41 61.330 -16.992 -3.713 1.00 0.00 O ATOM 667 CB SER A 41 59.328 -14.324 -4.786 1.00 0.00 C ATOM 668 OG SER A 41 60.085 -13.814 -5.876 1.00 0.00 O ATOM 0 H SER A 41 61.703 -13.266 -3.988 1.00 0.00 H new ATOM 0 HA SER A 41 59.713 -15.228 -2.869 1.00 0.00 H new ATOM 0 HB2 SER A 41 58.675 -15.128 -5.125 1.00 0.00 H new ATOM 0 HB3 SER A 41 58.687 -13.544 -4.376 1.00 0.00 H new ATOM 0 HG SER A 41 59.477 -13.483 -6.570 1.00 0.00 H new ATOM 674 N HIS A 42 61.706 -15.731 -5.471 1.00 0.00 N ATOM 675 CA HIS A 42 62.569 -16.780 -6.095 1.00 0.00 C ATOM 676 C HIS A 42 64.020 -16.545 -5.680 1.00 0.00 C ATOM 677 O HIS A 42 64.927 -17.201 -6.151 1.00 0.00 O ATOM 678 CB HIS A 42 62.450 -16.726 -7.618 1.00 0.00 C ATOM 679 CG HIS A 42 63.051 -15.451 -8.140 1.00 0.00 C ATOM 680 ND1 HIS A 42 64.310 -15.417 -8.720 1.00 0.00 N ATOM 681 CD2 HIS A 42 62.572 -14.169 -8.201 1.00 0.00 C ATOM 682 CE1 HIS A 42 64.543 -14.151 -9.108 1.00 0.00 C ATOM 683 NE2 HIS A 42 63.516 -13.352 -8.813 1.00 0.00 N ATOM 0 H HIS A 42 61.599 -14.876 -6.016 1.00 0.00 H new ATOM 0 HA HIS A 42 62.244 -17.763 -5.756 1.00 0.00 H new ATOM 0 HB2 HIS A 42 62.957 -17.584 -8.060 1.00 0.00 H new ATOM 0 HB3 HIS A 42 61.402 -16.789 -7.911 1.00 0.00 H new ATOM 0 HD2 HIS A 42 61.611 -13.844 -7.831 1.00 0.00 H new ATOM 0 HE1 HIS A 42 65.448 -13.822 -9.597 1.00 0.00 H new ATOM 0 HE2 HIS A 42 63.439 -12.352 -8.998 1.00 0.00 H new ATOM 692 N PHE A 43 64.245 -15.608 -4.796 1.00 0.00 N ATOM 693 CA PHE A 43 65.635 -15.320 -4.337 1.00 0.00 C ATOM 694 C PHE A 43 65.864 -16.024 -3.001 1.00 0.00 C ATOM 695 O PHE A 43 66.947 -16.000 -2.453 1.00 0.00 O ATOM 696 CB PHE A 43 65.812 -13.810 -4.146 1.00 0.00 C ATOM 697 CG PHE A 43 65.816 -13.122 -5.493 1.00 0.00 C ATOM 698 CD1 PHE A 43 66.912 -13.282 -6.351 1.00 0.00 C ATOM 699 CD2 PHE A 43 64.733 -12.323 -5.884 1.00 0.00 C ATOM 700 CE1 PHE A 43 66.925 -12.643 -7.595 1.00 0.00 C ATOM 701 CE2 PHE A 43 64.747 -11.684 -7.130 1.00 0.00 C ATOM 702 CZ PHE A 43 65.844 -11.844 -7.985 1.00 0.00 C ATOM 0 H PHE A 43 63.522 -15.028 -4.371 1.00 0.00 H new ATOM 0 HA PHE A 43 66.350 -15.676 -5.079 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.006 -13.415 -3.528 1.00 0.00 H new ATOM 0 HB3 PHE A 43 66.745 -13.607 -3.621 1.00 0.00 H new ATOM 0 HD1 PHE A 43 67.747 -13.899 -6.052 1.00 0.00 H new ATOM 0 HD2 PHE A 43 63.887 -12.200 -5.224 1.00 0.00 H new ATOM 0 HE1 PHE A 43 67.770 -12.766 -8.256 1.00 0.00 H new ATOM 0 HE2 PHE A 43 63.912 -11.068 -7.431 1.00 0.00 H new ATOM 0 HZ PHE A 43 65.856 -11.351 -8.946 1.00 0.00 H new ATOM 712 N LEU A 44 64.848 -16.667 -2.480 1.00 0.00 N ATOM 713 CA LEU A 44 64.990 -17.395 -1.180 1.00 0.00 C ATOM 714 C LEU A 44 64.268 -18.743 -1.295 1.00 0.00 C ATOM 715 O LEU A 44 63.183 -18.835 -1.832 1.00 0.00 O ATOM 716 CB LEU A 44 64.368 -16.540 -0.049 1.00 0.00 C ATOM 717 CG LEU A 44 65.238 -16.574 1.227 1.00 0.00 C ATOM 718 CD1 LEU A 44 65.422 -18.024 1.703 1.00 0.00 C ATOM 719 CD2 LEU A 44 66.616 -15.922 0.963 1.00 0.00 C ATOM 0 H LEU A 44 63.921 -16.719 -2.902 1.00 0.00 H new ATOM 0 HA LEU A 44 66.041 -17.568 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 44 64.257 -15.510 -0.388 1.00 0.00 H new ATOM 0 HB3 LEU A 44 63.368 -16.909 0.180 1.00 0.00 H new ATOM 0 HG LEU A 44 64.730 -16.007 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 44 66.037 -18.036 2.603 1.00 0.00 H new ATOM 0 HD12 LEU A 44 64.448 -18.461 1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 44 65.912 -18.604 0.921 1.00 0.00 H new ATOM 0 HD21 LEU A 44 67.215 -15.955 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 44 67.130 -16.466 0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 44 66.475 -14.885 0.659 1.00 0.00 H new ATOM 731 N GLU A 45 64.862 -19.792 -0.801 1.00 0.00 N ATOM 732 CA GLU A 45 64.198 -21.120 -0.897 1.00 0.00 C ATOM 733 C GLU A 45 62.859 -21.074 -0.147 1.00 0.00 C ATOM 734 O GLU A 45 61.895 -20.511 -0.627 1.00 0.00 O ATOM 735 CB GLU A 45 65.115 -22.191 -0.302 1.00 0.00 C ATOM 736 CG GLU A 45 64.509 -23.574 -0.545 1.00 0.00 C ATOM 737 CD GLU A 45 65.435 -24.645 0.029 1.00 0.00 C ATOM 738 OE1 GLU A 45 66.540 -24.300 0.411 1.00 0.00 O ATOM 739 OE2 GLU A 45 65.024 -25.793 0.074 1.00 0.00 O ATOM 0 H GLU A 45 65.771 -19.788 -0.339 1.00 0.00 H new ATOM 0 HA GLU A 45 64.006 -21.367 -1.941 1.00 0.00 H new ATOM 0 HB2 GLU A 45 66.104 -22.131 -0.756 1.00 0.00 H new ATOM 0 HB3 GLU A 45 65.244 -22.021 0.767 1.00 0.00 H new ATOM 0 HG2 GLU A 45 63.527 -23.639 -0.078 1.00 0.00 H new ATOM 0 HG3 GLU A 45 64.365 -23.737 -1.613 1.00 0.00 H new ATOM 746 N GLU A 46 62.784 -21.652 1.024 1.00 0.00 N ATOM 747 CA GLU A 46 61.504 -21.625 1.790 1.00 0.00 C ATOM 748 C GLU A 46 61.796 -21.909 3.262 1.00 0.00 C ATOM 749 O GLU A 46 62.315 -22.949 3.610 1.00 0.00 O ATOM 750 CB GLU A 46 60.545 -22.689 1.238 1.00 0.00 C ATOM 751 CG GLU A 46 59.201 -22.613 1.969 1.00 0.00 C ATOM 752 CD GLU A 46 58.262 -23.681 1.404 1.00 0.00 C ATOM 753 OE1 GLU A 46 58.654 -24.343 0.458 1.00 0.00 O ATOM 754 OE2 GLU A 46 57.168 -23.817 1.928 1.00 0.00 O ATOM 0 H GLU A 46 63.553 -22.141 1.482 1.00 0.00 H new ATOM 0 HA GLU A 46 61.040 -20.644 1.691 1.00 0.00 H new ATOM 0 HB2 GLU A 46 60.396 -22.537 0.169 1.00 0.00 H new ATOM 0 HB3 GLU A 46 60.980 -23.681 1.361 1.00 0.00 H new ATOM 0 HG2 GLU A 46 59.345 -22.767 3.038 1.00 0.00 H new ATOM 0 HG3 GLU A 46 58.762 -21.623 1.846 1.00 0.00 H new ATOM 761 N ILE A 47 61.468 -20.989 4.134 1.00 0.00 N ATOM 762 CA ILE A 47 61.730 -21.206 5.589 1.00 0.00 C ATOM 763 C ILE A 47 60.454 -21.704 6.268 1.00 0.00 C ATOM 764 O ILE A 47 59.437 -21.037 6.280 1.00 0.00 O ATOM 765 CB ILE A 47 62.180 -19.884 6.227 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.483 -19.416 5.561 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.421 -20.101 7.726 1.00 0.00 C ATOM 768 CD1 ILE A 47 63.798 -17.978 5.990 1.00 0.00 C ATOM 0 H ILE A 47 61.030 -20.098 3.901 1.00 0.00 H new ATOM 0 HA ILE A 47 62.515 -21.951 5.714 1.00 0.00 H new ATOM 0 HB ILE A 47 61.408 -19.127 6.088 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.303 -20.077 5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 47 63.387 -19.469 4.477 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.741 -19.164 8.182 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.498 -20.438 8.198 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.196 -20.855 7.865 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.723 -17.651 5.515 1.00 0.00 H new ATOM 0 HD12 ILE A 47 62.983 -17.321 5.687 1.00 0.00 H new ATOM 0 HD13 ILE A 47 63.913 -17.938 7.073 1.00 0.00 H new ATOM 780 N LYS A 48 60.508 -22.888 6.830 1.00 0.00 N ATOM 781 CA LYS A 48 59.315 -23.472 7.516 1.00 0.00 C ATOM 782 C LYS A 48 59.529 -23.441 9.034 1.00 0.00 C ATOM 783 O LYS A 48 58.583 -23.457 9.798 1.00 0.00 O ATOM 784 CB LYS A 48 59.124 -24.925 7.040 1.00 0.00 C ATOM 785 CG LYS A 48 60.491 -25.596 6.856 1.00 0.00 C ATOM 786 CD LYS A 48 60.321 -27.122 6.794 1.00 0.00 C ATOM 787 CE LYS A 48 59.463 -27.515 5.586 1.00 0.00 C ATOM 788 NZ LYS A 48 58.021 -27.332 5.916 1.00 0.00 N ATOM 0 H LYS A 48 61.338 -23.480 6.842 1.00 0.00 H new ATOM 0 HA LYS A 48 58.426 -22.890 7.273 1.00 0.00 H new ATOM 0 HB2 LYS A 48 58.531 -25.480 7.767 1.00 0.00 H new ATOM 0 HB3 LYS A 48 58.572 -24.940 6.100 1.00 0.00 H new ATOM 0 HG2 LYS A 48 60.962 -25.236 5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 48 61.151 -25.328 7.681 1.00 0.00 H new ATOM 0 HD2 LYS A 48 61.298 -27.601 6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 48 59.854 -27.480 7.712 1.00 0.00 H new ATOM 0 HE2 LYS A 48 59.729 -26.904 4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 48 59.655 -28.553 5.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 57.491 -28.182 5.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 57.916 -27.178 6.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 57.649 -26.508 5.402 1.00 0.00 H new ATOM 802 N GLU A 49 60.767 -23.400 9.478 1.00 0.00 N ATOM 803 CA GLU A 49 61.049 -23.379 10.952 1.00 0.00 C ATOM 804 C GLU A 49 61.561 -21.997 11.382 1.00 0.00 C ATOM 805 O GLU A 49 62.388 -21.393 10.726 1.00 0.00 O ATOM 806 CB GLU A 49 62.103 -24.443 11.274 1.00 0.00 C ATOM 807 CG GLU A 49 61.492 -25.831 11.064 1.00 0.00 C ATOM 808 CD GLU A 49 62.530 -26.907 11.387 1.00 0.00 C ATOM 809 OE1 GLU A 49 63.684 -26.557 11.564 1.00 0.00 O ATOM 810 OE2 GLU A 49 62.151 -28.066 11.448 1.00 0.00 O ATOM 0 H GLU A 49 61.594 -23.380 8.882 1.00 0.00 H new ATOM 0 HA GLU A 49 60.128 -23.591 11.495 1.00 0.00 H new ATOM 0 HB2 GLU A 49 62.975 -24.315 10.633 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.445 -24.334 12.303 1.00 0.00 H new ATOM 0 HG2 GLU A 49 60.617 -25.954 11.702 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.153 -25.937 10.034 1.00 0.00 H new ATOM 817 N GLN A 50 61.070 -21.499 12.488 1.00 0.00 N ATOM 818 CA GLN A 50 61.513 -20.160 12.984 1.00 0.00 C ATOM 819 C GLN A 50 62.968 -20.244 13.454 1.00 0.00 C ATOM 820 O GLN A 50 63.717 -19.289 13.381 1.00 0.00 O ATOM 821 CB GLN A 50 60.625 -19.755 14.161 1.00 0.00 C ATOM 822 CG GLN A 50 60.806 -20.758 15.305 1.00 0.00 C ATOM 823 CD GLN A 50 59.734 -20.508 16.369 1.00 0.00 C ATOM 824 OE1 GLN A 50 58.593 -20.247 16.044 1.00 0.00 O ATOM 825 NE2 GLN A 50 60.053 -20.564 17.633 1.00 0.00 N ATOM 0 H GLN A 50 60.377 -21.965 13.073 1.00 0.00 H new ATOM 0 HA GLN A 50 61.435 -19.424 12.184 1.00 0.00 H new ATOM 0 HB2 GLN A 50 60.885 -18.752 14.498 1.00 0.00 H new ATOM 0 HB3 GLN A 50 59.581 -19.726 13.850 1.00 0.00 H new ATOM 0 HG2 GLN A 50 60.729 -21.777 14.926 1.00 0.00 H new ATOM 0 HG3 GLN A 50 61.799 -20.655 15.741 1.00 0.00 H new ATOM 0 HE21 GLN A 50 61.010 -20.783 17.908 1.00 0.00 H new ATOM 0 HE22 GLN A 50 59.345 -20.389 18.346 1.00 0.00 H new ATOM 834 N GLU A 51 63.363 -21.381 13.943 1.00 0.00 N ATOM 835 CA GLU A 51 64.757 -21.547 14.437 1.00 0.00 C ATOM 836 C GLU A 51 65.729 -21.214 13.309 1.00 0.00 C ATOM 837 O GLU A 51 66.815 -20.721 13.534 1.00 0.00 O ATOM 838 CB GLU A 51 64.959 -23.000 14.878 1.00 0.00 C ATOM 839 CG GLU A 51 66.345 -23.176 15.503 1.00 0.00 C ATOM 840 CD GLU A 51 66.393 -22.431 16.835 1.00 0.00 C ATOM 841 OE1 GLU A 51 65.334 -22.136 17.365 1.00 0.00 O ATOM 842 OE2 GLU A 51 67.487 -22.166 17.305 1.00 0.00 O ATOM 0 H GLU A 51 62.776 -22.211 14.023 1.00 0.00 H new ATOM 0 HA GLU A 51 64.938 -20.881 15.281 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.190 -23.279 15.598 1.00 0.00 H new ATOM 0 HB3 GLU A 51 64.851 -23.666 14.022 1.00 0.00 H new ATOM 0 HG2 GLU A 51 66.556 -24.234 15.657 1.00 0.00 H new ATOM 0 HG3 GLU A 51 67.112 -22.792 14.830 1.00 0.00 H new ATOM 849 N VAL A 52 65.338 -21.452 12.096 1.00 0.00 N ATOM 850 CA VAL A 52 66.216 -21.127 10.942 1.00 0.00 C ATOM 851 C VAL A 52 66.326 -19.601 10.834 1.00 0.00 C ATOM 852 O VAL A 52 67.350 -19.060 10.467 1.00 0.00 O ATOM 853 CB VAL A 52 65.593 -21.707 9.670 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.351 -21.217 8.434 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.656 -23.237 9.728 1.00 0.00 C ATOM 0 H VAL A 52 64.438 -21.863 11.849 1.00 0.00 H new ATOM 0 HA VAL A 52 67.210 -21.553 11.076 1.00 0.00 H new ATOM 0 HB VAL A 52 64.556 -21.378 9.603 1.00 0.00 H new ATOM 0 HG11 VAL A 52 65.896 -21.638 7.537 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.306 -20.129 8.387 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.392 -21.534 8.496 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.213 -23.654 8.824 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.696 -23.556 9.803 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.104 -23.591 10.599 1.00 0.00 H new ATOM 865 N VAL A 53 65.268 -18.910 11.168 1.00 0.00 N ATOM 866 CA VAL A 53 65.297 -17.419 11.108 1.00 0.00 C ATOM 867 C VAL A 53 66.214 -16.892 12.212 1.00 0.00 C ATOM 868 O VAL A 53 66.981 -15.970 12.010 1.00 0.00 O ATOM 869 CB VAL A 53 63.878 -16.864 11.302 1.00 0.00 C ATOM 870 CG1 VAL A 53 63.923 -15.338 11.452 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.017 -17.236 10.094 1.00 0.00 C ATOM 0 H VAL A 53 64.385 -19.314 11.480 1.00 0.00 H new ATOM 0 HA VAL A 53 65.673 -17.099 10.136 1.00 0.00 H new ATOM 0 HB VAL A 53 63.447 -17.295 12.206 1.00 0.00 H new ATOM 0 HG11 VAL A 53 62.911 -14.956 11.589 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.530 -15.075 12.318 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.359 -14.897 10.556 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.010 -16.843 10.230 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.454 -16.810 9.191 1.00 0.00 H new ATOM 0 HG23 VAL A 53 62.973 -18.321 9.999 1.00 0.00 H new ATOM 881 N ASP A 54 66.132 -17.468 13.382 1.00 0.00 N ATOM 882 CA ASP A 54 66.994 -16.999 14.507 1.00 0.00 C ATOM 883 C ASP A 54 68.468 -17.161 14.128 1.00 0.00 C ATOM 884 O ASP A 54 69.284 -16.306 14.403 1.00 0.00 O ATOM 885 CB ASP A 54 66.687 -17.814 15.772 1.00 0.00 C ATOM 886 CG ASP A 54 65.299 -17.445 16.300 1.00 0.00 C ATOM 887 OD1 ASP A 54 64.816 -16.383 15.945 1.00 0.00 O ATOM 888 OD2 ASP A 54 64.742 -18.232 17.048 1.00 0.00 O ATOM 0 H ASP A 54 65.507 -18.242 13.607 1.00 0.00 H new ATOM 0 HA ASP A 54 66.788 -15.947 14.704 1.00 0.00 H new ATOM 0 HB2 ASP A 54 66.730 -18.880 15.549 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.441 -17.617 16.535 1.00 0.00 H new ATOM 893 N LYS A 55 68.813 -18.240 13.481 1.00 0.00 N ATOM 894 CA LYS A 55 70.235 -18.435 13.071 1.00 0.00 C ATOM 895 C LYS A 55 70.638 -17.298 12.139 1.00 0.00 C ATOM 896 O LYS A 55 71.652 -16.658 12.318 1.00 0.00 O ATOM 897 CB LYS A 55 70.364 -19.769 12.335 1.00 0.00 C ATOM 898 CG LYS A 55 71.824 -20.033 11.958 1.00 0.00 C ATOM 899 CD LYS A 55 71.911 -21.410 11.298 1.00 0.00 C ATOM 900 CE LYS A 55 73.335 -21.680 10.813 1.00 0.00 C ATOM 901 NZ LYS A 55 74.281 -21.583 11.960 1.00 0.00 N ATOM 0 H LYS A 55 68.176 -18.993 13.219 1.00 0.00 H new ATOM 0 HA LYS A 55 70.882 -18.439 13.948 1.00 0.00 H new ATOM 0 HB2 LYS A 55 69.993 -20.577 12.966 1.00 0.00 H new ATOM 0 HB3 LYS A 55 69.747 -19.757 11.437 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.185 -19.262 11.277 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.457 -19.997 12.845 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.610 -22.180 12.008 1.00 0.00 H new ATOM 0 HD3 LYS A 55 71.218 -21.462 10.458 1.00 0.00 H new ATOM 0 HE2 LYS A 55 73.395 -22.671 10.362 1.00 0.00 H new ATOM 0 HE3 LYS A 55 73.609 -20.961 10.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 75.187 -22.023 11.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 74.437 -20.583 12.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.880 -22.076 12.783 1.00 0.00 H new ATOM 915 N VAL A 56 69.840 -17.050 11.141 1.00 0.00 N ATOM 916 CA VAL A 56 70.159 -15.961 10.180 1.00 0.00 C ATOM 917 C VAL A 56 70.143 -14.616 10.911 1.00 0.00 C ATOM 918 O VAL A 56 70.966 -13.756 10.672 1.00 0.00 O ATOM 919 CB VAL A 56 69.104 -15.938 9.065 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.300 -14.691 8.190 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.238 -17.196 8.203 1.00 0.00 C ATOM 0 H VAL A 56 68.976 -17.557 10.949 1.00 0.00 H new ATOM 0 HA VAL A 56 71.145 -16.135 9.750 1.00 0.00 H new ATOM 0 HB VAL A 56 68.110 -15.911 9.513 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.549 -14.679 7.400 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.196 -13.796 8.803 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.295 -14.712 7.745 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.488 -17.177 7.412 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.233 -17.228 7.759 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.089 -18.080 8.823 1.00 0.00 H new ATOM 931 N MET A 57 69.194 -14.425 11.785 1.00 0.00 N ATOM 932 CA MET A 57 69.100 -13.130 12.519 1.00 0.00 C ATOM 933 C MET A 57 70.377 -12.883 13.323 1.00 0.00 C ATOM 934 O MET A 57 70.897 -11.785 13.352 1.00 0.00 O ATOM 935 CB MET A 57 67.891 -13.178 13.458 1.00 0.00 C ATOM 936 CG MET A 57 67.760 -11.860 14.223 1.00 0.00 C ATOM 937 SD MET A 57 67.468 -10.504 13.055 1.00 0.00 S ATOM 938 CE MET A 57 66.244 -9.600 14.035 1.00 0.00 C ATOM 0 H MET A 57 68.478 -15.111 12.024 1.00 0.00 H new ATOM 0 HA MET A 57 68.980 -12.315 11.805 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.983 -13.365 12.884 1.00 0.00 H new ATOM 0 HB3 MET A 57 68.000 -14.005 14.160 1.00 0.00 H new ATOM 0 HG2 MET A 57 66.938 -11.922 14.936 1.00 0.00 H new ATOM 0 HG3 MET A 57 68.667 -11.670 14.797 1.00 0.00 H new ATOM 0 HE1 MET A 57 66.083 -8.615 13.597 1.00 0.00 H new ATOM 0 HE2 MET A 57 65.304 -10.152 14.042 1.00 0.00 H new ATOM 0 HE3 MET A 57 66.607 -9.488 15.057 1.00 0.00 H new ATOM 948 N GLU A 58 70.883 -13.884 13.982 1.00 0.00 N ATOM 949 CA GLU A 58 72.125 -13.686 14.781 1.00 0.00 C ATOM 950 C GLU A 58 73.245 -13.246 13.840 1.00 0.00 C ATOM 951 O GLU A 58 74.044 -12.386 14.160 1.00 0.00 O ATOM 952 CB GLU A 58 72.507 -14.999 15.472 1.00 0.00 C ATOM 953 CG GLU A 58 71.487 -15.319 16.569 1.00 0.00 C ATOM 954 CD GLU A 58 71.596 -14.285 17.689 1.00 0.00 C ATOM 955 OE1 GLU A 58 72.695 -14.086 18.182 1.00 0.00 O ATOM 956 OE2 GLU A 58 70.581 -13.701 18.031 1.00 0.00 O ATOM 0 H GLU A 58 70.494 -14.827 14.004 1.00 0.00 H new ATOM 0 HA GLU A 58 71.963 -12.923 15.543 1.00 0.00 H new ATOM 0 HB2 GLU A 58 72.539 -15.809 14.743 1.00 0.00 H new ATOM 0 HB3 GLU A 58 73.505 -14.918 15.902 1.00 0.00 H new ATOM 0 HG2 GLU A 58 70.479 -15.316 16.154 1.00 0.00 H new ATOM 0 HG3 GLU A 58 71.665 -16.319 16.965 1.00 0.00 H new ATOM 963 N THR A 59 73.304 -13.832 12.675 1.00 0.00 N ATOM 964 CA THR A 59 74.359 -13.453 11.697 1.00 0.00 C ATOM 965 C THR A 59 74.133 -12.010 11.238 1.00 0.00 C ATOM 966 O THR A 59 75.062 -11.242 11.089 1.00 0.00 O ATOM 967 CB THR A 59 74.296 -14.404 10.494 1.00 0.00 C ATOM 968 OG1 THR A 59 74.511 -15.738 10.938 1.00 0.00 O ATOM 969 CG2 THR A 59 75.370 -14.027 9.471 1.00 0.00 C ATOM 0 H THR A 59 72.663 -14.560 12.359 1.00 0.00 H new ATOM 0 HA THR A 59 75.341 -13.528 12.163 1.00 0.00 H new ATOM 0 HB THR A 59 73.315 -14.325 10.025 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.696 -16.077 11.363 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.318 -14.707 8.621 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.204 -13.005 9.129 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.354 -14.099 9.933 1.00 0.00 H new ATOM 977 N LEU A 60 72.903 -11.633 11.026 1.00 0.00 N ATOM 978 CA LEU A 60 72.614 -10.236 10.591 1.00 0.00 C ATOM 979 C LEU A 60 72.885 -9.270 11.747 1.00 0.00 C ATOM 980 O LEU A 60 73.387 -8.181 11.554 1.00 0.00 O ATOM 981 CB LEU A 60 71.133 -10.118 10.162 1.00 0.00 C ATOM 982 CG LEU A 60 71.001 -10.250 8.643 1.00 0.00 C ATOM 983 CD1 LEU A 60 71.436 -11.651 8.217 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.543 -10.013 8.244 1.00 0.00 C ATOM 0 H LEU A 60 72.084 -12.231 11.135 1.00 0.00 H new ATOM 0 HA LEU A 60 73.257 -9.985 9.748 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.544 -10.893 10.653 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.730 -9.158 10.486 1.00 0.00 H new ATOM 0 HG LEU A 60 71.635 -9.513 8.150 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.343 -11.748 7.135 1.00 0.00 H new ATOM 0 HD12 LEU A 60 72.474 -11.814 8.508 1.00 0.00 H new ATOM 0 HD13 LEU A 60 70.802 -12.392 8.703 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.442 -10.106 7.163 1.00 0.00 H new ATOM 0 HD22 LEU A 60 68.907 -10.752 8.732 1.00 0.00 H new ATOM 0 HD23 LEU A 60 69.239 -9.013 8.552 1.00 0.00 H new ATOM 996 N ASP A 61 72.522 -9.642 12.940 1.00 0.00 N ATOM 997 CA ASP A 61 72.719 -8.722 14.090 1.00 0.00 C ATOM 998 C ASP A 61 74.199 -8.579 14.418 1.00 0.00 C ATOM 999 O ASP A 61 74.738 -9.295 15.237 1.00 0.00 O ATOM 1000 CB ASP A 61 71.990 -9.270 15.313 1.00 0.00 C ATOM 1001 CG ASP A 61 71.971 -8.199 16.405 1.00 0.00 C ATOM 1002 OD1 ASP A 61 72.624 -7.185 16.226 1.00 0.00 O ATOM 1003 OD2 ASP A 61 71.305 -8.415 17.403 1.00 0.00 O ATOM 0 H ASP A 61 72.098 -10.541 13.168 1.00 0.00 H new ATOM 0 HA ASP A 61 72.319 -7.744 13.821 1.00 0.00 H new ATOM 0 HB2 ASP A 61 70.972 -9.555 15.048 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.488 -10.169 15.676 1.00 0.00 H new ATOM 1008 N GLU A 62 74.857 -7.636 13.810 1.00 0.00 N ATOM 1009 CA GLU A 62 76.294 -7.429 14.112 1.00 0.00 C ATOM 1010 C GLU A 62 76.426 -6.863 15.529 1.00 0.00 C ATOM 1011 O GLU A 62 77.447 -7.009 16.172 1.00 0.00 O ATOM 1012 CB GLU A 62 76.894 -6.437 13.105 1.00 0.00 C ATOM 1013 CG GLU A 62 76.981 -7.090 11.722 1.00 0.00 C ATOM 1014 CD GLU A 62 78.017 -8.219 11.751 1.00 0.00 C ATOM 1015 OE1 GLU A 62 78.855 -8.202 12.636 1.00 0.00 O ATOM 1016 OE2 GLU A 62 77.953 -9.078 10.887 1.00 0.00 O ATOM 0 H GLU A 62 74.461 -7.001 13.117 1.00 0.00 H new ATOM 0 HA GLU A 62 76.827 -8.377 14.041 1.00 0.00 H new ATOM 0 HB2 GLU A 62 76.279 -5.539 13.055 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.886 -6.126 13.434 1.00 0.00 H new ATOM 0 HG2 GLU A 62 76.007 -7.484 11.433 1.00 0.00 H new ATOM 0 HG3 GLU A 62 77.259 -6.347 10.975 1.00 0.00 H new ATOM 1023 N ASP A 63 75.401 -6.203 16.014 1.00 0.00 N ATOM 1024 CA ASP A 63 75.461 -5.605 17.383 1.00 0.00 C ATOM 1025 C ASP A 63 74.879 -6.573 18.435 1.00 0.00 C ATOM 1026 O ASP A 63 74.997 -6.346 19.622 1.00 0.00 O ATOM 1027 CB ASP A 63 74.640 -4.308 17.392 1.00 0.00 C ATOM 1028 CG ASP A 63 74.806 -3.579 16.059 1.00 0.00 C ATOM 1029 OD1 ASP A 63 75.922 -3.516 15.570 1.00 0.00 O ATOM 1030 OD2 ASP A 63 73.809 -3.095 15.548 1.00 0.00 O ATOM 0 H ASP A 63 74.523 -6.053 15.517 1.00 0.00 H new ATOM 0 HA ASP A 63 76.503 -5.406 17.633 1.00 0.00 H new ATOM 0 HB2 ASP A 63 73.588 -4.534 17.564 1.00 0.00 H new ATOM 0 HB3 ASP A 63 74.966 -3.666 18.211 1.00 0.00 H new ATOM 1035 N GLY A 64 74.243 -7.633 18.014 1.00 0.00 N ATOM 1036 CA GLY A 64 73.648 -8.587 18.999 1.00 0.00 C ATOM 1037 C GLY A 64 72.473 -7.908 19.710 1.00 0.00 C ATOM 1038 O GLY A 64 72.044 -8.325 20.769 1.00 0.00 O ATOM 0 H GLY A 64 74.109 -7.881 17.034 1.00 0.00 H new ATOM 0 HA2 GLY A 64 73.309 -9.489 18.490 1.00 0.00 H new ATOM 0 HA3 GLY A 64 74.400 -8.894 19.726 1.00 0.00 H new ATOM 1042 N ASP A 65 71.959 -6.856 19.134 1.00 0.00 N ATOM 1043 CA ASP A 65 70.823 -6.121 19.763 1.00 0.00 C ATOM 1044 C ASP A 65 69.563 -6.985 19.743 1.00 0.00 C ATOM 1045 O ASP A 65 68.566 -6.651 20.349 1.00 0.00 O ATOM 1046 CB ASP A 65 70.542 -4.848 18.963 1.00 0.00 C ATOM 1047 CG ASP A 65 71.692 -3.859 19.132 1.00 0.00 C ATOM 1048 OD1 ASP A 65 72.363 -3.927 20.148 1.00 0.00 O ATOM 1049 OD2 ASP A 65 71.884 -3.054 18.235 1.00 0.00 O ATOM 0 H ASP A 65 72.280 -6.470 18.246 1.00 0.00 H new ATOM 0 HA ASP A 65 71.088 -5.878 20.792 1.00 0.00 H new ATOM 0 HB2 ASP A 65 70.414 -5.092 17.908 1.00 0.00 H new ATOM 0 HB3 ASP A 65 69.610 -4.395 19.301 1.00 0.00 H new ATOM 1054 N GLY A 66 69.589 -8.085 19.048 1.00 0.00 N ATOM 1055 CA GLY A 66 68.381 -8.956 18.988 1.00 0.00 C ATOM 1056 C GLY A 66 67.468 -8.465 17.866 1.00 0.00 C ATOM 1057 O GLY A 66 66.602 -9.181 17.405 1.00 0.00 O ATOM 0 H GLY A 66 70.393 -8.420 18.518 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.672 -9.991 18.810 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.852 -8.932 19.941 1.00 0.00 H new ATOM 1061 N GLU A 67 67.660 -7.248 17.413 1.00 0.00 N ATOM 1062 CA GLU A 67 66.813 -6.689 16.314 1.00 0.00 C ATOM 1063 C GLU A 67 67.720 -6.101 15.231 1.00 0.00 C ATOM 1064 O GLU A 67 68.898 -5.889 15.449 1.00 0.00 O ATOM 1065 CB GLU A 67 65.907 -5.593 16.878 1.00 0.00 C ATOM 1066 CG GLU A 67 64.910 -6.215 17.858 1.00 0.00 C ATOM 1067 CD GLU A 67 64.064 -5.113 18.492 1.00 0.00 C ATOM 1068 OE1 GLU A 67 64.310 -3.957 18.188 1.00 0.00 O ATOM 1069 OE2 GLU A 67 63.184 -5.440 19.271 1.00 0.00 O ATOM 0 H GLU A 67 68.376 -6.612 17.763 1.00 0.00 H new ATOM 0 HA GLU A 67 66.197 -7.479 15.884 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.505 -4.835 17.383 1.00 0.00 H new ATOM 0 HB3 GLU A 67 65.375 -5.093 16.069 1.00 0.00 H new ATOM 0 HG2 GLU A 67 64.269 -6.927 17.338 1.00 0.00 H new ATOM 0 HG3 GLU A 67 65.442 -6.770 18.631 1.00 0.00 H new ATOM 1076 N CYS A 68 67.187 -5.837 14.058 1.00 0.00 N ATOM 1077 CA CYS A 68 68.020 -5.262 12.955 1.00 0.00 C ATOM 1078 C CYS A 68 67.719 -3.769 12.810 1.00 0.00 C ATOM 1079 O CYS A 68 66.652 -3.377 12.378 1.00 0.00 O ATOM 1080 CB CYS A 68 67.662 -5.966 11.645 1.00 0.00 C ATOM 1081 SG CYS A 68 68.107 -7.719 11.752 1.00 0.00 S ATOM 0 H CYS A 68 66.208 -5.996 13.819 1.00 0.00 H new ATOM 0 HA CYS A 68 69.076 -5.403 13.184 1.00 0.00 H new ATOM 0 HB2 CYS A 68 66.595 -5.863 11.445 1.00 0.00 H new ATOM 0 HB3 CYS A 68 68.188 -5.497 10.813 1.00 0.00 H new ATOM 0 HG CYS A 68 67.799 -8.314 10.638 1.00 0.00 H new ATOM 1087 N ASP A 69 68.649 -2.936 13.185 1.00 0.00 N ATOM 1088 CA ASP A 69 68.425 -1.464 13.096 1.00 0.00 C ATOM 1089 C ASP A 69 68.391 -0.997 11.634 1.00 0.00 C ATOM 1090 O ASP A 69 68.593 -1.760 10.709 1.00 0.00 O ATOM 1091 CB ASP A 69 69.544 -0.736 13.847 1.00 0.00 C ATOM 1092 CG ASP A 69 69.131 0.715 14.113 1.00 0.00 C ATOM 1093 OD1 ASP A 69 69.226 1.517 13.199 1.00 0.00 O ATOM 1094 OD2 ASP A 69 68.732 1.000 15.231 1.00 0.00 O ATOM 0 H ASP A 69 69.560 -3.212 13.551 1.00 0.00 H new ATOM 0 HA ASP A 69 67.461 -1.231 13.548 1.00 0.00 H new ATOM 0 HB2 ASP A 69 69.752 -1.243 14.789 1.00 0.00 H new ATOM 0 HB3 ASP A 69 70.463 -0.761 13.262 1.00 0.00 H new ATOM 1099 N PHE A 70 68.142 0.269 11.446 1.00 0.00 N ATOM 1100 CA PHE A 70 68.093 0.840 10.069 1.00 0.00 C ATOM 1101 C PHE A 70 69.451 0.634 9.396 1.00 0.00 C ATOM 1102 O PHE A 70 69.540 0.206 8.260 1.00 0.00 O ATOM 1103 CB PHE A 70 67.797 2.337 10.142 1.00 0.00 C ATOM 1104 CG PHE A 70 67.737 2.901 8.741 1.00 0.00 C ATOM 1105 CD1 PHE A 70 68.900 3.380 8.135 1.00 0.00 C ATOM 1106 CD2 PHE A 70 66.517 2.948 8.054 1.00 0.00 C ATOM 1107 CE1 PHE A 70 68.850 3.907 6.839 1.00 0.00 C ATOM 1108 CE2 PHE A 70 66.466 3.476 6.757 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.634 3.955 6.151 1.00 0.00 C ATOM 0 H PHE A 70 67.969 0.940 12.195 1.00 0.00 H new ATOM 0 HA PHE A 70 67.310 0.342 9.497 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.851 2.508 10.656 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.570 2.845 10.719 1.00 0.00 H new ATOM 0 HD1 PHE A 70 69.839 3.344 8.667 1.00 0.00 H new ATOM 0 HD2 PHE A 70 65.617 2.578 8.523 1.00 0.00 H new ATOM 0 HE1 PHE A 70 69.750 4.276 6.371 1.00 0.00 H new ATOM 0 HE2 PHE A 70 65.527 3.513 6.225 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.595 4.362 5.151 1.00 0.00 H new ATOM 1119 N GLN A 71 70.504 0.976 10.081 1.00 0.00 N ATOM 1120 CA GLN A 71 71.861 0.838 9.479 1.00 0.00 C ATOM 1121 C GLN A 71 72.099 -0.630 9.117 1.00 0.00 C ATOM 1122 O GLN A 71 72.418 -0.950 7.990 1.00 0.00 O ATOM 1123 CB GLN A 71 72.914 1.312 10.487 1.00 0.00 C ATOM 1124 CG GLN A 71 74.317 1.183 9.885 1.00 0.00 C ATOM 1125 CD GLN A 71 75.340 1.706 10.896 1.00 0.00 C ATOM 1126 OE1 GLN A 71 74.983 2.379 11.843 1.00 0.00 O ATOM 1127 NE2 GLN A 71 76.603 1.417 10.745 1.00 0.00 N ATOM 0 H GLN A 71 70.486 1.345 11.032 1.00 0.00 H new ATOM 0 HA GLN A 71 71.935 1.447 8.578 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.723 2.349 10.764 1.00 0.00 H new ATOM 0 HB3 GLN A 71 72.846 0.721 11.400 1.00 0.00 H new ATOM 0 HG2 GLN A 71 74.528 0.142 9.640 1.00 0.00 H new ATOM 0 HG3 GLN A 71 74.382 1.749 8.956 1.00 0.00 H new ATOM 0 HE21 GLN A 71 76.906 0.852 9.951 1.00 0.00 H new ATOM 0 HE22 GLN A 71 77.288 1.756 11.421 1.00 0.00 H new ATOM 1136 N GLU A 72 71.939 -1.526 10.053 1.00 0.00 N ATOM 1137 CA GLU A 72 72.152 -2.971 9.734 1.00 0.00 C ATOM 1138 C GLU A 72 71.169 -3.371 8.634 1.00 0.00 C ATOM 1139 O GLU A 72 71.519 -4.018 7.670 1.00 0.00 O ATOM 1140 CB GLU A 72 71.878 -3.802 10.990 1.00 0.00 C ATOM 1141 CG GLU A 72 72.983 -3.555 12.017 1.00 0.00 C ATOM 1142 CD GLU A 72 72.586 -4.184 13.356 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.795 -3.577 14.060 1.00 0.00 O ATOM 1144 OE2 GLU A 72 73.078 -5.258 13.657 1.00 0.00 O ATOM 0 H GLU A 72 71.673 -1.325 11.017 1.00 0.00 H new ATOM 0 HA GLU A 72 73.175 -3.143 9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.909 -3.535 11.411 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.834 -4.861 10.736 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.922 -3.983 11.666 1.00 0.00 H new ATOM 0 HG3 GLU A 72 73.147 -2.484 12.140 1.00 0.00 H new ATOM 1151 N PHE A 73 69.936 -2.991 8.798 1.00 0.00 N ATOM 1152 CA PHE A 73 68.896 -3.343 7.787 1.00 0.00 C ATOM 1153 C PHE A 73 69.455 -3.076 6.380 1.00 0.00 C ATOM 1154 O PHE A 73 69.231 -3.835 5.458 1.00 0.00 O ATOM 1155 CB PHE A 73 67.638 -2.503 8.023 1.00 0.00 C ATOM 1156 CG PHE A 73 66.679 -2.689 6.869 1.00 0.00 C ATOM 1157 CD1 PHE A 73 66.759 -1.841 5.758 1.00 0.00 C ATOM 1158 CD2 PHE A 73 65.714 -3.702 6.907 1.00 0.00 C ATOM 1159 CE1 PHE A 73 65.877 -2.004 4.687 1.00 0.00 C ATOM 1160 CE2 PHE A 73 64.828 -3.866 5.834 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.909 -3.016 4.724 1.00 0.00 C ATOM 0 H PHE A 73 69.598 -2.448 9.593 1.00 0.00 H new ATOM 0 HA PHE A 73 68.633 -4.397 7.879 1.00 0.00 H new ATOM 0 HB2 PHE A 73 67.161 -2.800 8.957 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.905 -1.451 8.121 1.00 0.00 H new ATOM 0 HD1 PHE A 73 67.504 -1.059 5.729 1.00 0.00 H new ATOM 0 HD2 PHE A 73 65.652 -4.357 7.763 1.00 0.00 H new ATOM 0 HE1 PHE A 73 65.941 -1.350 3.830 1.00 0.00 H new ATOM 0 HE2 PHE A 73 64.083 -4.647 5.863 1.00 0.00 H new ATOM 0 HZ PHE A 73 64.226 -3.141 3.897 1.00 0.00 H new ATOM 1171 N MET A 74 70.195 -2.014 6.220 1.00 0.00 N ATOM 1172 CA MET A 74 70.793 -1.699 4.886 1.00 0.00 C ATOM 1173 C MET A 74 71.851 -2.757 4.549 1.00 0.00 C ATOM 1174 O MET A 74 72.109 -3.057 3.399 1.00 0.00 O ATOM 1175 CB MET A 74 71.444 -0.308 4.934 1.00 0.00 C ATOM 1176 CG MET A 74 71.934 0.096 3.537 1.00 0.00 C ATOM 1177 SD MET A 74 70.513 0.370 2.445 1.00 0.00 S ATOM 1178 CE MET A 74 70.207 2.104 2.875 1.00 0.00 C ATOM 0 H MET A 74 70.414 -1.345 6.958 1.00 0.00 H new ATOM 0 HA MET A 74 70.017 -1.704 4.121 1.00 0.00 H new ATOM 0 HB2 MET A 74 70.726 0.425 5.302 1.00 0.00 H new ATOM 0 HB3 MET A 74 72.280 -0.314 5.633 1.00 0.00 H new ATOM 0 HG2 MET A 74 72.536 1.003 3.601 1.00 0.00 H new ATOM 0 HG3 MET A 74 72.575 -0.684 3.126 1.00 0.00 H new ATOM 0 HE1 MET A 74 69.356 2.476 2.304 1.00 0.00 H new ATOM 0 HE2 MET A 74 69.991 2.182 3.940 1.00 0.00 H new ATOM 0 HE3 MET A 74 71.090 2.698 2.640 1.00 0.00 H new ATOM 1188 N ALA A 75 72.453 -3.341 5.554 1.00 0.00 N ATOM 1189 CA ALA A 75 73.479 -4.395 5.297 1.00 0.00 C ATOM 1190 C ALA A 75 72.821 -5.539 4.525 1.00 0.00 C ATOM 1191 O ALA A 75 73.243 -5.914 3.449 1.00 0.00 O ATOM 1192 CB ALA A 75 74.013 -4.920 6.633 1.00 0.00 C ATOM 0 H ALA A 75 72.279 -3.134 6.538 1.00 0.00 H new ATOM 0 HA ALA A 75 74.305 -3.981 4.718 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.762 -5.690 6.448 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.465 -4.100 7.192 1.00 0.00 H new ATOM 0 HB3 ALA A 75 73.192 -5.344 7.211 1.00 0.00 H new ATOM 1198 N PHE A 76 71.791 -6.099 5.090 1.00 0.00 N ATOM 1199 CA PHE A 76 71.090 -7.232 4.423 1.00 0.00 C ATOM 1200 C PHE A 76 70.661 -6.792 3.025 1.00 0.00 C ATOM 1201 O PHE A 76 70.765 -7.538 2.070 1.00 0.00 O ATOM 1202 CB PHE A 76 69.863 -7.639 5.237 1.00 0.00 C ATOM 1203 CG PHE A 76 69.172 -8.783 4.544 1.00 0.00 C ATOM 1204 CD1 PHE A 76 69.693 -10.074 4.662 1.00 0.00 C ATOM 1205 CD2 PHE A 76 68.013 -8.560 3.790 1.00 0.00 C ATOM 1206 CE1 PHE A 76 69.058 -11.146 4.033 1.00 0.00 C ATOM 1207 CE2 PHE A 76 67.376 -9.635 3.155 1.00 0.00 C ATOM 1208 CZ PHE A 76 67.901 -10.930 3.279 1.00 0.00 C ATOM 0 H PHE A 76 71.401 -5.820 5.990 1.00 0.00 H new ATOM 0 HA PHE A 76 71.761 -8.088 4.352 1.00 0.00 H new ATOM 0 HB2 PHE A 76 70.160 -7.933 6.244 1.00 0.00 H new ATOM 0 HB3 PHE A 76 69.182 -6.794 5.339 1.00 0.00 H new ATOM 0 HD1 PHE A 76 70.589 -10.243 5.241 1.00 0.00 H new ATOM 0 HD2 PHE A 76 67.611 -7.562 3.698 1.00 0.00 H new ATOM 0 HE1 PHE A 76 69.461 -12.143 4.129 1.00 0.00 H new ATOM 0 HE2 PHE A 76 66.483 -9.467 2.572 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.411 -11.760 2.792 1.00 0.00 H new ATOM 1218 N VAL A 77 70.207 -5.580 2.886 1.00 0.00 N ATOM 1219 CA VAL A 77 69.811 -5.110 1.531 1.00 0.00 C ATOM 1220 C VAL A 77 71.049 -5.191 0.634 1.00 0.00 C ATOM 1221 O VAL A 77 70.989 -5.651 -0.491 1.00 0.00 O ATOM 1222 CB VAL A 77 69.299 -3.660 1.596 1.00 0.00 C ATOM 1223 CG1 VAL A 77 69.146 -3.103 0.179 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.930 -3.629 2.288 1.00 0.00 C ATOM 0 H VAL A 77 70.094 -4.902 3.640 1.00 0.00 H new ATOM 0 HA VAL A 77 69.008 -5.731 1.134 1.00 0.00 H new ATOM 0 HB VAL A 77 70.013 -3.056 2.156 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.783 -2.076 0.229 1.00 0.00 H new ATOM 0 HG12 VAL A 77 70.112 -3.123 -0.326 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.434 -3.713 -0.377 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.568 -2.602 2.333 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.223 -4.238 1.724 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.024 -4.026 3.299 1.00 0.00 H new ATOM 1234 N SER A 78 72.173 -4.741 1.126 1.00 0.00 N ATOM 1235 CA SER A 78 73.421 -4.788 0.313 1.00 0.00 C ATOM 1236 C SER A 78 73.841 -6.242 0.081 1.00 0.00 C ATOM 1237 O SER A 78 74.263 -6.611 -0.996 1.00 0.00 O ATOM 1238 CB SER A 78 74.532 -4.055 1.061 1.00 0.00 C ATOM 1239 OG SER A 78 74.964 -4.852 2.156 1.00 0.00 O ATOM 0 H SER A 78 72.280 -4.342 2.059 1.00 0.00 H new ATOM 0 HA SER A 78 73.242 -4.311 -0.650 1.00 0.00 H new ATOM 0 HB2 SER A 78 75.367 -3.854 0.390 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.171 -3.090 1.418 1.00 0.00 H new ATOM 0 HG SER A 78 74.215 -4.996 2.772 1.00 0.00 H new ATOM 1245 N MET A 79 73.767 -7.064 1.089 1.00 0.00 N ATOM 1246 CA MET A 79 74.203 -8.480 0.922 1.00 0.00 C ATOM 1247 C MET A 79 73.425 -9.112 -0.228 1.00 0.00 C ATOM 1248 O MET A 79 73.977 -9.801 -1.062 1.00 0.00 O ATOM 1249 CB MET A 79 73.930 -9.253 2.215 1.00 0.00 C ATOM 1250 CG MET A 79 74.466 -10.679 2.079 1.00 0.00 C ATOM 1251 SD MET A 79 74.192 -11.577 3.628 1.00 0.00 S ATOM 1252 CE MET A 79 74.628 -13.223 3.019 1.00 0.00 C ATOM 0 H MET A 79 73.425 -6.819 2.018 1.00 0.00 H new ATOM 0 HA MET A 79 75.270 -8.513 0.701 1.00 0.00 H new ATOM 0 HB2 MET A 79 74.407 -8.753 3.058 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.860 -9.273 2.420 1.00 0.00 H new ATOM 0 HG2 MET A 79 73.966 -11.190 1.256 1.00 0.00 H new ATOM 0 HG3 MET A 79 75.530 -10.658 1.841 1.00 0.00 H new ATOM 0 HE1 MET A 79 74.527 -13.948 3.827 1.00 0.00 H new ATOM 0 HE2 MET A 79 73.962 -13.496 2.201 1.00 0.00 H new ATOM 0 HE3 MET A 79 75.658 -13.218 2.662 1.00 0.00 H new ATOM 1262 N VAL A 80 72.156 -8.858 -0.302 1.00 0.00 N ATOM 1263 CA VAL A 80 71.355 -9.416 -1.420 1.00 0.00 C ATOM 1264 C VAL A 80 71.922 -8.886 -2.742 1.00 0.00 C ATOM 1265 O VAL A 80 71.909 -9.557 -3.757 1.00 0.00 O ATOM 1266 CB VAL A 80 69.898 -8.988 -1.267 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.110 -9.411 -2.507 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.308 -9.669 -0.032 1.00 0.00 C ATOM 0 H VAL A 80 71.636 -8.287 0.364 1.00 0.00 H new ATOM 0 HA VAL A 80 71.404 -10.505 -1.410 1.00 0.00 H new ATOM 0 HB VAL A 80 69.840 -7.905 -1.155 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.069 -9.106 -2.398 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.538 -8.935 -3.390 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.161 -10.494 -2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.267 -9.369 0.086 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.363 -10.751 -0.152 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.873 -9.373 0.852 1.00 0.00 H new ATOM 1278 N THR A 81 72.453 -7.696 -2.717 1.00 0.00 N ATOM 1279 CA THR A 81 73.066 -7.115 -3.947 1.00 0.00 C ATOM 1280 C THR A 81 74.477 -7.689 -4.119 1.00 0.00 C ATOM 1281 O THR A 81 74.859 -8.144 -5.181 1.00 0.00 O ATOM 1282 CB THR A 81 73.140 -5.591 -3.803 1.00 0.00 C ATOM 1283 OG1 THR A 81 71.871 -5.097 -3.410 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.543 -4.951 -5.132 1.00 0.00 C ATOM 0 H THR A 81 72.490 -7.096 -1.893 1.00 0.00 H new ATOM 0 HA THR A 81 72.462 -7.365 -4.819 1.00 0.00 H new ATOM 0 HB THR A 81 73.887 -5.341 -3.050 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.737 -5.263 -2.454 1.00 0.00 H new ATOM 0 HG21 THR A 81 73.591 -3.868 -5.015 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.520 -5.327 -5.436 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.805 -5.201 -5.895 1.00 0.00 H new ATOM 1292 N THR A 82 75.250 -7.664 -3.065 1.00 0.00 N ATOM 1293 CA THR A 82 76.648 -8.191 -3.113 1.00 0.00 C ATOM 1294 C THR A 82 76.636 -9.718 -3.188 1.00 0.00 C ATOM 1295 O THR A 82 77.611 -10.341 -3.559 1.00 0.00 O ATOM 1296 CB THR A 82 77.385 -7.750 -1.845 1.00 0.00 C ATOM 1297 OG1 THR A 82 77.102 -6.381 -1.593 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.894 -7.931 -2.024 1.00 0.00 C ATOM 0 H THR A 82 74.967 -7.295 -2.157 1.00 0.00 H new ATOM 0 HA THR A 82 77.152 -7.800 -3.997 1.00 0.00 H new ATOM 0 HB THR A 82 77.051 -8.360 -1.006 1.00 0.00 H new ATOM 0 HG1 THR A 82 77.526 -5.827 -2.282 1.00 0.00 H new ATOM 0 HG21 THR A 82 79.409 -7.614 -1.117 1.00 0.00 H new ATOM 0 HG22 THR A 82 79.114 -8.981 -2.219 1.00 0.00 H new ATOM 0 HG23 THR A 82 79.236 -7.327 -2.864 1.00 0.00 H new ATOM 1306 N ALA A 83 75.537 -10.330 -2.852 1.00 0.00 N ATOM 1307 CA ALA A 83 75.475 -11.816 -2.921 1.00 0.00 C ATOM 1308 C ALA A 83 75.333 -12.260 -4.379 1.00 0.00 C ATOM 1309 O ALA A 83 75.941 -13.223 -4.805 1.00 0.00 O ATOM 1310 CB ALA A 83 74.273 -12.323 -2.124 1.00 0.00 C ATOM 0 H ALA A 83 74.684 -9.870 -2.534 1.00 0.00 H new ATOM 0 HA ALA A 83 76.392 -12.228 -2.500 1.00 0.00 H new ATOM 0 HB1 ALA A 83 74.233 -13.411 -2.178 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.371 -12.015 -1.083 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.357 -11.905 -2.542 1.00 0.00 H new ATOM 1316 N CYS A 84 74.516 -11.579 -5.144 1.00 0.00 N ATOM 1317 CA CYS A 84 74.313 -11.981 -6.571 1.00 0.00 C ATOM 1318 C CYS A 84 75.377 -11.340 -7.468 1.00 0.00 C ATOM 1319 O CYS A 84 75.664 -10.162 -7.374 1.00 0.00 O ATOM 1320 CB CYS A 84 72.927 -11.533 -7.039 1.00 0.00 C ATOM 1321 SG CYS A 84 71.652 -12.453 -6.141 1.00 0.00 S ATOM 0 H CYS A 84 73.982 -10.764 -4.843 1.00 0.00 H new ATOM 0 HA CYS A 84 74.397 -13.066 -6.640 1.00 0.00 H new ATOM 0 HB2 CYS A 84 72.804 -10.463 -6.870 1.00 0.00 H new ATOM 0 HB3 CYS A 84 72.823 -11.701 -8.111 1.00 0.00 H new ATOM 0 HG CYS A 84 70.476 -12.067 -6.540 1.00 0.00 H new ATOM 1327 N HIS A 85 75.946 -12.114 -8.354 1.00 0.00 N ATOM 1328 CA HIS A 85 76.976 -11.577 -9.287 1.00 0.00 C ATOM 1329 C HIS A 85 76.265 -10.873 -10.452 1.00 0.00 C ATOM 1330 O HIS A 85 75.061 -10.956 -10.584 1.00 0.00 O ATOM 1331 CB HIS A 85 77.834 -12.734 -9.802 1.00 0.00 C ATOM 1332 CG HIS A 85 78.640 -13.290 -8.659 1.00 0.00 C ATOM 1333 ND1 HIS A 85 79.851 -12.734 -8.272 1.00 0.00 N ATOM 1334 CD2 HIS A 85 78.418 -14.341 -7.800 1.00 0.00 C ATOM 1335 CE1 HIS A 85 80.307 -13.441 -7.223 1.00 0.00 C ATOM 1336 NE2 HIS A 85 79.473 -14.429 -6.896 1.00 0.00 N ATOM 0 H HIS A 85 75.738 -13.106 -8.471 1.00 0.00 H new ATOM 0 HA HIS A 85 77.621 -10.861 -8.777 1.00 0.00 H new ATOM 0 HB2 HIS A 85 77.201 -13.511 -10.230 1.00 0.00 H new ATOM 0 HB3 HIS A 85 78.495 -12.388 -10.596 1.00 0.00 H new ATOM 0 HD2 HIS A 85 77.559 -14.996 -7.823 1.00 0.00 H new ATOM 0 HE1 HIS A 85 81.234 -13.234 -6.709 1.00 0.00 H new ATOM 0 HE2 HIS A 85 79.585 -15.107 -6.142 1.00 0.00 H new ATOM 1345 N GLU A 86 76.980 -10.160 -11.288 1.00 0.00 N ATOM 1346 CA GLU A 86 76.302 -9.448 -12.414 1.00 0.00 C ATOM 1347 C GLU A 86 75.349 -10.408 -13.133 1.00 0.00 C ATOM 1348 O GLU A 86 75.768 -11.368 -13.748 1.00 0.00 O ATOM 1349 CB GLU A 86 77.348 -8.938 -13.409 1.00 0.00 C ATOM 1350 CG GLU A 86 78.140 -7.798 -12.773 1.00 0.00 C ATOM 1351 CD GLU A 86 79.180 -7.281 -13.769 1.00 0.00 C ATOM 1352 OE1 GLU A 86 79.352 -7.914 -14.799 1.00 0.00 O ATOM 1353 OE2 GLU A 86 79.779 -6.257 -13.491 1.00 0.00 O ATOM 0 H GLU A 86 77.992 -10.041 -11.240 1.00 0.00 H new ATOM 0 HA GLU A 86 75.739 -8.605 -12.013 1.00 0.00 H new ATOM 0 HB2 GLU A 86 78.020 -9.748 -13.694 1.00 0.00 H new ATOM 0 HB3 GLU A 86 76.861 -8.592 -14.321 1.00 0.00 H new ATOM 0 HG2 GLU A 86 77.467 -6.991 -12.482 1.00 0.00 H new ATOM 0 HG3 GLU A 86 78.632 -8.145 -11.865 1.00 0.00 H new ATOM 1360 N PHE A 87 74.062 -10.154 -13.053 1.00 0.00 N ATOM 1361 CA PHE A 87 73.063 -11.047 -13.719 1.00 0.00 C ATOM 1362 C PHE A 87 72.500 -10.385 -14.982 1.00 0.00 C ATOM 1363 O PHE A 87 71.969 -11.052 -15.848 1.00 0.00 O ATOM 1364 CB PHE A 87 71.917 -11.332 -12.750 1.00 0.00 C ATOM 1365 CG PHE A 87 70.922 -12.248 -13.418 1.00 0.00 C ATOM 1366 CD1 PHE A 87 71.072 -13.636 -13.315 1.00 0.00 C ATOM 1367 CD2 PHE A 87 69.847 -11.709 -14.131 1.00 0.00 C ATOM 1368 CE1 PHE A 87 70.143 -14.486 -13.928 1.00 0.00 C ATOM 1369 CE2 PHE A 87 68.920 -12.558 -14.746 1.00 0.00 C ATOM 1370 CZ PHE A 87 69.068 -13.948 -14.644 1.00 0.00 C ATOM 0 H PHE A 87 73.661 -9.361 -12.552 1.00 0.00 H new ATOM 0 HA PHE A 87 73.559 -11.976 -14.001 1.00 0.00 H new ATOM 0 HB2 PHE A 87 72.300 -11.793 -11.840 1.00 0.00 H new ATOM 0 HB3 PHE A 87 71.433 -10.401 -12.456 1.00 0.00 H new ATOM 0 HD1 PHE A 87 71.903 -14.051 -12.764 1.00 0.00 H new ATOM 0 HD2 PHE A 87 69.732 -10.638 -14.207 1.00 0.00 H new ATOM 0 HE1 PHE A 87 70.256 -15.557 -13.848 1.00 0.00 H new ATOM 0 HE2 PHE A 87 68.091 -12.142 -15.299 1.00 0.00 H new ATOM 0 HZ PHE A 87 68.352 -14.604 -15.118 1.00 0.00 H new ATOM 1380 N PHE A 88 72.586 -9.085 -15.094 1.00 0.00 N ATOM 1381 CA PHE A 88 72.025 -8.414 -16.306 1.00 0.00 C ATOM 1382 C PHE A 88 73.010 -8.533 -17.474 1.00 0.00 C ATOM 1383 O PHE A 88 74.007 -7.844 -17.537 1.00 0.00 O ATOM 1384 CB PHE A 88 71.747 -6.934 -15.991 1.00 0.00 C ATOM 1385 CG PHE A 88 73.046 -6.187 -15.788 1.00 0.00 C ATOM 1386 CD1 PHE A 88 73.722 -6.284 -14.568 1.00 0.00 C ATOM 1387 CD2 PHE A 88 73.577 -5.400 -16.821 1.00 0.00 C ATOM 1388 CE1 PHE A 88 74.927 -5.599 -14.378 1.00 0.00 C ATOM 1389 CE2 PHE A 88 74.783 -4.713 -16.630 1.00 0.00 C ATOM 1390 CZ PHE A 88 75.458 -4.815 -15.408 1.00 0.00 C ATOM 0 H PHE A 88 73.015 -8.464 -14.408 1.00 0.00 H new ATOM 0 HA PHE A 88 71.091 -8.900 -16.589 1.00 0.00 H new ATOM 0 HB2 PHE A 88 71.183 -6.481 -16.807 1.00 0.00 H new ATOM 0 HB3 PHE A 88 71.131 -6.855 -15.095 1.00 0.00 H new ATOM 0 HD1 PHE A 88 73.314 -6.888 -13.771 1.00 0.00 H new ATOM 0 HD2 PHE A 88 73.056 -5.324 -17.764 1.00 0.00 H new ATOM 0 HE1 PHE A 88 75.448 -5.675 -13.435 1.00 0.00 H new ATOM 0 HE2 PHE A 88 75.191 -4.106 -17.424 1.00 0.00 H new ATOM 0 HZ PHE A 88 76.389 -4.288 -15.260 1.00 0.00 H new ATOM 1400 N GLU A 89 72.729 -9.409 -18.409 1.00 0.00 N ATOM 1401 CA GLU A 89 73.632 -9.583 -19.593 1.00 0.00 C ATOM 1402 C GLU A 89 72.943 -9.010 -20.832 1.00 0.00 C ATOM 1403 O GLU A 89 71.831 -9.377 -21.158 1.00 0.00 O ATOM 1404 CB GLU A 89 73.910 -11.072 -19.811 1.00 0.00 C ATOM 1405 CG GLU A 89 74.913 -11.242 -20.955 1.00 0.00 C ATOM 1406 CD GLU A 89 75.275 -12.720 -21.098 1.00 0.00 C ATOM 1407 OE1 GLU A 89 74.822 -13.500 -20.277 1.00 0.00 O ATOM 1408 OE2 GLU A 89 76.002 -13.046 -22.022 1.00 0.00 O ATOM 0 H GLU A 89 71.908 -10.015 -18.403 1.00 0.00 H new ATOM 0 HA GLU A 89 74.573 -9.062 -19.417 1.00 0.00 H new ATOM 0 HB2 GLU A 89 74.305 -11.517 -18.898 1.00 0.00 H new ATOM 0 HB3 GLU A 89 72.983 -11.595 -20.045 1.00 0.00 H new ATOM 0 HG2 GLU A 89 74.486 -10.869 -21.886 1.00 0.00 H new ATOM 0 HG3 GLU A 89 75.809 -10.654 -20.758 1.00 0.00 H new ATOM 1415 N HIS A 90 73.585 -8.104 -21.519 1.00 0.00 N ATOM 1416 CA HIS A 90 72.950 -7.506 -22.728 1.00 0.00 C ATOM 1417 C HIS A 90 71.564 -6.984 -22.346 1.00 0.00 C ATOM 1418 O HIS A 90 71.388 -6.383 -21.304 1.00 0.00 O ATOM 1419 CB HIS A 90 72.816 -8.575 -23.819 1.00 0.00 C ATOM 1420 CG HIS A 90 72.441 -7.921 -25.121 1.00 0.00 C ATOM 1421 ND1 HIS A 90 73.270 -7.003 -25.750 1.00 0.00 N ATOM 1422 CD2 HIS A 90 71.331 -8.035 -25.925 1.00 0.00 C ATOM 1423 CE1 HIS A 90 72.652 -6.604 -26.877 1.00 0.00 C ATOM 1424 NE2 HIS A 90 71.470 -7.204 -27.028 1.00 0.00 N ATOM 0 H HIS A 90 74.517 -7.754 -21.297 1.00 0.00 H new ATOM 0 HA HIS A 90 73.563 -6.688 -23.105 1.00 0.00 H new ATOM 0 HB2 HIS A 90 73.756 -9.116 -23.929 1.00 0.00 H new ATOM 0 HB3 HIS A 90 72.058 -9.306 -23.536 1.00 0.00 H new ATOM 0 HD2 HIS A 90 70.482 -8.673 -25.728 1.00 0.00 H new ATOM 0 HE1 HIS A 90 73.062 -5.887 -27.573 1.00 0.00 H new ATOM 0 HE2 HIS A 90 70.808 -7.078 -27.793 1.00 0.00 H new ATOM 1433 N GLU A 91 70.577 -7.227 -23.169 1.00 0.00 N ATOM 1434 CA GLU A 91 69.194 -6.770 -22.856 1.00 0.00 C ATOM 1435 C GLU A 91 69.221 -5.351 -22.273 1.00 0.00 C ATOM 1436 O GLU A 91 69.414 -4.422 -23.041 1.00 0.00 O ATOM 1437 CB GLU A 91 68.592 -7.745 -21.845 1.00 0.00 C ATOM 1438 CG GLU A 91 68.124 -9.021 -22.557 1.00 0.00 C ATOM 1439 CD GLU A 91 66.927 -8.707 -23.457 1.00 0.00 C ATOM 1440 OE1 GLU A 91 65.942 -8.198 -22.946 1.00 0.00 O ATOM 1441 OE2 GLU A 91 67.015 -8.981 -24.644 1.00 0.00 O ATOM 1442 OXT GLU A 91 69.044 -5.220 -21.075 1.00 0.00 O ATOM 0 H GLU A 91 70.673 -7.728 -24.053 1.00 0.00 H new ATOM 0 HA GLU A 91 68.591 -6.748 -23.764 1.00 0.00 H new ATOM 0 HB2 GLU A 91 69.331 -7.994 -21.084 1.00 0.00 H new ATOM 0 HB3 GLU A 91 67.752 -7.277 -21.332 1.00 0.00 H new ATOM 0 HG2 GLU A 91 68.938 -9.435 -23.152 1.00 0.00 H new ATOM 0 HG3 GLU A 91 67.849 -9.778 -21.822 1.00 0.00 H new TER 1449 GLU A 91 ATOM 1450 N SER B 1 58.879 -6.556 -8.736 1.00 0.00 N ATOM 1451 CA SER B 1 58.779 -5.789 -7.458 1.00 0.00 C ATOM 1452 C SER B 1 59.458 -4.422 -7.610 1.00 0.00 C ATOM 1453 O SER B 1 60.515 -4.302 -8.198 1.00 0.00 O ATOM 1454 CB SER B 1 59.452 -6.580 -6.337 1.00 0.00 C ATOM 1455 OG SER B 1 59.132 -7.958 -6.479 1.00 0.00 O ATOM 0 H1 SER B 1 59.092 -7.552 -8.527 1.00 0.00 H new ATOM 0 H2 SER B 1 57.976 -6.495 -9.249 1.00 0.00 H new ATOM 0 H3 SER B 1 59.638 -6.155 -9.323 1.00 0.00 H new ATOM 0 HA SER B 1 57.728 -5.634 -7.213 1.00 0.00 H new ATOM 0 HB2 SER B 1 60.532 -6.440 -6.375 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.117 -6.215 -5.366 1.00 0.00 H new ATOM 0 HG SER B 1 59.563 -8.469 -5.763 1.00 0.00 H new ATOM 1463 N GLU B 2 58.840 -3.392 -7.101 1.00 0.00 N ATOM 1464 CA GLU B 2 59.417 -2.024 -7.216 1.00 0.00 C ATOM 1465 C GLU B 2 60.748 -1.936 -6.469 1.00 0.00 C ATOM 1466 O GLU B 2 61.651 -1.229 -6.875 1.00 0.00 O ATOM 1467 CB GLU B 2 58.429 -1.013 -6.627 1.00 0.00 C ATOM 1468 CG GLU B 2 57.205 -0.924 -7.542 1.00 0.00 C ATOM 1469 CD GLU B 2 56.201 0.083 -6.978 1.00 0.00 C ATOM 1470 OE1 GLU B 2 56.379 0.499 -5.845 1.00 0.00 O ATOM 1471 OE2 GLU B 2 55.279 0.431 -7.696 1.00 0.00 O ATOM 0 H GLU B 2 57.950 -3.441 -6.605 1.00 0.00 H new ATOM 0 HA GLU B 2 59.596 -1.802 -8.268 1.00 0.00 H new ATOM 0 HB2 GLU B 2 58.129 -1.319 -5.625 1.00 0.00 H new ATOM 0 HB3 GLU B 2 58.901 -0.035 -6.533 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.511 -0.622 -8.544 1.00 0.00 H new ATOM 0 HG3 GLU B 2 56.737 -1.904 -7.633 1.00 0.00 H new ATOM 1478 N LEU B 3 60.885 -2.645 -5.384 1.00 0.00 N ATOM 1479 CA LEU B 3 62.163 -2.602 -4.620 1.00 0.00 C ATOM 1480 C LEU B 3 63.256 -3.307 -5.426 1.00 0.00 C ATOM 1481 O LEU B 3 64.409 -2.929 -5.395 1.00 0.00 O ATOM 1482 CB LEU B 3 61.962 -3.309 -3.275 1.00 0.00 C ATOM 1483 CG LEU B 3 63.259 -3.287 -2.447 1.00 0.00 C ATOM 1484 CD1 LEU B 3 63.645 -1.839 -2.102 1.00 0.00 C ATOM 1485 CD2 LEU B 3 63.039 -4.073 -1.146 1.00 0.00 C ATOM 0 H LEU B 3 60.166 -3.253 -4.992 1.00 0.00 H new ATOM 0 HA LEU B 3 62.462 -1.569 -4.444 1.00 0.00 H new ATOM 0 HB2 LEU B 3 61.162 -2.821 -2.719 1.00 0.00 H new ATOM 0 HB3 LEU B 3 61.650 -4.340 -3.444 1.00 0.00 H new ATOM 0 HG LEU B 3 64.061 -3.741 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU B 3 64.564 -1.837 -1.516 1.00 0.00 H new ATOM 0 HD12 LEU B 3 63.800 -1.275 -3.022 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.845 -1.377 -1.523 1.00 0.00 H new ATOM 0 HD21 LEU B 3 63.955 -4.061 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU B 3 62.232 -3.613 -0.575 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.774 -5.103 -1.384 1.00 0.00 H new ATOM 1497 N GLU B 4 62.898 -4.332 -6.152 1.00 0.00 N ATOM 1498 CA GLU B 4 63.907 -5.063 -6.961 1.00 0.00 C ATOM 1499 C GLU B 4 64.515 -4.113 -7.999 1.00 0.00 C ATOM 1500 O GLU B 4 65.707 -4.109 -8.224 1.00 0.00 O ATOM 1501 CB GLU B 4 63.226 -6.256 -7.644 1.00 0.00 C ATOM 1502 CG GLU B 4 64.259 -7.051 -8.441 1.00 0.00 C ATOM 1503 CD GLU B 4 63.580 -8.254 -9.094 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.425 -8.500 -8.784 1.00 0.00 O ATOM 1505 OE2 GLU B 4 64.224 -8.910 -9.896 1.00 0.00 O ATOM 0 H GLU B 4 61.946 -4.693 -6.218 1.00 0.00 H new ATOM 0 HA GLU B 4 64.710 -5.432 -6.323 1.00 0.00 H new ATOM 0 HB2 GLU B 4 62.757 -6.896 -6.897 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.434 -5.905 -8.305 1.00 0.00 H new ATOM 0 HG2 GLU B 4 64.713 -6.417 -9.203 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.063 -7.385 -7.785 1.00 0.00 H new ATOM 1512 N LYS B 5 63.706 -3.306 -8.626 1.00 0.00 N ATOM 1513 CA LYS B 5 64.242 -2.351 -9.637 1.00 0.00 C ATOM 1514 C LYS B 5 65.252 -1.421 -8.964 1.00 0.00 C ATOM 1515 O LYS B 5 66.277 -1.088 -9.523 1.00 0.00 O ATOM 1516 CB LYS B 5 63.102 -1.514 -10.221 1.00 0.00 C ATOM 1517 CG LYS B 5 63.642 -0.635 -11.356 1.00 0.00 C ATOM 1518 CD LYS B 5 62.493 0.186 -11.951 1.00 0.00 C ATOM 1519 CE LYS B 5 63.012 1.043 -13.107 1.00 0.00 C ATOM 1520 NZ LYS B 5 63.471 0.158 -14.216 1.00 0.00 N ATOM 0 H LYS B 5 62.697 -3.266 -8.483 1.00 0.00 H new ATOM 0 HA LYS B 5 64.725 -2.910 -10.438 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.313 -2.166 -10.596 1.00 0.00 H new ATOM 0 HB3 LYS B 5 62.659 -0.891 -9.444 1.00 0.00 H new ATOM 0 HG2 LYS B 5 64.421 0.028 -10.979 1.00 0.00 H new ATOM 0 HG3 LYS B 5 64.098 -1.256 -12.127 1.00 0.00 H new ATOM 0 HD2 LYS B 5 61.704 -0.478 -12.304 1.00 0.00 H new ATOM 0 HD3 LYS B 5 62.053 0.823 -11.183 1.00 0.00 H new ATOM 0 HE2 LYS B 5 62.225 1.709 -13.461 1.00 0.00 H new ATOM 0 HE3 LYS B 5 63.834 1.673 -12.766 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 63.517 0.704 -15.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 64.414 -0.219 -13.992 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 62.802 -0.630 -14.331 1.00 0.00 H new ATOM 1534 N ALA B 6 64.963 -0.992 -7.767 1.00 0.00 N ATOM 1535 CA ALA B 6 65.904 -0.080 -7.056 1.00 0.00 C ATOM 1536 C ALA B 6 67.263 -0.764 -6.885 1.00 0.00 C ATOM 1537 O ALA B 6 68.297 -0.208 -7.200 1.00 0.00 O ATOM 1538 CB ALA B 6 65.344 0.248 -5.670 1.00 0.00 C ATOM 0 H ALA B 6 64.117 -1.233 -7.250 1.00 0.00 H new ATOM 0 HA ALA B 6 66.022 0.833 -7.640 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.031 0.915 -5.149 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.375 0.735 -5.775 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.227 -0.672 -5.098 1.00 0.00 H new ATOM 1544 N MET B 7 67.262 -1.966 -6.375 1.00 0.00 N ATOM 1545 CA MET B 7 68.546 -2.694 -6.162 1.00 0.00 C ATOM 1546 C MET B 7 69.256 -2.879 -7.507 1.00 0.00 C ATOM 1547 O MET B 7 70.423 -2.580 -7.663 1.00 0.00 O ATOM 1548 CB MET B 7 68.228 -4.061 -5.551 1.00 0.00 C ATOM 1549 CG MET B 7 69.519 -4.727 -5.088 1.00 0.00 C ATOM 1550 SD MET B 7 69.178 -6.433 -4.584 1.00 0.00 S ATOM 1551 CE MET B 7 68.100 -6.060 -3.178 1.00 0.00 C ATOM 0 H MET B 7 66.424 -2.477 -6.096 1.00 0.00 H new ATOM 0 HA MET B 7 69.196 -2.129 -5.494 1.00 0.00 H new ATOM 0 HB2 MET B 7 67.545 -3.944 -4.710 1.00 0.00 H new ATOM 0 HB3 MET B 7 67.725 -4.691 -6.285 1.00 0.00 H new ATOM 0 HG2 MET B 7 70.255 -4.715 -5.892 1.00 0.00 H new ATOM 0 HG3 MET B 7 69.948 -4.170 -4.255 1.00 0.00 H new ATOM 0 HE1 MET B 7 68.335 -6.730 -2.351 1.00 0.00 H new ATOM 0 HE2 MET B 7 68.256 -5.028 -2.864 1.00 0.00 H new ATOM 0 HE3 MET B 7 67.059 -6.197 -3.471 1.00 0.00 H new ATOM 1561 N VAL B 8 68.546 -3.389 -8.474 1.00 0.00 N ATOM 1562 CA VAL B 8 69.144 -3.631 -9.817 1.00 0.00 C ATOM 1563 C VAL B 8 69.694 -2.310 -10.373 1.00 0.00 C ATOM 1564 O VAL B 8 70.728 -2.277 -11.011 1.00 0.00 O ATOM 1565 CB VAL B 8 68.053 -4.180 -10.749 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.571 -4.226 -12.190 1.00 0.00 C ATOM 1567 CG2 VAL B 8 67.657 -5.594 -10.300 1.00 0.00 C ATOM 0 H VAL B 8 67.564 -3.652 -8.390 1.00 0.00 H new ATOM 0 HA VAL B 8 69.959 -4.351 -9.744 1.00 0.00 H new ATOM 0 HB VAL B 8 67.182 -3.526 -10.703 1.00 0.00 H new ATOM 0 HG11 VAL B 8 67.792 -4.616 -12.844 1.00 0.00 H new ATOM 0 HG12 VAL B 8 68.844 -3.221 -12.511 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.446 -4.874 -12.242 1.00 0.00 H new ATOM 0 HG21 VAL B 8 66.883 -5.982 -10.962 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.529 -6.246 -10.340 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.277 -5.558 -9.279 1.00 0.00 H new ATOM 1577 N ALA B 9 69.010 -1.222 -10.141 1.00 0.00 N ATOM 1578 CA ALA B 9 69.499 0.091 -10.653 1.00 0.00 C ATOM 1579 C ALA B 9 70.875 0.406 -10.054 1.00 0.00 C ATOM 1580 O ALA B 9 71.752 0.914 -10.726 1.00 0.00 O ATOM 1581 CB ALA B 9 68.500 1.189 -10.264 1.00 0.00 C ATOM 0 H ALA B 9 68.134 -1.185 -9.619 1.00 0.00 H new ATOM 0 HA ALA B 9 69.589 0.046 -11.738 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.853 2.151 -10.636 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.526 0.966 -10.701 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.410 1.231 -9.179 1.00 0.00 H new ATOM 1587 N LEU B 10 71.062 0.131 -8.793 1.00 0.00 N ATOM 1588 CA LEU B 10 72.372 0.443 -8.146 1.00 0.00 C ATOM 1589 C LEU B 10 73.506 -0.324 -8.837 1.00 0.00 C ATOM 1590 O LEU B 10 74.526 0.243 -9.173 1.00 0.00 O ATOM 1591 CB LEU B 10 72.311 0.032 -6.669 1.00 0.00 C ATOM 1592 CG LEU B 10 71.281 0.905 -5.938 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.076 0.373 -4.515 1.00 0.00 C ATOM 1594 CD2 LEU B 10 71.756 2.375 -5.890 1.00 0.00 C ATOM 0 H LEU B 10 70.366 -0.296 -8.181 1.00 0.00 H new ATOM 0 HA LEU B 10 72.566 1.512 -8.232 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.038 -1.020 -6.584 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.292 0.145 -6.208 1.00 0.00 H new ATOM 0 HG LEU B 10 70.336 0.865 -6.479 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.345 0.993 -3.997 1.00 0.00 H new ATOM 0 HD12 LEU B 10 70.714 -0.654 -4.559 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.023 0.401 -3.976 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.014 2.980 -5.369 1.00 0.00 H new ATOM 0 HD22 LEU B 10 72.708 2.433 -5.362 1.00 0.00 H new ATOM 0 HD23 LEU B 10 71.881 2.750 -6.906 1.00 0.00 H new ATOM 1606 N ILE B 11 73.348 -1.602 -9.053 1.00 0.00 N ATOM 1607 CA ILE B 11 74.439 -2.366 -9.722 1.00 0.00 C ATOM 1608 C ILE B 11 74.702 -1.783 -11.107 1.00 0.00 C ATOM 1609 O ILE B 11 75.827 -1.510 -11.476 1.00 0.00 O ATOM 1610 CB ILE B 11 74.022 -3.826 -9.880 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.798 -4.445 -8.504 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.124 -4.592 -10.609 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.156 -5.824 -8.665 1.00 0.00 C ATOM 0 H ILE B 11 72.522 -2.144 -8.799 1.00 0.00 H new ATOM 0 HA ILE B 11 75.341 -2.299 -9.113 1.00 0.00 H new ATOM 0 HB ILE B 11 73.098 -3.879 -10.456 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.746 -4.533 -7.974 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.156 -3.801 -7.903 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.828 -5.635 -10.723 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.284 -4.151 -11.593 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.047 -4.538 -10.032 1.00 0.00 H new ATOM 0 HD11 ILE B 11 72.995 -6.268 -7.682 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.200 -5.722 -9.178 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.815 -6.466 -9.250 1.00 0.00 H new ATOM 1625 N ASP B 12 73.674 -1.606 -11.885 1.00 0.00 N ATOM 1626 CA ASP B 12 73.876 -1.062 -13.253 1.00 0.00 C ATOM 1627 C ASP B 12 74.520 0.323 -13.153 1.00 0.00 C ATOM 1628 O ASP B 12 75.428 0.650 -13.889 1.00 0.00 O ATOM 1629 CB ASP B 12 72.522 -0.963 -13.965 1.00 0.00 C ATOM 1630 CG ASP B 12 72.726 -0.449 -15.392 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.824 -0.006 -15.690 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.786 -0.514 -16.165 1.00 0.00 O ATOM 0 H ASP B 12 72.707 -1.813 -11.634 1.00 0.00 H new ATOM 0 HA ASP B 12 74.530 -1.722 -13.823 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.039 -1.940 -13.986 1.00 0.00 H new ATOM 0 HB3 ASP B 12 71.861 -0.292 -13.417 1.00 0.00 H new ATOM 1637 N VAL B 13 74.058 1.135 -12.244 1.00 0.00 N ATOM 1638 CA VAL B 13 74.646 2.499 -12.095 1.00 0.00 C ATOM 1639 C VAL B 13 76.065 2.412 -11.511 1.00 0.00 C ATOM 1640 O VAL B 13 76.945 3.153 -11.898 1.00 0.00 O ATOM 1641 CB VAL B 13 73.753 3.360 -11.187 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.459 4.682 -10.852 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.443 3.667 -11.916 1.00 0.00 C ATOM 0 H VAL B 13 73.300 0.915 -11.598 1.00 0.00 H new ATOM 0 HA VAL B 13 74.704 2.963 -13.080 1.00 0.00 H new ATOM 0 HB VAL B 13 73.552 2.815 -10.265 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.818 5.284 -10.208 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.397 4.473 -10.337 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.665 5.228 -11.773 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.805 4.278 -11.277 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.658 4.208 -12.838 1.00 0.00 H new ATOM 0 HG23 VAL B 13 71.932 2.734 -12.154 1.00 0.00 H new ATOM 1653 N PHE B 14 76.288 1.541 -10.561 1.00 0.00 N ATOM 1654 CA PHE B 14 77.646 1.446 -9.938 1.00 0.00 C ATOM 1655 C PHE B 14 78.669 0.927 -10.954 1.00 0.00 C ATOM 1656 O PHE B 14 79.677 1.554 -11.209 1.00 0.00 O ATOM 1657 CB PHE B 14 77.581 0.482 -8.744 1.00 0.00 C ATOM 1658 CG PHE B 14 78.940 0.351 -8.074 1.00 0.00 C ATOM 1659 CD1 PHE B 14 79.831 -0.642 -8.499 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.303 1.207 -7.018 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.082 -0.781 -7.879 1.00 0.00 C ATOM 1662 CE2 PHE B 14 80.557 1.061 -6.396 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.443 0.070 -6.829 1.00 0.00 C ATOM 0 H PHE B 14 75.593 0.893 -10.190 1.00 0.00 H new ATOM 0 HA PHE B 14 77.955 2.437 -9.607 1.00 0.00 H new ATOM 0 HB2 PHE B 14 76.849 0.842 -8.021 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.242 -0.498 -9.081 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.554 -1.303 -9.307 1.00 0.00 H new ATOM 0 HD2 PHE B 14 78.620 1.975 -6.685 1.00 0.00 H new ATOM 0 HE1 PHE B 14 81.767 -1.546 -8.213 1.00 0.00 H new ATOM 0 HE2 PHE B 14 80.835 1.715 -5.583 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.406 -0.039 -6.353 1.00 0.00 H new ATOM 1673 N HIS B 15 78.440 -0.236 -11.500 1.00 0.00 N ATOM 1674 CA HIS B 15 79.421 -0.832 -12.454 1.00 0.00 C ATOM 1675 C HIS B 15 79.634 0.064 -13.675 1.00 0.00 C ATOM 1676 O HIS B 15 80.748 0.225 -14.133 1.00 0.00 O ATOM 1677 CB HIS B 15 78.889 -2.199 -12.902 1.00 0.00 C ATOM 1678 CG HIS B 15 79.058 -3.198 -11.786 1.00 0.00 C ATOM 1679 ND1 HIS B 15 78.187 -3.263 -10.706 1.00 0.00 N ATOM 1680 CD2 HIS B 15 79.997 -4.178 -11.569 1.00 0.00 C ATOM 1681 CE1 HIS B 15 78.619 -4.250 -9.897 1.00 0.00 C ATOM 1682 NE2 HIS B 15 79.713 -4.836 -10.378 1.00 0.00 N ATOM 0 H HIS B 15 77.610 -0.803 -11.326 1.00 0.00 H new ATOM 0 HA HIS B 15 80.383 -0.936 -11.952 1.00 0.00 H new ATOM 0 HB2 HIS B 15 77.837 -2.119 -13.176 1.00 0.00 H new ATOM 0 HB3 HIS B 15 79.425 -2.536 -13.789 1.00 0.00 H new ATOM 0 HD1 HIS B 15 77.370 -2.672 -10.553 1.00 0.00 H new ATOM 0 HD2 HIS B 15 80.827 -4.402 -12.223 1.00 0.00 H new ATOM 0 HE1 HIS B 15 78.137 -4.531 -8.972 1.00 0.00 H new ATOM 1691 N GLN B 16 78.613 0.670 -14.206 1.00 0.00 N ATOM 1692 CA GLN B 16 78.829 1.555 -15.378 1.00 0.00 C ATOM 1693 C GLN B 16 79.586 2.808 -14.944 1.00 0.00 C ATOM 1694 O GLN B 16 80.453 3.296 -15.641 1.00 0.00 O ATOM 1695 CB GLN B 16 77.482 1.941 -15.990 1.00 0.00 C ATOM 1696 CG GLN B 16 76.868 0.721 -16.679 1.00 0.00 C ATOM 1697 CD GLN B 16 75.549 1.119 -17.342 1.00 0.00 C ATOM 1698 OE1 GLN B 16 75.079 0.446 -18.238 1.00 0.00 O ATOM 1699 NE2 GLN B 16 74.925 2.189 -16.935 1.00 0.00 N ATOM 0 H GLN B 16 77.648 0.592 -13.883 1.00 0.00 H new ATOM 0 HA GLN B 16 79.419 1.025 -16.126 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.811 2.311 -15.215 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.615 2.750 -16.709 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.558 0.326 -17.425 1.00 0.00 H new ATOM 0 HG3 GLN B 16 76.697 -0.073 -15.952 1.00 0.00 H new ATOM 0 HE21 GLN B 16 75.319 2.754 -16.183 1.00 0.00 H new ATOM 0 HE22 GLN B 16 74.043 2.461 -17.369 1.00 0.00 H new ATOM 1708 N TYR B 17 79.264 3.337 -13.798 1.00 0.00 N ATOM 1709 CA TYR B 17 79.976 4.558 -13.332 1.00 0.00 C ATOM 1710 C TYR B 17 81.377 4.198 -12.823 1.00 0.00 C ATOM 1711 O TYR B 17 82.350 4.846 -13.147 1.00 0.00 O ATOM 1712 CB TYR B 17 79.206 5.245 -12.206 1.00 0.00 C ATOM 1713 CG TYR B 17 79.844 6.588 -11.955 1.00 0.00 C ATOM 1714 CD1 TYR B 17 80.934 6.699 -11.082 1.00 0.00 C ATOM 1715 CD2 TYR B 17 79.366 7.720 -12.623 1.00 0.00 C ATOM 1716 CE1 TYR B 17 81.538 7.945 -10.875 1.00 0.00 C ATOM 1717 CE2 TYR B 17 79.972 8.965 -12.418 1.00 0.00 C ATOM 1718 CZ TYR B 17 81.058 9.078 -11.544 1.00 0.00 C ATOM 1719 OH TYR B 17 81.654 10.308 -11.338 1.00 0.00 O ATOM 0 H TYR B 17 78.545 2.981 -13.168 1.00 0.00 H new ATOM 0 HA TYR B 17 80.053 5.238 -14.181 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.158 5.367 -12.480 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.230 4.637 -11.302 1.00 0.00 H new ATOM 0 HD1 TYR B 17 81.308 5.825 -10.570 1.00 0.00 H new ATOM 0 HD2 TYR B 17 78.528 7.633 -13.298 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.375 8.033 -10.198 1.00 0.00 H new ATOM 0 HE2 TYR B 17 79.601 9.838 -12.935 1.00 0.00 H new ATOM 0 HH TYR B 17 81.252 10.971 -11.938 1.00 0.00 H new ATOM 1729 N SER B 18 81.486 3.182 -12.013 1.00 0.00 N ATOM 1730 CA SER B 18 82.819 2.795 -11.469 1.00 0.00 C ATOM 1731 C SER B 18 83.676 2.142 -12.558 1.00 0.00 C ATOM 1732 O SER B 18 84.884 2.083 -12.451 1.00 0.00 O ATOM 1733 CB SER B 18 82.623 1.818 -10.309 1.00 0.00 C ATOM 1734 OG SER B 18 83.891 1.476 -9.763 1.00 0.00 O ATOM 0 H SER B 18 80.707 2.601 -11.703 1.00 0.00 H new ATOM 0 HA SER B 18 83.333 3.689 -11.117 1.00 0.00 H new ATOM 0 HB2 SER B 18 81.993 2.268 -9.542 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.110 0.921 -10.656 1.00 0.00 H new ATOM 0 HG SER B 18 83.769 0.851 -9.018 1.00 0.00 H new ATOM 1740 N GLY B 19 83.066 1.630 -13.594 1.00 0.00 N ATOM 1741 CA GLY B 19 83.854 0.963 -14.676 1.00 0.00 C ATOM 1742 C GLY B 19 84.305 1.985 -15.721 1.00 0.00 C ATOM 1743 O GLY B 19 84.586 1.643 -16.853 1.00 0.00 O ATOM 0 H GLY B 19 82.056 1.644 -13.739 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.724 0.466 -14.246 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.249 0.191 -15.152 1.00 0.00 H new ATOM 1747 N ARG B 20 84.389 3.236 -15.357 1.00 0.00 N ATOM 1748 CA ARG B 20 84.838 4.266 -16.335 1.00 0.00 C ATOM 1749 C ARG B 20 86.370 4.295 -16.398 1.00 0.00 C ATOM 1750 O ARG B 20 86.951 4.388 -17.459 1.00 0.00 O ATOM 1751 CB ARG B 20 84.322 5.638 -15.901 1.00 0.00 C ATOM 1752 CG ARG B 20 82.805 5.697 -16.090 1.00 0.00 C ATOM 1753 CD ARG B 20 82.278 7.072 -15.666 1.00 0.00 C ATOM 1754 NE ARG B 20 82.599 7.322 -14.225 1.00 0.00 N ATOM 1755 CZ ARG B 20 83.672 7.995 -13.877 1.00 0.00 C ATOM 1756 NH1 ARG B 20 84.510 8.427 -14.780 1.00 0.00 N ATOM 1757 NH2 ARG B 20 83.917 8.218 -12.614 1.00 0.00 N ATOM 0 H ARG B 20 84.166 3.588 -14.426 1.00 0.00 H new ATOM 0 HA ARG B 20 84.443 4.019 -17.321 1.00 0.00 H new ATOM 0 HB2 ARG B 20 84.576 5.820 -14.857 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.803 6.421 -16.487 1.00 0.00 H new ATOM 0 HG2 ARG B 20 82.552 5.507 -17.133 1.00 0.00 H new ATOM 0 HG3 ARG B 20 82.326 4.916 -15.499 1.00 0.00 H new ATOM 0 HD2 ARG B 20 82.725 7.849 -16.287 1.00 0.00 H new ATOM 0 HD3 ARG B 20 81.200 7.121 -15.821 1.00 0.00 H new ATOM 0 HE ARG B 20 81.975 6.964 -13.502 1.00 0.00 H new ATOM 0 HH11 ARG B 20 84.335 8.243 -15.768 1.00 0.00 H new ATOM 0 HH12 ARG B 20 85.340 8.949 -14.498 1.00 0.00 H new ATOM 0 HH21 ARG B 20 83.276 7.870 -11.901 1.00 0.00 H new ATOM 0 HH22 ARG B 20 84.749 8.740 -12.340 1.00 0.00 H new ATOM 1771 N GLU B 21 87.020 4.207 -15.264 1.00 0.00 N ATOM 1772 CA GLU B 21 88.516 4.226 -15.243 1.00 0.00 C ATOM 1773 C GLU B 21 89.016 4.032 -13.807 1.00 0.00 C ATOM 1774 O GLU B 21 88.361 4.419 -12.863 1.00 0.00 O ATOM 1775 CB GLU B 21 89.019 5.581 -15.754 1.00 0.00 C ATOM 1776 CG GLU B 21 90.552 5.584 -15.788 1.00 0.00 C ATOM 1777 CD GLU B 21 91.048 6.880 -16.435 1.00 0.00 C ATOM 1778 OE1 GLU B 21 90.215 7.654 -16.881 1.00 0.00 O ATOM 1779 OE2 GLU B 21 92.250 7.078 -16.475 1.00 0.00 O ATOM 0 H GLU B 21 86.578 4.123 -14.349 1.00 0.00 H new ATOM 0 HA GLU B 21 88.889 3.423 -15.879 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.623 5.774 -16.751 1.00 0.00 H new ATOM 0 HB3 GLU B 21 88.658 6.381 -15.107 1.00 0.00 H new ATOM 0 HG2 GLU B 21 90.949 5.495 -14.777 1.00 0.00 H new ATOM 0 HG3 GLU B 21 90.915 4.723 -16.349 1.00 0.00 H new ATOM 1786 N GLY B 22 90.187 3.471 -13.630 1.00 0.00 N ATOM 1787 CA GLY B 22 90.737 3.300 -12.246 1.00 0.00 C ATOM 1788 C GLY B 22 90.353 1.941 -11.653 1.00 0.00 C ATOM 1789 O GLY B 22 89.627 1.868 -10.683 1.00 0.00 O ATOM 0 H GLY B 22 90.785 3.125 -14.380 1.00 0.00 H new ATOM 0 HA2 GLY B 22 91.823 3.394 -12.271 1.00 0.00 H new ATOM 0 HA3 GLY B 22 90.363 4.097 -11.604 1.00 0.00 H new ATOM 1793 N ASP B 23 90.847 0.868 -12.211 1.00 0.00 N ATOM 1794 CA ASP B 23 90.519 -0.481 -11.659 1.00 0.00 C ATOM 1795 C ASP B 23 89.002 -0.644 -11.576 1.00 0.00 C ATOM 1796 O ASP B 23 88.360 -0.134 -10.679 1.00 0.00 O ATOM 1797 CB ASP B 23 91.130 -0.639 -10.261 1.00 0.00 C ATOM 1798 CG ASP B 23 92.655 -0.677 -10.370 1.00 0.00 C ATOM 1799 OD1 ASP B 23 93.144 -0.986 -11.444 1.00 0.00 O ATOM 1800 OD2 ASP B 23 93.307 -0.395 -9.378 1.00 0.00 O ATOM 0 H ASP B 23 91.463 0.866 -13.024 1.00 0.00 H new ATOM 0 HA ASP B 23 90.933 -1.246 -12.317 1.00 0.00 H new ATOM 0 HB2 ASP B 23 90.821 0.189 -9.622 1.00 0.00 H new ATOM 0 HB3 ASP B 23 90.766 -1.554 -9.795 1.00 0.00 H new ATOM 1805 N LYS B 24 88.424 -1.348 -12.507 1.00 0.00 N ATOM 1806 CA LYS B 24 86.947 -1.540 -12.487 1.00 0.00 C ATOM 1807 C LYS B 24 86.531 -2.112 -11.133 1.00 0.00 C ATOM 1808 O LYS B 24 87.186 -2.980 -10.595 1.00 0.00 O ATOM 1809 CB LYS B 24 86.559 -2.526 -13.594 1.00 0.00 C ATOM 1810 CG LYS B 24 86.850 -1.897 -14.957 1.00 0.00 C ATOM 1811 CD LYS B 24 86.491 -2.883 -16.077 1.00 0.00 C ATOM 1812 CE LYS B 24 84.989 -3.220 -16.038 1.00 0.00 C ATOM 1813 NZ LYS B 24 84.762 -4.414 -15.171 1.00 0.00 N ATOM 0 H LYS B 24 88.910 -1.799 -13.282 1.00 0.00 H new ATOM 0 HA LYS B 24 86.447 -0.585 -12.649 1.00 0.00 H new ATOM 0 HB2 LYS B 24 87.119 -3.454 -13.482 1.00 0.00 H new ATOM 0 HB3 LYS B 24 85.502 -2.780 -13.516 1.00 0.00 H new ATOM 0 HG2 LYS B 24 86.276 -0.978 -15.073 1.00 0.00 H new ATOM 0 HG3 LYS B 24 87.903 -1.625 -15.024 1.00 0.00 H new ATOM 0 HD2 LYS B 24 86.748 -2.452 -17.045 1.00 0.00 H new ATOM 0 HD3 LYS B 24 87.077 -3.795 -15.968 1.00 0.00 H new ATOM 0 HE2 LYS B 24 84.426 -2.369 -15.656 1.00 0.00 H new ATOM 0 HE3 LYS B 24 84.625 -3.416 -17.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 84.340 -5.178 -15.736 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 85.670 -4.735 -14.778 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 84.118 -4.162 -14.394 1.00 0.00 H new ATOM 1827 N HIS B 25 85.455 -1.615 -10.577 1.00 0.00 N ATOM 1828 CA HIS B 25 84.978 -2.102 -9.249 1.00 0.00 C ATOM 1829 C HIS B 25 85.864 -1.517 -8.134 1.00 0.00 C ATOM 1830 O HIS B 25 86.249 -2.200 -7.206 1.00 0.00 O ATOM 1831 CB HIS B 25 85.025 -3.641 -9.226 1.00 0.00 C ATOM 1832 CG HIS B 25 84.003 -4.173 -8.256 1.00 0.00 C ATOM 1833 ND1 HIS B 25 82.670 -4.341 -8.599 1.00 0.00 N ATOM 1834 CD2 HIS B 25 84.105 -4.558 -6.943 1.00 0.00 C ATOM 1835 CE1 HIS B 25 82.027 -4.809 -7.512 1.00 0.00 C ATOM 1836 NE2 HIS B 25 82.857 -4.957 -6.479 1.00 0.00 N ATOM 0 H HIS B 25 84.880 -0.883 -10.993 1.00 0.00 H new ATOM 0 HA HIS B 25 83.951 -1.777 -9.082 1.00 0.00 H new ATOM 0 HB2 HIS B 25 84.830 -4.034 -10.224 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.021 -3.978 -8.939 1.00 0.00 H new ATOM 0 HD2 HIS B 25 85.014 -4.552 -6.360 1.00 0.00 H new ATOM 0 HE1 HIS B 25 80.972 -5.036 -7.481 1.00 0.00 H new ATOM 0 HE2 HIS B 25 82.625 -5.293 -5.544 1.00 0.00 H new ATOM 1845 N LYS B 26 86.174 -0.246 -8.217 1.00 0.00 N ATOM 1846 CA LYS B 26 87.021 0.408 -7.169 1.00 0.00 C ATOM 1847 C LYS B 26 86.830 1.926 -7.292 1.00 0.00 C ATOM 1848 O LYS B 26 87.021 2.487 -8.351 1.00 0.00 O ATOM 1849 CB LYS B 26 88.498 0.044 -7.403 1.00 0.00 C ATOM 1850 CG LYS B 26 89.321 0.258 -6.119 1.00 0.00 C ATOM 1851 CD LYS B 26 89.149 -0.937 -5.163 1.00 0.00 C ATOM 1852 CE LYS B 26 90.198 -0.862 -4.047 1.00 0.00 C ATOM 1853 NZ LYS B 26 90.081 -2.066 -3.174 1.00 0.00 N ATOM 0 H LYS B 26 85.874 0.372 -8.972 1.00 0.00 H new ATOM 0 HA LYS B 26 86.733 0.071 -6.173 1.00 0.00 H new ATOM 0 HB2 LYS B 26 88.576 -0.996 -7.722 1.00 0.00 H new ATOM 0 HB3 LYS B 26 88.905 0.655 -8.208 1.00 0.00 H new ATOM 0 HG2 LYS B 26 90.374 0.381 -6.371 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.003 1.176 -5.625 1.00 0.00 H new ATOM 0 HD2 LYS B 26 88.147 -0.931 -4.734 1.00 0.00 H new ATOM 0 HD3 LYS B 26 89.255 -1.873 -5.712 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.198 -0.807 -4.476 1.00 0.00 H new ATOM 0 HE3 LYS B 26 90.054 0.043 -3.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 90.792 -2.016 -2.417 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 89.130 -2.099 -2.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 90.239 -2.923 -3.742 1.00 0.00 H new ATOM 1867 N LEU B 27 86.434 2.599 -6.237 1.00 0.00 N ATOM 1868 CA LEU B 27 86.214 4.083 -6.340 1.00 0.00 C ATOM 1869 C LEU B 27 87.452 4.845 -5.856 1.00 0.00 C ATOM 1870 O LEU B 27 87.814 4.800 -4.696 1.00 0.00 O ATOM 1871 CB LEU B 27 84.998 4.480 -5.487 1.00 0.00 C ATOM 1872 CG LEU B 27 83.694 4.177 -6.248 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.527 5.125 -7.458 1.00 0.00 C ATOM 1874 CD2 LEU B 27 83.710 2.719 -6.724 1.00 0.00 C ATOM 0 H LEU B 27 86.255 2.194 -5.318 1.00 0.00 H new ATOM 0 HA LEU B 27 86.032 4.340 -7.384 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.012 3.934 -4.544 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.047 5.541 -5.242 1.00 0.00 H new ATOM 0 HG LEU B 27 82.852 4.335 -5.575 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.599 4.890 -7.979 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.497 6.157 -7.110 1.00 0.00 H new ATOM 0 HD13 LEU B 27 84.368 4.996 -8.140 1.00 0.00 H new ATOM 0 HD21 LEU B 27 82.788 2.502 -7.263 1.00 0.00 H new ATOM 0 HD22 LEU B 27 84.562 2.561 -7.385 1.00 0.00 H new ATOM 0 HD23 LEU B 27 83.791 2.056 -5.863 1.00 0.00 H new ATOM 1886 N LYS B 28 88.095 5.552 -6.752 1.00 0.00 N ATOM 1887 CA LYS B 28 89.311 6.341 -6.383 1.00 0.00 C ATOM 1888 C LYS B 28 88.897 7.777 -6.030 1.00 0.00 C ATOM 1889 O LYS B 28 87.785 8.193 -6.283 1.00 0.00 O ATOM 1890 CB LYS B 28 90.294 6.367 -7.562 1.00 0.00 C ATOM 1891 CG LYS B 28 90.854 4.960 -7.799 1.00 0.00 C ATOM 1892 CD LYS B 28 91.841 4.980 -8.970 1.00 0.00 C ATOM 1893 CE LYS B 28 92.394 3.572 -9.186 1.00 0.00 C ATOM 1894 NZ LYS B 28 93.333 3.578 -10.341 1.00 0.00 N ATOM 0 H LYS B 28 87.826 5.617 -7.734 1.00 0.00 H new ATOM 0 HA LYS B 28 89.795 5.876 -5.524 1.00 0.00 H new ATOM 0 HB2 LYS B 28 89.790 6.724 -8.460 1.00 0.00 H new ATOM 0 HB3 LYS B 28 91.107 7.062 -7.355 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.353 4.602 -6.898 1.00 0.00 H new ATOM 0 HG3 LYS B 28 90.040 4.266 -8.010 1.00 0.00 H new ATOM 0 HD2 LYS B 28 91.344 5.331 -9.874 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.655 5.675 -8.763 1.00 0.00 H new ATOM 0 HE2 LYS B 28 92.908 3.230 -8.288 1.00 0.00 H new ATOM 0 HE3 LYS B 28 91.578 2.874 -9.371 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 93.194 2.716 -10.906 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 93.150 4.413 -10.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.312 3.609 -9.992 1.00 0.00 H new ATOM 1908 N LYS B 29 89.781 8.529 -5.423 1.00 0.00 N ATOM 1909 CA LYS B 29 89.437 9.931 -5.022 1.00 0.00 C ATOM 1910 C LYS B 29 88.918 10.725 -6.233 1.00 0.00 C ATOM 1911 O LYS B 29 87.990 11.499 -6.119 1.00 0.00 O ATOM 1912 CB LYS B 29 90.700 10.624 -4.490 1.00 0.00 C ATOM 1913 CG LYS B 29 91.135 9.981 -3.169 1.00 0.00 C ATOM 1914 CD LYS B 29 92.398 10.676 -2.640 1.00 0.00 C ATOM 1915 CE LYS B 29 92.852 10.002 -1.338 1.00 0.00 C ATOM 1916 NZ LYS B 29 92.013 10.479 -0.203 1.00 0.00 N ATOM 0 H LYS B 29 90.728 8.233 -5.187 1.00 0.00 H new ATOM 0 HA LYS B 29 88.663 9.897 -4.255 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.503 10.547 -5.223 1.00 0.00 H new ATOM 0 HB3 LYS B 29 90.506 11.686 -4.340 1.00 0.00 H new ATOM 0 HG2 LYS B 29 90.333 10.058 -2.435 1.00 0.00 H new ATOM 0 HG3 LYS B 29 91.329 8.919 -3.318 1.00 0.00 H new ATOM 0 HD2 LYS B 29 93.193 10.623 -3.384 1.00 0.00 H new ATOM 0 HD3 LYS B 29 92.196 11.732 -2.463 1.00 0.00 H new ATOM 0 HE2 LYS B 29 92.772 8.919 -1.431 1.00 0.00 H new ATOM 0 HE3 LYS B 29 93.901 10.229 -1.147 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 91.857 9.698 0.465 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 92.499 11.259 0.284 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 91.097 10.814 -0.565 1.00 0.00 H new ATOM 1930 N SER B 30 89.508 10.546 -7.387 1.00 0.00 N ATOM 1931 CA SER B 30 89.048 11.301 -8.597 1.00 0.00 C ATOM 1932 C SER B 30 87.654 10.829 -9.018 1.00 0.00 C ATOM 1933 O SER B 30 86.844 11.595 -9.503 1.00 0.00 O ATOM 1934 CB SER B 30 90.022 11.057 -9.749 1.00 0.00 C ATOM 1935 OG SER B 30 89.886 9.714 -10.194 1.00 0.00 O ATOM 0 H SER B 30 90.289 9.910 -7.546 1.00 0.00 H new ATOM 0 HA SER B 30 89.011 12.363 -8.355 1.00 0.00 H new ATOM 0 HB2 SER B 30 89.817 11.747 -10.567 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.045 11.244 -9.423 1.00 0.00 H new ATOM 0 HG SER B 30 90.507 9.550 -10.934 1.00 0.00 H new ATOM 1941 N GLU B 31 87.370 9.573 -8.833 1.00 0.00 N ATOM 1942 CA GLU B 31 86.033 9.041 -9.218 1.00 0.00 C ATOM 1943 C GLU B 31 84.985 9.608 -8.263 1.00 0.00 C ATOM 1944 O GLU B 31 83.845 9.820 -8.622 1.00 0.00 O ATOM 1945 CB GLU B 31 86.043 7.516 -9.119 1.00 0.00 C ATOM 1946 CG GLU B 31 86.936 6.946 -10.218 1.00 0.00 C ATOM 1947 CD GLU B 31 86.909 5.419 -10.150 1.00 0.00 C ATOM 1948 OE1 GLU B 31 85.938 4.889 -9.636 1.00 0.00 O ATOM 1949 OE2 GLU B 31 87.852 4.809 -10.618 1.00 0.00 O ATOM 0 H GLU B 31 88.008 8.887 -8.430 1.00 0.00 H new ATOM 0 HA GLU B 31 85.798 9.332 -10.242 1.00 0.00 H new ATOM 0 HB2 GLU B 31 86.408 7.206 -8.140 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.030 7.127 -9.219 1.00 0.00 H new ATOM 0 HG2 GLU B 31 86.591 7.284 -11.195 1.00 0.00 H new ATOM 0 HG3 GLU B 31 87.957 7.309 -10.098 1.00 0.00 H new ATOM 1956 N LEU B 32 85.380 9.871 -7.053 1.00 0.00 N ATOM 1957 CA LEU B 32 84.429 10.447 -6.065 1.00 0.00 C ATOM 1958 C LEU B 32 84.115 11.899 -6.429 1.00 0.00 C ATOM 1959 O LEU B 32 82.995 12.350 -6.313 1.00 0.00 O ATOM 1960 CB LEU B 32 85.036 10.422 -4.664 1.00 0.00 C ATOM 1961 CG LEU B 32 85.199 8.984 -4.164 1.00 0.00 C ATOM 1962 CD1 LEU B 32 85.898 9.020 -2.805 1.00 0.00 C ATOM 1963 CD2 LEU B 32 83.827 8.294 -4.022 1.00 0.00 C ATOM 0 H LEU B 32 86.325 9.712 -6.703 1.00 0.00 H new ATOM 0 HA LEU B 32 83.518 9.849 -6.082 1.00 0.00 H new ATOM 0 HB2 LEU B 32 86.006 10.920 -4.675 1.00 0.00 H new ATOM 0 HB3 LEU B 32 84.399 10.980 -3.978 1.00 0.00 H new ATOM 0 HG LEU B 32 85.791 8.418 -4.883 1.00 0.00 H new ATOM 0 HD11 LEU B 32 86.023 8.003 -2.433 1.00 0.00 H new ATOM 0 HD12 LEU B 32 86.876 9.490 -2.911 1.00 0.00 H new ATOM 0 HD13 LEU B 32 85.295 9.593 -2.101 1.00 0.00 H new ATOM 0 HD21 LEU B 32 83.968 7.274 -3.666 1.00 0.00 H new ATOM 0 HD22 LEU B 32 83.214 8.846 -3.309 1.00 0.00 H new ATOM 0 HD23 LEU B 32 83.328 8.274 -4.991 1.00 0.00 H new ATOM 1975 N LYS B 33 85.103 12.636 -6.860 1.00 0.00 N ATOM 1976 CA LYS B 33 84.867 14.060 -7.218 1.00 0.00 C ATOM 1977 C LYS B 33 83.900 14.138 -8.404 1.00 0.00 C ATOM 1978 O LYS B 33 83.001 14.955 -8.433 1.00 0.00 O ATOM 1979 CB LYS B 33 86.204 14.713 -7.576 1.00 0.00 C ATOM 1980 CG LYS B 33 85.988 16.194 -7.899 1.00 0.00 C ATOM 1981 CD LYS B 33 87.343 16.908 -7.981 1.00 0.00 C ATOM 1982 CE LYS B 33 88.205 16.287 -9.084 1.00 0.00 C ATOM 1983 NZ LYS B 33 87.377 16.053 -10.302 1.00 0.00 N ATOM 0 H LYS B 33 86.063 12.312 -6.979 1.00 0.00 H new ATOM 0 HA LYS B 33 84.425 14.588 -6.373 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.903 14.611 -6.746 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.649 14.206 -8.432 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.455 16.296 -8.844 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.368 16.657 -7.131 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.191 17.968 -8.182 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.858 16.836 -7.023 1.00 0.00 H new ATOM 0 HE2 LYS B 33 89.039 16.948 -9.322 1.00 0.00 H new ATOM 0 HE3 LYS B 33 88.632 15.346 -8.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 87.988 16.061 -11.144 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 86.903 15.130 -10.227 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 86.662 16.804 -10.385 1.00 0.00 H new ATOM 1997 N GLU B 34 84.067 13.281 -9.375 1.00 0.00 N ATOM 1998 CA GLU B 34 83.144 13.295 -10.546 1.00 0.00 C ATOM 1999 C GLU B 34 81.762 12.807 -10.112 1.00 0.00 C ATOM 2000 O GLU B 34 80.749 13.380 -10.465 1.00 0.00 O ATOM 2001 CB GLU B 34 83.692 12.375 -11.646 1.00 0.00 C ATOM 2002 CG GLU B 34 84.943 12.999 -12.273 1.00 0.00 C ATOM 2003 CD GLU B 34 85.456 12.090 -13.394 1.00 0.00 C ATOM 2004 OE1 GLU B 34 84.900 11.016 -13.561 1.00 0.00 O ATOM 2005 OE2 GLU B 34 86.391 12.484 -14.072 1.00 0.00 O ATOM 0 H GLU B 34 84.801 12.573 -9.408 1.00 0.00 H new ATOM 0 HA GLU B 34 83.065 14.311 -10.932 1.00 0.00 H new ATOM 0 HB2 GLU B 34 83.933 11.398 -11.228 1.00 0.00 H new ATOM 0 HB3 GLU B 34 82.932 12.216 -12.411 1.00 0.00 H new ATOM 0 HG2 GLU B 34 84.711 13.988 -12.669 1.00 0.00 H new ATOM 0 HG3 GLU B 34 85.715 13.132 -11.515 1.00 0.00 H new ATOM 2012 N LEU B 35 81.713 11.747 -9.360 1.00 0.00 N ATOM 2013 CA LEU B 35 80.396 11.216 -8.908 1.00 0.00 C ATOM 2014 C LEU B 35 79.667 12.285 -8.089 1.00 0.00 C ATOM 2015 O LEU B 35 78.508 12.567 -8.306 1.00 0.00 O ATOM 2016 CB LEU B 35 80.624 9.962 -8.047 1.00 0.00 C ATOM 2017 CG LEU B 35 79.285 9.378 -7.558 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.496 8.787 -8.735 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.574 8.274 -6.538 1.00 0.00 C ATOM 0 H LEU B 35 82.527 11.223 -9.037 1.00 0.00 H new ATOM 0 HA LEU B 35 79.788 10.954 -9.774 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.162 9.212 -8.626 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.250 10.213 -7.191 1.00 0.00 H new ATOM 0 HG LEU B 35 78.692 10.171 -7.103 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.553 8.379 -8.372 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.295 9.569 -9.468 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.079 7.993 -9.202 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.634 7.851 -6.183 1.00 0.00 H new ATOM 0 HD22 LEU B 35 80.169 7.491 -7.008 1.00 0.00 H new ATOM 0 HD23 LEU B 35 80.125 8.692 -5.695 1.00 0.00 H new ATOM 2031 N ILE B 36 80.342 12.863 -7.132 1.00 0.00 N ATOM 2032 CA ILE B 36 79.705 13.899 -6.269 1.00 0.00 C ATOM 2033 C ILE B 36 79.261 15.096 -7.114 1.00 0.00 C ATOM 2034 O ILE B 36 78.137 15.549 -7.029 1.00 0.00 O ATOM 2035 CB ILE B 36 80.736 14.350 -5.233 1.00 0.00 C ATOM 2036 CG1 ILE B 36 81.019 13.194 -4.268 1.00 0.00 C ATOM 2037 CG2 ILE B 36 80.210 15.555 -4.444 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.288 13.491 -3.469 1.00 0.00 C ATOM 0 H ILE B 36 81.316 12.660 -6.909 1.00 0.00 H new ATOM 0 HA ILE B 36 78.825 13.485 -5.777 1.00 0.00 H new ATOM 0 HB ILE B 36 81.652 14.640 -5.747 1.00 0.00 H new ATOM 0 HG12 ILE B 36 80.175 13.057 -3.592 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.137 12.264 -4.824 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.955 15.863 -3.711 1.00 0.00 H new ATOM 0 HG22 ILE B 36 80.011 16.380 -5.129 1.00 0.00 H new ATOM 0 HG23 ILE B 36 79.289 15.280 -3.931 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.487 12.667 -2.783 1.00 0.00 H new ATOM 0 HD12 ILE B 36 83.130 13.606 -4.152 1.00 0.00 H new ATOM 0 HD13 ILE B 36 82.153 14.412 -2.901 1.00 0.00 H new ATOM 2050 N ASN B 37 80.141 15.608 -7.926 1.00 0.00 N ATOM 2051 CA ASN B 37 79.792 16.781 -8.776 1.00 0.00 C ATOM 2052 C ASN B 37 78.653 16.429 -9.741 1.00 0.00 C ATOM 2053 O ASN B 37 77.769 17.228 -9.983 1.00 0.00 O ATOM 2054 CB ASN B 37 81.024 17.190 -9.581 1.00 0.00 C ATOM 2055 CG ASN B 37 80.681 18.393 -10.458 1.00 0.00 C ATOM 2056 OD1 ASN B 37 80.253 18.234 -11.583 1.00 0.00 O ATOM 2057 ND2 ASN B 37 80.862 19.599 -9.995 1.00 0.00 N ATOM 0 H ASN B 37 81.094 15.263 -8.039 1.00 0.00 H new ATOM 0 HA ASN B 37 79.466 17.600 -8.135 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.845 17.439 -8.909 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.360 16.358 -10.200 1.00 0.00 H new ATOM 0 HD21 ASN B 37 80.644 20.407 -10.578 1.00 0.00 H new ATOM 0 HD22 ASN B 37 81.221 19.734 -9.050 1.00 0.00 H new ATOM 2064 N ASN B 38 78.676 15.251 -10.306 1.00 0.00 N ATOM 2065 CA ASN B 38 77.604 14.858 -11.271 1.00 0.00 C ATOM 2066 C ASN B 38 76.387 14.304 -10.524 1.00 0.00 C ATOM 2067 O ASN B 38 75.263 14.445 -10.958 1.00 0.00 O ATOM 2068 CB ASN B 38 78.143 13.779 -12.212 1.00 0.00 C ATOM 2069 CG ASN B 38 77.082 13.444 -13.262 1.00 0.00 C ATOM 2070 OD1 ASN B 38 76.793 12.289 -13.502 1.00 0.00 O ATOM 2071 ND2 ASN B 38 76.481 14.414 -13.895 1.00 0.00 N ATOM 0 H ASN B 38 79.391 14.542 -10.142 1.00 0.00 H new ATOM 0 HA ASN B 38 77.303 15.739 -11.838 1.00 0.00 H new ATOM 0 HB2 ASN B 38 79.054 14.127 -12.698 1.00 0.00 H new ATOM 0 HB3 ASN B 38 78.405 12.885 -11.646 1.00 0.00 H new ATOM 0 HD21 ASN B 38 75.767 14.203 -14.592 1.00 0.00 H new ATOM 0 HD22 ASN B 38 76.725 15.383 -13.692 1.00 0.00 H new ATOM 2078 N GLU B 39 76.612 13.647 -9.423 1.00 0.00 N ATOM 2079 CA GLU B 39 75.470 13.045 -8.663 1.00 0.00 C ATOM 2080 C GLU B 39 74.809 14.073 -7.739 1.00 0.00 C ATOM 2081 O GLU B 39 73.735 14.563 -8.022 1.00 0.00 O ATOM 2082 CB GLU B 39 75.967 11.866 -7.820 1.00 0.00 C ATOM 2083 CG GLU B 39 74.769 11.108 -7.237 1.00 0.00 C ATOM 2084 CD GLU B 39 73.962 10.467 -8.366 1.00 0.00 C ATOM 2085 OE1 GLU B 39 74.565 10.083 -9.355 1.00 0.00 O ATOM 2086 OE2 GLU B 39 72.754 10.371 -8.224 1.00 0.00 O ATOM 0 H GLU B 39 77.534 13.498 -9.012 1.00 0.00 H new ATOM 0 HA GLU B 39 74.733 12.704 -9.390 1.00 0.00 H new ATOM 0 HB2 GLU B 39 76.570 11.196 -8.433 1.00 0.00 H new ATOM 0 HB3 GLU B 39 76.608 12.226 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU B 39 75.115 10.341 -6.544 1.00 0.00 H new ATOM 0 HG3 GLU B 39 74.137 11.790 -6.668 1.00 0.00 H new ATOM 2093 N LEU B 40 75.411 14.378 -6.620 1.00 0.00 N ATOM 2094 CA LEU B 40 74.769 15.346 -5.684 1.00 0.00 C ATOM 2095 C LEU B 40 74.822 16.754 -6.280 1.00 0.00 C ATOM 2096 O LEU B 40 75.866 17.226 -6.686 1.00 0.00 O ATOM 2097 CB LEU B 40 75.511 15.334 -4.340 1.00 0.00 C ATOM 2098 CG LEU B 40 75.609 13.897 -3.813 1.00 0.00 C ATOM 2099 CD1 LEU B 40 76.415 13.883 -2.508 1.00 0.00 C ATOM 2100 CD2 LEU B 40 74.202 13.335 -3.550 1.00 0.00 C ATOM 0 H LEU B 40 76.310 14.003 -6.316 1.00 0.00 H new ATOM 0 HA LEU B 40 73.730 15.057 -5.529 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.509 15.755 -4.461 1.00 0.00 H new ATOM 0 HB3 LEU B 40 74.986 15.960 -3.619 1.00 0.00 H new ATOM 0 HG LEU B 40 76.108 13.278 -4.559 1.00 0.00 H new ATOM 0 HD11 LEU B 40 76.484 12.861 -2.134 1.00 0.00 H new ATOM 0 HD12 LEU B 40 77.417 14.270 -2.695 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.917 14.508 -1.766 1.00 0.00 H new ATOM 0 HD21 LEU B 40 74.282 12.314 -3.176 1.00 0.00 H new ATOM 0 HD22 LEU B 40 73.695 13.954 -2.810 1.00 0.00 H new ATOM 0 HD23 LEU B 40 73.630 13.338 -4.478 1.00 0.00 H new ATOM 2112 N SER B 41 73.698 17.433 -6.328 1.00 0.00 N ATOM 2113 CA SER B 41 73.662 18.823 -6.888 1.00 0.00 C ATOM 2114 C SER B 41 73.261 19.799 -5.782 1.00 0.00 C ATOM 2115 O SER B 41 74.074 20.551 -5.281 1.00 0.00 O ATOM 2116 CB SER B 41 72.630 18.894 -8.013 1.00 0.00 C ATOM 2117 OG SER B 41 71.351 18.538 -7.499 1.00 0.00 O ATOM 0 H SER B 41 72.798 17.081 -6.001 1.00 0.00 H new ATOM 0 HA SER B 41 74.646 19.084 -7.277 1.00 0.00 H new ATOM 0 HB2 SER B 41 72.600 19.900 -8.432 1.00 0.00 H new ATOM 0 HB3 SER B 41 72.910 18.220 -8.823 1.00 0.00 H new ATOM 0 HG SER B 41 70.686 18.584 -8.217 1.00 0.00 H new ATOM 2123 N HIS B 42 72.013 19.793 -5.391 1.00 0.00 N ATOM 2124 CA HIS B 42 71.563 20.720 -4.311 1.00 0.00 C ATOM 2125 C HIS B 42 71.700 20.025 -2.959 1.00 0.00 C ATOM 2126 O HIS B 42 71.286 20.542 -1.939 1.00 0.00 O ATOM 2127 CB HIS B 42 70.105 21.126 -4.538 1.00 0.00 C ATOM 2128 CG HIS B 42 69.195 19.944 -4.342 1.00 0.00 C ATOM 2129 ND1 HIS B 42 68.439 19.782 -3.189 1.00 0.00 N ATOM 2130 CD2 HIS B 42 68.879 18.882 -5.153 1.00 0.00 C ATOM 2131 CE1 HIS B 42 67.705 18.663 -3.340 1.00 0.00 C ATOM 2132 NE2 HIS B 42 67.937 18.079 -4.516 1.00 0.00 N ATOM 0 H HIS B 42 71.287 19.187 -5.773 1.00 0.00 H new ATOM 0 HA HIS B 42 72.183 21.616 -4.326 1.00 0.00 H new ATOM 0 HB2 HIS B 42 69.831 21.923 -3.847 1.00 0.00 H new ATOM 0 HB3 HIS B 42 69.984 21.523 -5.546 1.00 0.00 H new ATOM 0 HD2 HIS B 42 69.296 18.698 -6.132 1.00 0.00 H new ATOM 0 HE1 HIS B 42 67.014 18.286 -2.600 1.00 0.00 H new ATOM 0 HE2 HIS B 42 67.513 17.223 -4.874 1.00 0.00 H new ATOM 2141 N PHE B 43 72.285 18.858 -2.945 1.00 0.00 N ATOM 2142 CA PHE B 43 72.464 18.120 -1.662 1.00 0.00 C ATOM 2143 C PHE B 43 73.890 18.342 -1.167 1.00 0.00 C ATOM 2144 O PHE B 43 74.264 17.892 -0.102 1.00 0.00 O ATOM 2145 CB PHE B 43 72.234 16.624 -1.893 1.00 0.00 C ATOM 2146 CG PHE B 43 70.767 16.368 -2.162 1.00 0.00 C ATOM 2147 CD1 PHE B 43 69.838 16.494 -1.123 1.00 0.00 C ATOM 2148 CD2 PHE B 43 70.338 15.998 -3.443 1.00 0.00 C ATOM 2149 CE1 PHE B 43 68.481 16.249 -1.362 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.983 15.754 -3.683 1.00 0.00 C ATOM 2151 CZ PHE B 43 68.053 15.879 -2.643 1.00 0.00 C ATOM 0 H PHE B 43 72.648 18.382 -3.771 1.00 0.00 H new ATOM 0 HA PHE B 43 71.749 18.482 -0.923 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.833 16.280 -2.736 1.00 0.00 H new ATOM 0 HB3 PHE B 43 72.558 16.058 -1.020 1.00 0.00 H new ATOM 0 HD1 PHE B 43 70.169 16.781 -0.136 1.00 0.00 H new ATOM 0 HD2 PHE B 43 71.054 15.901 -4.245 1.00 0.00 H new ATOM 0 HE1 PHE B 43 67.765 16.345 -0.559 1.00 0.00 H new ATOM 0 HE2 PHE B 43 68.653 15.469 -4.671 1.00 0.00 H new ATOM 0 HZ PHE B 43 67.006 15.690 -2.829 1.00 0.00 H new ATOM 2161 N LEU B 44 74.686 19.051 -1.929 1.00 0.00 N ATOM 2162 CA LEU B 44 76.096 19.328 -1.511 1.00 0.00 C ATOM 2163 C LEU B 44 76.421 20.789 -1.831 1.00 0.00 C ATOM 2164 O LEU B 44 76.076 21.298 -2.879 1.00 0.00 O ATOM 2165 CB LEU B 44 77.054 18.385 -2.283 1.00 0.00 C ATOM 2166 CG LEU B 44 78.148 17.807 -1.359 1.00 0.00 C ATOM 2167 CD1 LEU B 44 78.997 18.944 -0.768 1.00 0.00 C ATOM 2168 CD2 LEU B 44 77.515 16.964 -0.228 1.00 0.00 C ATOM 0 H LEU B 44 74.418 19.452 -2.828 1.00 0.00 H new ATOM 0 HA LEU B 44 76.217 19.153 -0.442 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.483 17.569 -2.727 1.00 0.00 H new ATOM 0 HB3 LEU B 44 77.520 18.931 -3.103 1.00 0.00 H new ATOM 0 HG LEU B 44 78.794 17.158 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU B 44 79.765 18.525 -0.118 1.00 0.00 H new ATOM 0 HD12 LEU B 44 79.470 19.502 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU B 44 78.358 19.612 -0.190 1.00 0.00 H new ATOM 0 HD21 LEU B 44 78.302 16.565 0.412 1.00 0.00 H new ATOM 0 HD22 LEU B 44 76.848 17.591 0.364 1.00 0.00 H new ATOM 0 HD23 LEU B 44 76.948 16.140 -0.662 1.00 0.00 H new ATOM 2180 N GLU B 45 77.081 21.468 -0.940 1.00 0.00 N ATOM 2181 CA GLU B 45 77.415 22.888 -1.213 1.00 0.00 C ATOM 2182 C GLU B 45 78.302 22.967 -2.464 1.00 0.00 C ATOM 2183 O GLU B 45 77.831 22.824 -3.574 1.00 0.00 O ATOM 2184 CB GLU B 45 78.145 23.479 -0.010 1.00 0.00 C ATOM 2185 CG GLU B 45 78.335 24.979 -0.228 1.00 0.00 C ATOM 2186 CD GLU B 45 79.011 25.589 0.999 1.00 0.00 C ATOM 2187 OE1 GLU B 45 79.140 24.888 1.989 1.00 0.00 O ATOM 2188 OE2 GLU B 45 79.388 26.746 0.927 1.00 0.00 O ATOM 0 H GLU B 45 77.401 21.105 -0.042 1.00 0.00 H new ATOM 0 HA GLU B 45 76.502 23.457 -1.386 1.00 0.00 H new ATOM 0 HB2 GLU B 45 77.574 23.301 0.901 1.00 0.00 H new ATOM 0 HB3 GLU B 45 79.112 22.992 0.119 1.00 0.00 H new ATOM 0 HG2 GLU B 45 78.942 25.154 -1.116 1.00 0.00 H new ATOM 0 HG3 GLU B 45 77.371 25.457 -0.401 1.00 0.00 H new ATOM 2195 N GLU B 46 79.580 23.191 -2.298 1.00 0.00 N ATOM 2196 CA GLU B 46 80.482 23.277 -3.480 1.00 0.00 C ATOM 2197 C GLU B 46 81.927 23.043 -3.031 1.00 0.00 C ATOM 2198 O GLU B 46 82.454 23.773 -2.213 1.00 0.00 O ATOM 2199 CB GLU B 46 80.363 24.665 -4.114 1.00 0.00 C ATOM 2200 CG GLU B 46 81.186 24.709 -5.403 1.00 0.00 C ATOM 2201 CD GLU B 46 81.061 26.091 -6.046 1.00 0.00 C ATOM 2202 OE1 GLU B 46 80.269 26.881 -5.556 1.00 0.00 O ATOM 2203 OE2 GLU B 46 81.756 26.335 -7.017 1.00 0.00 O ATOM 0 H GLU B 46 80.036 23.318 -1.394 1.00 0.00 H new ATOM 0 HA GLU B 46 80.199 22.520 -4.211 1.00 0.00 H new ATOM 0 HB2 GLU B 46 79.318 24.890 -4.329 1.00 0.00 H new ATOM 0 HB3 GLU B 46 80.716 25.426 -3.418 1.00 0.00 H new ATOM 0 HG2 GLU B 46 82.232 24.491 -5.186 1.00 0.00 H new ATOM 0 HG3 GLU B 46 80.838 23.942 -6.095 1.00 0.00 H new ATOM 2210 N ILE B 47 82.575 22.029 -3.551 1.00 0.00 N ATOM 2211 CA ILE B 47 83.988 21.749 -3.143 1.00 0.00 C ATOM 2212 C ILE B 47 84.944 22.340 -4.180 1.00 0.00 C ATOM 2213 O ILE B 47 84.936 21.964 -5.337 1.00 0.00 O ATOM 2214 CB ILE B 47 84.197 20.233 -3.044 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.231 19.663 -1.997 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.637 19.948 -2.604 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.240 18.132 -2.053 1.00 0.00 C ATOM 0 H ILE B 47 82.187 21.384 -4.239 1.00 0.00 H new ATOM 0 HA ILE B 47 84.188 22.204 -2.173 1.00 0.00 H new ATOM 0 HB ILE B 47 84.011 19.771 -4.014 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.520 20.000 -1.002 1.00 0.00 H new ATOM 0 HG13 ILE B 47 82.223 20.036 -2.179 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.789 18.871 -2.533 1.00 0.00 H new ATOM 0 HG22 ILE B 47 86.330 20.365 -3.335 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.817 20.405 -1.631 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.551 17.737 -1.306 1.00 0.00 H new ATOM 0 HD12 ILE B 47 82.929 17.802 -3.044 1.00 0.00 H new ATOM 0 HD13 ILE B 47 84.246 17.766 -1.848 1.00 0.00 H new ATOM 2229 N LYS B 48 85.769 23.271 -3.769 1.00 0.00 N ATOM 2230 CA LYS B 48 86.739 23.912 -4.709 1.00 0.00 C ATOM 2231 C LYS B 48 88.154 23.399 -4.412 1.00 0.00 C ATOM 2232 O LYS B 48 89.022 23.438 -5.260 1.00 0.00 O ATOM 2233 CB LYS B 48 86.682 25.437 -4.522 1.00 0.00 C ATOM 2234 CG LYS B 48 86.473 25.767 -3.041 1.00 0.00 C ATOM 2235 CD LYS B 48 86.816 27.239 -2.781 1.00 0.00 C ATOM 2236 CE LYS B 48 85.868 28.153 -3.569 1.00 0.00 C ATOM 2237 NZ LYS B 48 86.394 28.335 -4.952 1.00 0.00 N ATOM 0 H LYS B 48 85.812 23.618 -2.811 1.00 0.00 H new ATOM 0 HA LYS B 48 86.481 23.663 -5.738 1.00 0.00 H new ATOM 0 HB2 LYS B 48 87.606 25.892 -4.879 1.00 0.00 H new ATOM 0 HB3 LYS B 48 85.870 25.856 -5.116 1.00 0.00 H new ATOM 0 HG2 LYS B 48 85.439 25.570 -2.758 1.00 0.00 H new ATOM 0 HG3 LYS B 48 87.100 25.124 -2.424 1.00 0.00 H new ATOM 0 HD2 LYS B 48 86.738 27.455 -1.715 1.00 0.00 H new ATOM 0 HD3 LYS B 48 87.848 27.436 -3.072 1.00 0.00 H new ATOM 0 HE2 LYS B 48 84.869 27.718 -3.602 1.00 0.00 H new ATOM 0 HE3 LYS B 48 85.779 29.119 -3.072 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 86.448 29.350 -5.172 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 87.343 27.915 -5.021 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 85.759 27.867 -5.629 1.00 0.00 H new ATOM 2251 N GLU B 49 88.393 22.922 -3.211 1.00 0.00 N ATOM 2252 CA GLU B 49 89.761 22.410 -2.850 1.00 0.00 C ATOM 2253 C GLU B 49 89.746 20.882 -2.715 1.00 0.00 C ATOM 2254 O GLU B 49 88.851 20.303 -2.131 1.00 0.00 O ATOM 2255 CB GLU B 49 90.191 23.037 -1.522 1.00 0.00 C ATOM 2256 CG GLU B 49 90.463 24.525 -1.745 1.00 0.00 C ATOM 2257 CD GLU B 49 90.871 25.187 -0.427 1.00 0.00 C ATOM 2258 OE1 GLU B 49 90.781 24.532 0.599 1.00 0.00 O ATOM 2259 OE2 GLU B 49 91.263 26.343 -0.464 1.00 0.00 O ATOM 0 H GLU B 49 87.701 22.864 -2.464 1.00 0.00 H new ATOM 0 HA GLU B 49 90.463 22.681 -3.638 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.411 22.904 -0.772 1.00 0.00 H new ATOM 0 HB3 GLU B 49 91.085 22.542 -1.143 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.253 24.652 -2.485 1.00 0.00 H new ATOM 0 HG3 GLU B 49 89.572 25.010 -2.144 1.00 0.00 H new ATOM 2266 N GLN B 50 90.746 20.233 -3.250 1.00 0.00 N ATOM 2267 CA GLN B 50 90.828 18.743 -3.160 1.00 0.00 C ATOM 2268 C GLN B 50 91.099 18.335 -1.713 1.00 0.00 C ATOM 2269 O GLN B 50 90.679 17.292 -1.257 1.00 0.00 O ATOM 2270 CB GLN B 50 91.979 18.258 -4.044 1.00 0.00 C ATOM 2271 CG GLN B 50 93.290 18.889 -3.566 1.00 0.00 C ATOM 2272 CD GLN B 50 94.394 18.578 -4.577 1.00 0.00 C ATOM 2273 OE1 GLN B 50 94.189 18.703 -5.767 1.00 0.00 O ATOM 2274 NE2 GLN B 50 95.560 18.168 -4.157 1.00 0.00 N ATOM 0 H GLN B 50 91.517 20.675 -3.750 1.00 0.00 H new ATOM 0 HA GLN B 50 89.889 18.300 -3.492 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.050 17.171 -4.003 1.00 0.00 H new ATOM 0 HB3 GLN B 50 91.791 18.527 -5.084 1.00 0.00 H new ATOM 0 HG2 GLN B 50 93.171 19.967 -3.459 1.00 0.00 H new ATOM 0 HG3 GLN B 50 93.559 18.499 -2.584 1.00 0.00 H new ATOM 0 HE21 GLN B 50 95.734 18.062 -3.157 1.00 0.00 H new ATOM 0 HE22 GLN B 50 96.297 17.953 -4.828 1.00 0.00 H new ATOM 2283 N GLU B 51 91.806 19.157 -0.994 1.00 0.00 N ATOM 2284 CA GLU B 51 92.126 18.837 0.424 1.00 0.00 C ATOM 2285 C GLU B 51 90.826 18.594 1.190 1.00 0.00 C ATOM 2286 O GLU B 51 90.774 17.807 2.113 1.00 0.00 O ATOM 2287 CB GLU B 51 92.866 20.022 1.051 1.00 0.00 C ATOM 2288 CG GLU B 51 93.334 19.659 2.464 1.00 0.00 C ATOM 2289 CD GLU B 51 94.404 18.569 2.381 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.989 18.421 1.320 1.00 0.00 O ATOM 2291 OE2 GLU B 51 94.623 17.902 3.379 1.00 0.00 O ATOM 0 H GLU B 51 92.180 20.045 -1.330 1.00 0.00 H new ATOM 0 HA GLU B 51 92.752 17.946 0.469 1.00 0.00 H new ATOM 0 HB2 GLU B 51 93.722 20.294 0.434 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.211 20.892 1.088 1.00 0.00 H new ATOM 0 HG2 GLU B 51 93.735 20.541 2.964 1.00 0.00 H new ATOM 0 HG3 GLU B 51 92.490 19.311 3.060 1.00 0.00 H new ATOM 2298 N VAL B 52 89.774 19.248 0.796 1.00 0.00 N ATOM 2299 CA VAL B 52 88.467 19.050 1.472 1.00 0.00 C ATOM 2300 C VAL B 52 87.962 17.642 1.152 1.00 0.00 C ATOM 2301 O VAL B 52 87.333 16.988 1.961 1.00 0.00 O ATOM 2302 CB VAL B 52 87.481 20.100 0.951 1.00 0.00 C ATOM 2303 CG1 VAL B 52 86.068 19.816 1.475 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.934 21.485 1.421 1.00 0.00 C ATOM 0 H VAL B 52 89.764 19.918 0.027 1.00 0.00 H new ATOM 0 HA VAL B 52 88.568 19.159 2.552 1.00 0.00 H new ATOM 0 HB VAL B 52 87.461 20.063 -0.138 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.380 20.572 1.095 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.746 18.830 1.138 1.00 0.00 H new ATOM 0 HG13 VAL B 52 86.072 19.844 2.565 1.00 0.00 H new ATOM 0 HG21 VAL B 52 87.238 22.239 1.055 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.956 21.510 2.510 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.931 21.693 1.033 1.00 0.00 H new ATOM 2314 N VAL B 53 88.255 17.170 -0.027 1.00 0.00 N ATOM 2315 CA VAL B 53 87.818 15.799 -0.415 1.00 0.00 C ATOM 2316 C VAL B 53 88.617 14.773 0.392 1.00 0.00 C ATOM 2317 O VAL B 53 88.086 13.782 0.854 1.00 0.00 O ATOM 2318 CB VAL B 53 88.060 15.577 -1.916 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.810 14.106 -2.270 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.118 16.472 -2.735 1.00 0.00 C ATOM 0 H VAL B 53 88.780 17.675 -0.741 1.00 0.00 H new ATOM 0 HA VAL B 53 86.754 15.684 -0.208 1.00 0.00 H new ATOM 0 HB VAL B 53 89.093 15.834 -2.151 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.983 13.954 -3.335 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.489 13.474 -1.698 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.780 13.844 -2.028 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.295 16.310 -3.798 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.083 16.225 -2.497 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.306 17.518 -2.491 1.00 0.00 H new ATOM 2330 N ASP B 54 89.895 14.997 0.552 1.00 0.00 N ATOM 2331 CA ASP B 54 90.732 14.029 1.319 1.00 0.00 C ATOM 2332 C ASP B 54 90.209 13.917 2.751 1.00 0.00 C ATOM 2333 O ASP B 54 90.136 12.843 3.311 1.00 0.00 O ATOM 2334 CB ASP B 54 92.188 14.510 1.337 1.00 0.00 C ATOM 2335 CG ASP B 54 92.790 14.372 -0.065 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.248 13.608 -0.848 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.783 15.029 -0.331 1.00 0.00 O ATOM 0 H ASP B 54 90.394 15.807 0.185 1.00 0.00 H new ATOM 0 HA ASP B 54 90.681 13.051 0.841 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.235 15.549 1.664 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.767 13.925 2.052 1.00 0.00 H new ATOM 2342 N LYS B 55 89.824 15.015 3.342 1.00 0.00 N ATOM 2343 CA LYS B 55 89.290 14.960 4.732 1.00 0.00 C ATOM 2344 C LYS B 55 88.048 14.070 4.742 1.00 0.00 C ATOM 2345 O LYS B 55 87.919 13.167 5.541 1.00 0.00 O ATOM 2346 CB LYS B 55 88.916 16.376 5.181 1.00 0.00 C ATOM 2347 CG LYS B 55 88.391 16.360 6.618 1.00 0.00 C ATOM 2348 CD LYS B 55 88.110 17.803 7.045 1.00 0.00 C ATOM 2349 CE LYS B 55 87.534 17.839 8.462 1.00 0.00 C ATOM 2350 NZ LYS B 55 88.474 17.174 9.409 1.00 0.00 N ATOM 0 H LYS B 55 89.856 15.945 2.924 1.00 0.00 H new ATOM 0 HA LYS B 55 90.039 14.554 5.411 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.787 17.028 5.113 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.157 16.787 4.515 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.483 15.761 6.683 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.123 15.903 7.284 1.00 0.00 H new ATOM 0 HD2 LYS B 55 89.030 18.386 7.005 1.00 0.00 H new ATOM 0 HD3 LYS B 55 87.409 18.265 6.349 1.00 0.00 H new ATOM 0 HE2 LYS B 55 87.365 18.871 8.769 1.00 0.00 H new ATOM 0 HE3 LYS B 55 86.567 17.337 8.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 88.234 17.445 10.384 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 88.397 16.142 9.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 89.448 17.471 9.197 1.00 0.00 H new ATOM 2364 N VAL B 56 87.139 14.321 3.842 1.00 0.00 N ATOM 2365 CA VAL B 56 85.896 13.498 3.771 1.00 0.00 C ATOM 2366 C VAL B 56 86.254 12.050 3.425 1.00 0.00 C ATOM 2367 O VAL B 56 85.691 11.114 3.957 1.00 0.00 O ATOM 2368 CB VAL B 56 84.983 14.068 2.678 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.805 13.116 2.424 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.456 15.434 3.118 1.00 0.00 C ATOM 0 H VAL B 56 87.203 15.065 3.147 1.00 0.00 H new ATOM 0 HA VAL B 56 85.386 13.522 4.734 1.00 0.00 H new ATOM 0 HB VAL B 56 85.554 14.176 1.756 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.163 13.530 1.646 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.184 12.146 2.103 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.230 12.995 3.342 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.807 15.841 2.342 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.891 15.325 4.044 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.294 16.112 3.282 1.00 0.00 H new ATOM 2380 N MET B 57 87.175 11.862 2.520 1.00 0.00 N ATOM 2381 CA MET B 57 87.560 10.479 2.115 1.00 0.00 C ATOM 2382 C MET B 57 88.088 9.705 3.320 1.00 0.00 C ATOM 2383 O MET B 57 87.777 8.545 3.508 1.00 0.00 O ATOM 2384 CB MET B 57 88.642 10.556 1.033 1.00 0.00 C ATOM 2385 CG MET B 57 89.053 9.149 0.587 1.00 0.00 C ATOM 2386 SD MET B 57 87.634 8.313 -0.173 1.00 0.00 S ATOM 2387 CE MET B 57 88.534 7.466 -1.497 1.00 0.00 C ATOM 0 H MET B 57 87.679 12.609 2.042 1.00 0.00 H new ATOM 0 HA MET B 57 86.685 9.960 1.724 1.00 0.00 H new ATOM 0 HB2 MET B 57 88.271 11.121 0.178 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.511 11.091 1.416 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.877 9.208 -0.124 1.00 0.00 H new ATOM 0 HG3 MET B 57 89.411 8.575 1.442 1.00 0.00 H new ATOM 0 HE1 MET B 57 87.885 6.723 -1.961 1.00 0.00 H new ATOM 0 HE2 MET B 57 88.848 8.193 -2.246 1.00 0.00 H new ATOM 0 HE3 MET B 57 89.412 6.971 -1.081 1.00 0.00 H new ATOM 2397 N GLU B 58 88.892 10.324 4.132 1.00 0.00 N ATOM 2398 CA GLU B 58 89.438 9.601 5.314 1.00 0.00 C ATOM 2399 C GLU B 58 88.276 9.180 6.208 1.00 0.00 C ATOM 2400 O GLU B 58 88.248 8.090 6.745 1.00 0.00 O ATOM 2401 CB GLU B 58 90.380 10.514 6.098 1.00 0.00 C ATOM 2402 CG GLU B 58 91.653 10.772 5.288 1.00 0.00 C ATOM 2403 CD GLU B 58 92.457 9.477 5.168 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.720 8.871 6.193 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.791 9.110 4.053 1.00 0.00 O ATOM 0 H GLU B 58 89.195 11.293 4.032 1.00 0.00 H new ATOM 0 HA GLU B 58 89.994 8.724 4.982 1.00 0.00 H new ATOM 0 HB2 GLU B 58 89.883 11.458 6.321 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.634 10.054 7.053 1.00 0.00 H new ATOM 0 HG2 GLU B 58 91.396 11.145 4.297 1.00 0.00 H new ATOM 0 HG3 GLU B 58 92.254 11.542 5.772 1.00 0.00 H new ATOM 2412 N THR B 59 87.307 10.040 6.360 1.00 0.00 N ATOM 2413 CA THR B 59 86.131 9.702 7.205 1.00 0.00 C ATOM 2414 C THR B 59 85.357 8.550 6.564 1.00 0.00 C ATOM 2415 O THR B 59 84.896 7.648 7.235 1.00 0.00 O ATOM 2416 CB THR B 59 85.228 10.933 7.328 1.00 0.00 C ATOM 2417 OG1 THR B 59 85.958 11.987 7.944 1.00 0.00 O ATOM 2418 CG2 THR B 59 83.997 10.592 8.167 1.00 0.00 C ATOM 0 H THR B 59 87.281 10.966 5.933 1.00 0.00 H new ATOM 0 HA THR B 59 86.465 9.399 8.197 1.00 0.00 H new ATOM 0 HB THR B 59 84.901 11.247 6.337 1.00 0.00 H new ATOM 0 HG1 THR B 59 86.579 12.378 7.294 1.00 0.00 H new ATOM 0 HG21 THR B 59 83.359 11.472 8.251 1.00 0.00 H new ATOM 0 HG22 THR B 59 83.442 9.785 7.688 1.00 0.00 H new ATOM 0 HG23 THR B 59 84.311 10.275 9.162 1.00 0.00 H new ATOM 2426 N LEU B 60 85.231 8.566 5.267 1.00 0.00 N ATOM 2427 CA LEU B 60 84.502 7.464 4.574 1.00 0.00 C ATOM 2428 C LEU B 60 85.329 6.180 4.641 1.00 0.00 C ATOM 2429 O LEU B 60 84.798 5.103 4.821 1.00 0.00 O ATOM 2430 CB LEU B 60 84.268 7.847 3.095 1.00 0.00 C ATOM 2431 CG LEU B 60 82.865 8.435 2.907 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.763 9.760 3.660 1.00 0.00 C ATOM 2433 CD2 LEU B 60 82.608 8.660 1.409 1.00 0.00 C ATOM 0 H LEU B 60 85.601 9.294 4.655 1.00 0.00 H new ATOM 0 HA LEU B 60 83.542 7.304 5.064 1.00 0.00 H new ATOM 0 HB2 LEU B 60 85.018 8.572 2.778 1.00 0.00 H new ATOM 0 HB3 LEU B 60 84.388 6.967 2.462 1.00 0.00 H new ATOM 0 HG LEU B 60 82.119 7.745 3.301 1.00 0.00 H new ATOM 0 HD11 LEU B 60 81.765 10.178 3.527 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.946 9.591 4.721 1.00 0.00 H new ATOM 0 HD13 LEU B 60 83.504 10.458 3.271 1.00 0.00 H new ATOM 0 HD21 LEU B 60 81.611 9.078 1.270 1.00 0.00 H new ATOM 0 HD22 LEU B 60 83.351 9.352 1.012 1.00 0.00 H new ATOM 0 HD23 LEU B 60 82.680 7.709 0.881 1.00 0.00 H new ATOM 2445 N ASP B 61 86.613 6.273 4.453 1.00 0.00 N ATOM 2446 CA ASP B 61 87.449 5.043 4.461 1.00 0.00 C ATOM 2447 C ASP B 61 87.523 4.451 5.862 1.00 0.00 C ATOM 2448 O ASP B 61 88.412 4.755 6.633 1.00 0.00 O ATOM 2449 CB ASP B 61 88.862 5.388 3.998 1.00 0.00 C ATOM 2450 CG ASP B 61 89.632 4.093 3.753 1.00 0.00 C ATOM 2451 OD1 ASP B 61 89.117 3.045 4.108 1.00 0.00 O ATOM 2452 OD2 ASP B 61 90.721 4.170 3.217 1.00 0.00 O ATOM 0 H ASP B 61 87.119 7.144 4.295 1.00 0.00 H new ATOM 0 HA ASP B 61 86.996 4.313 3.790 1.00 0.00 H new ATOM 0 HB2 ASP B 61 88.825 5.983 3.085 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.369 5.991 4.751 1.00 0.00 H new ATOM 2457 N GLU B 62 86.612 3.586 6.189 1.00 0.00 N ATOM 2458 CA GLU B 62 86.651 2.952 7.529 1.00 0.00 C ATOM 2459 C GLU B 62 87.844 1.997 7.591 1.00 0.00 C ATOM 2460 O GLU B 62 88.350 1.690 8.652 1.00 0.00 O ATOM 2461 CB GLU B 62 85.351 2.174 7.771 1.00 0.00 C ATOM 2462 CG GLU B 62 84.190 3.156 7.945 1.00 0.00 C ATOM 2463 CD GLU B 62 84.360 3.922 9.262 1.00 0.00 C ATOM 2464 OE1 GLU B 62 85.089 3.441 10.114 1.00 0.00 O ATOM 2465 OE2 GLU B 62 83.762 4.977 9.392 1.00 0.00 O ATOM 0 H GLU B 62 85.843 3.291 5.588 1.00 0.00 H new ATOM 0 HA GLU B 62 86.753 3.719 8.297 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.153 1.506 6.932 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.449 1.550 8.659 1.00 0.00 H new ATOM 0 HG2 GLU B 62 84.161 3.853 7.108 1.00 0.00 H new ATOM 0 HG3 GLU B 62 83.242 2.618 7.945 1.00 0.00 H new ATOM 2472 N ASP B 63 88.288 1.512 6.460 1.00 0.00 N ATOM 2473 CA ASP B 63 89.440 0.560 6.445 1.00 0.00 C ATOM 2474 C ASP B 63 90.768 1.307 6.223 1.00 0.00 C ATOM 2475 O ASP B 63 91.830 0.732 6.344 1.00 0.00 O ATOM 2476 CB ASP B 63 89.234 -0.447 5.308 1.00 0.00 C ATOM 2477 CG ASP B 63 87.747 -0.775 5.173 1.00 0.00 C ATOM 2478 OD1 ASP B 63 87.110 -0.989 6.191 1.00 0.00 O ATOM 2479 OD2 ASP B 63 87.270 -0.806 4.050 1.00 0.00 O ATOM 0 H ASP B 63 87.901 1.735 5.543 1.00 0.00 H new ATOM 0 HA ASP B 63 89.487 0.049 7.407 1.00 0.00 H new ATOM 0 HB2 ASP B 63 89.612 -0.036 4.372 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.800 -1.357 5.508 1.00 0.00 H new ATOM 2484 N GLY B 64 90.726 2.567 5.885 1.00 0.00 N ATOM 2485 CA GLY B 64 91.999 3.308 5.649 1.00 0.00 C ATOM 2486 C GLY B 64 92.665 2.776 4.374 1.00 0.00 C ATOM 2487 O GLY B 64 93.842 2.978 4.144 1.00 0.00 O ATOM 0 H GLY B 64 89.873 3.112 5.763 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.799 4.375 5.551 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.668 3.186 6.501 1.00 0.00 H new ATOM 2491 N ASP B 65 91.920 2.088 3.550 1.00 0.00 N ATOM 2492 CA ASP B 65 92.494 1.519 2.294 1.00 0.00 C ATOM 2493 C ASP B 65 92.858 2.642 1.329 1.00 0.00 C ATOM 2494 O ASP B 65 93.485 2.421 0.314 1.00 0.00 O ATOM 2495 CB ASP B 65 91.447 0.633 1.618 1.00 0.00 C ATOM 2496 CG ASP B 65 91.203 -0.616 2.463 1.00 0.00 C ATOM 2497 OD1 ASP B 65 92.109 -1.011 3.180 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.110 -1.152 2.385 1.00 0.00 O ATOM 0 H ASP B 65 90.929 1.894 3.694 1.00 0.00 H new ATOM 0 HA ASP B 65 93.384 0.942 2.545 1.00 0.00 H new ATOM 0 HB2 ASP B 65 90.516 1.186 1.492 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.786 0.349 0.622 1.00 0.00 H new ATOM 2503 N GLY B 66 92.466 3.845 1.631 1.00 0.00 N ATOM 2504 CA GLY B 66 92.785 4.979 0.721 1.00 0.00 C ATOM 2505 C GLY B 66 91.719 5.059 -0.375 1.00 0.00 C ATOM 2506 O GLY B 66 91.587 6.060 -1.049 1.00 0.00 O ATOM 0 H GLY B 66 91.939 4.094 2.468 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.818 5.913 1.282 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.771 4.839 0.277 1.00 0.00 H new ATOM 2510 N GLU B 67 90.945 4.009 -0.551 1.00 0.00 N ATOM 2511 CA GLU B 67 89.874 4.008 -1.601 1.00 0.00 C ATOM 2512 C GLU B 67 88.556 3.545 -0.969 1.00 0.00 C ATOM 2513 O GLU B 67 88.543 2.997 0.120 1.00 0.00 O ATOM 2514 CB GLU B 67 90.266 3.055 -2.732 1.00 0.00 C ATOM 2515 CG GLU B 67 91.491 3.614 -3.459 1.00 0.00 C ATOM 2516 CD GLU B 67 91.929 2.636 -4.547 1.00 0.00 C ATOM 2517 OE1 GLU B 67 91.327 1.582 -4.643 1.00 0.00 O ATOM 2518 OE2 GLU B 67 92.863 2.956 -5.264 1.00 0.00 O ATOM 0 H GLU B 67 91.011 3.148 -0.008 1.00 0.00 H new ATOM 0 HA GLU B 67 89.754 5.013 -2.007 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.487 2.066 -2.330 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.436 2.938 -3.429 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.255 4.583 -3.900 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.304 3.776 -2.752 1.00 0.00 H new ATOM 2525 N CYS B 68 87.443 3.760 -1.636 1.00 0.00 N ATOM 2526 CA CYS B 68 86.121 3.335 -1.071 1.00 0.00 C ATOM 2527 C CYS B 68 85.648 2.063 -1.779 1.00 0.00 C ATOM 2528 O CYS B 68 85.285 2.084 -2.938 1.00 0.00 O ATOM 2529 CB CYS B 68 85.093 4.442 -1.313 1.00 0.00 C ATOM 2530 SG CYS B 68 85.564 5.918 -0.380 1.00 0.00 S ATOM 0 H CYS B 68 87.395 4.212 -2.549 1.00 0.00 H new ATOM 0 HA CYS B 68 86.227 3.146 -0.003 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.036 4.674 -2.377 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.102 4.106 -1.007 1.00 0.00 H new ATOM 0 HG CYS B 68 84.692 6.859 -0.588 1.00 0.00 H new ATOM 2536 N ASP B 69 85.670 0.955 -1.094 1.00 0.00 N ATOM 2537 CA ASP B 69 85.247 -0.328 -1.726 1.00 0.00 C ATOM 2538 C ASP B 69 83.733 -0.344 -1.986 1.00 0.00 C ATOM 2539 O ASP B 69 83.013 0.573 -1.643 1.00 0.00 O ATOM 2540 CB ASP B 69 85.617 -1.493 -0.802 1.00 0.00 C ATOM 2541 CG ASP B 69 85.575 -2.806 -1.589 1.00 0.00 C ATOM 2542 OD1 ASP B 69 84.490 -3.328 -1.780 1.00 0.00 O ATOM 2543 OD2 ASP B 69 86.634 -3.271 -1.983 1.00 0.00 O ATOM 0 H ASP B 69 85.964 0.881 -0.120 1.00 0.00 H new ATOM 0 HA ASP B 69 85.760 -0.428 -2.682 1.00 0.00 H new ATOM 0 HB2 ASP B 69 86.613 -1.338 -0.386 1.00 0.00 H new ATOM 0 HB3 ASP B 69 84.924 -1.538 0.038 1.00 0.00 H new ATOM 2548 N PHE B 70 83.266 -1.408 -2.584 1.00 0.00 N ATOM 2549 CA PHE B 70 81.809 -1.542 -2.876 1.00 0.00 C ATOM 2550 C PHE B 70 81.028 -1.496 -1.558 1.00 0.00 C ATOM 2551 O PHE B 70 80.046 -0.794 -1.423 1.00 0.00 O ATOM 2552 CB PHE B 70 81.534 -2.879 -3.568 1.00 0.00 C ATOM 2553 CG PHE B 70 80.060 -2.984 -3.876 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.193 -3.541 -2.933 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.564 -2.536 -5.105 1.00 0.00 C ATOM 2556 CE1 PHE B 70 77.827 -3.648 -3.216 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.196 -2.642 -5.390 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.328 -3.199 -4.443 1.00 0.00 C ATOM 0 H PHE B 70 83.838 -2.197 -2.885 1.00 0.00 H new ATOM 0 HA PHE B 70 81.498 -0.726 -3.529 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.116 -2.953 -4.487 1.00 0.00 H new ATOM 0 HB3 PHE B 70 81.844 -3.704 -2.927 1.00 0.00 H new ATOM 0 HD1 PHE B 70 79.577 -3.889 -1.986 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.236 -2.108 -5.835 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.157 -4.078 -2.486 1.00 0.00 H new ATOM 0 HE2 PHE B 70 77.812 -2.295 -6.338 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.273 -3.282 -4.660 1.00 0.00 H new ATOM 2568 N GLN B 71 81.448 -2.271 -0.596 1.00 0.00 N ATOM 2569 CA GLN B 71 80.722 -2.303 0.706 1.00 0.00 C ATOM 2570 C GLN B 71 80.722 -0.899 1.319 1.00 0.00 C ATOM 2571 O GLN B 71 79.680 -0.361 1.637 1.00 0.00 O ATOM 2572 CB GLN B 71 81.414 -3.297 1.646 1.00 0.00 C ATOM 2573 CG GLN B 71 80.686 -3.345 2.993 1.00 0.00 C ATOM 2574 CD GLN B 71 81.378 -4.365 3.901 1.00 0.00 C ATOM 2575 OE1 GLN B 71 82.161 -5.170 3.441 1.00 0.00 O ATOM 2576 NE2 GLN B 71 81.136 -4.353 5.185 1.00 0.00 N ATOM 0 H GLN B 71 82.262 -2.883 -0.655 1.00 0.00 H new ATOM 0 HA GLN B 71 79.691 -2.621 0.552 1.00 0.00 H new ATOM 0 HB2 GLN B 71 81.425 -4.289 1.194 1.00 0.00 H new ATOM 0 HB3 GLN B 71 82.453 -3.004 1.796 1.00 0.00 H new ATOM 0 HG2 GLN B 71 80.694 -2.360 3.460 1.00 0.00 H new ATOM 0 HG3 GLN B 71 79.642 -3.620 2.846 1.00 0.00 H new ATOM 0 HE21 GLN B 71 80.478 -3.677 5.574 1.00 0.00 H new ATOM 0 HE22 GLN B 71 81.605 -5.019 5.799 1.00 0.00 H new ATOM 2585 N GLU B 72 81.866 -0.294 1.475 1.00 0.00 N ATOM 2586 CA GLU B 72 81.895 1.080 2.059 1.00 0.00 C ATOM 2587 C GLU B 72 81.079 2.005 1.156 1.00 0.00 C ATOM 2588 O GLU B 72 80.270 2.789 1.607 1.00 0.00 O ATOM 2589 CB GLU B 72 83.345 1.572 2.104 1.00 0.00 C ATOM 2590 CG GLU B 72 84.125 0.784 3.157 1.00 0.00 C ATOM 2591 CD GLU B 72 85.619 1.098 3.030 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.248 0.534 2.150 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.110 1.894 3.813 1.00 0.00 O ATOM 0 H GLU B 72 82.775 -0.685 1.227 1.00 0.00 H new ATOM 0 HA GLU B 72 81.479 1.074 3.066 1.00 0.00 H new ATOM 0 HB2 GLU B 72 83.811 1.450 1.126 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.371 2.636 2.339 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.772 1.043 4.155 1.00 0.00 H new ATOM 0 HG3 GLU B 72 83.955 -0.285 3.026 1.00 0.00 H new ATOM 2600 N PHE B 73 81.312 1.914 -0.123 1.00 0.00 N ATOM 2601 CA PHE B 73 80.575 2.785 -1.085 1.00 0.00 C ATOM 2602 C PHE B 73 79.083 2.799 -0.714 1.00 0.00 C ATOM 2603 O PHE B 73 78.423 3.816 -0.791 1.00 0.00 O ATOM 2604 CB PHE B 73 80.755 2.253 -2.511 1.00 0.00 C ATOM 2605 CG PHE B 73 79.833 2.992 -3.453 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.259 4.165 -4.090 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.547 2.498 -3.687 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.394 4.841 -4.962 1.00 0.00 C ATOM 2609 CE2 PHE B 73 77.683 3.172 -4.557 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.106 4.343 -5.196 1.00 0.00 C ATOM 0 H PHE B 73 81.983 1.273 -0.547 1.00 0.00 H new ATOM 0 HA PHE B 73 80.970 3.800 -1.036 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.790 2.379 -2.828 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.540 1.185 -2.540 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.253 4.548 -3.909 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.219 1.594 -3.195 1.00 0.00 H new ATOM 0 HE1 PHE B 73 79.721 5.746 -5.453 1.00 0.00 H new ATOM 0 HE2 PHE B 73 76.689 2.788 -4.735 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.440 4.862 -5.869 1.00 0.00 H new ATOM 2620 N MET B 74 78.560 1.680 -0.295 1.00 0.00 N ATOM 2621 CA MET B 74 77.118 1.616 0.105 1.00 0.00 C ATOM 2622 C MET B 74 76.915 2.430 1.390 1.00 0.00 C ATOM 2623 O MET B 74 75.854 2.965 1.638 1.00 0.00 O ATOM 2624 CB MET B 74 76.722 0.152 0.341 1.00 0.00 C ATOM 2625 CG MET B 74 75.216 0.051 0.610 1.00 0.00 C ATOM 2626 SD MET B 74 74.299 0.479 -0.892 1.00 0.00 S ATOM 2627 CE MET B 74 74.318 -1.159 -1.663 1.00 0.00 C ATOM 0 H MET B 74 79.069 0.800 -0.211 1.00 0.00 H new ATOM 0 HA MET B 74 76.493 2.032 -0.685 1.00 0.00 H new ATOM 0 HB2 MET B 74 76.985 -0.449 -0.529 1.00 0.00 H new ATOM 0 HB3 MET B 74 77.278 -0.252 1.187 1.00 0.00 H new ATOM 0 HG2 MET B 74 74.960 -0.960 0.928 1.00 0.00 H new ATOM 0 HG3 MET B 74 74.936 0.722 1.422 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.780 -1.122 -2.610 1.00 0.00 H new ATOM 0 HE2 MET B 74 75.349 -1.465 -1.843 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.837 -1.879 -1.001 1.00 0.00 H new ATOM 2637 N ALA B 75 77.938 2.538 2.196 1.00 0.00 N ATOM 2638 CA ALA B 75 77.817 3.331 3.457 1.00 0.00 C ATOM 2639 C ALA B 75 77.462 4.776 3.091 1.00 0.00 C ATOM 2640 O ALA B 75 76.472 5.323 3.534 1.00 0.00 O ATOM 2641 CB ALA B 75 79.160 3.307 4.195 1.00 0.00 C ATOM 0 H ALA B 75 78.851 2.113 2.037 1.00 0.00 H new ATOM 0 HA ALA B 75 77.043 2.908 4.098 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.079 3.884 5.116 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.426 2.277 4.434 1.00 0.00 H new ATOM 0 HB3 ALA B 75 79.932 3.743 3.561 1.00 0.00 H new ATOM 2647 N PHE B 76 78.283 5.386 2.288 1.00 0.00 N ATOM 2648 CA PHE B 76 78.032 6.799 1.882 1.00 0.00 C ATOM 2649 C PHE B 76 76.643 6.898 1.250 1.00 0.00 C ATOM 2650 O PHE B 76 75.904 7.828 1.501 1.00 0.00 O ATOM 2651 CB PHE B 76 79.094 7.245 0.880 1.00 0.00 C ATOM 2652 CG PHE B 76 78.821 8.673 0.481 1.00 0.00 C ATOM 2653 CD1 PHE B 76 79.193 9.715 1.337 1.00 0.00 C ATOM 2654 CD2 PHE B 76 78.200 8.957 -0.741 1.00 0.00 C ATOM 2655 CE1 PHE B 76 78.945 11.042 0.974 1.00 0.00 C ATOM 2656 CE2 PHE B 76 77.950 10.287 -1.105 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.325 11.329 -0.243 1.00 0.00 C ATOM 0 H PHE B 76 79.124 4.966 1.891 1.00 0.00 H new ATOM 0 HA PHE B 76 78.081 7.447 2.757 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.087 7.160 1.321 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.079 6.599 0.002 1.00 0.00 H new ATOM 0 HD1 PHE B 76 79.672 9.494 2.279 1.00 0.00 H new ATOM 0 HD2 PHE B 76 77.914 8.152 -1.402 1.00 0.00 H new ATOM 0 HE1 PHE B 76 79.233 11.845 1.636 1.00 0.00 H new ATOM 0 HE2 PHE B 76 77.470 10.510 -2.047 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.134 12.355 -0.522 1.00 0.00 H new ATOM 2667 N VAL B 77 76.263 5.927 0.470 1.00 0.00 N ATOM 2668 CA VAL B 77 74.901 5.968 -0.127 1.00 0.00 C ATOM 2669 C VAL B 77 73.899 5.982 1.031 1.00 0.00 C ATOM 2670 O VAL B 77 72.942 6.730 1.031 1.00 0.00 O ATOM 2671 CB VAL B 77 74.674 4.725 -1.003 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.197 4.629 -1.398 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.522 4.832 -2.274 1.00 0.00 C ATOM 0 H VAL B 77 76.829 5.115 0.222 1.00 0.00 H new ATOM 0 HA VAL B 77 74.780 6.851 -0.755 1.00 0.00 H new ATOM 0 HB VAL B 77 74.960 3.837 -0.439 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.043 3.746 -2.019 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.584 4.553 -0.500 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.911 5.520 -1.957 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.361 3.950 -2.894 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.234 5.724 -2.830 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.576 4.897 -2.004 1.00 0.00 H new ATOM 2683 N SER B 78 74.115 5.153 2.017 1.00 0.00 N ATOM 2684 CA SER B 78 73.179 5.109 3.177 1.00 0.00 C ATOM 2685 C SER B 78 73.261 6.418 3.968 1.00 0.00 C ATOM 2686 O SER B 78 72.262 6.953 4.401 1.00 0.00 O ATOM 2687 CB SER B 78 73.554 3.940 4.086 1.00 0.00 C ATOM 2688 OG SER B 78 74.753 4.248 4.786 1.00 0.00 O ATOM 0 H SER B 78 74.900 4.504 2.069 1.00 0.00 H new ATOM 0 HA SER B 78 72.161 4.978 2.810 1.00 0.00 H new ATOM 0 HB2 SER B 78 72.748 3.742 4.793 1.00 0.00 H new ATOM 0 HB3 SER B 78 73.688 3.034 3.495 1.00 0.00 H new ATOM 0 HG SER B 78 75.449 4.505 4.146 1.00 0.00 H new ATOM 2694 N MET B 79 74.443 6.919 4.192 1.00 0.00 N ATOM 2695 CA MET B 79 74.574 8.170 4.990 1.00 0.00 C ATOM 2696 C MET B 79 73.744 9.275 4.343 1.00 0.00 C ATOM 2697 O MET B 79 73.052 10.016 5.010 1.00 0.00 O ATOM 2698 CB MET B 79 76.044 8.589 5.029 1.00 0.00 C ATOM 2699 CG MET B 79 76.205 9.815 5.927 1.00 0.00 C ATOM 2700 SD MET B 79 77.954 10.258 6.039 1.00 0.00 S ATOM 2701 CE MET B 79 77.726 11.847 6.873 1.00 0.00 C ATOM 0 H MET B 79 75.320 6.519 3.859 1.00 0.00 H new ATOM 0 HA MET B 79 74.216 7.998 6.005 1.00 0.00 H new ATOM 0 HB2 MET B 79 76.656 7.769 5.403 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.395 8.815 4.022 1.00 0.00 H new ATOM 0 HG2 MET B 79 75.633 10.651 5.525 1.00 0.00 H new ATOM 0 HG3 MET B 79 75.808 9.606 6.920 1.00 0.00 H new ATOM 0 HE1 MET B 79 78.698 12.309 7.047 1.00 0.00 H new ATOM 0 HE2 MET B 79 77.119 12.502 6.248 1.00 0.00 H new ATOM 0 HE3 MET B 79 77.224 11.688 7.827 1.00 0.00 H new ATOM 2711 N VAL B 80 73.776 9.370 3.051 1.00 0.00 N ATOM 2712 CA VAL B 80 72.960 10.403 2.362 1.00 0.00 C ATOM 2713 C VAL B 80 71.484 10.143 2.675 1.00 0.00 C ATOM 2714 O VAL B 80 70.684 11.051 2.782 1.00 0.00 O ATOM 2715 CB VAL B 80 73.205 10.325 0.854 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.245 11.260 0.121 1.00 0.00 C ATOM 2717 CG2 VAL B 80 74.643 10.753 0.562 1.00 0.00 C ATOM 0 H VAL B 80 74.333 8.776 2.437 1.00 0.00 H new ATOM 0 HA VAL B 80 73.237 11.399 2.707 1.00 0.00 H new ATOM 0 HB VAL B 80 73.040 9.303 0.513 1.00 0.00 H new ATOM 0 HG11 VAL B 80 72.426 11.199 -0.952 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.217 10.966 0.333 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.406 12.284 0.458 1.00 0.00 H new ATOM 0 HG21 VAL B 80 74.827 10.701 -0.511 1.00 0.00 H new ATOM 0 HG22 VAL B 80 74.795 11.776 0.907 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.333 10.088 1.082 1.00 0.00 H new ATOM 2727 N THR B 81 71.136 8.899 2.861 1.00 0.00 N ATOM 2728 CA THR B 81 69.728 8.550 3.211 1.00 0.00 C ATOM 2729 C THR B 81 69.515 8.781 4.712 1.00 0.00 C ATOM 2730 O THR B 81 68.565 9.411 5.133 1.00 0.00 O ATOM 2731 CB THR B 81 69.469 7.078 2.878 1.00 0.00 C ATOM 2732 OG1 THR B 81 69.871 6.828 1.542 1.00 0.00 O ATOM 2733 CG2 THR B 81 67.978 6.760 3.032 1.00 0.00 C ATOM 0 H THR B 81 71.770 8.104 2.785 1.00 0.00 H new ATOM 0 HA THR B 81 69.040 9.174 2.641 1.00 0.00 H new ATOM 0 HB THR B 81 70.038 6.447 3.561 1.00 0.00 H new ATOM 0 HG1 THR B 81 70.849 6.788 1.497 1.00 0.00 H new ATOM 0 HG21 THR B 81 67.803 5.711 2.793 1.00 0.00 H new ATOM 0 HG22 THR B 81 67.669 6.955 4.059 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.400 7.388 2.354 1.00 0.00 H new ATOM 2741 N THR B 82 70.401 8.257 5.512 1.00 0.00 N ATOM 2742 CA THR B 82 70.294 8.407 6.991 1.00 0.00 C ATOM 2743 C THR B 82 70.612 9.849 7.401 1.00 0.00 C ATOM 2744 O THR B 82 70.283 10.282 8.488 1.00 0.00 O ATOM 2745 CB THR B 82 71.294 7.458 7.650 1.00 0.00 C ATOM 2746 OG1 THR B 82 71.213 6.185 7.026 1.00 0.00 O ATOM 2747 CG2 THR B 82 70.977 7.317 9.138 1.00 0.00 C ATOM 0 H THR B 82 71.210 7.721 5.197 1.00 0.00 H new ATOM 0 HA THR B 82 69.279 8.169 7.310 1.00 0.00 H new ATOM 0 HB THR B 82 72.301 7.861 7.537 1.00 0.00 H new ATOM 0 HG1 THR B 82 70.362 5.759 7.261 1.00 0.00 H new ATOM 0 HG21 THR B 82 71.694 6.639 9.600 1.00 0.00 H new ATOM 0 HG22 THR B 82 71.040 8.294 9.618 1.00 0.00 H new ATOM 0 HG23 THR B 82 69.970 6.918 9.259 1.00 0.00 H new ATOM 2755 N ALA B 83 71.238 10.597 6.538 1.00 0.00 N ATOM 2756 CA ALA B 83 71.564 12.009 6.886 1.00 0.00 C ATOM 2757 C ALA B 83 70.302 12.870 6.790 1.00 0.00 C ATOM 2758 O ALA B 83 70.052 13.722 7.619 1.00 0.00 O ATOM 2759 CB ALA B 83 72.612 12.551 5.917 1.00 0.00 C ATOM 0 H ALA B 83 71.537 10.295 5.611 1.00 0.00 H new ATOM 0 HA ALA B 83 71.954 12.042 7.903 1.00 0.00 H new ATOM 0 HB1 ALA B 83 72.847 13.584 6.175 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.516 11.946 5.983 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.222 12.511 4.900 1.00 0.00 H new ATOM 2765 N CYS B 84 69.517 12.665 5.764 1.00 0.00 N ATOM 2766 CA CYS B 84 68.280 13.483 5.581 1.00 0.00 C ATOM 2767 C CYS B 84 67.110 12.887 6.364 1.00 0.00 C ATOM 2768 O CYS B 84 66.852 11.700 6.316 1.00 0.00 O ATOM 2769 CB CYS B 84 67.925 13.520 4.095 1.00 0.00 C ATOM 2770 SG CYS B 84 69.175 14.485 3.214 1.00 0.00 S ATOM 0 H CYS B 84 69.680 11.963 5.042 1.00 0.00 H new ATOM 0 HA CYS B 84 68.467 14.490 5.953 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.879 12.508 3.694 1.00 0.00 H new ATOM 0 HB3 CYS B 84 66.939 13.963 3.954 1.00 0.00 H new ATOM 0 HG CYS B 84 68.883 14.520 1.948 1.00 0.00 H new ATOM 2776 N HIS B 85 66.389 13.713 7.072 1.00 0.00 N ATOM 2777 CA HIS B 85 65.217 13.224 7.853 1.00 0.00 C ATOM 2778 C HIS B 85 64.016 13.072 6.902 1.00 0.00 C ATOM 2779 O HIS B 85 64.071 13.498 5.764 1.00 0.00 O ATOM 2780 CB HIS B 85 64.907 14.236 8.959 1.00 0.00 C ATOM 2781 CG HIS B 85 66.029 14.222 9.965 1.00 0.00 C ATOM 2782 ND1 HIS B 85 66.099 13.273 10.974 1.00 0.00 N ATOM 2783 CD2 HIS B 85 67.138 15.021 10.127 1.00 0.00 C ATOM 2784 CE1 HIS B 85 67.213 13.521 11.690 1.00 0.00 C ATOM 2785 NE2 HIS B 85 67.879 14.573 11.215 1.00 0.00 N ATOM 0 H HIS B 85 66.564 14.715 7.143 1.00 0.00 H new ATOM 0 HA HIS B 85 65.430 12.257 8.308 1.00 0.00 H new ATOM 0 HB2 HIS B 85 64.794 15.234 8.535 1.00 0.00 H new ATOM 0 HB3 HIS B 85 63.963 13.986 9.444 1.00 0.00 H new ATOM 0 HD2 HIS B 85 67.393 15.866 9.505 1.00 0.00 H new ATOM 0 HE1 HIS B 85 67.527 12.939 12.544 1.00 0.00 H new ATOM 0 HE2 HIS B 85 68.749 14.967 11.574 1.00 0.00 H new ATOM 2794 N GLU B 86 62.940 12.455 7.333 1.00 0.00 N ATOM 2795 CA GLU B 86 61.769 12.279 6.409 1.00 0.00 C ATOM 2796 C GLU B 86 61.457 13.610 5.716 1.00 0.00 C ATOM 2797 O GLU B 86 61.066 14.572 6.348 1.00 0.00 O ATOM 2798 CB GLU B 86 60.531 11.822 7.196 1.00 0.00 C ATOM 2799 CG GLU B 86 60.731 10.389 7.695 1.00 0.00 C ATOM 2800 CD GLU B 86 59.497 9.934 8.478 1.00 0.00 C ATOM 2801 OE1 GLU B 86 58.638 10.763 8.734 1.00 0.00 O ATOM 2802 OE2 GLU B 86 59.428 8.760 8.804 1.00 0.00 O ATOM 0 H GLU B 86 62.821 12.070 8.270 1.00 0.00 H new ATOM 0 HA GLU B 86 62.022 11.522 5.666 1.00 0.00 H new ATOM 0 HB2 GLU B 86 60.359 12.490 8.040 1.00 0.00 H new ATOM 0 HB3 GLU B 86 59.646 11.875 6.562 1.00 0.00 H new ATOM 0 HG2 GLU B 86 60.904 9.721 6.851 1.00 0.00 H new ATOM 0 HG3 GLU B 86 61.616 10.336 8.330 1.00 0.00 H new ATOM 2809 N PHE B 87 61.636 13.672 4.415 1.00 0.00 N ATOM 2810 CA PHE B 87 61.364 14.936 3.662 1.00 0.00 C ATOM 2811 C PHE B 87 60.063 14.826 2.858 1.00 0.00 C ATOM 2812 O PHE B 87 59.482 15.821 2.473 1.00 0.00 O ATOM 2813 CB PHE B 87 62.522 15.213 2.702 1.00 0.00 C ATOM 2814 CG PHE B 87 62.255 16.503 1.967 1.00 0.00 C ATOM 2815 CD1 PHE B 87 62.674 17.719 2.515 1.00 0.00 C ATOM 2816 CD2 PHE B 87 61.592 16.479 0.735 1.00 0.00 C ATOM 2817 CE1 PHE B 87 62.427 18.917 1.830 1.00 0.00 C ATOM 2818 CE2 PHE B 87 61.346 17.673 0.051 1.00 0.00 C ATOM 2819 CZ PHE B 87 61.764 18.893 0.599 1.00 0.00 C ATOM 0 H PHE B 87 61.961 12.894 3.841 1.00 0.00 H new ATOM 0 HA PHE B 87 61.264 15.750 4.380 1.00 0.00 H new ATOM 0 HB2 PHE B 87 63.460 15.281 3.254 1.00 0.00 H new ATOM 0 HB3 PHE B 87 62.628 14.391 1.994 1.00 0.00 H new ATOM 0 HD1 PHE B 87 63.187 17.735 3.465 1.00 0.00 H new ATOM 0 HD2 PHE B 87 61.270 15.538 0.313 1.00 0.00 H new ATOM 0 HE1 PHE B 87 62.748 19.857 2.253 1.00 0.00 H new ATOM 0 HE2 PHE B 87 60.834 17.655 -0.900 1.00 0.00 H new ATOM 0 HZ PHE B 87 61.574 19.815 0.070 1.00 0.00 H new ATOM 2829 N PHE B 88 59.604 13.634 2.581 1.00 0.00 N ATOM 2830 CA PHE B 88 58.348 13.492 1.783 1.00 0.00 C ATOM 2831 C PHE B 88 57.131 13.682 2.691 1.00 0.00 C ATOM 2832 O PHE B 88 56.766 12.816 3.459 1.00 0.00 O ATOM 2833 CB PHE B 88 58.308 12.100 1.126 1.00 0.00 C ATOM 2834 CG PHE B 88 58.135 11.026 2.179 1.00 0.00 C ATOM 2835 CD1 PHE B 88 59.234 10.604 2.938 1.00 0.00 C ATOM 2836 CD2 PHE B 88 56.873 10.457 2.401 1.00 0.00 C ATOM 2837 CE1 PHE B 88 59.071 9.614 3.916 1.00 0.00 C ATOM 2838 CE2 PHE B 88 56.711 9.470 3.380 1.00 0.00 C ATOM 2839 CZ PHE B 88 57.809 9.048 4.138 1.00 0.00 C ATOM 0 H PHE B 88 60.040 12.758 2.870 1.00 0.00 H new ATOM 0 HA PHE B 88 58.327 14.254 1.004 1.00 0.00 H new ATOM 0 HB2 PHE B 88 57.488 12.052 0.410 1.00 0.00 H new ATOM 0 HB3 PHE B 88 59.228 11.927 0.568 1.00 0.00 H new ATOM 0 HD1 PHE B 88 60.207 11.042 2.769 1.00 0.00 H new ATOM 0 HD2 PHE B 88 56.025 10.781 1.816 1.00 0.00 H new ATOM 0 HE1 PHE B 88 59.919 9.287 4.499 1.00 0.00 H new ATOM 0 HE2 PHE B 88 55.738 9.034 3.551 1.00 0.00 H new ATOM 0 HZ PHE B 88 57.684 8.287 4.894 1.00 0.00 H new ATOM 2849 N GLU B 89 56.495 14.824 2.602 1.00 0.00 N ATOM 2850 CA GLU B 89 55.289 15.093 3.447 1.00 0.00 C ATOM 2851 C GLU B 89 54.052 15.088 2.550 1.00 0.00 C ATOM 2852 O GLU B 89 53.981 15.808 1.572 1.00 0.00 O ATOM 2853 CB GLU B 89 55.432 16.455 4.123 1.00 0.00 C ATOM 2854 CG GLU B 89 54.226 16.703 5.028 1.00 0.00 C ATOM 2855 CD GLU B 89 54.426 18.010 5.793 1.00 0.00 C ATOM 2856 OE1 GLU B 89 55.468 18.618 5.618 1.00 0.00 O ATOM 2857 OE2 GLU B 89 53.535 18.381 6.539 1.00 0.00 O ATOM 0 H GLU B 89 56.760 15.586 1.977 1.00 0.00 H new ATOM 0 HA GLU B 89 55.192 14.325 4.215 1.00 0.00 H new ATOM 0 HB2 GLU B 89 56.352 16.488 4.707 1.00 0.00 H new ATOM 0 HB3 GLU B 89 55.504 17.241 3.371 1.00 0.00 H new ATOM 0 HG2 GLU B 89 53.315 16.753 4.432 1.00 0.00 H new ATOM 0 HG3 GLU B 89 54.105 15.875 5.726 1.00 0.00 H new ATOM 2864 N HIS B 90 53.086 14.274 2.861 1.00 0.00 N ATOM 2865 CA HIS B 90 51.865 14.216 2.015 1.00 0.00 C ATOM 2866 C HIS B 90 52.284 13.974 0.565 1.00 0.00 C ATOM 2867 O HIS B 90 53.153 13.169 0.292 1.00 0.00 O ATOM 2868 CB HIS B 90 51.111 15.542 2.115 1.00 0.00 C ATOM 2869 CG HIS B 90 49.750 15.395 1.494 1.00 0.00 C ATOM 2870 ND1 HIS B 90 48.803 14.513 1.991 1.00 0.00 N ATOM 2871 CD2 HIS B 90 49.163 16.006 0.412 1.00 0.00 C ATOM 2872 CE1 HIS B 90 47.706 14.617 1.217 1.00 0.00 C ATOM 2873 NE2 HIS B 90 47.876 15.512 0.244 1.00 0.00 N ATOM 0 H HIS B 90 53.089 13.646 3.665 1.00 0.00 H new ATOM 0 HA HIS B 90 51.215 13.409 2.354 1.00 0.00 H new ATOM 0 HB2 HIS B 90 51.015 15.840 3.159 1.00 0.00 H new ATOM 0 HB3 HIS B 90 51.670 16.329 1.609 1.00 0.00 H new ATOM 0 HD2 HIS B 90 49.630 16.754 -0.211 1.00 0.00 H new ATOM 0 HE1 HIS B 90 46.801 14.046 1.366 1.00 0.00 H new ATOM 0 HE2 HIS B 90 47.202 15.778 -0.474 1.00 0.00 H new ATOM 2882 N GLU B 91 51.687 14.675 -0.365 1.00 0.00 N ATOM 2883 CA GLU B 91 52.053 14.507 -1.799 1.00 0.00 C ATOM 2884 C GLU B 91 52.249 13.021 -2.126 1.00 0.00 C ATOM 2885 O GLU B 91 51.255 12.323 -2.233 1.00 0.00 O ATOM 2886 CB GLU B 91 53.350 15.272 -2.053 1.00 0.00 C ATOM 2887 CG GLU B 91 53.061 16.771 -2.188 1.00 0.00 C ATOM 2888 CD GLU B 91 52.288 17.031 -3.482 1.00 0.00 C ATOM 2889 OE1 GLU B 91 52.797 16.677 -4.532 1.00 0.00 O ATOM 2890 OE2 GLU B 91 51.202 17.579 -3.400 1.00 0.00 O ATOM 2891 OXT GLU B 91 53.389 12.612 -2.266 1.00 0.00 O ATOM 0 H GLU B 91 50.955 15.363 -0.188 1.00 0.00 H new ATOM 0 HA GLU B 91 51.256 14.894 -2.434 1.00 0.00 H new ATOM 0 HB2 GLU B 91 54.048 15.101 -1.234 1.00 0.00 H new ATOM 0 HB3 GLU B 91 53.827 14.903 -2.961 1.00 0.00 H new ATOM 0 HG2 GLU B 91 52.483 17.119 -1.332 1.00 0.00 H new ATOM 0 HG3 GLU B 91 53.995 17.333 -2.192 1.00 0.00 H new TER 2898 GLU B 91 HETATM 2899 CA CA A 101 59.141 -1.447 13.141 1.00 0.00 CA HETATM 2900 CA CA B 102 86.969 2.617 -10.665 1.00 0.00 CA HETATM 2901 CA CA A 103 71.388 -4.571 15.824 1.00 0.00 CA HETATM 2902 CA CA B 104 88.431 1.175 2.345 1.00 0.00 CA