USER MOD reduce.3.24.130724 H: found=0, std=0, add=1072, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1072 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 LYS NZ :NH3+ 145:sc= 1.26 (180deg=1.05) USER MOD Set 1.2: A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 SER N :NH3+ -145:sc= 0.0374 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0379 USER MOD Single : A 5 MET CE :methyl 161:sc= -0.1 (180deg=-0.592) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 146:sc= 1.25 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 11 ASN : amide:sc= -0.788 K(o=-0.79,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl -125:sc= -0.282 (180deg=-1.81!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 147:sc= -0.22 (180deg=-0.899) USER MOD Single : A 24 SER OG : rot 2:sc= 0.177 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0428 USER MOD Single : A 34 TYR OH : rot 180:sc= -0.286 USER MOD Single : A 35 ASN : amide:sc= -1.66! C(o=-1.7!,f=-4.5!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot -148:sc= 1.23 USER MOD Single : A 43 MET CE :methyl -173:sc= -2.3 (180deg=-2.32!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.00866 USER MOD Single : A 53 ASN : amide:sc= -0.0958 X(o=-0.096,f=-0.027) USER MOD Single : A 57 THR OG1 : rot 127:sc= 0.0664 USER MOD Single : A 58 LYS NZ :NH3+ -140:sc= 1.26 (180deg=0.462) USER MOD Single : A 67 ASN : amide:sc= -0.956 X(o=-0.96,f=-0.66) USER MOD Single : A 69 HIS : no HE2:sc= -0.878 K(o=-0.88,f=-1.4) USER MOD Single : A 70 HIS : no HD1:sc= -2.33 K(o=-2.3,f=-0.082) USER MOD Single : A 72 ASN : amide:sc= -0.724 K(o=-0.72,f=-2!) USER MOD Single : A 74 LYS NZ :NH3+ -122:sc= -0.308 (180deg=-1.48) USER MOD Single : A 78 MET CE :methyl -174:sc= -0.664 (180deg=-0.726) USER MOD Single : A 79 LYS NZ :NH3+ -144:sc= 1.31 (180deg=0.43) USER MOD Single : A 80 HIS : no HD1:sc= -0.319 X(o=-0.32,f=-0.26) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl 163:sc= -0.239 (180deg=-0.991) USER MOD Single : A 88 GLN : amide:sc= 0.575 K(o=0.57,f=-1.1) USER MOD Single : A 89 GLN : amide:sc= -0.724 K(o=-0.72,f=-5.4!) USER MOD Single : A 95 HIS : no HD1:sc= -0.0233 X(o=-0.023,f=-0.017) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 80:sc= 1.29 USER MOD Single : A 104 ASN : amide:sc=-0.00382 K(o=-0.0038,f=-0.78) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl -140:sc= -0.082 (180deg=-0.42) USER MOD Single : A 116 MET CE :methyl -123:sc= -0.598 (180deg=-3.51!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -142:sc= 0.608 (180deg=0.0911) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ -119:sc= -0.0604 (180deg=-0.0883) USER MOD Single : A 126 ASN : amide:sc= 0.0891 K(o=0.089,f=-0.79) USER MOD Single : A 130 ASN : amide:sc= 0.0698 K(o=0.07,f=-3.6!) USER MOD Single : A 131 MET CE :methyl -157:sc= -0.149 (180deg=-0.746) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -3.393 -15.223 -3.074 1.00 0.00 N ATOM 2 CA SER A 1 -4.743 -15.544 -2.556 1.00 0.00 C ATOM 3 C SER A 1 -5.558 -14.272 -2.330 1.00 0.00 C ATOM 4 O SER A 1 -4.999 -13.224 -1.999 1.00 0.00 O ATOM 5 CB SER A 1 -4.613 -16.329 -1.251 1.00 0.00 C ATOM 6 OG SER A 1 -3.779 -15.654 -0.324 1.00 0.00 O ATOM 0 H1 SER A 1 -3.093 -15.962 -3.742 1.00 0.00 H new ATOM 0 H2 SER A 1 -3.418 -14.305 -3.561 1.00 0.00 H new ATOM 0 H3 SER A 1 -2.719 -15.177 -2.283 1.00 0.00 H new ATOM 0 HA SER A 1 -5.267 -16.151 -3.294 1.00 0.00 H new ATOM 0 HB2 SER A 1 -5.600 -16.478 -0.814 1.00 0.00 H new ATOM 0 HB3 SER A 1 -4.204 -17.318 -1.458 1.00 0.00 H new ATOM 0 HG SER A 1 -3.716 -16.178 0.501 1.00 0.00 H new ATOM 14 N PRO A 2 -6.892 -14.345 -2.505 1.00 0.00 N ATOM 15 CA PRO A 2 -7.778 -13.182 -2.365 1.00 0.00 C ATOM 16 C PRO A 2 -7.827 -12.642 -0.937 1.00 0.00 C ATOM 17 O PRO A 2 -8.195 -11.486 -0.720 1.00 0.00 O ATOM 18 CB PRO A 2 -9.152 -13.714 -2.785 1.00 0.00 C ATOM 19 CG PRO A 2 -9.070 -15.191 -2.606 1.00 0.00 C ATOM 20 CD PRO A 2 -7.639 -15.565 -2.867 1.00 0.00 C ATOM 0 HA PRO A 2 -7.430 -12.344 -2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -9.944 -13.286 -2.171 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.375 -13.454 -3.820 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -9.370 -15.478 -1.598 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -9.739 -15.705 -3.296 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -7.331 -16.418 -2.263 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.480 -15.839 -3.910 1.00 0.00 H new ATOM 28 N GLU A 3 -7.464 -13.490 0.028 1.00 0.00 N ATOM 29 CA GLU A 3 -7.374 -13.091 1.433 1.00 0.00 C ATOM 30 C GLU A 3 -6.641 -11.761 1.593 1.00 0.00 C ATOM 31 O GLU A 3 -7.247 -10.748 1.940 1.00 0.00 O ATOM 32 CB GLU A 3 -6.656 -14.161 2.274 1.00 0.00 C ATOM 33 CG GLU A 3 -7.442 -15.448 2.469 1.00 0.00 C ATOM 34 CD GLU A 3 -7.469 -16.320 1.234 1.00 0.00 C ATOM 35 OE1 GLU A 3 -8.379 -16.150 0.403 1.00 0.00 O ATOM 36 OE2 GLU A 3 -6.578 -17.182 1.092 1.00 0.00 O ATOM 0 H GLU A 3 -7.226 -14.467 -0.142 1.00 0.00 H new ATOM 0 HA GLU A 3 -8.398 -12.979 1.790 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -5.705 -14.400 1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -6.425 -13.740 3.253 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -7.006 -16.011 3.294 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -8.465 -15.202 2.755 1.00 0.00 H new ATOM 43 N ILE A 4 -5.339 -11.763 1.327 1.00 0.00 N ATOM 44 CA ILE A 4 -4.535 -10.570 1.511 1.00 0.00 C ATOM 45 C ILE A 4 -4.680 -9.602 0.329 1.00 0.00 C ATOM 46 O ILE A 4 -4.216 -8.461 0.379 1.00 0.00 O ATOM 47 CB ILE A 4 -3.048 -10.930 1.754 1.00 0.00 C ATOM 48 CG1 ILE A 4 -2.311 -9.765 2.421 1.00 0.00 C ATOM 49 CG2 ILE A 4 -2.360 -11.320 0.450 1.00 0.00 C ATOM 50 CD1 ILE A 4 -2.970 -9.276 3.692 1.00 0.00 C ATOM 0 H ILE A 4 -4.824 -12.575 0.985 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.908 -10.061 2.400 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.016 -11.788 2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.291 -10.074 2.647 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.244 -8.937 1.715 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -1.317 -11.568 0.649 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -2.863 -12.185 0.018 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -2.407 -10.486 -0.250 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -2.392 -8.451 4.107 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -3.981 -8.935 3.470 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.013 -10.090 4.416 1.00 0.00 H new ATOM 62 N MET A 5 -5.326 -10.064 -0.738 1.00 0.00 N ATOM 63 CA MET A 5 -5.600 -9.221 -1.892 1.00 0.00 C ATOM 64 C MET A 5 -6.715 -8.233 -1.577 1.00 0.00 C ATOM 65 O MET A 5 -6.862 -7.208 -2.250 1.00 0.00 O ATOM 66 CB MET A 5 -5.971 -10.079 -3.099 1.00 0.00 C ATOM 67 CG MET A 5 -4.769 -10.685 -3.806 1.00 0.00 C ATOM 68 SD MET A 5 -5.233 -11.733 -5.199 1.00 0.00 S ATOM 69 CE MET A 5 -6.051 -10.546 -6.263 1.00 0.00 C ATOM 0 H MET A 5 -5.669 -11.021 -0.825 1.00 0.00 H new ATOM 0 HA MET A 5 -4.699 -8.657 -2.132 1.00 0.00 H new ATOM 0 HB2 MET A 5 -6.634 -10.881 -2.774 1.00 0.00 H new ATOM 0 HB3 MET A 5 -6.531 -9.470 -3.809 1.00 0.00 H new ATOM 0 HG2 MET A 5 -4.120 -9.884 -4.160 1.00 0.00 H new ATOM 0 HG3 MET A 5 -4.191 -11.272 -3.092 1.00 0.00 H new ATOM 0 HE1 MET A 5 -6.093 -10.937 -7.279 1.00 0.00 H new ATOM 0 HE2 MET A 5 -7.063 -10.369 -5.900 1.00 0.00 H new ATOM 0 HE3 MET A 5 -5.495 -9.609 -6.258 1.00 0.00 H new ATOM 79 N LYS A 6 -7.516 -8.556 -0.568 1.00 0.00 N ATOM 80 CA LYS A 6 -8.502 -7.624 -0.050 1.00 0.00 C ATOM 81 C LYS A 6 -7.790 -6.546 0.761 1.00 0.00 C ATOM 82 O LYS A 6 -7.531 -6.709 1.952 1.00 0.00 O ATOM 83 CB LYS A 6 -9.538 -8.358 0.810 1.00 0.00 C ATOM 84 CG LYS A 6 -10.662 -7.466 1.315 1.00 0.00 C ATOM 85 CD LYS A 6 -11.667 -8.249 2.146 1.00 0.00 C ATOM 86 CE LYS A 6 -12.337 -9.345 1.327 1.00 0.00 C ATOM 87 NZ LYS A 6 -13.337 -10.104 2.123 1.00 0.00 N ATOM 0 H LYS A 6 -7.499 -9.459 -0.094 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.032 -7.157 -0.880 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.968 -9.173 0.227 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.033 -8.809 1.664 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.244 -6.657 1.915 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.170 -7.005 0.468 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.163 -8.692 3.005 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -12.425 -7.570 2.536 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.826 -8.902 0.459 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.578 -10.031 0.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.769 -10.839 1.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.867 -10.549 2.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -14.076 -9.455 2.462 1.00 0.00 H new ATOM 101 N ASN A 7 -7.440 -5.459 0.090 1.00 0.00 N ATOM 102 CA ASN A 7 -6.650 -4.402 0.704 1.00 0.00 C ATOM 103 C ASN A 7 -7.473 -3.595 1.696 1.00 0.00 C ATOM 104 O ASN A 7 -8.584 -3.160 1.391 1.00 0.00 O ATOM 105 CB ASN A 7 -6.057 -3.476 -0.360 1.00 0.00 C ATOM 106 CG ASN A 7 -4.900 -4.115 -1.103 1.00 0.00 C ATOM 107 OD1 ASN A 7 -3.751 -4.010 -0.682 1.00 0.00 O ATOM 108 ND2 ASN A 7 -5.188 -4.777 -2.212 1.00 0.00 N ATOM 0 H ASN A 7 -7.692 -5.285 -0.883 1.00 0.00 H new ATOM 0 HA ASN A 7 -5.836 -4.881 1.248 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -6.835 -3.201 -1.072 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -5.717 -2.555 0.113 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -4.443 -5.222 -2.749 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -6.155 -4.843 -2.530 1.00 0.00 H new ATOM 115 N LEU A 8 -6.903 -3.396 2.877 1.00 0.00 N ATOM 116 CA LEU A 8 -7.545 -2.632 3.940 1.00 0.00 C ATOM 117 C LEU A 8 -7.917 -1.232 3.463 1.00 0.00 C ATOM 118 O LEU A 8 -9.042 -0.778 3.662 1.00 0.00 O ATOM 119 CB LEU A 8 -6.609 -2.535 5.147 1.00 0.00 C ATOM 120 CG LEU A 8 -6.172 -3.877 5.732 1.00 0.00 C ATOM 121 CD1 LEU A 8 -5.103 -3.675 6.795 1.00 0.00 C ATOM 122 CD2 LEU A 8 -7.369 -4.618 6.309 1.00 0.00 C ATOM 0 H LEU A 8 -5.983 -3.759 3.126 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.460 -3.150 4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -5.720 -1.976 4.855 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.106 -1.959 5.928 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.746 -4.481 4.931 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.805 -4.642 7.200 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.237 -3.185 6.351 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.500 -3.053 7.597 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.042 -5.572 6.722 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.823 -4.018 7.098 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.101 -4.796 5.521 1.00 0.00 H new ATOM 134 N SER A 9 -6.971 -0.563 2.813 1.00 0.00 N ATOM 135 CA SER A 9 -7.188 0.791 2.320 1.00 0.00 C ATOM 136 C SER A 9 -8.316 0.836 1.287 1.00 0.00 C ATOM 137 O SER A 9 -9.022 1.839 1.176 1.00 0.00 O ATOM 138 CB SER A 9 -5.892 1.340 1.724 1.00 0.00 C ATOM 139 OG SER A 9 -4.860 1.357 2.696 1.00 0.00 O ATOM 0 H SER A 9 -6.044 -0.939 2.615 1.00 0.00 H new ATOM 0 HA SER A 9 -7.488 1.416 3.161 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.588 0.727 0.875 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.059 2.349 1.346 1.00 0.00 H new ATOM 0 HG SER A 9 -4.000 1.176 2.263 1.00 0.00 H new ATOM 145 N ASN A 10 -8.490 -0.260 0.555 1.00 0.00 N ATOM 146 CA ASN A 10 -9.548 -0.355 -0.445 1.00 0.00 C ATOM 147 C ASN A 10 -10.899 -0.555 0.232 1.00 0.00 C ATOM 148 O ASN A 10 -11.917 -0.032 -0.219 1.00 0.00 O ATOM 149 CB ASN A 10 -9.260 -1.509 -1.414 1.00 0.00 C ATOM 150 CG ASN A 10 -10.391 -1.755 -2.396 1.00 0.00 C ATOM 151 OD1 ASN A 10 -11.299 -2.542 -2.130 1.00 0.00 O ATOM 152 ND2 ASN A 10 -10.346 -1.085 -3.537 1.00 0.00 N ATOM 0 H ASN A 10 -7.911 -1.096 0.636 1.00 0.00 H new ATOM 0 HA ASN A 10 -9.578 0.576 -1.011 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -8.346 -1.292 -1.967 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -9.078 -2.419 -0.843 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -11.081 -1.212 -4.233 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -9.576 -0.441 -3.720 1.00 0.00 H new ATOM 159 N ASN A 11 -10.892 -1.307 1.325 1.00 0.00 N ATOM 160 CA ASN A 11 -12.105 -1.552 2.093 1.00 0.00 C ATOM 161 C ASN A 11 -12.558 -0.267 2.775 1.00 0.00 C ATOM 162 O ASN A 11 -13.718 0.130 2.655 1.00 0.00 O ATOM 163 CB ASN A 11 -11.866 -2.649 3.135 1.00 0.00 C ATOM 164 CG ASN A 11 -13.114 -2.995 3.929 1.00 0.00 C ATOM 165 OD1 ASN A 11 -13.037 -3.329 5.110 1.00 0.00 O ATOM 166 ND2 ASN A 11 -14.271 -2.935 3.288 1.00 0.00 N ATOM 0 H ASN A 11 -10.058 -1.759 1.700 1.00 0.00 H new ATOM 0 HA ASN A 11 -12.888 -1.887 1.413 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -11.501 -3.545 2.634 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -11.083 -2.326 3.821 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -15.136 -3.170 3.774 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -14.297 -2.654 2.308 1.00 0.00 H new ATOM 173 N PHE A 12 -11.645 0.359 3.507 1.00 0.00 N ATOM 174 CA PHE A 12 -11.900 1.674 4.106 1.00 0.00 C ATOM 175 C PHE A 12 -12.423 2.704 3.086 1.00 0.00 C ATOM 176 O PHE A 12 -13.626 2.970 3.052 1.00 0.00 O ATOM 177 CB PHE A 12 -10.646 2.211 4.802 1.00 0.00 C ATOM 178 CG PHE A 12 -10.374 1.562 6.131 1.00 0.00 C ATOM 179 CD1 PHE A 12 -11.106 1.920 7.251 1.00 0.00 C ATOM 180 CD2 PHE A 12 -9.389 0.597 6.264 1.00 0.00 C ATOM 181 CE1 PHE A 12 -10.863 1.328 8.476 1.00 0.00 C ATOM 182 CE2 PHE A 12 -9.141 0.001 7.485 1.00 0.00 C ATOM 183 CZ PHE A 12 -9.880 0.366 8.594 1.00 0.00 C ATOM 0 H PHE A 12 -10.718 -0.019 3.704 1.00 0.00 H new ATOM 0 HA PHE A 12 -12.686 1.526 4.847 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -9.786 2.061 4.150 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -10.752 3.286 4.946 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -11.877 2.672 7.166 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.807 0.307 5.402 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.442 1.618 9.340 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -8.370 -0.750 7.573 1.00 0.00 H new ATOM 0 HZ PHE A 12 -9.689 -0.100 9.550 1.00 0.00 H new ATOM 193 N GLY A 13 -11.538 3.276 2.253 1.00 0.00 N ATOM 194 CA GLY A 13 -11.954 4.323 1.326 1.00 0.00 C ATOM 195 C GLY A 13 -12.637 5.508 2.007 1.00 0.00 C ATOM 196 O GLY A 13 -13.555 6.106 1.445 1.00 0.00 O ATOM 0 H GLY A 13 -10.549 3.032 2.207 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.081 4.682 0.781 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.635 3.895 0.590 1.00 0.00 H new ATOM 200 N LYS A 14 -12.186 5.858 3.209 1.00 0.00 N ATOM 201 CA LYS A 14 -12.796 6.938 3.973 1.00 0.00 C ATOM 202 C LYS A 14 -12.400 8.305 3.420 1.00 0.00 C ATOM 203 O LYS A 14 -13.234 9.200 3.307 1.00 0.00 O ATOM 204 CB LYS A 14 -12.394 6.819 5.450 1.00 0.00 C ATOM 205 CG LYS A 14 -12.725 8.039 6.304 1.00 0.00 C ATOM 206 CD LYS A 14 -14.220 8.312 6.373 1.00 0.00 C ATOM 207 CE LYS A 14 -14.511 9.550 7.208 1.00 0.00 C ATOM 208 NZ LYS A 14 -15.953 9.905 7.207 1.00 0.00 N ATOM 0 H LYS A 14 -11.398 5.407 3.674 1.00 0.00 H new ATOM 0 HA LYS A 14 -13.879 6.850 3.886 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -12.890 5.948 5.878 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.321 6.634 5.506 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -12.339 7.888 7.312 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.218 8.913 5.896 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -14.615 8.447 5.366 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -14.731 7.451 6.803 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.182 9.380 8.233 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.932 10.390 6.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -16.102 10.754 7.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -16.263 10.094 6.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -16.505 9.116 7.599 1.00 0.00 H new ATOM 222 N ALA A 15 -11.139 8.455 3.051 1.00 0.00 N ATOM 223 CA ALA A 15 -10.627 9.751 2.636 1.00 0.00 C ATOM 224 C ALA A 15 -9.612 9.608 1.513 1.00 0.00 C ATOM 225 O ALA A 15 -8.443 9.304 1.753 1.00 0.00 O ATOM 226 CB ALA A 15 -10.003 10.462 3.825 1.00 0.00 C ATOM 0 H ALA A 15 -10.454 7.700 3.030 1.00 0.00 H new ATOM 0 HA ALA A 15 -11.460 10.344 2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.621 11.433 3.509 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -10.756 10.603 4.600 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.184 9.861 4.220 1.00 0.00 H new ATOM 232 N MET A 16 -10.060 9.832 0.289 1.00 0.00 N ATOM 233 CA MET A 16 -9.196 9.707 -0.875 1.00 0.00 C ATOM 234 C MET A 16 -8.349 10.960 -1.072 1.00 0.00 C ATOM 235 O MET A 16 -7.137 10.874 -1.267 1.00 0.00 O ATOM 236 CB MET A 16 -10.016 9.419 -2.132 1.00 0.00 C ATOM 237 CG MET A 16 -10.098 7.941 -2.475 1.00 0.00 C ATOM 238 SD MET A 16 -10.819 6.945 -1.155 1.00 0.00 S ATOM 239 CE MET A 16 -10.519 5.296 -1.787 1.00 0.00 C ATOM 0 H MET A 16 -11.020 10.102 0.074 1.00 0.00 H new ATOM 0 HA MET A 16 -8.524 8.867 -0.698 1.00 0.00 H new ATOM 0 HB2 MET A 16 -11.025 9.809 -1.996 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.578 9.956 -2.973 1.00 0.00 H new ATOM 0 HG2 MET A 16 -10.692 7.817 -3.381 1.00 0.00 H new ATOM 0 HG3 MET A 16 -9.097 7.570 -2.696 1.00 0.00 H new ATOM 0 HE1 MET A 16 -11.460 4.747 -1.832 1.00 0.00 H new ATOM 0 HE2 MET A 16 -10.089 5.362 -2.786 1.00 0.00 H new ATOM 0 HE3 MET A 16 -9.826 4.774 -1.127 1.00 0.00 H new ATOM 249 N ASP A 17 -8.986 12.124 -0.986 1.00 0.00 N ATOM 250 CA ASP A 17 -8.303 13.396 -1.228 1.00 0.00 C ATOM 251 C ASP A 17 -7.249 13.682 -0.177 1.00 0.00 C ATOM 252 O ASP A 17 -6.222 14.291 -0.468 1.00 0.00 O ATOM 253 CB ASP A 17 -9.299 14.553 -1.293 1.00 0.00 C ATOM 254 CG ASP A 17 -8.615 15.880 -1.568 1.00 0.00 C ATOM 255 OD1 ASP A 17 -8.129 16.084 -2.704 1.00 0.00 O ATOM 256 OD2 ASP A 17 -8.571 16.729 -0.653 1.00 0.00 O ATOM 0 H ASP A 17 -9.974 12.215 -0.751 1.00 0.00 H new ATOM 0 HA ASP A 17 -7.803 13.305 -2.192 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -10.033 14.355 -2.074 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -9.844 14.615 -0.351 1.00 0.00 H new ATOM 261 N GLN A 18 -7.469 13.209 1.035 1.00 0.00 N ATOM 262 CA GLN A 18 -6.551 13.527 2.111 1.00 0.00 C ATOM 263 C GLN A 18 -5.402 12.530 2.185 1.00 0.00 C ATOM 264 O GLN A 18 -4.338 12.846 2.713 1.00 0.00 O ATOM 265 CB GLN A 18 -7.284 13.652 3.441 1.00 0.00 C ATOM 266 CG GLN A 18 -8.020 14.976 3.568 1.00 0.00 C ATOM 267 CD GLN A 18 -8.194 15.394 5.015 1.00 0.00 C ATOM 268 OE1 GLN A 18 -7.329 16.053 5.590 1.00 0.00 O ATOM 269 NE2 GLN A 18 -9.310 15.013 5.614 1.00 0.00 N ATOM 0 H GLN A 18 -8.257 12.616 1.296 1.00 0.00 H new ATOM 0 HA GLN A 18 -6.109 14.499 1.891 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.995 12.832 3.541 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -6.569 13.555 4.258 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -7.470 15.749 3.031 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.998 14.894 3.095 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -10.003 14.467 5.102 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -9.478 15.265 6.588 1.00 0.00 H new ATOM 278 N CYS A 19 -5.595 11.339 1.639 1.00 0.00 N ATOM 279 CA CYS A 19 -4.471 10.440 1.436 1.00 0.00 C ATOM 280 C CYS A 19 -3.657 10.937 0.245 1.00 0.00 C ATOM 281 O CYS A 19 -2.426 10.876 0.240 1.00 0.00 O ATOM 282 CB CYS A 19 -4.933 8.993 1.225 1.00 0.00 C ATOM 283 SG CYS A 19 -3.607 7.854 0.715 1.00 0.00 S ATOM 0 H CYS A 19 -6.499 10.978 1.334 1.00 0.00 H new ATOM 0 HA CYS A 19 -3.849 10.439 2.331 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -5.376 8.626 2.151 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.718 8.981 0.469 1.00 0.00 H new ATOM 288 N LYS A 20 -4.369 11.491 -0.740 1.00 0.00 N ATOM 289 CA LYS A 20 -3.762 12.042 -1.941 1.00 0.00 C ATOM 290 C LYS A 20 -2.823 13.188 -1.570 1.00 0.00 C ATOM 291 O LYS A 20 -1.692 13.263 -2.053 1.00 0.00 O ATOM 292 CB LYS A 20 -4.874 12.531 -2.882 1.00 0.00 C ATOM 293 CG LYS A 20 -4.525 12.532 -4.367 1.00 0.00 C ATOM 294 CD LYS A 20 -3.443 13.541 -4.706 1.00 0.00 C ATOM 295 CE LYS A 20 -3.739 14.261 -6.009 1.00 0.00 C ATOM 296 NZ LYS A 20 -5.044 14.976 -5.965 1.00 0.00 N ATOM 0 H LYS A 20 -5.386 11.567 -0.721 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.177 11.275 -2.449 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.753 11.904 -2.734 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.152 13.544 -2.591 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.194 11.536 -4.660 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.420 12.754 -4.948 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -3.357 14.269 -3.899 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.481 13.033 -4.781 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -2.942 14.974 -6.219 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.747 13.541 -6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -4.986 15.841 -6.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -5.791 14.359 -6.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -5.268 15.229 -4.981 1.00 0.00 H new ATOM 310 N ASP A 21 -3.291 14.069 -0.695 1.00 0.00 N ATOM 311 CA ASP A 21 -2.485 15.196 -0.240 1.00 0.00 C ATOM 312 C ASP A 21 -1.352 14.748 0.676 1.00 0.00 C ATOM 313 O ASP A 21 -0.231 15.240 0.561 1.00 0.00 O ATOM 314 CB ASP A 21 -3.348 16.228 0.489 1.00 0.00 C ATOM 315 CG ASP A 21 -2.503 17.301 1.152 1.00 0.00 C ATOM 316 OD1 ASP A 21 -2.080 18.250 0.459 1.00 0.00 O ATOM 317 OD2 ASP A 21 -2.244 17.192 2.371 1.00 0.00 O ATOM 0 H ASP A 21 -4.224 14.025 -0.286 1.00 0.00 H new ATOM 0 HA ASP A 21 -2.051 15.652 -1.130 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.035 16.692 -0.218 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.956 15.727 1.242 1.00 0.00 H new ATOM 322 N GLU A 22 -1.633 13.796 1.561 1.00 0.00 N ATOM 323 CA GLU A 22 -0.662 13.389 2.575 1.00 0.00 C ATOM 324 C GLU A 22 0.616 12.860 1.929 1.00 0.00 C ATOM 325 O GLU A 22 1.716 13.214 2.351 1.00 0.00 O ATOM 326 CB GLU A 22 -1.259 12.320 3.488 1.00 0.00 C ATOM 327 CG GLU A 22 -0.505 12.120 4.794 1.00 0.00 C ATOM 328 CD GLU A 22 -0.732 13.230 5.801 1.00 0.00 C ATOM 329 OE1 GLU A 22 -1.740 13.949 5.688 1.00 0.00 O ATOM 330 OE2 GLU A 22 0.093 13.356 6.736 1.00 0.00 O ATOM 0 H GLU A 22 -2.520 13.294 1.598 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.412 14.268 3.169 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -2.291 12.588 3.715 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.287 11.373 2.949 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.808 11.171 5.237 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.561 12.047 4.581 1.00 0.00 H new ATOM 337 N LEU A 23 0.481 12.029 0.898 1.00 0.00 N ATOM 338 CA LEU A 23 1.656 11.509 0.205 1.00 0.00 C ATOM 339 C LEU A 23 2.072 12.446 -0.910 1.00 0.00 C ATOM 340 O LEU A 23 3.133 12.280 -1.513 1.00 0.00 O ATOM 341 CB LEU A 23 1.388 10.116 -0.365 1.00 0.00 C ATOM 342 CG LEU A 23 0.935 9.093 0.664 1.00 0.00 C ATOM 343 CD1 LEU A 23 0.988 7.687 0.094 1.00 0.00 C ATOM 344 CD2 LEU A 23 1.808 9.232 1.884 1.00 0.00 C ATOM 0 H LEU A 23 -0.414 11.706 0.529 1.00 0.00 H new ATOM 0 HA LEU A 23 2.465 11.436 0.932 1.00 0.00 H new ATOM 0 HB2 LEU A 23 0.627 10.195 -1.141 1.00 0.00 H new ATOM 0 HB3 LEU A 23 2.296 9.752 -0.845 1.00 0.00 H new ATOM 0 HG LEU A 23 -0.103 9.276 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.659 6.975 0.851 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.333 7.622 -0.775 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.010 7.453 -0.204 1.00 0.00 H new ATOM 0 HD21 LEU A 23 1.500 8.506 2.637 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.847 9.052 1.610 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.709 10.239 2.289 1.00 0.00 H new ATOM 356 N SER A 24 1.221 13.430 -1.161 1.00 0.00 N ATOM 357 CA SER A 24 1.410 14.374 -2.253 1.00 0.00 C ATOM 358 C SER A 24 1.502 13.628 -3.583 1.00 0.00 C ATOM 359 O SER A 24 2.267 14.005 -4.475 1.00 0.00 O ATOM 360 CB SER A 24 2.655 15.226 -2.000 1.00 0.00 C ATOM 361 OG SER A 24 2.523 15.960 -0.790 1.00 0.00 O ATOM 0 H SER A 24 0.378 13.597 -0.612 1.00 0.00 H new ATOM 0 HA SER A 24 0.551 15.043 -2.305 1.00 0.00 H new ATOM 0 HB2 SER A 24 3.536 14.586 -1.949 1.00 0.00 H new ATOM 0 HB3 SER A 24 2.808 15.912 -2.833 1.00 0.00 H new ATOM 0 HG SER A 24 1.667 15.741 -0.366 1.00 0.00 H new ATOM 367 N LEU A 25 0.695 12.573 -3.696 1.00 0.00 N ATOM 368 CA LEU A 25 0.673 11.724 -4.892 1.00 0.00 C ATOM 369 C LEU A 25 0.442 12.549 -6.152 1.00 0.00 C ATOM 370 O LEU A 25 -0.558 13.260 -6.262 1.00 0.00 O ATOM 371 CB LEU A 25 -0.425 10.649 -4.797 1.00 0.00 C ATOM 372 CG LEU A 25 -0.287 9.661 -3.640 1.00 0.00 C ATOM 373 CD1 LEU A 25 -1.073 10.141 -2.441 1.00 0.00 C ATOM 374 CD2 LEU A 25 -0.747 8.278 -4.040 1.00 0.00 C ATOM 0 H LEU A 25 0.042 12.283 -2.968 1.00 0.00 H new ATOM 0 HA LEU A 25 1.648 11.240 -4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.390 11.148 -4.711 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.439 10.087 -5.731 1.00 0.00 H new ATOM 0 HG LEU A 25 0.769 9.604 -3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -0.965 9.426 -1.625 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.696 11.113 -2.124 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -2.126 10.230 -2.708 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.636 7.599 -3.195 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -1.794 8.315 -4.340 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -0.143 7.921 -4.874 1.00 0.00 H new ATOM 386 N PRO A 26 1.377 12.488 -7.114 1.00 0.00 N ATOM 387 CA PRO A 26 1.188 13.109 -8.425 1.00 0.00 C ATOM 388 C PRO A 26 0.046 12.440 -9.184 1.00 0.00 C ATOM 389 O PRO A 26 -0.278 11.274 -8.928 1.00 0.00 O ATOM 390 CB PRO A 26 2.533 12.883 -9.131 1.00 0.00 C ATOM 391 CG PRO A 26 3.496 12.611 -8.026 1.00 0.00 C ATOM 392 CD PRO A 26 2.704 11.857 -7.002 1.00 0.00 C ATOM 0 HA PRO A 26 0.920 14.164 -8.361 1.00 0.00 H new ATOM 0 HB2 PRO A 26 2.480 12.045 -9.826 1.00 0.00 H new ATOM 0 HB3 PRO A 26 2.830 13.758 -9.709 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.346 12.026 -8.378 1.00 0.00 H new ATOM 0 HG3 PRO A 26 3.896 13.537 -7.613 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.668 10.790 -7.219 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.124 11.964 -6.002 1.00 0.00 H new ATOM 400 N ASP A 27 -0.561 13.170 -10.113 1.00 0.00 N ATOM 401 CA ASP A 27 -1.734 12.672 -10.828 1.00 0.00 C ATOM 402 C ASP A 27 -1.426 11.400 -11.608 1.00 0.00 C ATOM 403 O ASP A 27 -2.278 10.526 -11.732 1.00 0.00 O ATOM 404 CB ASP A 27 -2.327 13.741 -11.756 1.00 0.00 C ATOM 405 CG ASP A 27 -1.302 14.394 -12.660 1.00 0.00 C ATOM 406 OD1 ASP A 27 -0.897 13.780 -13.666 1.00 0.00 O ATOM 407 OD2 ASP A 27 -0.893 15.538 -12.368 1.00 0.00 O ATOM 0 H ASP A 27 -0.263 14.106 -10.389 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.480 12.428 -10.072 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.104 13.286 -12.370 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -2.808 14.510 -11.151 1.00 0.00 H new ATOM 412 N SER A 28 -0.200 11.280 -12.088 1.00 0.00 N ATOM 413 CA SER A 28 0.216 10.102 -12.831 1.00 0.00 C ATOM 414 C SER A 28 0.174 8.845 -11.957 1.00 0.00 C ATOM 415 O SER A 28 -0.263 7.779 -12.405 1.00 0.00 O ATOM 416 CB SER A 28 1.618 10.321 -13.401 1.00 0.00 C ATOM 417 OG SER A 28 2.436 11.028 -12.481 1.00 0.00 O ATOM 0 H SER A 28 0.527 11.986 -11.976 1.00 0.00 H new ATOM 0 HA SER A 28 -0.483 9.948 -13.653 1.00 0.00 H new ATOM 0 HB2 SER A 28 2.074 9.359 -13.634 1.00 0.00 H new ATOM 0 HB3 SER A 28 1.552 10.877 -14.336 1.00 0.00 H new ATOM 0 HG SER A 28 3.328 11.155 -12.867 1.00 0.00 H new ATOM 423 N VAL A 29 0.598 8.971 -10.705 1.00 0.00 N ATOM 424 CA VAL A 29 0.660 7.823 -9.823 1.00 0.00 C ATOM 425 C VAL A 29 -0.717 7.429 -9.319 1.00 0.00 C ATOM 426 O VAL A 29 -1.129 6.289 -9.498 1.00 0.00 O ATOM 427 CB VAL A 29 1.571 8.054 -8.615 1.00 0.00 C ATOM 428 CG1 VAL A 29 1.698 6.757 -7.830 1.00 0.00 C ATOM 429 CG2 VAL A 29 2.935 8.567 -9.051 1.00 0.00 C ATOM 0 H VAL A 29 0.900 9.850 -10.285 1.00 0.00 H new ATOM 0 HA VAL A 29 1.078 7.017 -10.427 1.00 0.00 H new ATOM 0 HB VAL A 29 1.130 8.817 -7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.346 6.915 -6.968 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.712 6.440 -7.490 1.00 0.00 H new ATOM 0 HG13 VAL A 29 2.127 5.985 -8.469 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.563 8.723 -8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.406 7.836 -9.709 1.00 0.00 H new ATOM 0 HG23 VAL A 29 2.816 9.510 -9.584 1.00 0.00 H new ATOM 439 N VAL A 30 -1.434 8.365 -8.696 1.00 0.00 N ATOM 440 CA VAL A 30 -2.727 8.044 -8.110 1.00 0.00 C ATOM 441 C VAL A 30 -3.700 7.520 -9.182 1.00 0.00 C ATOM 442 O VAL A 30 -4.569 6.698 -8.899 1.00 0.00 O ATOM 443 CB VAL A 30 -3.323 9.227 -7.336 1.00 0.00 C ATOM 444 CG1 VAL A 30 -3.834 10.302 -8.246 1.00 0.00 C ATOM 445 CG2 VAL A 30 -4.419 8.762 -6.392 1.00 0.00 C ATOM 0 H VAL A 30 -1.143 9.337 -8.587 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.566 7.248 -7.383 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.514 9.659 -6.747 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.246 11.117 -7.651 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.016 10.678 -8.860 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.613 9.894 -8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.825 9.619 -5.855 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.213 8.283 -6.965 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.006 8.049 -5.678 1.00 0.00 H new ATOM 455 N ALA A 31 -3.511 7.967 -10.426 1.00 0.00 N ATOM 456 CA ALA A 31 -4.317 7.489 -11.551 1.00 0.00 C ATOM 457 C ALA A 31 -3.998 6.037 -11.890 1.00 0.00 C ATOM 458 O ALA A 31 -4.898 5.204 -12.005 1.00 0.00 O ATOM 459 CB ALA A 31 -4.070 8.348 -12.770 1.00 0.00 C ATOM 0 H ALA A 31 -2.806 8.660 -10.679 1.00 0.00 H new ATOM 0 HA ALA A 31 -5.364 7.554 -11.256 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.674 7.983 -13.601 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.342 9.380 -12.549 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.015 8.301 -13.041 1.00 0.00 H new ATOM 465 N ASP A 32 -2.713 5.741 -12.066 1.00 0.00 N ATOM 466 CA ASP A 32 -2.280 4.378 -12.365 1.00 0.00 C ATOM 467 C ASP A 32 -2.597 3.463 -11.195 1.00 0.00 C ATOM 468 O ASP A 32 -2.959 2.301 -11.372 1.00 0.00 O ATOM 469 CB ASP A 32 -0.784 4.345 -12.672 1.00 0.00 C ATOM 470 CG ASP A 32 -0.289 2.945 -12.977 1.00 0.00 C ATOM 471 OD1 ASP A 32 -0.552 2.447 -14.093 1.00 0.00 O ATOM 472 OD2 ASP A 32 0.374 2.346 -12.111 1.00 0.00 O ATOM 0 H ASP A 32 -1.956 6.422 -12.007 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.819 4.027 -13.245 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -0.576 4.995 -13.522 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -0.232 4.746 -11.822 1.00 0.00 H new ATOM 477 N LEU A 33 -2.464 4.010 -9.999 1.00 0.00 N ATOM 478 CA LEU A 33 -2.848 3.324 -8.776 1.00 0.00 C ATOM 479 C LEU A 33 -4.312 2.873 -8.824 1.00 0.00 C ATOM 480 O LEU A 33 -4.649 1.790 -8.344 1.00 0.00 O ATOM 481 CB LEU A 33 -2.584 4.261 -7.597 1.00 0.00 C ATOM 482 CG LEU A 33 -3.368 4.007 -6.316 1.00 0.00 C ATOM 483 CD1 LEU A 33 -2.428 4.022 -5.130 1.00 0.00 C ATOM 484 CD2 LEU A 33 -4.431 5.073 -6.155 1.00 0.00 C ATOM 0 H LEU A 33 -2.086 4.945 -9.848 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.254 2.418 -8.660 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.522 4.212 -7.358 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.791 5.280 -7.923 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.849 3.030 -6.370 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.993 3.840 -4.216 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.675 3.243 -5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -1.938 4.994 -5.066 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.992 4.892 -5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.958 6.054 -6.103 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.109 5.042 -7.008 1.00 0.00 H new ATOM 496 N TYR A 34 -5.180 3.702 -9.394 1.00 0.00 N ATOM 497 CA TYR A 34 -6.587 3.333 -9.565 1.00 0.00 C ATOM 498 C TYR A 34 -6.844 2.387 -10.750 1.00 0.00 C ATOM 499 O TYR A 34 -8.002 2.144 -11.092 1.00 0.00 O ATOM 500 CB TYR A 34 -7.470 4.579 -9.688 1.00 0.00 C ATOM 501 CG TYR A 34 -7.617 5.318 -8.383 1.00 0.00 C ATOM 502 CD1 TYR A 34 -7.850 4.624 -7.203 1.00 0.00 C ATOM 503 CD2 TYR A 34 -7.494 6.699 -8.322 1.00 0.00 C ATOM 504 CE1 TYR A 34 -7.962 5.284 -5.999 1.00 0.00 C ATOM 505 CE2 TYR A 34 -7.598 7.367 -7.118 1.00 0.00 C ATOM 506 CZ TYR A 34 -7.831 6.654 -5.962 1.00 0.00 C ATOM 507 OH TYR A 34 -7.912 7.307 -4.757 1.00 0.00 O ATOM 0 H TYR A 34 -4.939 4.629 -9.745 1.00 0.00 H new ATOM 0 HA TYR A 34 -6.854 2.781 -8.664 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -7.044 5.249 -10.434 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -8.456 4.286 -10.048 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.945 3.549 -7.230 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -7.315 7.259 -9.228 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.151 4.731 -5.091 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -7.497 8.442 -7.082 1.00 0.00 H new ATOM 0 HH TYR A 34 -7.798 8.270 -4.899 1.00 0.00 H new ATOM 517 N ASN A 35 -5.797 1.853 -11.383 1.00 0.00 N ATOM 518 CA ASN A 35 -5.987 0.926 -12.494 1.00 0.00 C ATOM 519 C ASN A 35 -6.645 -0.352 -11.991 1.00 0.00 C ATOM 520 O ASN A 35 -6.023 -1.149 -11.289 1.00 0.00 O ATOM 521 CB ASN A 35 -4.651 0.613 -13.176 1.00 0.00 C ATOM 522 CG ASN A 35 -4.801 -0.326 -14.356 1.00 0.00 C ATOM 523 OD1 ASN A 35 -5.872 -0.428 -14.951 1.00 0.00 O ATOM 524 ND2 ASN A 35 -3.718 -0.985 -14.731 1.00 0.00 N ATOM 0 H ASN A 35 -4.823 2.045 -11.148 1.00 0.00 H new ATOM 0 HA ASN A 35 -6.638 1.393 -13.233 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -4.194 1.543 -13.513 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -3.972 0.169 -12.448 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -3.753 -1.605 -15.540 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -2.848 -0.874 -14.211 1.00 0.00 H new ATOM 531 N PHE A 36 -7.914 -0.527 -12.335 1.00 0.00 N ATOM 532 CA PHE A 36 -8.703 -1.632 -11.811 1.00 0.00 C ATOM 533 C PHE A 36 -8.426 -2.922 -12.579 1.00 0.00 C ATOM 534 O PHE A 36 -8.724 -4.016 -12.100 1.00 0.00 O ATOM 535 CB PHE A 36 -10.193 -1.288 -11.866 1.00 0.00 C ATOM 536 CG PHE A 36 -11.052 -2.182 -11.019 1.00 0.00 C ATOM 537 CD1 PHE A 36 -11.083 -2.027 -9.644 1.00 0.00 C ATOM 538 CD2 PHE A 36 -11.824 -3.179 -11.594 1.00 0.00 C ATOM 539 CE1 PHE A 36 -11.868 -2.847 -8.856 1.00 0.00 C ATOM 540 CE2 PHE A 36 -12.609 -4.002 -10.811 1.00 0.00 C ATOM 541 CZ PHE A 36 -12.630 -3.836 -9.441 1.00 0.00 C ATOM 0 H PHE A 36 -8.419 0.084 -12.976 1.00 0.00 H new ATOM 0 HA PHE A 36 -8.414 -1.793 -10.772 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -10.330 -0.256 -11.544 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -10.532 -1.347 -12.900 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -10.486 -1.255 -9.181 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -11.812 -3.314 -12.666 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -11.885 -2.713 -7.784 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -13.206 -4.775 -11.271 1.00 0.00 H new ATOM 0 HZ PHE A 36 -13.243 -4.480 -8.828 1.00 0.00 H new ATOM 551 N TRP A 37 -7.861 -2.795 -13.769 1.00 0.00 N ATOM 552 CA TRP A 37 -7.511 -3.963 -14.561 1.00 0.00 C ATOM 553 C TRP A 37 -6.288 -4.649 -13.962 1.00 0.00 C ATOM 554 O TRP A 37 -5.291 -3.996 -13.649 1.00 0.00 O ATOM 555 CB TRP A 37 -7.262 -3.567 -16.017 1.00 0.00 C ATOM 556 CG TRP A 37 -8.502 -3.102 -16.722 1.00 0.00 C ATOM 557 CD1 TRP A 37 -9.419 -3.887 -17.357 1.00 0.00 C ATOM 558 CD2 TRP A 37 -8.960 -1.752 -16.866 1.00 0.00 C ATOM 559 NE1 TRP A 37 -10.421 -3.108 -17.884 1.00 0.00 N ATOM 560 CE2 TRP A 37 -10.163 -1.796 -17.597 1.00 0.00 C ATOM 561 CE3 TRP A 37 -8.476 -0.510 -16.446 1.00 0.00 C ATOM 562 CZ2 TRP A 37 -10.882 -0.648 -17.918 1.00 0.00 C ATOM 563 CZ3 TRP A 37 -9.192 0.629 -16.765 1.00 0.00 C ATOM 564 CH2 TRP A 37 -10.384 0.553 -17.494 1.00 0.00 C ATOM 0 H TRP A 37 -7.636 -1.901 -14.206 1.00 0.00 H new ATOM 0 HA TRP A 37 -8.343 -4.667 -14.544 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -6.515 -2.774 -16.049 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -6.845 -4.420 -16.553 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -9.365 -4.963 -17.434 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -11.227 -3.453 -18.405 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -7.558 -0.441 -15.882 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -11.801 -0.704 -18.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -8.825 1.593 -16.446 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -10.921 1.461 -17.726 1.00 0.00 H new ATOM 575 N LYS A 38 -6.374 -5.964 -13.796 1.00 0.00 N ATOM 576 CA LYS A 38 -5.338 -6.722 -13.100 1.00 0.00 C ATOM 577 C LYS A 38 -4.141 -7.025 -14.003 1.00 0.00 C ATOM 578 O LYS A 38 -3.734 -8.180 -14.151 1.00 0.00 O ATOM 579 CB LYS A 38 -5.924 -8.024 -12.541 1.00 0.00 C ATOM 580 CG LYS A 38 -6.605 -8.891 -13.593 1.00 0.00 C ATOM 581 CD LYS A 38 -7.139 -10.190 -13.003 1.00 0.00 C ATOM 582 CE LYS A 38 -8.303 -9.952 -12.053 1.00 0.00 C ATOM 583 NZ LYS A 38 -8.929 -11.229 -11.615 1.00 0.00 N ATOM 0 H LYS A 38 -7.152 -6.530 -14.135 1.00 0.00 H new ATOM 0 HA LYS A 38 -4.976 -6.104 -12.278 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.126 -8.599 -12.071 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.645 -7.782 -11.760 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.425 -8.334 -14.046 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -5.896 -9.119 -14.389 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -7.459 -10.849 -13.810 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.337 -10.703 -12.472 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.953 -9.401 -11.180 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -9.051 -9.330 -12.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.718 -11.025 -10.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.286 -11.744 -12.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.221 -11.812 -11.124 1.00 0.00 H new ATOM 597 N ASP A 39 -3.592 -5.978 -14.610 1.00 0.00 N ATOM 598 CA ASP A 39 -2.340 -6.078 -15.376 1.00 0.00 C ATOM 599 C ASP A 39 -1.248 -6.918 -14.674 1.00 0.00 C ATOM 600 O ASP A 39 -0.579 -7.713 -15.338 1.00 0.00 O ATOM 601 CB ASP A 39 -1.794 -4.679 -15.675 1.00 0.00 C ATOM 602 CG ASP A 39 -0.533 -4.718 -16.519 1.00 0.00 C ATOM 603 OD1 ASP A 39 -0.615 -5.108 -17.703 1.00 0.00 O ATOM 604 OD2 ASP A 39 0.545 -4.357 -16.008 1.00 0.00 O ATOM 0 H ASP A 39 -3.993 -5.040 -14.590 1.00 0.00 H new ATOM 0 HA ASP A 39 -2.591 -6.598 -16.300 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -2.557 -4.097 -16.193 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -1.584 -4.166 -14.737 1.00 0.00 H new ATOM 609 N ASP A 40 -1.062 -6.746 -13.351 1.00 0.00 N ATOM 610 CA ASP A 40 -0.036 -7.467 -12.595 1.00 0.00 C ATOM 611 C ASP A 40 1.348 -7.030 -13.052 1.00 0.00 C ATOM 612 O ASP A 40 2.133 -7.817 -13.585 1.00 0.00 O ATOM 613 CB ASP A 40 -0.202 -8.990 -12.710 1.00 0.00 C ATOM 614 CG ASP A 40 0.740 -9.750 -11.793 1.00 0.00 C ATOM 615 OD1 ASP A 40 0.809 -9.417 -10.591 1.00 0.00 O ATOM 616 OD2 ASP A 40 1.421 -10.687 -12.270 1.00 0.00 O ATOM 0 H ASP A 40 -1.619 -6.106 -12.785 1.00 0.00 H new ATOM 0 HA ASP A 40 -0.155 -7.217 -11.541 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -1.231 -9.259 -12.472 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -0.024 -9.295 -13.741 1.00 0.00 H new ATOM 621 N TYR A 41 1.620 -5.748 -12.874 1.00 0.00 N ATOM 622 CA TYR A 41 2.897 -5.180 -13.256 1.00 0.00 C ATOM 623 C TYR A 41 3.835 -5.090 -12.063 1.00 0.00 C ATOM 624 O TYR A 41 3.465 -5.432 -10.934 1.00 0.00 O ATOM 625 CB TYR A 41 2.717 -3.798 -13.914 1.00 0.00 C ATOM 626 CG TYR A 41 2.390 -2.635 -12.985 1.00 0.00 C ATOM 627 CD1 TYR A 41 1.891 -2.832 -11.704 1.00 0.00 C ATOM 628 CD2 TYR A 41 2.586 -1.327 -13.412 1.00 0.00 C ATOM 629 CE1 TYR A 41 1.599 -1.765 -10.877 1.00 0.00 C ATOM 630 CE2 TYR A 41 2.297 -0.255 -12.592 1.00 0.00 C ATOM 631 CZ TYR A 41 1.801 -0.477 -11.327 1.00 0.00 C ATOM 632 OH TYR A 41 1.513 0.590 -10.512 1.00 0.00 O ATOM 0 H TYR A 41 0.967 -5.079 -12.465 1.00 0.00 H new ATOM 0 HA TYR A 41 3.348 -5.847 -13.991 1.00 0.00 H new ATOM 0 HB2 TYR A 41 3.633 -3.556 -14.453 1.00 0.00 H new ATOM 0 HB3 TYR A 41 1.922 -3.875 -14.656 1.00 0.00 H new ATOM 0 HD1 TYR A 41 1.728 -3.838 -11.348 1.00 0.00 H new ATOM 0 HD2 TYR A 41 2.972 -1.146 -14.404 1.00 0.00 H new ATOM 0 HE1 TYR A 41 1.214 -1.938 -9.883 1.00 0.00 H new ATOM 0 HE2 TYR A 41 2.459 0.754 -12.941 1.00 0.00 H new ATOM 0 HH TYR A 41 1.216 1.348 -11.058 1.00 0.00 H new ATOM 642 N VAL A 42 5.043 -4.636 -12.322 1.00 0.00 N ATOM 643 CA VAL A 42 6.025 -4.427 -11.275 1.00 0.00 C ATOM 644 C VAL A 42 5.813 -3.060 -10.636 1.00 0.00 C ATOM 645 O VAL A 42 5.744 -2.045 -11.330 1.00 0.00 O ATOM 646 CB VAL A 42 7.466 -4.514 -11.824 1.00 0.00 C ATOM 647 CG1 VAL A 42 8.479 -4.436 -10.693 1.00 0.00 C ATOM 648 CG2 VAL A 42 7.662 -5.787 -12.632 1.00 0.00 C ATOM 0 H VAL A 42 5.372 -4.402 -13.259 1.00 0.00 H new ATOM 0 HA VAL A 42 5.893 -5.214 -10.532 1.00 0.00 H new ATOM 0 HB VAL A 42 7.627 -3.663 -12.486 1.00 0.00 H new ATOM 0 HG11 VAL A 42 9.487 -4.499 -11.103 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.361 -3.491 -10.163 1.00 0.00 H new ATOM 0 HG13 VAL A 42 8.316 -5.262 -10.001 1.00 0.00 H new ATOM 0 HG21 VAL A 42 8.684 -5.825 -13.008 1.00 0.00 H new ATOM 0 HG22 VAL A 42 7.476 -6.653 -11.997 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.966 -5.796 -13.471 1.00 0.00 H new ATOM 658 N MET A 43 5.677 -3.048 -9.318 1.00 0.00 N ATOM 659 CA MET A 43 5.497 -1.815 -8.567 1.00 0.00 C ATOM 660 C MET A 43 6.762 -0.967 -8.634 1.00 0.00 C ATOM 661 O MET A 43 7.753 -1.259 -7.972 1.00 0.00 O ATOM 662 CB MET A 43 5.144 -2.150 -7.119 1.00 0.00 C ATOM 663 CG MET A 43 4.714 -0.954 -6.292 1.00 0.00 C ATOM 664 SD MET A 43 4.099 -1.440 -4.669 1.00 0.00 S ATOM 665 CE MET A 43 2.818 -2.601 -5.136 1.00 0.00 C ATOM 0 H MET A 43 5.688 -3.889 -8.741 1.00 0.00 H new ATOM 0 HA MET A 43 4.682 -1.239 -9.005 1.00 0.00 H new ATOM 0 HB2 MET A 43 4.342 -2.889 -7.114 1.00 0.00 H new ATOM 0 HB3 MET A 43 6.008 -2.614 -6.644 1.00 0.00 H new ATOM 0 HG2 MET A 43 5.558 -0.275 -6.171 1.00 0.00 H new ATOM 0 HG3 MET A 43 3.937 -0.406 -6.825 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.257 -2.899 -4.250 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.144 -2.130 -5.851 1.00 0.00 H new ATOM 0 HE3 MET A 43 3.273 -3.481 -5.591 1.00 0.00 H new ATOM 675 N THR A 44 6.721 0.070 -9.455 1.00 0.00 N ATOM 676 CA THR A 44 7.901 0.874 -9.726 1.00 0.00 C ATOM 677 C THR A 44 7.910 2.193 -8.954 1.00 0.00 C ATOM 678 O THR A 44 8.973 2.752 -8.689 1.00 0.00 O ATOM 679 CB THR A 44 8.008 1.162 -11.234 1.00 0.00 C ATOM 680 OG1 THR A 44 6.710 1.460 -11.768 1.00 0.00 O ATOM 681 CG2 THR A 44 8.605 -0.024 -11.977 1.00 0.00 C ATOM 0 H THR A 44 5.881 0.375 -9.946 1.00 0.00 H new ATOM 0 HA THR A 44 8.760 0.294 -9.390 1.00 0.00 H new ATOM 0 HB THR A 44 8.666 2.020 -11.369 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.785 1.644 -12.728 1.00 0.00 H new ATOM 0 HG21 THR A 44 8.669 0.207 -13.040 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.603 -0.231 -11.590 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.972 -0.899 -11.834 1.00 0.00 H new ATOM 689 N ASP A 45 6.734 2.702 -8.613 1.00 0.00 N ATOM 690 CA ASP A 45 6.644 3.987 -7.932 1.00 0.00 C ATOM 691 C ASP A 45 6.402 3.838 -6.438 1.00 0.00 C ATOM 692 O ASP A 45 5.439 3.208 -5.998 1.00 0.00 O ATOM 693 CB ASP A 45 5.566 4.862 -8.541 1.00 0.00 C ATOM 694 CG ASP A 45 5.727 6.288 -8.068 1.00 0.00 C ATOM 695 OD1 ASP A 45 6.648 6.976 -8.560 1.00 0.00 O ATOM 696 OD2 ASP A 45 4.981 6.709 -7.175 1.00 0.00 O ATOM 0 H ASP A 45 5.837 2.251 -8.794 1.00 0.00 H new ATOM 0 HA ASP A 45 7.612 4.469 -8.068 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.626 4.822 -9.629 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.581 4.487 -8.262 1.00 0.00 H new ATOM 701 N ARG A 46 7.321 4.416 -5.678 1.00 0.00 N ATOM 702 CA ARG A 46 7.208 4.538 -4.220 1.00 0.00 C ATOM 703 C ARG A 46 5.839 5.059 -3.763 1.00 0.00 C ATOM 704 O ARG A 46 5.290 4.561 -2.781 1.00 0.00 O ATOM 705 CB ARG A 46 8.319 5.447 -3.648 1.00 0.00 C ATOM 706 CG ARG A 46 8.311 6.900 -4.132 1.00 0.00 C ATOM 707 CD ARG A 46 8.615 7.006 -5.617 1.00 0.00 C ATOM 708 NE ARG A 46 9.944 6.486 -5.931 1.00 0.00 N ATOM 709 CZ ARG A 46 10.268 5.936 -7.098 1.00 0.00 C ATOM 710 NH1 ARG A 46 9.383 5.896 -8.089 1.00 0.00 N ATOM 711 NH2 ARG A 46 11.486 5.443 -7.278 1.00 0.00 N ATOM 0 H ARG A 46 8.178 4.820 -6.055 1.00 0.00 H new ATOM 0 HA ARG A 46 7.323 3.527 -3.830 1.00 0.00 H new ATOM 0 HB2 ARG A 46 8.238 5.446 -2.561 1.00 0.00 H new ATOM 0 HB3 ARG A 46 9.285 5.007 -3.896 1.00 0.00 H new ATOM 0 HG2 ARG A 46 7.337 7.345 -3.929 1.00 0.00 H new ATOM 0 HG3 ARG A 46 9.047 7.474 -3.569 1.00 0.00 H new ATOM 0 HD2 ARG A 46 7.864 6.454 -6.183 1.00 0.00 H new ATOM 0 HD3 ARG A 46 8.548 8.048 -5.930 1.00 0.00 H new ATOM 0 HE ARG A 46 10.666 6.548 -5.213 1.00 0.00 H new ATOM 0 HH11 ARG A 46 8.451 6.288 -7.956 1.00 0.00 H new ATOM 0 HH12 ARG A 46 9.636 5.473 -8.982 1.00 0.00 H new ATOM 0 HH21 ARG A 46 12.170 5.486 -6.523 1.00 0.00 H new ATOM 0 HH22 ARG A 46 11.738 5.020 -8.171 1.00 0.00 H new ATOM 725 N LEU A 47 5.277 6.044 -4.463 1.00 0.00 N ATOM 726 CA LEU A 47 4.016 6.642 -4.032 1.00 0.00 C ATOM 727 C LEU A 47 2.873 5.633 -4.116 1.00 0.00 C ATOM 728 O LEU A 47 1.852 5.787 -3.445 1.00 0.00 O ATOM 729 CB LEU A 47 3.676 7.915 -4.833 1.00 0.00 C ATOM 730 CG LEU A 47 4.374 9.198 -4.375 1.00 0.00 C ATOM 731 CD1 LEU A 47 4.263 9.350 -2.872 1.00 0.00 C ATOM 732 CD2 LEU A 47 5.825 9.224 -4.820 1.00 0.00 C ATOM 0 H LEU A 47 5.668 6.439 -5.318 1.00 0.00 H new ATOM 0 HA LEU A 47 4.143 6.935 -2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.928 7.741 -5.879 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.599 8.074 -4.786 1.00 0.00 H new ATOM 0 HG LEU A 47 3.873 10.044 -4.845 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.764 10.267 -2.561 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.212 9.397 -2.588 1.00 0.00 H new ATOM 0 HD13 LEU A 47 4.733 8.496 -2.384 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.293 10.147 -4.480 1.00 0.00 H new ATOM 0 HD22 LEU A 47 6.352 8.371 -4.393 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.873 9.172 -5.908 1.00 0.00 H new ATOM 744 N ALA A 48 3.067 4.573 -4.895 1.00 0.00 N ATOM 745 CA ALA A 48 2.047 3.555 -5.042 1.00 0.00 C ATOM 746 C ALA A 48 2.136 2.603 -3.865 1.00 0.00 C ATOM 747 O ALA A 48 1.187 2.453 -3.090 1.00 0.00 O ATOM 748 CB ALA A 48 2.222 2.815 -6.357 1.00 0.00 C ATOM 0 H ALA A 48 3.919 4.402 -5.429 1.00 0.00 H new ATOM 0 HA ALA A 48 1.060 4.018 -5.055 1.00 0.00 H new ATOM 0 HB1 ALA A 48 1.448 2.054 -6.452 1.00 0.00 H new ATOM 0 HB2 ALA A 48 2.141 3.520 -7.185 1.00 0.00 H new ATOM 0 HB3 ALA A 48 3.203 2.340 -6.379 1.00 0.00 H new ATOM 754 N GLY A 49 3.296 1.956 -3.759 1.00 0.00 N ATOM 755 CA GLY A 49 3.648 1.197 -2.563 1.00 0.00 C ATOM 756 C GLY A 49 3.224 1.854 -1.246 1.00 0.00 C ATOM 757 O GLY A 49 2.639 1.187 -0.395 1.00 0.00 O ATOM 0 H GLY A 49 4.008 1.943 -4.489 1.00 0.00 H new ATOM 0 HA2 GLY A 49 3.189 0.210 -2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.727 1.046 -2.548 1.00 0.00 H new ATOM 761 N CYS A 50 3.510 3.149 -1.059 1.00 0.00 N ATOM 762 CA CYS A 50 3.122 3.838 0.169 1.00 0.00 C ATOM 763 C CYS A 50 1.604 3.973 0.285 1.00 0.00 C ATOM 764 O CYS A 50 1.040 3.760 1.360 1.00 0.00 O ATOM 765 CB CYS A 50 3.774 5.223 0.257 1.00 0.00 C ATOM 766 SG CYS A 50 5.457 5.225 0.961 1.00 0.00 S ATOM 0 H CYS A 50 4.003 3.731 -1.736 1.00 0.00 H new ATOM 0 HA CYS A 50 3.477 3.228 1.000 1.00 0.00 H new ATOM 0 HB2 CYS A 50 3.812 5.657 -0.742 1.00 0.00 H new ATOM 0 HB3 CYS A 50 3.140 5.871 0.862 1.00 0.00 H new ATOM 771 N ALA A 51 0.944 4.305 -0.823 1.00 0.00 N ATOM 772 CA ALA A 51 -0.500 4.538 -0.811 1.00 0.00 C ATOM 773 C ALA A 51 -1.278 3.281 -0.429 1.00 0.00 C ATOM 774 O ALA A 51 -2.406 3.370 0.063 1.00 0.00 O ATOM 775 CB ALA A 51 -0.966 5.050 -2.161 1.00 0.00 C ATOM 0 H ALA A 51 1.383 4.418 -1.737 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.700 5.294 -0.052 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.043 5.218 -2.135 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.458 5.987 -2.390 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.733 4.313 -2.930 1.00 0.00 H new ATOM 781 N ILE A 52 -0.670 2.115 -0.644 1.00 0.00 N ATOM 782 CA ILE A 52 -1.291 0.847 -0.269 1.00 0.00 C ATOM 783 C ILE A 52 -1.606 0.814 1.226 1.00 0.00 C ATOM 784 O ILE A 52 -2.664 0.334 1.642 1.00 0.00 O ATOM 785 CB ILE A 52 -0.391 -0.355 -0.629 1.00 0.00 C ATOM 786 CG1 ILE A 52 -0.108 -0.372 -2.132 1.00 0.00 C ATOM 787 CG2 ILE A 52 -1.045 -1.662 -0.194 1.00 0.00 C ATOM 788 CD1 ILE A 52 0.791 -1.508 -2.562 1.00 0.00 C ATOM 0 H ILE A 52 0.250 2.023 -1.075 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.219 0.768 -0.835 1.00 0.00 H new ATOM 0 HB ILE A 52 0.555 -0.252 -0.098 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.053 -0.443 -2.671 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.352 0.574 -2.418 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -0.397 -2.498 -0.456 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.202 -1.649 0.884 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -2.004 -1.775 -0.699 1.00 0.00 H new ATOM 0 HD11 ILE A 52 0.949 -1.459 -3.639 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.750 -1.427 -2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.323 -2.459 -2.307 1.00 0.00 H new ATOM 800 N ASN A 53 -0.704 1.356 2.029 1.00 0.00 N ATOM 801 CA ASN A 53 -0.896 1.398 3.473 1.00 0.00 C ATOM 802 C ASN A 53 -1.052 2.839 3.940 1.00 0.00 C ATOM 803 O ASN A 53 -0.528 3.237 4.974 1.00 0.00 O ATOM 804 CB ASN A 53 0.284 0.724 4.191 1.00 0.00 C ATOM 805 CG ASN A 53 1.630 1.350 3.858 1.00 0.00 C ATOM 806 OD1 ASN A 53 2.284 0.957 2.895 1.00 0.00 O ATOM 807 ND2 ASN A 53 2.052 2.321 4.652 1.00 0.00 N ATOM 0 H ASN A 53 0.169 1.773 1.707 1.00 0.00 H new ATOM 0 HA ASN A 53 -1.806 0.851 3.721 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.123 0.777 5.268 1.00 0.00 H new ATOM 0 HB3 ASN A 53 0.307 -0.333 3.924 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.950 2.771 4.474 1.00 0.00 H new ATOM 0 HD22 ASN A 53 1.479 2.619 5.442 1.00 0.00 H new ATOM 814 N CYS A 54 -1.820 3.610 3.193 1.00 0.00 N ATOM 815 CA CYS A 54 -2.004 5.017 3.510 1.00 0.00 C ATOM 816 C CYS A 54 -3.311 5.259 4.263 1.00 0.00 C ATOM 817 O CYS A 54 -3.320 5.929 5.289 1.00 0.00 O ATOM 818 CB CYS A 54 -1.967 5.839 2.223 1.00 0.00 C ATOM 819 SG CYS A 54 -2.517 7.564 2.400 1.00 0.00 S ATOM 0 H CYS A 54 -2.325 3.290 2.367 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.191 5.330 4.165 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -0.948 5.836 1.836 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.593 5.348 1.477 1.00 0.00 H new ATOM 824 N LEU A 55 -4.403 4.669 3.782 1.00 0.00 N ATOM 825 CA LEU A 55 -5.732 4.932 4.345 1.00 0.00 C ATOM 826 C LEU A 55 -5.813 4.549 5.821 1.00 0.00 C ATOM 827 O LEU A 55 -6.117 5.384 6.680 1.00 0.00 O ATOM 828 CB LEU A 55 -6.817 4.183 3.559 1.00 0.00 C ATOM 829 CG LEU A 55 -7.315 4.869 2.278 1.00 0.00 C ATOM 830 CD1 LEU A 55 -7.898 6.235 2.598 1.00 0.00 C ATOM 831 CD2 LEU A 55 -6.201 4.992 1.247 1.00 0.00 C ATOM 0 H LEU A 55 -4.398 4.007 3.006 1.00 0.00 H new ATOM 0 HA LEU A 55 -5.903 6.005 4.262 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.431 3.199 3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.671 4.024 4.218 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.100 4.246 1.849 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.246 6.707 1.679 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -8.735 6.121 3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.132 6.859 3.058 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.586 5.482 0.352 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.385 5.584 1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -5.834 3.999 0.988 1.00 0.00 H new ATOM 843 N ALA A 56 -5.494 3.300 6.123 1.00 0.00 N ATOM 844 CA ALA A 56 -5.692 2.787 7.470 1.00 0.00 C ATOM 845 C ALA A 56 -4.539 3.185 8.377 1.00 0.00 C ATOM 846 O ALA A 56 -4.655 3.142 9.599 1.00 0.00 O ATOM 847 CB ALA A 56 -5.838 1.273 7.436 1.00 0.00 C ATOM 0 H ALA A 56 -5.101 2.629 5.462 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.606 3.223 7.872 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.986 0.899 8.449 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.697 1.004 6.821 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -4.936 0.830 7.014 1.00 0.00 H new ATOM 853 N THR A 57 -3.437 3.596 7.775 1.00 0.00 N ATOM 854 CA THR A 57 -2.299 4.059 8.539 1.00 0.00 C ATOM 855 C THR A 57 -2.437 5.541 8.904 1.00 0.00 C ATOM 856 O THR A 57 -2.148 5.930 10.034 1.00 0.00 O ATOM 857 CB THR A 57 -0.973 3.778 7.803 1.00 0.00 C ATOM 858 OG1 THR A 57 -0.713 2.369 7.819 1.00 0.00 O ATOM 859 CG2 THR A 57 0.186 4.529 8.437 1.00 0.00 C ATOM 0 H THR A 57 -3.309 3.618 6.763 1.00 0.00 H new ATOM 0 HA THR A 57 -2.278 3.494 9.471 1.00 0.00 H new ATOM 0 HB THR A 57 -1.069 4.127 6.775 1.00 0.00 H new ATOM 0 HG1 THR A 57 -0.546 2.057 6.905 1.00 0.00 H new ATOM 0 HG21 THR A 57 1.104 4.308 7.893 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.010 5.601 8.398 1.00 0.00 H new ATOM 0 HG23 THR A 57 0.296 4.218 9.476 1.00 0.00 H new ATOM 867 N LYS A 58 -2.889 6.371 7.964 1.00 0.00 N ATOM 868 CA LYS A 58 -3.095 7.784 8.261 1.00 0.00 C ATOM 869 C LYS A 58 -4.318 7.993 9.148 1.00 0.00 C ATOM 870 O LYS A 58 -4.484 9.064 9.732 1.00 0.00 O ATOM 871 CB LYS A 58 -3.227 8.617 6.980 1.00 0.00 C ATOM 872 CG LYS A 58 -1.982 8.633 6.084 1.00 0.00 C ATOM 873 CD LYS A 58 -0.764 9.300 6.735 1.00 0.00 C ATOM 874 CE LYS A 58 -1.160 10.330 7.785 1.00 0.00 C ATOM 875 NZ LYS A 58 0.012 11.075 8.313 1.00 0.00 N ATOM 0 H LYS A 58 -3.115 6.095 7.009 1.00 0.00 H new ATOM 0 HA LYS A 58 -2.212 8.125 8.802 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.068 8.234 6.401 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.471 9.643 7.256 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.724 7.608 5.816 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.219 9.155 5.157 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.138 8.536 7.197 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -0.162 9.783 5.965 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.870 11.034 7.351 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.670 9.829 8.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.096 11.210 9.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.880 10.535 8.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.073 12.002 7.846 1.00 0.00 H new ATOM 889 N LEU A 59 -5.174 6.978 9.243 1.00 0.00 N ATOM 890 CA LEU A 59 -6.275 7.006 10.180 1.00 0.00 C ATOM 891 C LEU A 59 -5.743 7.042 11.613 1.00 0.00 C ATOM 892 O LEU A 59 -5.903 8.044 12.316 1.00 0.00 O ATOM 893 CB LEU A 59 -7.137 5.769 9.967 1.00 0.00 C ATOM 894 CG LEU A 59 -8.589 5.923 10.385 1.00 0.00 C ATOM 895 CD1 LEU A 59 -9.449 4.979 9.575 1.00 0.00 C ATOM 896 CD2 LEU A 59 -8.766 5.661 11.875 1.00 0.00 C ATOM 0 H LEU A 59 -5.119 6.130 8.679 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.876 7.900 10.015 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.104 5.498 8.912 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.700 4.939 10.522 1.00 0.00 H new ATOM 0 HG LEU A 59 -8.899 6.950 10.193 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -10.491 5.089 9.874 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -9.349 5.214 8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -9.127 3.952 9.751 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -9.816 5.779 12.143 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -8.444 4.646 12.107 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -8.165 6.371 12.443 1.00 0.00 H new ATOM 908 N ASP A 60 -5.084 5.958 12.023 1.00 0.00 N ATOM 909 CA ASP A 60 -4.510 5.854 13.366 1.00 0.00 C ATOM 910 C ASP A 60 -3.744 4.544 13.507 1.00 0.00 C ATOM 911 O ASP A 60 -4.331 3.471 13.372 1.00 0.00 O ATOM 912 CB ASP A 60 -5.604 5.928 14.438 1.00 0.00 C ATOM 913 CG ASP A 60 -5.042 5.918 15.847 1.00 0.00 C ATOM 914 OD1 ASP A 60 -4.343 6.882 16.219 1.00 0.00 O ATOM 915 OD2 ASP A 60 -5.311 4.955 16.593 1.00 0.00 O ATOM 0 H ASP A 60 -4.934 5.134 11.440 1.00 0.00 H new ATOM 0 HA ASP A 60 -3.828 6.692 13.508 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -6.191 6.835 14.291 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.284 5.085 14.316 1.00 0.00 H new ATOM 920 N VAL A 61 -2.443 4.626 13.775 1.00 0.00 N ATOM 921 CA VAL A 61 -1.619 3.423 13.867 1.00 0.00 C ATOM 922 C VAL A 61 -0.179 3.762 14.291 1.00 0.00 C ATOM 923 O VAL A 61 0.776 3.053 13.959 1.00 0.00 O ATOM 924 CB VAL A 61 -1.603 2.702 12.494 1.00 0.00 C ATOM 925 CG1 VAL A 61 -0.756 3.462 11.491 1.00 0.00 C ATOM 926 CG2 VAL A 61 -1.133 1.266 12.613 1.00 0.00 C ATOM 0 H VAL A 61 -1.942 5.500 13.931 1.00 0.00 H new ATOM 0 HA VAL A 61 -2.050 2.770 14.626 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.631 2.680 12.132 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.762 2.935 10.537 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -1.164 4.464 11.355 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.267 3.534 11.860 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -1.137 0.799 11.628 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.122 1.247 13.019 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.801 0.718 13.277 1.00 0.00 H new ATOM 936 N VAL A 62 -0.012 4.806 15.081 1.00 0.00 N ATOM 937 CA VAL A 62 1.330 5.212 15.470 1.00 0.00 C ATOM 938 C VAL A 62 1.740 4.581 16.801 1.00 0.00 C ATOM 939 O VAL A 62 1.072 4.752 17.820 1.00 0.00 O ATOM 940 CB VAL A 62 1.485 6.751 15.517 1.00 0.00 C ATOM 941 CG1 VAL A 62 1.196 7.350 14.151 1.00 0.00 C ATOM 942 CG2 VAL A 62 0.589 7.378 16.579 1.00 0.00 C ATOM 0 H VAL A 62 -0.767 5.378 15.460 1.00 0.00 H new ATOM 0 HA VAL A 62 2.005 4.843 14.698 1.00 0.00 H new ATOM 0 HB VAL A 62 2.517 6.973 15.790 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.308 8.433 14.198 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.895 6.944 13.420 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.177 7.104 13.854 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.728 8.459 16.580 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -0.453 7.146 16.359 1.00 0.00 H new ATOM 0 HG23 VAL A 62 0.851 6.978 17.558 1.00 0.00 H new ATOM 952 N ASP A 63 2.804 3.781 16.765 1.00 0.00 N ATOM 953 CA ASP A 63 3.362 3.191 17.978 1.00 0.00 C ATOM 954 C ASP A 63 4.047 4.252 18.858 1.00 0.00 C ATOM 955 O ASP A 63 3.729 4.361 20.043 1.00 0.00 O ATOM 956 CB ASP A 63 4.349 2.070 17.616 1.00 0.00 C ATOM 957 CG ASP A 63 4.320 0.917 18.594 1.00 0.00 C ATOM 958 OD1 ASP A 63 3.421 0.065 18.480 1.00 0.00 O ATOM 959 OD2 ASP A 63 5.214 0.844 19.460 1.00 0.00 O ATOM 0 H ASP A 63 3.296 3.527 15.908 1.00 0.00 H new ATOM 0 HA ASP A 63 2.540 2.767 18.555 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.117 1.698 16.618 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.358 2.481 17.577 1.00 0.00 H new ATOM 964 N PRO A 64 4.995 5.053 18.308 1.00 0.00 N ATOM 965 CA PRO A 64 5.759 6.031 19.072 1.00 0.00 C ATOM 966 C PRO A 64 5.211 7.458 18.937 1.00 0.00 C ATOM 967 O PRO A 64 4.005 7.666 18.807 1.00 0.00 O ATOM 968 CB PRO A 64 7.151 5.923 18.422 1.00 0.00 C ATOM 969 CG PRO A 64 6.952 5.136 17.157 1.00 0.00 C ATOM 970 CD PRO A 64 5.468 5.077 16.929 1.00 0.00 C ATOM 0 HA PRO A 64 5.736 5.835 20.144 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.560 6.910 18.208 1.00 0.00 H new ATOM 0 HB3 PRO A 64 7.855 5.423 19.087 1.00 0.00 H new ATOM 0 HG2 PRO A 64 7.456 5.615 16.317 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.371 4.134 17.252 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.097 5.941 16.377 1.00 0.00 H new ATOM 0 HD3 PRO A 64 5.168 4.190 16.371 1.00 0.00 H new ATOM 978 N ASP A 65 6.123 8.431 18.913 1.00 0.00 N ATOM 979 CA ASP A 65 5.775 9.856 18.985 1.00 0.00 C ATOM 980 C ASP A 65 5.133 10.370 17.698 1.00 0.00 C ATOM 981 O ASP A 65 4.682 11.516 17.631 1.00 0.00 O ATOM 982 CB ASP A 65 7.033 10.677 19.270 1.00 0.00 C ATOM 983 CG ASP A 65 7.996 10.702 18.103 1.00 0.00 C ATOM 984 OD1 ASP A 65 8.690 9.690 17.878 1.00 0.00 O ATOM 985 OD2 ASP A 65 8.068 11.743 17.414 1.00 0.00 O ATOM 0 H ASP A 65 7.125 8.256 18.843 1.00 0.00 H new ATOM 0 HA ASP A 65 5.047 9.966 19.788 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.746 11.698 19.519 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.539 10.266 20.144 1.00 0.00 H new ATOM 990 N GLY A 66 5.088 9.528 16.688 1.00 0.00 N ATOM 991 CA GLY A 66 4.577 9.942 15.398 1.00 0.00 C ATOM 992 C GLY A 66 5.219 9.151 14.285 1.00 0.00 C ATOM 993 O GLY A 66 4.554 8.424 13.544 1.00 0.00 O ATOM 0 H GLY A 66 5.397 8.557 16.734 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.496 9.805 15.370 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.768 11.005 15.251 1.00 0.00 H new ATOM 997 N ASN A 67 6.529 9.283 14.196 1.00 0.00 N ATOM 998 CA ASN A 67 7.327 8.547 13.226 1.00 0.00 C ATOM 999 C ASN A 67 7.684 7.180 13.784 1.00 0.00 C ATOM 1000 O ASN A 67 7.515 6.942 14.974 1.00 0.00 O ATOM 1001 CB ASN A 67 8.611 9.319 12.918 1.00 0.00 C ATOM 1002 CG ASN A 67 9.225 9.907 14.175 1.00 0.00 C ATOM 1003 OD1 ASN A 67 8.986 11.068 14.503 1.00 0.00 O ATOM 1004 ND2 ASN A 67 9.992 9.111 14.902 1.00 0.00 N ATOM 0 H ASN A 67 7.074 9.904 14.794 1.00 0.00 H new ATOM 0 HA ASN A 67 6.748 8.426 12.310 1.00 0.00 H new ATOM 0 HB2 ASN A 67 9.329 8.654 12.438 1.00 0.00 H new ATOM 0 HB3 ASN A 67 8.394 10.119 12.210 1.00 0.00 H new ATOM 0 HD21 ASN A 67 10.408 9.455 15.768 1.00 0.00 H new ATOM 0 HD22 ASN A 67 10.167 8.154 14.597 1.00 0.00 H new ATOM 1011 N LEU A 68 8.149 6.284 12.915 1.00 0.00 N ATOM 1012 CA LEU A 68 8.694 4.991 13.333 1.00 0.00 C ATOM 1013 C LEU A 68 7.595 4.076 13.888 1.00 0.00 C ATOM 1014 O LEU A 68 7.845 3.215 14.732 1.00 0.00 O ATOM 1015 CB LEU A 68 9.812 5.217 14.369 1.00 0.00 C ATOM 1016 CG LEU A 68 11.095 4.386 14.194 1.00 0.00 C ATOM 1017 CD1 LEU A 68 10.843 2.926 14.509 1.00 0.00 C ATOM 1018 CD2 LEU A 68 11.658 4.536 12.787 1.00 0.00 C ATOM 0 H LEU A 68 8.159 6.432 11.906 1.00 0.00 H new ATOM 0 HA LEU A 68 9.116 4.488 12.463 1.00 0.00 H new ATOM 0 HB2 LEU A 68 10.085 6.272 14.350 1.00 0.00 H new ATOM 0 HB3 LEU A 68 9.405 5.010 15.359 1.00 0.00 H new ATOM 0 HG LEU A 68 11.834 4.767 14.899 1.00 0.00 H new ATOM 0 HD11 LEU A 68 11.766 2.361 14.377 1.00 0.00 H new ATOM 0 HD12 LEU A 68 10.502 2.830 15.540 1.00 0.00 H new ATOM 0 HD13 LEU A 68 10.079 2.535 13.837 1.00 0.00 H new ATOM 0 HD21 LEU A 68 12.564 3.938 12.692 1.00 0.00 H new ATOM 0 HD22 LEU A 68 10.920 4.194 12.061 1.00 0.00 H new ATOM 0 HD23 LEU A 68 11.893 5.584 12.599 1.00 0.00 H new ATOM 1030 N HIS A 69 6.377 4.247 13.389 1.00 0.00 N ATOM 1031 CA HIS A 69 5.255 3.401 13.790 1.00 0.00 C ATOM 1032 C HIS A 69 5.356 1.997 13.184 1.00 0.00 C ATOM 1033 O HIS A 69 4.638 1.655 12.248 1.00 0.00 O ATOM 1034 CB HIS A 69 3.918 4.060 13.399 1.00 0.00 C ATOM 1035 CG HIS A 69 3.896 4.664 12.017 1.00 0.00 C ATOM 1036 ND1 HIS A 69 3.781 3.922 10.860 1.00 0.00 N ATOM 1037 CD2 HIS A 69 3.981 5.957 11.618 1.00 0.00 C ATOM 1038 CE1 HIS A 69 3.802 4.731 9.816 1.00 0.00 C ATOM 1039 NE2 HIS A 69 3.922 5.971 10.248 1.00 0.00 N ATOM 0 H HIS A 69 6.139 4.965 12.705 1.00 0.00 H new ATOM 0 HA HIS A 69 5.295 3.295 14.874 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.126 3.314 13.468 1.00 0.00 H new ATOM 0 HB3 HIS A 69 3.686 4.839 14.125 1.00 0.00 H new ATOM 0 HD1 HIS A 69 3.693 2.907 10.817 1.00 0.00 H new ATOM 0 HD2 HIS A 69 4.078 6.819 12.262 1.00 0.00 H new ATOM 0 HE1 HIS A 69 3.733 4.428 8.782 1.00 0.00 H new ATOM 1048 N HIS A 70 6.265 1.196 13.727 1.00 0.00 N ATOM 1049 CA HIS A 70 6.493 -0.165 13.236 1.00 0.00 C ATOM 1050 C HIS A 70 5.544 -1.182 13.888 1.00 0.00 C ATOM 1051 O HIS A 70 4.860 -1.946 13.196 1.00 0.00 O ATOM 1052 CB HIS A 70 7.970 -0.579 13.440 1.00 0.00 C ATOM 1053 CG HIS A 70 8.440 -0.597 14.875 1.00 0.00 C ATOM 1054 ND1 HIS A 70 8.904 -1.732 15.501 1.00 0.00 N ATOM 1055 CD2 HIS A 70 8.530 0.394 15.796 1.00 0.00 C ATOM 1056 CE1 HIS A 70 9.244 -1.442 16.744 1.00 0.00 C ATOM 1057 NE2 HIS A 70 9.028 -0.159 16.949 1.00 0.00 N ATOM 0 H HIS A 70 6.860 1.464 14.511 1.00 0.00 H new ATOM 0 HA HIS A 70 6.276 -0.165 12.168 1.00 0.00 H new ATOM 0 HB2 HIS A 70 8.114 -1.572 13.015 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.604 0.105 12.875 1.00 0.00 H new ATOM 0 HD2 HIS A 70 8.259 1.429 15.649 1.00 0.00 H new ATOM 0 HE1 HIS A 70 9.634 -2.140 17.470 1.00 0.00 H new ATOM 0 HE2 HIS A 70 9.202 0.341 17.821 1.00 0.00 H new ATOM 1066 N GLY A 71 5.481 -1.159 15.217 1.00 0.00 N ATOM 1067 CA GLY A 71 4.757 -2.173 15.958 1.00 0.00 C ATOM 1068 C GLY A 71 3.284 -2.204 15.628 1.00 0.00 C ATOM 1069 O GLY A 71 2.777 -3.210 15.130 1.00 0.00 O ATOM 0 H GLY A 71 5.924 -0.447 15.797 1.00 0.00 H new ATOM 0 HA2 GLY A 71 5.192 -3.150 15.747 1.00 0.00 H new ATOM 0 HA3 GLY A 71 4.881 -1.993 17.026 1.00 0.00 H new ATOM 1073 N ASN A 72 2.604 -1.097 15.902 1.00 0.00 N ATOM 1074 CA ASN A 72 1.168 -0.993 15.667 1.00 0.00 C ATOM 1075 C ASN A 72 0.785 -1.281 14.216 1.00 0.00 C ATOM 1076 O ASN A 72 -0.293 -1.803 13.966 1.00 0.00 O ATOM 1077 CB ASN A 72 0.640 0.384 16.089 1.00 0.00 C ATOM 1078 CG ASN A 72 0.292 0.439 17.566 1.00 0.00 C ATOM 1079 OD1 ASN A 72 -0.038 -0.577 18.173 1.00 0.00 O ATOM 1080 ND2 ASN A 72 0.336 1.627 18.149 1.00 0.00 N ATOM 0 H ASN A 72 3.027 -0.254 16.290 1.00 0.00 H new ATOM 0 HA ASN A 72 0.700 -1.760 16.284 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.390 1.142 15.866 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -0.244 0.628 15.500 1.00 0.00 H new ATOM 0 HD21 ASN A 72 0.091 1.721 19.135 1.00 0.00 H new ATOM 0 HD22 ASN A 72 0.615 2.448 17.612 1.00 0.00 H new ATOM 1087 N ALA A 73 1.659 -0.969 13.263 1.00 0.00 N ATOM 1088 CA ALA A 73 1.335 -1.190 11.857 1.00 0.00 C ATOM 1089 C ALA A 73 1.290 -2.680 11.535 1.00 0.00 C ATOM 1090 O ALA A 73 0.408 -3.152 10.811 1.00 0.00 O ATOM 1091 CB ALA A 73 2.342 -0.483 10.962 1.00 0.00 C ATOM 0 H ALA A 73 2.582 -0.569 13.434 1.00 0.00 H new ATOM 0 HA ALA A 73 0.346 -0.772 11.667 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.086 -0.658 9.917 1.00 0.00 H new ATOM 0 HB2 ALA A 73 2.322 0.588 11.166 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.341 -0.871 11.161 1.00 0.00 H new ATOM 1097 N LYS A 74 2.197 -3.433 12.137 1.00 0.00 N ATOM 1098 CA LYS A 74 2.228 -4.870 11.925 1.00 0.00 C ATOM 1099 C LYS A 74 1.166 -5.540 12.783 1.00 0.00 C ATOM 1100 O LYS A 74 0.539 -6.516 12.372 1.00 0.00 O ATOM 1101 CB LYS A 74 3.610 -5.426 12.259 1.00 0.00 C ATOM 1102 CG LYS A 74 4.706 -4.963 11.310 1.00 0.00 C ATOM 1103 CD LYS A 74 6.098 -5.314 11.822 1.00 0.00 C ATOM 1104 CE LYS A 74 6.247 -6.805 12.097 1.00 0.00 C ATOM 1105 NZ LYS A 74 5.814 -7.173 13.475 1.00 0.00 N ATOM 0 H LYS A 74 2.914 -3.077 12.769 1.00 0.00 H new ATOM 0 HA LYS A 74 2.018 -5.078 10.876 1.00 0.00 H new ATOM 0 HB2 LYS A 74 3.874 -5.131 13.275 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.566 -6.515 12.244 1.00 0.00 H new ATOM 0 HG2 LYS A 74 4.555 -5.420 10.332 1.00 0.00 H new ATOM 0 HG3 LYS A 74 4.633 -3.884 11.172 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.843 -5.005 11.088 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.300 -4.755 12.736 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.658 -7.366 11.372 1.00 0.00 H new ATOM 0 HE3 LYS A 74 7.288 -7.096 11.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 6.603 -7.627 13.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.524 -6.316 13.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 5.012 -7.833 13.422 1.00 0.00 H new ATOM 1119 N ASP A 75 0.960 -4.992 13.970 1.00 0.00 N ATOM 1120 CA ASP A 75 -0.068 -5.481 14.880 1.00 0.00 C ATOM 1121 C ASP A 75 -1.459 -5.263 14.282 1.00 0.00 C ATOM 1122 O ASP A 75 -2.325 -6.135 14.356 1.00 0.00 O ATOM 1123 CB ASP A 75 0.064 -4.772 16.231 1.00 0.00 C ATOM 1124 CG ASP A 75 -0.934 -5.258 17.261 1.00 0.00 C ATOM 1125 OD1 ASP A 75 -0.919 -6.458 17.589 1.00 0.00 O ATOM 1126 OD2 ASP A 75 -1.718 -4.429 17.768 1.00 0.00 O ATOM 0 H ASP A 75 1.495 -4.202 14.329 1.00 0.00 H new ATOM 0 HA ASP A 75 0.066 -6.552 15.032 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.073 -4.920 16.615 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.067 -3.700 16.085 1.00 0.00 H new ATOM 1131 N PHE A 76 -1.654 -4.103 13.659 1.00 0.00 N ATOM 1132 CA PHE A 76 -2.920 -3.774 13.012 1.00 0.00 C ATOM 1133 C PHE A 76 -3.199 -4.731 11.857 1.00 0.00 C ATOM 1134 O PHE A 76 -4.336 -5.158 11.658 1.00 0.00 O ATOM 1135 CB PHE A 76 -2.901 -2.328 12.502 1.00 0.00 C ATOM 1136 CG PHE A 76 -4.198 -1.883 11.882 1.00 0.00 C ATOM 1137 CD1 PHE A 76 -5.293 -1.588 12.675 1.00 0.00 C ATOM 1138 CD2 PHE A 76 -4.323 -1.767 10.505 1.00 0.00 C ATOM 1139 CE1 PHE A 76 -6.488 -1.184 12.111 1.00 0.00 C ATOM 1140 CE2 PHE A 76 -5.516 -1.365 9.935 1.00 0.00 C ATOM 1141 CZ PHE A 76 -6.600 -1.074 10.740 1.00 0.00 C ATOM 0 H PHE A 76 -0.946 -3.372 13.589 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.716 -3.877 13.750 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.659 -1.664 13.332 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.103 -2.223 11.767 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.213 -1.675 13.749 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -3.478 -1.993 9.871 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.334 -0.955 12.743 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -5.601 -1.279 8.862 1.00 0.00 H new ATOM 0 HZ PHE A 76 -7.534 -0.761 10.297 1.00 0.00 H new ATOM 1151 N ALA A 77 -2.152 -5.085 11.119 1.00 0.00 N ATOM 1152 CA ALA A 77 -2.291 -5.985 9.982 1.00 0.00 C ATOM 1153 C ALA A 77 -2.635 -7.397 10.440 1.00 0.00 C ATOM 1154 O ALA A 77 -3.424 -8.090 9.798 1.00 0.00 O ATOM 1155 CB ALA A 77 -1.008 -6.005 9.169 1.00 0.00 C ATOM 0 H ALA A 77 -1.199 -4.762 11.288 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.106 -5.617 9.359 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.124 -6.681 8.322 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -0.793 -5.001 8.804 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.185 -6.348 9.796 1.00 0.00 H new ATOM 1161 N MET A 78 -2.055 -7.810 11.559 1.00 0.00 N ATOM 1162 CA MET A 78 -2.305 -9.145 12.100 1.00 0.00 C ATOM 1163 C MET A 78 -3.689 -9.252 12.725 1.00 0.00 C ATOM 1164 O MET A 78 -4.229 -10.349 12.859 1.00 0.00 O ATOM 1165 CB MET A 78 -1.244 -9.529 13.133 1.00 0.00 C ATOM 1166 CG MET A 78 0.146 -9.694 12.550 1.00 0.00 C ATOM 1167 SD MET A 78 1.347 -10.308 13.750 1.00 0.00 S ATOM 1168 CE MET A 78 1.298 -9.008 14.983 1.00 0.00 C ATOM 0 H MET A 78 -1.410 -7.244 12.110 1.00 0.00 H new ATOM 0 HA MET A 78 -2.253 -9.839 11.261 1.00 0.00 H new ATOM 0 HB2 MET A 78 -1.214 -8.765 13.910 1.00 0.00 H new ATOM 0 HB3 MET A 78 -1.539 -10.462 13.614 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.100 -10.382 11.706 1.00 0.00 H new ATOM 0 HG3 MET A 78 0.487 -8.734 12.161 1.00 0.00 H new ATOM 0 HE1 MET A 78 2.065 -9.191 15.736 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.482 -8.046 14.505 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.318 -8.995 15.459 1.00 0.00 H new ATOM 1178 N LYS A 79 -4.258 -8.127 13.134 1.00 0.00 N ATOM 1179 CA LYS A 79 -5.599 -8.140 13.687 1.00 0.00 C ATOM 1180 C LYS A 79 -6.638 -7.865 12.604 1.00 0.00 C ATOM 1181 O LYS A 79 -7.828 -8.095 12.812 1.00 0.00 O ATOM 1182 CB LYS A 79 -5.724 -7.125 14.833 1.00 0.00 C ATOM 1183 CG LYS A 79 -4.810 -7.429 16.011 1.00 0.00 C ATOM 1184 CD LYS A 79 -4.871 -6.338 17.072 1.00 0.00 C ATOM 1185 CE LYS A 79 -4.514 -4.975 16.495 1.00 0.00 C ATOM 1186 NZ LYS A 79 -4.346 -3.947 17.553 1.00 0.00 N ATOM 0 H LYS A 79 -3.818 -7.208 13.094 1.00 0.00 H new ATOM 0 HA LYS A 79 -5.789 -9.135 14.091 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -5.496 -6.129 14.453 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.757 -7.105 15.180 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.094 -8.383 16.454 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.784 -7.535 15.657 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.873 -6.302 17.500 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.186 -6.581 17.884 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.592 -5.056 15.919 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -5.295 -4.659 15.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.702 -3.033 17.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.880 -4.230 18.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.338 -3.857 17.793 1.00 0.00 H new ATOM 1200 N HIS A 80 -6.199 -7.377 11.439 1.00 0.00 N ATOM 1201 CA HIS A 80 -7.129 -7.026 10.371 1.00 0.00 C ATOM 1202 C HIS A 80 -6.529 -7.325 9.003 1.00 0.00 C ATOM 1203 O HIS A 80 -5.766 -6.526 8.463 1.00 0.00 O ATOM 1204 CB HIS A 80 -7.503 -5.540 10.448 1.00 0.00 C ATOM 1205 CG HIS A 80 -8.096 -5.128 11.754 1.00 0.00 C ATOM 1206 ND1 HIS A 80 -9.437 -5.211 12.037 1.00 0.00 N ATOM 1207 CD2 HIS A 80 -7.505 -4.660 12.874 1.00 0.00 C ATOM 1208 CE1 HIS A 80 -9.643 -4.816 13.278 1.00 0.00 C ATOM 1209 NE2 HIS A 80 -8.481 -4.478 13.812 1.00 0.00 N ATOM 0 H HIS A 80 -5.216 -7.219 11.217 1.00 0.00 H new ATOM 0 HA HIS A 80 -8.026 -7.631 10.503 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -6.611 -4.942 10.261 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -8.212 -5.313 9.652 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -6.451 -4.465 13.005 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -10.601 -4.775 13.775 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -8.338 -4.139 14.763 1.00 0.00 H new ATOM 1218 N GLY A 81 -6.844 -8.492 8.461 1.00 0.00 N ATOM 1219 CA GLY A 81 -6.443 -8.804 7.104 1.00 0.00 C ATOM 1220 C GLY A 81 -5.605 -10.056 7.030 1.00 0.00 C ATOM 1221 O GLY A 81 -6.058 -11.092 6.538 1.00 0.00 O ATOM 0 H GLY A 81 -7.369 -9.227 8.935 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -7.331 -8.926 6.484 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.879 -7.967 6.692 1.00 0.00 H new ATOM 1225 N ALA A 82 -4.389 -9.970 7.534 1.00 0.00 N ATOM 1226 CA ALA A 82 -3.497 -11.111 7.548 1.00 0.00 C ATOM 1227 C ALA A 82 -3.434 -11.691 8.943 1.00 0.00 C ATOM 1228 O ALA A 82 -3.323 -10.951 9.915 1.00 0.00 O ATOM 1229 CB ALA A 82 -2.100 -10.721 7.097 1.00 0.00 C ATOM 0 H ALA A 82 -3.997 -9.120 7.939 1.00 0.00 H new ATOM 0 HA ALA A 82 -3.886 -11.856 6.854 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -1.453 -11.598 7.118 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.142 -10.325 6.082 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -1.701 -9.959 7.767 1.00 0.00 H new ATOM 1235 N ASP A 83 -3.507 -13.000 9.058 1.00 0.00 N ATOM 1236 CA ASP A 83 -3.347 -13.619 10.361 1.00 0.00 C ATOM 1237 C ASP A 83 -1.875 -13.700 10.674 1.00 0.00 C ATOM 1238 O ASP A 83 -1.044 -13.403 9.807 1.00 0.00 O ATOM 1239 CB ASP A 83 -4.017 -14.984 10.457 1.00 0.00 C ATOM 1240 CG ASP A 83 -3.207 -16.114 9.872 1.00 0.00 C ATOM 1241 OD1 ASP A 83 -2.338 -16.645 10.590 1.00 0.00 O ATOM 1242 OD2 ASP A 83 -3.463 -16.503 8.714 1.00 0.00 O ATOM 0 H ASP A 83 -3.672 -13.646 8.286 1.00 0.00 H new ATOM 0 HA ASP A 83 -3.852 -13.000 11.103 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -4.221 -15.203 11.505 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -4.980 -14.940 9.947 1.00 0.00 H new ATOM 1247 N GLU A 84 -1.536 -14.098 11.886 1.00 0.00 N ATOM 1248 CA GLU A 84 -0.200 -13.939 12.345 1.00 0.00 C ATOM 1249 C GLU A 84 0.747 -14.789 11.530 1.00 0.00 C ATOM 1250 O GLU A 84 1.916 -14.473 11.387 1.00 0.00 O ATOM 1251 CB GLU A 84 -0.127 -14.186 13.859 1.00 0.00 C ATOM 1252 CG GLU A 84 0.189 -15.594 14.381 1.00 0.00 C ATOM 1253 CD GLU A 84 1.567 -16.118 14.033 1.00 0.00 C ATOM 1254 OE1 GLU A 84 2.562 -15.466 14.401 1.00 0.00 O ATOM 1255 OE2 GLU A 84 1.657 -17.200 13.411 1.00 0.00 O ATOM 0 H GLU A 84 -2.174 -14.529 12.555 1.00 0.00 H new ATOM 0 HA GLU A 84 0.127 -12.910 12.193 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.627 -13.511 14.264 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -1.085 -13.887 14.285 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.081 -15.594 15.466 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.555 -16.286 13.986 1.00 0.00 H new ATOM 1262 N THR A 85 0.222 -15.823 10.923 1.00 0.00 N ATOM 1263 CA THR A 85 1.057 -16.713 10.167 1.00 0.00 C ATOM 1264 C THR A 85 1.483 -16.030 8.863 1.00 0.00 C ATOM 1265 O THR A 85 2.598 -16.223 8.398 1.00 0.00 O ATOM 1266 CB THR A 85 0.360 -18.066 9.903 1.00 0.00 C ATOM 1267 OG1 THR A 85 1.340 -19.099 9.745 1.00 0.00 O ATOM 1268 CG2 THR A 85 -0.526 -18.024 8.668 1.00 0.00 C ATOM 0 H THR A 85 -0.769 -16.065 10.938 1.00 0.00 H new ATOM 0 HA THR A 85 1.949 -16.937 10.752 1.00 0.00 H new ATOM 0 HB THR A 85 -0.274 -18.275 10.765 1.00 0.00 H new ATOM 0 HG1 THR A 85 0.890 -19.954 9.580 1.00 0.00 H new ATOM 0 HG21 THR A 85 -0.995 -18.997 8.523 1.00 0.00 H new ATOM 0 HG22 THR A 85 -1.298 -17.266 8.800 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.078 -17.779 7.795 1.00 0.00 H new ATOM 1276 N MET A 86 0.625 -15.150 8.328 1.00 0.00 N ATOM 1277 CA MET A 86 0.893 -14.522 7.042 1.00 0.00 C ATOM 1278 C MET A 86 1.831 -13.352 7.241 1.00 0.00 C ATOM 1279 O MET A 86 2.781 -13.156 6.483 1.00 0.00 O ATOM 1280 CB MET A 86 -0.406 -14.056 6.377 1.00 0.00 C ATOM 1281 CG MET A 86 -1.455 -15.146 6.267 1.00 0.00 C ATOM 1282 SD MET A 86 -3.012 -14.543 5.583 1.00 0.00 S ATOM 1283 CE MET A 86 -2.483 -14.030 3.950 1.00 0.00 C ATOM 0 H MET A 86 -0.250 -14.864 8.767 1.00 0.00 H new ATOM 0 HA MET A 86 1.360 -15.255 6.384 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.818 -13.223 6.947 1.00 0.00 H new ATOM 0 HB3 MET A 86 -0.179 -13.679 5.380 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.073 -15.950 5.638 1.00 0.00 H new ATOM 0 HG3 MET A 86 -1.636 -15.572 7.254 1.00 0.00 H new ATOM 0 HE1 MET A 86 -3.354 -13.920 3.303 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.960 -13.076 4.020 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.813 -14.781 3.532 1.00 0.00 H new ATOM 1293 N ALA A 87 1.585 -12.604 8.303 1.00 0.00 N ATOM 1294 CA ALA A 87 2.444 -11.500 8.661 1.00 0.00 C ATOM 1295 C ALA A 87 3.835 -12.028 8.971 1.00 0.00 C ATOM 1296 O ALA A 87 4.840 -11.390 8.669 1.00 0.00 O ATOM 1297 CB ALA A 87 1.864 -10.770 9.855 1.00 0.00 C ATOM 0 H ALA A 87 0.794 -12.746 8.931 1.00 0.00 H new ATOM 0 HA ALA A 87 2.514 -10.797 7.831 1.00 0.00 H new ATOM 0 HB1 ALA A 87 2.514 -9.937 10.123 1.00 0.00 H new ATOM 0 HB2 ALA A 87 0.874 -10.391 9.604 1.00 0.00 H new ATOM 0 HB3 ALA A 87 1.786 -11.456 10.698 1.00 0.00 H new ATOM 1303 N GLN A 88 3.878 -13.233 9.526 1.00 0.00 N ATOM 1304 CA GLN A 88 5.133 -13.866 9.899 1.00 0.00 C ATOM 1305 C GLN A 88 5.847 -14.445 8.676 1.00 0.00 C ATOM 1306 O GLN A 88 7.063 -14.647 8.697 1.00 0.00 O ATOM 1307 CB GLN A 88 4.888 -14.942 10.959 1.00 0.00 C ATOM 1308 CG GLN A 88 5.094 -14.460 12.395 1.00 0.00 C ATOM 1309 CD GLN A 88 4.465 -13.104 12.688 1.00 0.00 C ATOM 1310 OE1 GLN A 88 5.096 -12.065 12.492 1.00 0.00 O ATOM 1311 NE2 GLN A 88 3.227 -13.093 13.175 1.00 0.00 N ATOM 0 H GLN A 88 3.050 -13.794 9.728 1.00 0.00 H new ATOM 0 HA GLN A 88 5.787 -13.106 10.326 1.00 0.00 H new ATOM 0 HB2 GLN A 88 3.869 -15.315 10.855 1.00 0.00 H new ATOM 0 HB3 GLN A 88 5.556 -15.782 10.770 1.00 0.00 H new ATOM 0 HG2 GLN A 88 4.676 -15.199 13.079 1.00 0.00 H new ATOM 0 HG3 GLN A 88 6.163 -14.405 12.599 1.00 0.00 H new ATOM 0 HE21 GLN A 88 2.731 -13.971 13.326 1.00 0.00 H new ATOM 0 HE22 GLN A 88 2.774 -12.206 13.397 1.00 0.00 H new ATOM 1320 N GLN A 89 5.102 -14.699 7.600 1.00 0.00 N ATOM 1321 CA GLN A 89 5.731 -15.097 6.341 1.00 0.00 C ATOM 1322 C GLN A 89 6.318 -13.866 5.649 1.00 0.00 C ATOM 1323 O GLN A 89 7.274 -13.974 4.881 1.00 0.00 O ATOM 1324 CB GLN A 89 4.746 -15.806 5.383 1.00 0.00 C ATOM 1325 CG GLN A 89 3.934 -16.925 6.015 1.00 0.00 C ATOM 1326 CD GLN A 89 4.756 -18.124 6.447 1.00 0.00 C ATOM 1327 OE1 GLN A 89 5.937 -18.013 6.773 1.00 0.00 O ATOM 1328 NE2 GLN A 89 4.116 -19.281 6.483 1.00 0.00 N ATOM 0 H GLN A 89 4.084 -14.638 7.573 1.00 0.00 H new ATOM 0 HA GLN A 89 6.519 -15.810 6.585 1.00 0.00 H new ATOM 0 HB2 GLN A 89 4.060 -15.064 4.976 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.309 -16.214 4.543 1.00 0.00 H new ATOM 0 HG2 GLN A 89 3.406 -16.530 6.883 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.177 -17.255 5.304 1.00 0.00 H new ATOM 0 HE21 GLN A 89 3.136 -19.331 6.204 1.00 0.00 H new ATOM 0 HE22 GLN A 89 4.602 -20.124 6.790 1.00 0.00 H new ATOM 1337 N LEU A 90 5.761 -12.691 5.946 1.00 0.00 N ATOM 1338 CA LEU A 90 6.215 -11.455 5.314 1.00 0.00 C ATOM 1339 C LEU A 90 7.407 -10.854 6.049 1.00 0.00 C ATOM 1340 O LEU A 90 8.372 -10.420 5.422 1.00 0.00 O ATOM 1341 CB LEU A 90 5.085 -10.422 5.240 1.00 0.00 C ATOM 1342 CG LEU A 90 4.214 -10.469 3.977 1.00 0.00 C ATOM 1343 CD1 LEU A 90 3.482 -11.796 3.857 1.00 0.00 C ATOM 1344 CD2 LEU A 90 3.224 -9.314 3.977 1.00 0.00 C ATOM 0 H LEU A 90 5.001 -12.571 6.615 1.00 0.00 H new ATOM 0 HA LEU A 90 6.525 -11.714 4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.439 -10.556 6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.523 -9.427 5.319 1.00 0.00 H new ATOM 0 HG LEU A 90 4.871 -10.373 3.112 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.874 -11.796 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.207 -12.608 3.807 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.839 -11.937 4.726 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.612 -9.359 3.076 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.582 -9.385 4.855 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.767 -8.369 4.000 1.00 0.00 H new ATOM 1356 N VAL A 91 7.343 -10.852 7.380 1.00 0.00 N ATOM 1357 CA VAL A 91 8.374 -10.220 8.210 1.00 0.00 C ATOM 1358 C VAL A 91 9.760 -10.790 7.924 1.00 0.00 C ATOM 1359 O VAL A 91 10.761 -10.079 7.993 1.00 0.00 O ATOM 1360 CB VAL A 91 8.074 -10.386 9.717 1.00 0.00 C ATOM 1361 CG1 VAL A 91 6.814 -9.635 10.116 1.00 0.00 C ATOM 1362 CG2 VAL A 91 7.967 -11.852 10.094 1.00 0.00 C ATOM 0 H VAL A 91 6.586 -11.282 7.911 1.00 0.00 H new ATOM 0 HA VAL A 91 8.361 -9.161 7.952 1.00 0.00 H new ATOM 0 HB VAL A 91 8.910 -9.954 10.267 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.631 -9.772 11.182 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.940 -8.574 9.903 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.966 -10.020 9.550 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.756 -11.939 11.160 1.00 0.00 H new ATOM 0 HG22 VAL A 91 7.161 -12.316 9.525 1.00 0.00 H new ATOM 0 HG23 VAL A 91 8.907 -12.355 9.868 1.00 0.00 H new ATOM 1372 N ASP A 92 9.795 -12.065 7.587 1.00 0.00 N ATOM 1373 CA ASP A 92 11.038 -12.768 7.323 1.00 0.00 C ATOM 1374 C ASP A 92 11.701 -12.230 6.058 1.00 0.00 C ATOM 1375 O ASP A 92 12.902 -11.936 6.047 1.00 0.00 O ATOM 1376 CB ASP A 92 10.752 -14.270 7.224 1.00 0.00 C ATOM 1377 CG ASP A 92 11.871 -15.051 6.565 1.00 0.00 C ATOM 1378 OD1 ASP A 92 12.977 -15.122 7.143 1.00 0.00 O ATOM 1379 OD2 ASP A 92 11.648 -15.610 5.473 1.00 0.00 O ATOM 0 H ASP A 92 8.961 -12.644 7.488 1.00 0.00 H new ATOM 0 HA ASP A 92 11.738 -12.603 8.142 1.00 0.00 H new ATOM 0 HB2 ASP A 92 10.582 -14.667 8.225 1.00 0.00 H new ATOM 0 HB3 ASP A 92 9.832 -14.421 6.660 1.00 0.00 H new ATOM 1384 N ILE A 93 10.906 -12.041 5.012 1.00 0.00 N ATOM 1385 CA ILE A 93 11.404 -11.448 3.779 1.00 0.00 C ATOM 1386 C ILE A 93 11.764 -9.989 4.025 1.00 0.00 C ATOM 1387 O ILE A 93 12.816 -9.521 3.593 1.00 0.00 O ATOM 1388 CB ILE A 93 10.371 -11.535 2.619 1.00 0.00 C ATOM 1389 CG1 ILE A 93 10.405 -12.900 1.915 1.00 0.00 C ATOM 1390 CG2 ILE A 93 10.616 -10.433 1.599 1.00 0.00 C ATOM 1391 CD1 ILE A 93 10.263 -14.085 2.842 1.00 0.00 C ATOM 0 H ILE A 93 9.917 -12.289 4.993 1.00 0.00 H new ATOM 0 HA ILE A 93 12.285 -12.015 3.478 1.00 0.00 H new ATOM 0 HB ILE A 93 9.384 -11.409 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 93 9.604 -12.934 1.176 1.00 0.00 H new ATOM 0 HG13 ILE A 93 11.345 -12.991 1.370 1.00 0.00 H new ATOM 0 HG21 ILE A 93 9.883 -10.511 0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 93 10.521 -9.461 2.083 1.00 0.00 H new ATOM 0 HG23 ILE A 93 11.619 -10.536 1.186 1.00 0.00 H new ATOM 0 HD11 ILE A 93 10.298 -15.007 2.262 1.00 0.00 H new ATOM 0 HD12 ILE A 93 11.078 -14.081 3.565 1.00 0.00 H new ATOM 0 HD13 ILE A 93 9.311 -14.023 3.368 1.00 0.00 H new ATOM 1403 N ILE A 94 10.888 -9.285 4.744 1.00 0.00 N ATOM 1404 CA ILE A 94 11.099 -7.872 5.029 1.00 0.00 C ATOM 1405 C ILE A 94 12.472 -7.644 5.638 1.00 0.00 C ATOM 1406 O ILE A 94 13.235 -6.805 5.174 1.00 0.00 O ATOM 1407 CB ILE A 94 10.030 -7.308 5.986 1.00 0.00 C ATOM 1408 CG1 ILE A 94 8.660 -7.358 5.319 1.00 0.00 C ATOM 1409 CG2 ILE A 94 10.376 -5.879 6.398 1.00 0.00 C ATOM 1410 CD1 ILE A 94 7.568 -6.758 6.165 1.00 0.00 C ATOM 0 H ILE A 94 10.030 -9.672 5.137 1.00 0.00 H new ATOM 0 HA ILE A 94 11.023 -7.348 4.076 1.00 0.00 H new ATOM 0 HB ILE A 94 10.006 -7.922 6.887 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.706 -6.828 4.367 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.409 -8.395 5.095 1.00 0.00 H new ATOM 0 HG21 ILE A 94 9.609 -5.499 7.073 1.00 0.00 H new ATOM 0 HG22 ILE A 94 11.342 -5.870 6.904 1.00 0.00 H new ATOM 0 HG23 ILE A 94 10.424 -5.246 5.512 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.618 -6.824 5.634 1.00 0.00 H new ATOM 0 HD12 ILE A 94 7.496 -7.303 7.106 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.798 -5.712 6.368 1.00 0.00 H new ATOM 1422 N HIS A 95 12.801 -8.441 6.644 1.00 0.00 N ATOM 1423 CA HIS A 95 14.039 -8.238 7.386 1.00 0.00 C ATOM 1424 C HIS A 95 15.251 -8.626 6.551 1.00 0.00 C ATOM 1425 O HIS A 95 16.277 -7.948 6.585 1.00 0.00 O ATOM 1426 CB HIS A 95 14.038 -9.044 8.691 1.00 0.00 C ATOM 1427 CG HIS A 95 12.936 -8.684 9.638 1.00 0.00 C ATOM 1428 ND1 HIS A 95 12.588 -9.476 10.706 1.00 0.00 N ATOM 1429 CD2 HIS A 95 12.099 -7.618 9.673 1.00 0.00 C ATOM 1430 CE1 HIS A 95 11.589 -8.920 11.359 1.00 0.00 C ATOM 1431 NE2 HIS A 95 11.271 -7.789 10.756 1.00 0.00 N ATOM 0 H HIS A 95 12.235 -9.227 6.964 1.00 0.00 H new ATOM 0 HA HIS A 95 14.101 -7.176 7.625 1.00 0.00 H new ATOM 0 HB2 HIS A 95 13.961 -10.104 8.449 1.00 0.00 H new ATOM 0 HB3 HIS A 95 14.994 -8.900 9.194 1.00 0.00 H new ATOM 0 HD2 HIS A 95 12.086 -6.790 8.980 1.00 0.00 H new ATOM 0 HE1 HIS A 95 11.110 -9.321 12.240 1.00 0.00 H new ATOM 0 HE2 HIS A 95 10.533 -7.148 11.046 1.00 0.00 H new ATOM 1440 N GLY A 96 15.118 -9.672 5.748 1.00 0.00 N ATOM 1441 CA GLY A 96 16.270 -10.186 5.045 1.00 0.00 C ATOM 1442 C GLY A 96 16.537 -9.443 3.761 1.00 0.00 C ATOM 1443 O GLY A 96 17.678 -9.089 3.469 1.00 0.00 O ATOM 0 H GLY A 96 14.243 -10.167 5.573 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.146 -10.118 5.690 1.00 0.00 H new ATOM 0 HA3 GLY A 96 16.117 -11.243 4.825 1.00 0.00 H new ATOM 1447 N CYS A 97 15.491 -9.185 2.997 1.00 0.00 N ATOM 1448 CA CYS A 97 15.648 -8.512 1.731 1.00 0.00 C ATOM 1449 C CYS A 97 15.982 -7.033 1.938 1.00 0.00 C ATOM 1450 O CYS A 97 16.839 -6.502 1.247 1.00 0.00 O ATOM 1451 CB CYS A 97 14.401 -8.698 0.860 1.00 0.00 C ATOM 1452 SG CYS A 97 13.892 -10.448 0.666 1.00 0.00 S ATOM 0 H CYS A 97 14.530 -9.432 3.234 1.00 0.00 H new ATOM 0 HA CYS A 97 16.487 -8.963 1.201 1.00 0.00 H new ATOM 0 HB2 CYS A 97 13.576 -8.135 1.297 1.00 0.00 H new ATOM 0 HB3 CYS A 97 14.590 -8.273 -0.126 1.00 0.00 H new ATOM 1457 N GLU A 98 15.330 -6.371 2.904 1.00 0.00 N ATOM 1458 CA GLU A 98 15.657 -4.974 3.214 1.00 0.00 C ATOM 1459 C GLU A 98 17.086 -4.855 3.736 1.00 0.00 C ATOM 1460 O GLU A 98 17.804 -3.916 3.388 1.00 0.00 O ATOM 1461 CB GLU A 98 14.680 -4.400 4.246 1.00 0.00 C ATOM 1462 CG GLU A 98 14.863 -2.912 4.508 1.00 0.00 C ATOM 1463 CD GLU A 98 13.961 -2.394 5.613 1.00 0.00 C ATOM 1464 OE1 GLU A 98 12.812 -2.001 5.320 1.00 0.00 O ATOM 1465 OE2 GLU A 98 14.404 -2.364 6.780 1.00 0.00 O ATOM 0 H GLU A 98 14.586 -6.772 3.475 1.00 0.00 H new ATOM 0 HA GLU A 98 15.570 -4.401 2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.660 -4.576 3.903 1.00 0.00 H new ATOM 0 HB3 GLU A 98 14.799 -4.941 5.185 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.902 -2.720 4.774 1.00 0.00 H new ATOM 0 HG3 GLU A 98 14.661 -2.359 3.591 1.00 0.00 H new ATOM 1472 N LYS A 99 17.513 -5.820 4.549 1.00 0.00 N ATOM 1473 CA LYS A 99 18.871 -5.818 5.069 1.00 0.00 C ATOM 1474 C LYS A 99 19.888 -6.047 3.951 1.00 0.00 C ATOM 1475 O LYS A 99 20.981 -5.481 3.967 1.00 0.00 O ATOM 1476 CB LYS A 99 19.023 -6.881 6.161 1.00 0.00 C ATOM 1477 CG LYS A 99 20.451 -7.060 6.642 1.00 0.00 C ATOM 1478 CD LYS A 99 20.522 -7.807 7.964 1.00 0.00 C ATOM 1479 CE LYS A 99 19.938 -9.206 7.867 1.00 0.00 C ATOM 1480 NZ LYS A 99 20.037 -9.927 9.160 1.00 0.00 N ATOM 0 H LYS A 99 16.940 -6.606 4.857 1.00 0.00 H new ATOM 0 HA LYS A 99 19.067 -4.838 5.505 1.00 0.00 H new ATOM 0 HB2 LYS A 99 18.394 -6.611 7.009 1.00 0.00 H new ATOM 0 HB3 LYS A 99 18.654 -7.834 5.782 1.00 0.00 H new ATOM 0 HG2 LYS A 99 21.021 -7.603 5.888 1.00 0.00 H new ATOM 0 HG3 LYS A 99 20.920 -6.083 6.753 1.00 0.00 H new ATOM 0 HD2 LYS A 99 21.561 -7.871 8.287 1.00 0.00 H new ATOM 0 HD3 LYS A 99 19.985 -7.243 8.727 1.00 0.00 H new ATOM 0 HE2 LYS A 99 18.893 -9.145 7.562 1.00 0.00 H new ATOM 0 HE3 LYS A 99 20.463 -9.768 7.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 19.629 -10.878 9.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 21.036 -10.006 9.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 19.515 -9.403 9.891 1.00 0.00 H new ATOM 1494 N SER A 100 19.514 -6.855 2.972 1.00 0.00 N ATOM 1495 CA SER A 100 20.415 -7.192 1.878 1.00 0.00 C ATOM 1496 C SER A 100 20.178 -6.289 0.666 1.00 0.00 C ATOM 1497 O SER A 100 20.779 -6.484 -0.393 1.00 0.00 O ATOM 1498 CB SER A 100 20.220 -8.655 1.482 1.00 0.00 C ATOM 1499 OG SER A 100 20.216 -9.491 2.625 1.00 0.00 O ATOM 0 H SER A 100 18.594 -7.290 2.911 1.00 0.00 H new ATOM 0 HA SER A 100 21.439 -7.038 2.219 1.00 0.00 H new ATOM 0 HB2 SER A 100 19.281 -8.767 0.941 1.00 0.00 H new ATOM 0 HB3 SER A 100 21.017 -8.962 0.805 1.00 0.00 H new ATOM 0 HG SER A 100 19.337 -9.451 3.056 1.00 0.00 H new ATOM 1505 N ALA A 101 19.306 -5.303 0.822 1.00 0.00 N ATOM 1506 CA ALA A 101 18.967 -4.405 -0.272 1.00 0.00 C ATOM 1507 C ALA A 101 20.069 -3.375 -0.485 1.00 0.00 C ATOM 1508 O ALA A 101 20.767 -3.000 0.461 1.00 0.00 O ATOM 1509 CB ALA A 101 17.636 -3.713 -0.003 1.00 0.00 C ATOM 0 H ALA A 101 18.820 -5.105 1.697 1.00 0.00 H new ATOM 0 HA ALA A 101 18.871 -4.997 -1.182 1.00 0.00 H new ATOM 0 HB1 ALA A 101 17.399 -3.046 -0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 101 16.850 -4.462 0.096 1.00 0.00 H new ATOM 0 HB3 ALA A 101 17.706 -3.136 0.919 1.00 0.00 H new ATOM 1515 N PRO A 102 20.251 -2.918 -1.732 1.00 0.00 N ATOM 1516 CA PRO A 102 21.245 -1.898 -2.063 1.00 0.00 C ATOM 1517 C PRO A 102 20.905 -0.565 -1.409 1.00 0.00 C ATOM 1518 O PRO A 102 19.732 -0.211 -1.292 1.00 0.00 O ATOM 1519 CB PRO A 102 21.167 -1.789 -3.595 1.00 0.00 C ATOM 1520 CG PRO A 102 20.444 -3.016 -4.034 1.00 0.00 C ATOM 1521 CD PRO A 102 19.500 -3.351 -2.919 1.00 0.00 C ATOM 0 HA PRO A 102 22.242 -2.158 -1.707 1.00 0.00 H new ATOM 0 HB2 PRO A 102 20.635 -0.888 -3.900 1.00 0.00 H new ATOM 0 HB3 PRO A 102 22.162 -1.737 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 102 19.904 -2.841 -4.965 1.00 0.00 H new ATOM 0 HG3 PRO A 102 21.139 -3.835 -4.218 1.00 0.00 H new ATOM 0 HD2 PRO A 102 18.552 -2.822 -3.016 1.00 0.00 H new ATOM 0 HD3 PRO A 102 19.269 -4.416 -2.888 1.00 0.00 H new ATOM 1529 N PRO A 103 21.926 0.194 -0.984 1.00 0.00 N ATOM 1530 CA PRO A 103 21.747 1.456 -0.255 1.00 0.00 C ATOM 1531 C PRO A 103 21.260 2.604 -1.142 1.00 0.00 C ATOM 1532 O PRO A 103 21.646 3.760 -0.948 1.00 0.00 O ATOM 1533 CB PRO A 103 23.150 1.767 0.289 1.00 0.00 C ATOM 1534 CG PRO A 103 23.971 0.550 0.021 1.00 0.00 C ATOM 1535 CD PRO A 103 23.345 -0.120 -1.163 1.00 0.00 C ATOM 0 HA PRO A 103 20.982 1.357 0.515 1.00 0.00 H new ATOM 0 HB2 PRO A 103 23.575 2.641 -0.204 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.115 1.988 1.356 1.00 0.00 H new ATOM 0 HG2 PRO A 103 25.008 0.817 -0.185 1.00 0.00 H new ATOM 0 HG3 PRO A 103 23.978 -0.114 0.886 1.00 0.00 H new ATOM 0 HD2 PRO A 103 23.733 0.271 -2.104 1.00 0.00 H new ATOM 0 HD3 PRO A 103 23.527 -1.195 -1.165 1.00 0.00 H new ATOM 1543 N ASN A 104 20.416 2.284 -2.109 1.00 0.00 N ATOM 1544 CA ASN A 104 19.786 3.295 -2.940 1.00 0.00 C ATOM 1545 C ASN A 104 18.671 3.944 -2.146 1.00 0.00 C ATOM 1546 O ASN A 104 17.665 3.303 -1.831 1.00 0.00 O ATOM 1547 CB ASN A 104 19.239 2.678 -4.226 1.00 0.00 C ATOM 1548 CG ASN A 104 20.338 2.217 -5.159 1.00 0.00 C ATOM 1549 OD1 ASN A 104 21.402 2.830 -5.241 1.00 0.00 O ATOM 1550 ND2 ASN A 104 20.098 1.119 -5.854 1.00 0.00 N ATOM 0 H ASN A 104 20.151 1.326 -2.338 1.00 0.00 H new ATOM 0 HA ASN A 104 20.524 4.045 -3.224 1.00 0.00 H new ATOM 0 HB2 ASN A 104 18.600 1.831 -3.976 1.00 0.00 H new ATOM 0 HB3 ASN A 104 18.614 3.409 -4.739 1.00 0.00 H new ATOM 0 HD21 ASN A 104 20.808 0.751 -6.487 1.00 0.00 H new ATOM 0 HD22 ASN A 104 19.203 0.640 -5.758 1.00 0.00 H new ATOM 1557 N ASP A 105 18.856 5.208 -1.810 1.00 0.00 N ATOM 1558 CA ASP A 105 17.999 5.865 -0.840 1.00 0.00 C ATOM 1559 C ASP A 105 16.652 6.273 -1.420 1.00 0.00 C ATOM 1560 O ASP A 105 16.525 7.309 -2.077 1.00 0.00 O ATOM 1561 CB ASP A 105 18.686 7.081 -0.227 1.00 0.00 C ATOM 1562 CG ASP A 105 17.866 7.674 0.901 1.00 0.00 C ATOM 1563 OD1 ASP A 105 17.795 7.046 1.978 1.00 0.00 O ATOM 1564 OD2 ASP A 105 17.292 8.769 0.720 1.00 0.00 O ATOM 0 H ASP A 105 19.592 5.800 -2.195 1.00 0.00 H new ATOM 0 HA ASP A 105 17.811 5.127 -0.060 1.00 0.00 H new ATOM 0 HB2 ASP A 105 19.668 6.794 0.148 1.00 0.00 H new ATOM 0 HB3 ASP A 105 18.847 7.836 -0.997 1.00 0.00 H new ATOM 1569 N ASP A 106 15.669 5.423 -1.208 1.00 0.00 N ATOM 1570 CA ASP A 106 14.277 5.796 -1.373 1.00 0.00 C ATOM 1571 C ASP A 106 13.475 5.073 -0.305 1.00 0.00 C ATOM 1572 O ASP A 106 13.207 3.870 -0.419 1.00 0.00 O ATOM 1573 CB ASP A 106 13.758 5.436 -2.771 1.00 0.00 C ATOM 1574 CG ASP A 106 12.360 5.981 -3.054 1.00 0.00 C ATOM 1575 OD1 ASP A 106 11.453 5.796 -2.211 1.00 0.00 O ATOM 1576 OD2 ASP A 106 12.162 6.578 -4.142 1.00 0.00 O ATOM 0 H ASP A 106 15.810 4.456 -0.917 1.00 0.00 H new ATOM 0 HA ASP A 106 14.173 6.876 -1.268 1.00 0.00 H new ATOM 0 HB2 ASP A 106 14.450 5.823 -3.519 1.00 0.00 H new ATOM 0 HB3 ASP A 106 13.747 4.351 -2.879 1.00 0.00 H new ATOM 1581 N LYS A 107 13.146 5.811 0.751 1.00 0.00 N ATOM 1582 CA LYS A 107 12.382 5.275 1.891 1.00 0.00 C ATOM 1583 C LYS A 107 11.223 4.331 1.514 1.00 0.00 C ATOM 1584 O LYS A 107 11.064 3.290 2.147 1.00 0.00 O ATOM 1585 CB LYS A 107 11.867 6.411 2.787 1.00 0.00 C ATOM 1586 CG LYS A 107 11.006 7.448 2.083 1.00 0.00 C ATOM 1587 CD LYS A 107 10.715 8.619 3.005 1.00 0.00 C ATOM 1588 CE LYS A 107 10.217 9.830 2.239 1.00 0.00 C ATOM 1589 NZ LYS A 107 9.995 10.993 3.135 1.00 0.00 N ATOM 0 H LYS A 107 13.397 6.795 0.848 1.00 0.00 H new ATOM 0 HA LYS A 107 13.096 4.658 2.437 1.00 0.00 H new ATOM 0 HB2 LYS A 107 11.290 5.976 3.603 1.00 0.00 H new ATOM 0 HB3 LYS A 107 12.723 6.916 3.235 1.00 0.00 H new ATOM 0 HG2 LYS A 107 11.515 7.802 1.186 1.00 0.00 H new ATOM 0 HG3 LYS A 107 10.070 6.992 1.759 1.00 0.00 H new ATOM 0 HD2 LYS A 107 9.969 8.324 3.743 1.00 0.00 H new ATOM 0 HD3 LYS A 107 11.619 8.883 3.554 1.00 0.00 H new ATOM 0 HE2 LYS A 107 10.941 10.097 1.469 1.00 0.00 H new ATOM 0 HE3 LYS A 107 9.287 9.581 1.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 9.655 11.802 2.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.286 10.747 3.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 10.889 11.247 3.603 1.00 0.00 H new ATOM 1603 N CYS A 108 10.404 4.661 0.517 1.00 0.00 N ATOM 1604 CA CYS A 108 9.280 3.800 0.191 1.00 0.00 C ATOM 1605 C CYS A 108 9.660 2.705 -0.813 1.00 0.00 C ATOM 1606 O CYS A 108 9.035 1.649 -0.834 1.00 0.00 O ATOM 1607 CB CYS A 108 8.116 4.632 -0.344 1.00 0.00 C ATOM 1608 SG CYS A 108 6.484 3.855 -0.128 1.00 0.00 S ATOM 0 H CYS A 108 10.496 5.495 -0.062 1.00 0.00 H new ATOM 0 HA CYS A 108 8.974 3.301 1.111 1.00 0.00 H new ATOM 0 HB2 CYS A 108 8.115 5.600 0.158 1.00 0.00 H new ATOM 0 HB3 CYS A 108 8.278 4.823 -1.405 1.00 0.00 H new ATOM 1613 N MET A 109 10.699 2.928 -1.621 1.00 0.00 N ATOM 1614 CA MET A 109 11.048 1.970 -2.669 1.00 0.00 C ATOM 1615 C MET A 109 11.717 0.729 -2.102 1.00 0.00 C ATOM 1616 O MET A 109 11.650 -0.351 -2.697 1.00 0.00 O ATOM 1617 CB MET A 109 11.951 2.595 -3.726 1.00 0.00 C ATOM 1618 CG MET A 109 11.195 3.416 -4.752 1.00 0.00 C ATOM 1619 SD MET A 109 9.937 2.462 -5.621 1.00 0.00 S ATOM 1620 CE MET A 109 10.943 1.219 -6.431 1.00 0.00 C ATOM 0 H MET A 109 11.303 3.748 -1.571 1.00 0.00 H new ATOM 0 HA MET A 109 10.109 1.676 -3.138 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.688 3.230 -3.235 1.00 0.00 H new ATOM 0 HB3 MET A 109 12.501 1.805 -4.237 1.00 0.00 H new ATOM 0 HG2 MET A 109 10.723 4.264 -4.256 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.901 3.823 -5.476 1.00 0.00 H new ATOM 0 HE1 MET A 109 10.564 1.044 -7.438 1.00 0.00 H new ATOM 0 HE2 MET A 109 11.975 1.566 -6.486 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.902 0.290 -5.862 1.00 0.00 H new ATOM 1630 N LYS A 110 12.362 0.877 -0.957 1.00 0.00 N ATOM 1631 CA LYS A 110 13.007 -0.263 -0.306 1.00 0.00 C ATOM 1632 C LYS A 110 11.973 -1.332 0.018 1.00 0.00 C ATOM 1633 O LYS A 110 12.191 -2.526 -0.183 1.00 0.00 O ATOM 1634 CB LYS A 110 13.756 0.164 0.965 1.00 0.00 C ATOM 1635 CG LYS A 110 12.958 0.982 1.966 1.00 0.00 C ATOM 1636 CD LYS A 110 12.314 0.083 3.009 1.00 0.00 C ATOM 1637 CE LYS A 110 11.664 0.872 4.131 1.00 0.00 C ATOM 1638 NZ LYS A 110 11.051 -0.028 5.143 1.00 0.00 N ATOM 0 H LYS A 110 12.456 1.763 -0.459 1.00 0.00 H new ATOM 0 HA LYS A 110 13.742 -0.675 -0.997 1.00 0.00 H new ATOM 0 HB2 LYS A 110 14.120 -0.733 1.467 1.00 0.00 H new ATOM 0 HB3 LYS A 110 14.632 0.742 0.670 1.00 0.00 H new ATOM 0 HG2 LYS A 110 13.612 1.704 2.456 1.00 0.00 H new ATOM 0 HG3 LYS A 110 12.188 1.551 1.445 1.00 0.00 H new ATOM 0 HD2 LYS A 110 11.564 -0.546 2.529 1.00 0.00 H new ATOM 0 HD3 LYS A 110 13.069 -0.583 3.427 1.00 0.00 H new ATOM 0 HE2 LYS A 110 12.409 1.507 4.610 1.00 0.00 H new ATOM 0 HE3 LYS A 110 10.901 1.532 3.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 11.152 0.393 6.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 10.042 -0.156 4.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 11.530 -0.951 5.122 1.00 0.00 H new ATOM 1652 N THR A 111 10.848 -0.868 0.517 1.00 0.00 N ATOM 1653 CA THR A 111 9.691 -1.688 0.787 1.00 0.00 C ATOM 1654 C THR A 111 9.184 -2.418 -0.471 1.00 0.00 C ATOM 1655 O THR A 111 8.441 -3.397 -0.372 1.00 0.00 O ATOM 1656 CB THR A 111 8.609 -0.784 1.411 1.00 0.00 C ATOM 1657 OG1 THR A 111 8.312 -1.225 2.743 1.00 0.00 O ATOM 1658 CG2 THR A 111 7.323 -0.718 0.582 1.00 0.00 C ATOM 0 H THR A 111 10.711 0.115 0.752 1.00 0.00 H new ATOM 0 HA THR A 111 9.958 -2.481 1.485 1.00 0.00 H new ATOM 0 HB THR A 111 9.019 0.226 1.432 1.00 0.00 H new ATOM 0 HG1 THR A 111 7.625 -0.645 3.134 1.00 0.00 H new ATOM 0 HG21 THR A 111 6.604 -0.066 1.077 1.00 0.00 H new ATOM 0 HG22 THR A 111 7.549 -0.324 -0.409 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.900 -1.718 0.487 1.00 0.00 H new ATOM 1666 N ILE A 112 9.635 -1.995 -1.646 1.00 0.00 N ATOM 1667 CA ILE A 112 9.219 -2.646 -2.871 1.00 0.00 C ATOM 1668 C ILE A 112 10.199 -3.768 -3.171 1.00 0.00 C ATOM 1669 O ILE A 112 9.807 -4.856 -3.596 1.00 0.00 O ATOM 1670 CB ILE A 112 9.127 -1.652 -4.054 1.00 0.00 C ATOM 1671 CG1 ILE A 112 7.709 -1.082 -4.175 1.00 0.00 C ATOM 1672 CG2 ILE A 112 9.537 -2.303 -5.373 1.00 0.00 C ATOM 1673 CD1 ILE A 112 7.253 -0.301 -2.966 1.00 0.00 C ATOM 0 H ILE A 112 10.280 -1.215 -1.771 1.00 0.00 H new ATOM 0 HA ILE A 112 8.216 -3.052 -2.738 1.00 0.00 H new ATOM 0 HB ILE A 112 9.823 -0.840 -3.846 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.663 -0.435 -5.051 1.00 0.00 H new ATOM 0 HG13 ILE A 112 7.013 -1.903 -4.348 1.00 0.00 H new ATOM 0 HG21 ILE A 112 9.459 -1.573 -6.179 1.00 0.00 H new ATOM 0 HG22 ILE A 112 10.566 -2.655 -5.301 1.00 0.00 H new ATOM 0 HG23 ILE A 112 8.879 -3.146 -5.582 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.241 0.068 -3.132 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.264 -0.948 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.924 0.542 -2.803 1.00 0.00 H new ATOM 1685 N ASP A 113 11.477 -3.499 -2.891 1.00 0.00 N ATOM 1686 CA ASP A 113 12.530 -4.491 -3.048 1.00 0.00 C ATOM 1687 C ASP A 113 12.256 -5.704 -2.162 1.00 0.00 C ATOM 1688 O ASP A 113 12.545 -6.831 -2.550 1.00 0.00 O ATOM 1689 CB ASP A 113 13.902 -3.880 -2.722 1.00 0.00 C ATOM 1690 CG ASP A 113 15.059 -4.803 -3.058 1.00 0.00 C ATOM 1691 OD1 ASP A 113 15.373 -5.699 -2.249 1.00 0.00 O ATOM 1692 OD2 ASP A 113 15.671 -4.626 -4.133 1.00 0.00 O ATOM 0 H ASP A 113 11.803 -2.594 -2.552 1.00 0.00 H new ATOM 0 HA ASP A 113 12.542 -4.820 -4.087 1.00 0.00 H new ATOM 0 HB2 ASP A 113 14.018 -2.947 -3.273 1.00 0.00 H new ATOM 0 HB3 ASP A 113 13.940 -3.631 -1.661 1.00 0.00 H new ATOM 1697 N VAL A 114 11.663 -5.482 -0.985 1.00 0.00 N ATOM 1698 CA VAL A 114 11.320 -6.595 -0.111 1.00 0.00 C ATOM 1699 C VAL A 114 10.021 -7.250 -0.563 1.00 0.00 C ATOM 1700 O VAL A 114 9.897 -8.470 -0.563 1.00 0.00 O ATOM 1701 CB VAL A 114 11.186 -6.192 1.372 1.00 0.00 C ATOM 1702 CG1 VAL A 114 12.534 -5.870 1.968 1.00 0.00 C ATOM 1703 CG2 VAL A 114 10.272 -5.017 1.540 1.00 0.00 C ATOM 0 H VAL A 114 11.417 -4.560 -0.625 1.00 0.00 H new ATOM 0 HA VAL A 114 12.150 -7.297 -0.187 1.00 0.00 H new ATOM 0 HB VAL A 114 10.757 -7.045 1.898 1.00 0.00 H new ATOM 0 HG11 VAL A 114 12.412 -5.589 3.014 1.00 0.00 H new ATOM 0 HG12 VAL A 114 13.180 -6.745 1.901 1.00 0.00 H new ATOM 0 HG13 VAL A 114 12.986 -5.043 1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 114 10.200 -4.760 2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 114 10.668 -4.166 0.986 1.00 0.00 H new ATOM 0 HG23 VAL A 114 9.282 -5.269 1.160 1.00 0.00 H new ATOM 1713 N ALA A 115 9.061 -6.436 -0.985 1.00 0.00 N ATOM 1714 CA ALA A 115 7.774 -6.950 -1.428 1.00 0.00 C ATOM 1715 C ALA A 115 7.932 -7.881 -2.624 1.00 0.00 C ATOM 1716 O ALA A 115 7.419 -9.012 -2.634 1.00 0.00 O ATOM 1717 CB ALA A 115 6.857 -5.796 -1.765 1.00 0.00 C ATOM 0 H ALA A 115 9.150 -5.421 -1.029 1.00 0.00 H new ATOM 0 HA ALA A 115 7.334 -7.532 -0.618 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.893 -6.182 -2.097 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.714 -5.175 -0.881 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.302 -5.198 -2.561 1.00 0.00 H new ATOM 1723 N MET A 116 8.667 -7.424 -3.630 1.00 0.00 N ATOM 1724 CA MET A 116 8.894 -8.245 -4.800 1.00 0.00 C ATOM 1725 C MET A 116 9.811 -9.421 -4.454 1.00 0.00 C ATOM 1726 O MET A 116 9.729 -10.478 -5.069 1.00 0.00 O ATOM 1727 CB MET A 116 9.392 -7.419 -6.014 1.00 0.00 C ATOM 1728 CG MET A 116 10.703 -6.652 -5.860 1.00 0.00 C ATOM 1729 SD MET A 116 12.149 -7.721 -5.721 1.00 0.00 S ATOM 1730 CE MET A 116 13.464 -6.520 -5.921 1.00 0.00 C ATOM 0 H MET A 116 9.107 -6.504 -3.656 1.00 0.00 H new ATOM 0 HA MET A 116 7.937 -8.661 -5.115 1.00 0.00 H new ATOM 0 HB2 MET A 116 9.498 -8.097 -6.861 1.00 0.00 H new ATOM 0 HB3 MET A 116 8.613 -6.703 -6.275 1.00 0.00 H new ATOM 0 HG2 MET A 116 10.831 -5.991 -6.717 1.00 0.00 H new ATOM 0 HG3 MET A 116 10.643 -6.019 -4.975 1.00 0.00 H new ATOM 0 HE1 MET A 116 14.098 -6.811 -6.758 1.00 0.00 H new ATOM 0 HE2 MET A 116 13.033 -5.538 -6.116 1.00 0.00 H new ATOM 0 HE3 MET A 116 14.061 -6.480 -5.010 1.00 0.00 H new ATOM 1740 N CYS A 117 10.619 -9.250 -3.414 1.00 0.00 N ATOM 1741 CA CYS A 117 11.510 -10.300 -2.925 1.00 0.00 C ATOM 1742 C CYS A 117 10.703 -11.400 -2.251 1.00 0.00 C ATOM 1743 O CYS A 117 11.125 -12.553 -2.191 1.00 0.00 O ATOM 1744 CB CYS A 117 12.523 -9.679 -1.952 1.00 0.00 C ATOM 1745 SG CYS A 117 13.832 -10.794 -1.342 1.00 0.00 S ATOM 0 H CYS A 117 10.676 -8.380 -2.885 1.00 0.00 H new ATOM 0 HA CYS A 117 12.050 -10.749 -3.759 1.00 0.00 H new ATOM 0 HB2 CYS A 117 12.997 -8.830 -2.445 1.00 0.00 H new ATOM 0 HB3 CYS A 117 11.978 -9.286 -1.093 1.00 0.00 H new ATOM 1750 N PHE A 118 9.511 -11.045 -1.794 1.00 0.00 N ATOM 1751 CA PHE A 118 8.638 -12.002 -1.140 1.00 0.00 C ATOM 1752 C PHE A 118 7.927 -12.856 -2.178 1.00 0.00 C ATOM 1753 O PHE A 118 7.863 -14.079 -2.041 1.00 0.00 O ATOM 1754 CB PHE A 118 7.623 -11.304 -0.219 1.00 0.00 C ATOM 1755 CG PHE A 118 6.568 -12.232 0.318 1.00 0.00 C ATOM 1756 CD1 PHE A 118 6.864 -13.126 1.335 1.00 0.00 C ATOM 1757 CD2 PHE A 118 5.282 -12.215 -0.200 1.00 0.00 C ATOM 1758 CE1 PHE A 118 5.901 -13.986 1.822 1.00 0.00 C ATOM 1759 CE2 PHE A 118 4.313 -13.073 0.284 1.00 0.00 C ATOM 1760 CZ PHE A 118 4.624 -13.959 1.296 1.00 0.00 C ATOM 0 H PHE A 118 9.129 -10.102 -1.865 1.00 0.00 H new ATOM 0 HA PHE A 118 9.254 -12.648 -0.514 1.00 0.00 H new ATOM 0 HB2 PHE A 118 8.155 -10.848 0.616 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.140 -10.496 -0.769 1.00 0.00 H new ATOM 0 HD1 PHE A 118 7.860 -13.150 1.751 1.00 0.00 H new ATOM 0 HD2 PHE A 118 5.035 -11.523 -0.991 1.00 0.00 H new ATOM 0 HE1 PHE A 118 6.145 -14.679 2.613 1.00 0.00 H new ATOM 0 HE2 PHE A 118 3.315 -13.051 -0.128 1.00 0.00 H new ATOM 0 HZ PHE A 118 3.869 -14.631 1.676 1.00 0.00 H new ATOM 1770 N LYS A 119 7.392 -12.224 -3.224 1.00 0.00 N ATOM 1771 CA LYS A 119 6.739 -12.986 -4.280 1.00 0.00 C ATOM 1772 C LYS A 119 7.786 -13.785 -5.064 1.00 0.00 C ATOM 1773 O LYS A 119 7.483 -14.847 -5.599 1.00 0.00 O ATOM 1774 CB LYS A 119 5.904 -12.078 -5.200 1.00 0.00 C ATOM 1775 CG LYS A 119 6.692 -11.431 -6.320 1.00 0.00 C ATOM 1776 CD LYS A 119 6.230 -10.012 -6.587 1.00 0.00 C ATOM 1777 CE LYS A 119 7.151 -9.331 -7.575 1.00 0.00 C ATOM 1778 NZ LYS A 119 6.948 -9.809 -8.967 1.00 0.00 N ATOM 0 H LYS A 119 7.398 -11.213 -3.359 1.00 0.00 H new ATOM 0 HA LYS A 119 6.041 -13.688 -3.824 1.00 0.00 H new ATOM 0 HB2 LYS A 119 5.095 -12.666 -5.633 1.00 0.00 H new ATOM 0 HB3 LYS A 119 5.443 -11.296 -4.597 1.00 0.00 H new ATOM 0 HG2 LYS A 119 7.751 -11.426 -6.063 1.00 0.00 H new ATOM 0 HG3 LYS A 119 6.587 -12.024 -7.228 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.212 -10.022 -6.977 1.00 0.00 H new ATOM 0 HD3 LYS A 119 6.208 -9.449 -5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 119 6.987 -8.254 -7.537 1.00 0.00 H new ATOM 0 HE3 LYS A 119 8.186 -9.506 -7.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 7.603 -9.312 -9.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 7.130 -10.832 -9.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 5.968 -9.619 -9.260 1.00 0.00 H new ATOM 1792 N LYS A 120 9.025 -13.272 -5.122 1.00 0.00 N ATOM 1793 CA LYS A 120 10.147 -14.043 -5.660 1.00 0.00 C ATOM 1794 C LYS A 120 10.347 -15.324 -4.857 1.00 0.00 C ATOM 1795 O LYS A 120 10.413 -16.419 -5.418 1.00 0.00 O ATOM 1796 CB LYS A 120 11.430 -13.211 -5.639 1.00 0.00 C ATOM 1797 CG LYS A 120 12.017 -12.998 -7.021 1.00 0.00 C ATOM 1798 CD LYS A 120 11.003 -12.332 -7.929 1.00 0.00 C ATOM 1799 CE LYS A 120 10.874 -10.848 -7.640 1.00 0.00 C ATOM 1800 NZ LYS A 120 12.034 -10.081 -8.160 1.00 0.00 N ATOM 0 H LYS A 120 9.270 -12.334 -4.805 1.00 0.00 H new ATOM 0 HA LYS A 120 9.915 -14.305 -6.692 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.222 -12.242 -5.185 1.00 0.00 H new ATOM 0 HB3 LYS A 120 12.168 -13.706 -5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 120 12.913 -12.381 -6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 120 12.321 -13.955 -7.445 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.297 -12.475 -8.969 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.033 -12.812 -7.803 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.957 -10.469 -8.090 1.00 0.00 H new ATOM 0 HE3 LYS A 120 10.789 -10.693 -6.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 12.279 -9.325 -7.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 12.848 -10.718 -8.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 11.789 -9.662 -9.080 1.00 0.00 H new ATOM 1814 N GLU A 121 10.426 -15.170 -3.540 1.00 0.00 N ATOM 1815 CA GLU A 121 10.555 -16.297 -2.624 1.00 0.00 C ATOM 1816 C GLU A 121 9.391 -17.295 -2.782 1.00 0.00 C ATOM 1817 O GLU A 121 9.622 -18.481 -3.026 1.00 0.00 O ATOM 1818 CB GLU A 121 10.631 -15.746 -1.193 1.00 0.00 C ATOM 1819 CG GLU A 121 10.620 -16.800 -0.101 1.00 0.00 C ATOM 1820 CD GLU A 121 11.795 -17.756 -0.166 1.00 0.00 C ATOM 1821 OE1 GLU A 121 12.923 -17.337 0.169 1.00 0.00 O ATOM 1822 OE2 GLU A 121 11.596 -18.932 -0.532 1.00 0.00 O ATOM 0 H GLU A 121 10.402 -14.261 -3.078 1.00 0.00 H new ATOM 0 HA GLU A 121 11.465 -16.852 -2.855 1.00 0.00 H new ATOM 0 HB2 GLU A 121 11.540 -15.152 -1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.790 -15.070 -1.034 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.619 -16.305 0.870 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.694 -17.371 -0.168 1.00 0.00 H new ATOM 1829 N ILE A 122 8.147 -16.818 -2.665 1.00 0.00 N ATOM 1830 CA ILE A 122 6.979 -17.673 -2.823 1.00 0.00 C ATOM 1831 C ILE A 122 6.961 -18.352 -4.206 1.00 0.00 C ATOM 1832 O ILE A 122 6.490 -19.484 -4.346 1.00 0.00 O ATOM 1833 CB ILE A 122 5.680 -16.854 -2.565 1.00 0.00 C ATOM 1834 CG1 ILE A 122 4.704 -17.662 -1.709 1.00 0.00 C ATOM 1835 CG2 ILE A 122 5.004 -16.400 -3.858 1.00 0.00 C ATOM 1836 CD1 ILE A 122 3.981 -18.763 -2.456 1.00 0.00 C ATOM 0 H ILE A 122 7.929 -15.843 -2.461 1.00 0.00 H new ATOM 0 HA ILE A 122 7.031 -18.471 -2.083 1.00 0.00 H new ATOM 0 HB ILE A 122 5.973 -15.953 -2.027 1.00 0.00 H new ATOM 0 HG12 ILE A 122 5.250 -18.103 -0.875 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.965 -16.983 -1.283 1.00 0.00 H new ATOM 0 HG21 ILE A 122 4.104 -15.834 -3.619 1.00 0.00 H new ATOM 0 HG22 ILE A 122 5.689 -15.770 -4.425 1.00 0.00 H new ATOM 0 HG23 ILE A 122 4.736 -17.272 -4.454 1.00 0.00 H new ATOM 0 HD11 ILE A 122 3.310 -19.285 -1.774 1.00 0.00 H new ATOM 0 HD12 ILE A 122 3.404 -18.330 -3.273 1.00 0.00 H new ATOM 0 HD13 ILE A 122 4.708 -19.468 -2.859 1.00 0.00 H new ATOM 1848 N HIS A 123 7.488 -17.672 -5.224 1.00 0.00 N ATOM 1849 CA HIS A 123 7.584 -18.261 -6.558 1.00 0.00 C ATOM 1850 C HIS A 123 8.639 -19.363 -6.633 1.00 0.00 C ATOM 1851 O HIS A 123 8.497 -20.297 -7.421 1.00 0.00 O ATOM 1852 CB HIS A 123 7.866 -17.199 -7.618 1.00 0.00 C ATOM 1853 CG HIS A 123 6.625 -16.622 -8.222 1.00 0.00 C ATOM 1854 ND1 HIS A 123 6.458 -16.451 -9.580 1.00 0.00 N ATOM 1855 CD2 HIS A 123 5.490 -16.165 -7.647 1.00 0.00 C ATOM 1856 CE1 HIS A 123 5.280 -15.906 -9.811 1.00 0.00 C ATOM 1857 NE2 HIS A 123 4.673 -15.723 -8.654 1.00 0.00 N ATOM 0 H HIS A 123 7.852 -16.722 -5.152 1.00 0.00 H new ATOM 0 HA HIS A 123 6.613 -18.713 -6.761 1.00 0.00 H new ATOM 0 HB2 HIS A 123 8.452 -16.396 -7.171 1.00 0.00 H new ATOM 0 HB3 HIS A 123 8.476 -17.637 -8.408 1.00 0.00 H new ATOM 0 HD2 HIS A 123 5.268 -16.151 -6.590 1.00 0.00 H new ATOM 0 HE1 HIS A 123 4.880 -15.653 -10.782 1.00 0.00 H new ATOM 0 HE2 HIS A 123 3.745 -15.318 -8.529 1.00 0.00 H new ATOM 1866 N LYS A 124 9.699 -19.263 -5.833 1.00 0.00 N ATOM 1867 CA LYS A 124 10.717 -20.295 -5.815 1.00 0.00 C ATOM 1868 C LYS A 124 10.174 -21.538 -5.126 1.00 0.00 C ATOM 1869 O LYS A 124 10.544 -22.659 -5.465 1.00 0.00 O ATOM 1870 CB LYS A 124 11.979 -19.804 -5.106 1.00 0.00 C ATOM 1871 CG LYS A 124 13.251 -20.522 -5.546 1.00 0.00 C ATOM 1872 CD LYS A 124 13.871 -19.878 -6.784 1.00 0.00 C ATOM 1873 CE LYS A 124 12.979 -19.988 -8.013 1.00 0.00 C ATOM 1874 NZ LYS A 124 12.820 -21.392 -8.479 1.00 0.00 N ATOM 0 H LYS A 124 9.869 -18.484 -5.197 1.00 0.00 H new ATOM 0 HA LYS A 124 10.982 -20.541 -6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 124 12.094 -18.736 -5.288 1.00 0.00 H new ATOM 0 HB3 LYS A 124 11.854 -19.932 -4.031 1.00 0.00 H new ATOM 0 HG2 LYS A 124 13.974 -20.511 -4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 124 13.023 -21.567 -5.756 1.00 0.00 H new ATOM 0 HD2 LYS A 124 14.072 -18.827 -6.579 1.00 0.00 H new ATOM 0 HD3 LYS A 124 14.830 -20.351 -6.993 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.998 -19.571 -7.784 1.00 0.00 H new ATOM 0 HE3 LYS A 124 13.401 -19.387 -8.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 13.189 -21.480 -9.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 13.347 -22.029 -7.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.812 -21.650 -8.467 1.00 0.00 H new ATOM 1888 N LEU A 125 9.308 -21.331 -4.140 1.00 0.00 N ATOM 1889 CA LEU A 125 8.596 -22.441 -3.513 1.00 0.00 C ATOM 1890 C LEU A 125 7.632 -23.094 -4.510 1.00 0.00 C ATOM 1891 O LEU A 125 7.534 -24.318 -4.565 1.00 0.00 O ATOM 1892 CB LEU A 125 7.822 -21.938 -2.291 1.00 0.00 C ATOM 1893 CG LEU A 125 8.671 -21.252 -1.218 1.00 0.00 C ATOM 1894 CD1 LEU A 125 7.781 -20.637 -0.149 1.00 0.00 C ATOM 1895 CD2 LEU A 125 9.639 -22.244 -0.592 1.00 0.00 C ATOM 0 H LEU A 125 9.082 -20.412 -3.759 1.00 0.00 H new ATOM 0 HA LEU A 125 9.324 -23.187 -3.196 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.057 -21.239 -2.628 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.304 -22.782 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 125 9.247 -20.456 -1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 125 8.401 -20.153 0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.122 -19.898 -0.605 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.182 -21.418 0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.235 -21.740 0.169 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.079 -23.059 -0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 125 10.298 -22.645 -1.362 1.00 0.00 H new ATOM 1907 N ASN A 126 6.965 -22.254 -5.316 1.00 0.00 N ATOM 1908 CA ASN A 126 6.117 -22.675 -6.439 1.00 0.00 C ATOM 1909 C ASN A 126 5.108 -23.766 -6.073 1.00 0.00 C ATOM 1910 O ASN A 126 3.955 -23.473 -5.753 1.00 0.00 O ATOM 1911 CB ASN A 126 6.973 -23.135 -7.623 1.00 0.00 C ATOM 1912 CG ASN A 126 6.145 -23.362 -8.875 1.00 0.00 C ATOM 1913 OD1 ASN A 126 5.123 -22.708 -9.083 1.00 0.00 O ATOM 1914 ND2 ASN A 126 6.576 -24.289 -9.715 1.00 0.00 N ATOM 0 H ASN A 126 7.002 -21.241 -5.202 1.00 0.00 H new ATOM 0 HA ASN A 126 5.539 -21.794 -6.719 1.00 0.00 H new ATOM 0 HB2 ASN A 126 7.740 -22.388 -7.827 1.00 0.00 H new ATOM 0 HB3 ASN A 126 7.490 -24.058 -7.359 1.00 0.00 H new ATOM 0 HD21 ASN A 126 6.056 -24.483 -10.571 1.00 0.00 H new ATOM 0 HD22 ASN A 126 7.428 -24.810 -9.507 1.00 0.00 H new ATOM 1921 N TRP A 127 5.548 -25.018 -6.123 1.00 0.00 N ATOM 1922 CA TRP A 127 4.668 -26.157 -5.923 1.00 0.00 C ATOM 1923 C TRP A 127 4.356 -26.375 -4.445 1.00 0.00 C ATOM 1924 O TRP A 127 5.162 -26.924 -3.689 1.00 0.00 O ATOM 1925 CB TRP A 127 5.276 -27.422 -6.546 1.00 0.00 C ATOM 1926 CG TRP A 127 6.778 -27.439 -6.538 1.00 0.00 C ATOM 1927 CD1 TRP A 127 7.596 -27.508 -5.448 1.00 0.00 C ATOM 1928 CD2 TRP A 127 7.638 -27.393 -7.683 1.00 0.00 C ATOM 1929 NE1 TRP A 127 8.910 -27.489 -5.844 1.00 0.00 N ATOM 1930 CE2 TRP A 127 8.963 -27.425 -7.211 1.00 0.00 C ATOM 1931 CE3 TRP A 127 7.418 -27.328 -9.061 1.00 0.00 C ATOM 1932 CZ2 TRP A 127 10.061 -27.391 -8.065 1.00 0.00 C ATOM 1933 CZ3 TRP A 127 8.508 -27.294 -9.910 1.00 0.00 C ATOM 1934 CH2 TRP A 127 9.815 -27.326 -9.409 1.00 0.00 C ATOM 0 H TRP A 127 6.520 -25.269 -6.303 1.00 0.00 H new ATOM 0 HA TRP A 127 3.725 -25.941 -6.426 1.00 0.00 H new ATOM 0 HB2 TRP A 127 4.909 -28.295 -6.005 1.00 0.00 H new ATOM 0 HB3 TRP A 127 4.926 -27.514 -7.574 1.00 0.00 H new ATOM 0 HD1 TRP A 127 7.259 -27.569 -4.424 1.00 0.00 H new ATOM 0 HE1 TRP A 127 9.717 -27.518 -5.221 1.00 0.00 H new ATOM 0 HE3 TRP A 127 6.413 -27.305 -9.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 11.070 -27.415 -7.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 8.349 -27.242 -10.977 1.00 0.00 H new ATOM 0 HH2 TRP A 127 10.646 -27.299 -10.098 1.00 0.00 H new ATOM 1945 N VAL A 128 3.184 -25.915 -4.041 1.00 0.00 N ATOM 1946 CA VAL A 128 2.696 -26.127 -2.690 1.00 0.00 C ATOM 1947 C VAL A 128 1.220 -26.549 -2.720 1.00 0.00 C ATOM 1948 O VAL A 128 0.328 -25.740 -2.975 1.00 0.00 O ATOM 1949 CB VAL A 128 2.899 -24.867 -1.804 1.00 0.00 C ATOM 1950 CG1 VAL A 128 2.298 -23.624 -2.449 1.00 0.00 C ATOM 1951 CG2 VAL A 128 2.322 -25.084 -0.411 1.00 0.00 C ATOM 0 H VAL A 128 2.547 -25.387 -4.637 1.00 0.00 H new ATOM 0 HA VAL A 128 3.279 -26.932 -2.242 1.00 0.00 H new ATOM 0 HB VAL A 128 3.973 -24.703 -1.710 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.460 -22.763 -1.800 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.776 -23.447 -3.413 1.00 0.00 H new ATOM 0 HG13 VAL A 128 1.228 -23.772 -2.596 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.476 -24.188 0.190 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.254 -25.290 -0.487 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.822 -25.929 0.062 1.00 0.00 H new ATOM 1961 N PRO A 129 0.959 -27.847 -2.513 1.00 0.00 N ATOM 1962 CA PRO A 129 -0.397 -28.399 -2.519 1.00 0.00 C ATOM 1963 C PRO A 129 -1.168 -28.054 -1.249 1.00 0.00 C ATOM 1964 O PRO A 129 -0.625 -28.111 -0.141 1.00 0.00 O ATOM 1965 CB PRO A 129 -0.179 -29.919 -2.611 1.00 0.00 C ATOM 1966 CG PRO A 129 1.287 -30.109 -2.832 1.00 0.00 C ATOM 1967 CD PRO A 129 1.956 -28.889 -2.273 1.00 0.00 C ATOM 0 HA PRO A 129 -0.990 -27.993 -3.338 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -0.504 -30.416 -1.697 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -0.756 -30.348 -3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 129 1.642 -31.011 -2.333 1.00 0.00 H new ATOM 0 HG3 PRO A 129 1.509 -30.223 -3.893 1.00 0.00 H new ATOM 0 HD2 PRO A 129 2.181 -28.999 -1.212 1.00 0.00 H new ATOM 0 HD3 PRO A 129 2.898 -28.674 -2.778 1.00 0.00 H new ATOM 1975 N ASN A 130 -2.432 -27.700 -1.413 1.00 0.00 N ATOM 1976 CA ASN A 130 -3.283 -27.355 -0.284 1.00 0.00 C ATOM 1977 C ASN A 130 -3.997 -28.602 0.234 1.00 0.00 C ATOM 1978 O ASN A 130 -4.237 -29.549 -0.520 1.00 0.00 O ATOM 1979 CB ASN A 130 -4.298 -26.272 -0.680 1.00 0.00 C ATOM 1980 CG ASN A 130 -5.456 -26.808 -1.503 1.00 0.00 C ATOM 1981 OD1 ASN A 130 -6.509 -27.138 -0.965 1.00 0.00 O ATOM 1982 ND2 ASN A 130 -5.268 -26.910 -2.809 1.00 0.00 N ATOM 0 H ASN A 130 -2.894 -27.644 -2.321 1.00 0.00 H new ATOM 0 HA ASN A 130 -2.658 -26.954 0.514 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -4.689 -25.803 0.223 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -3.787 -25.495 -1.248 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -6.012 -27.273 -3.405 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -4.379 -26.626 -3.220 1.00 0.00 H new ATOM 1989 N MET A 131 -4.316 -28.606 1.522 1.00 0.00 N ATOM 1990 CA MET A 131 -4.960 -29.756 2.154 1.00 0.00 C ATOM 1991 C MET A 131 -6.475 -29.702 1.993 1.00 0.00 C ATOM 1992 O MET A 131 -7.172 -30.663 2.324 1.00 0.00 O ATOM 1993 CB MET A 131 -4.605 -29.826 3.647 1.00 0.00 C ATOM 1994 CG MET A 131 -5.183 -28.693 4.492 1.00 0.00 C ATOM 1995 SD MET A 131 -4.553 -27.063 4.031 1.00 0.00 S ATOM 1996 CE MET A 131 -5.314 -26.035 5.286 1.00 0.00 C ATOM 0 H MET A 131 -4.140 -27.824 2.153 1.00 0.00 H new ATOM 0 HA MET A 131 -4.589 -30.651 1.654 1.00 0.00 H new ATOM 0 HB2 MET A 131 -4.958 -30.776 4.047 1.00 0.00 H new ATOM 0 HB3 MET A 131 -3.520 -29.821 3.750 1.00 0.00 H new ATOM 0 HG2 MET A 131 -6.269 -28.695 4.396 1.00 0.00 H new ATOM 0 HG3 MET A 131 -4.955 -28.879 5.542 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.373 -25.007 4.928 1.00 0.00 H new ATOM 0 HE2 MET A 131 -6.318 -26.403 5.499 1.00 0.00 H new ATOM 0 HE3 MET A 131 -4.715 -26.068 6.196 1.00 0.00 H new ATOM 2006 N ASP A 132 -6.960 -28.580 1.467 1.00 0.00 N ATOM 2007 CA ASP A 132 -8.394 -28.316 1.325 1.00 0.00 C ATOM 2008 C ASP A 132 -9.068 -28.142 2.678 1.00 0.00 C ATOM 2009 O ASP A 132 -9.115 -29.062 3.496 1.00 0.00 O ATOM 2010 CB ASP A 132 -9.108 -29.406 0.516 1.00 0.00 C ATOM 2011 CG ASP A 132 -9.207 -29.058 -0.955 1.00 0.00 C ATOM 2012 OD1 ASP A 132 -9.980 -28.136 -1.298 1.00 0.00 O ATOM 2013 OD2 ASP A 132 -8.525 -29.707 -1.778 1.00 0.00 O ATOM 0 H ASP A 132 -6.368 -27.823 1.125 1.00 0.00 H new ATOM 0 HA ASP A 132 -8.479 -27.380 0.772 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -8.573 -30.349 0.629 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -10.109 -29.558 0.919 1.00 0.00 H new ATOM 2018 N LEU A 133 -9.611 -26.955 2.897 1.00 0.00 N ATOM 2019 CA LEU A 133 -10.247 -26.628 4.165 1.00 0.00 C ATOM 2020 C LEU A 133 -11.701 -27.070 4.145 1.00 0.00 C ATOM 2021 O LEU A 133 -12.615 -26.243 4.169 1.00 0.00 O ATOM 2022 CB LEU A 133 -10.164 -25.122 4.469 1.00 0.00 C ATOM 2023 CG LEU A 133 -8.761 -24.559 4.739 1.00 0.00 C ATOM 2024 CD1 LEU A 133 -7.962 -24.433 3.449 1.00 0.00 C ATOM 2025 CD2 LEU A 133 -8.861 -23.209 5.438 1.00 0.00 C ATOM 0 H LEU A 133 -9.624 -26.200 2.212 1.00 0.00 H new ATOM 0 HA LEU A 133 -9.713 -27.159 4.953 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -10.595 -24.579 3.628 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -10.789 -24.913 5.337 1.00 0.00 H new ATOM 0 HG LEU A 133 -8.235 -25.256 5.392 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -6.973 -24.032 3.671 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -7.860 -25.415 2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -8.480 -23.762 2.764 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -7.860 -22.820 5.624 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -9.409 -22.511 4.805 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -9.386 -23.328 6.386 1.00 0.00 H new ATOM 2037 N VAL A 134 -11.907 -28.375 4.073 1.00 0.00 N ATOM 2038 CA VAL A 134 -13.247 -28.937 4.031 1.00 0.00 C ATOM 2039 C VAL A 134 -13.894 -28.910 5.414 1.00 0.00 C ATOM 2040 O VAL A 134 -13.509 -29.652 6.322 1.00 0.00 O ATOM 2041 CB VAL A 134 -13.249 -30.377 3.461 1.00 0.00 C ATOM 2042 CG1 VAL A 134 -12.977 -30.351 1.964 1.00 0.00 C ATOM 2043 CG2 VAL A 134 -12.219 -31.250 4.163 1.00 0.00 C ATOM 0 H VAL A 134 -11.159 -29.068 4.042 1.00 0.00 H new ATOM 0 HA VAL A 134 -13.836 -28.313 3.359 1.00 0.00 H new ATOM 0 HB VAL A 134 -14.235 -30.806 3.639 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -12.981 -31.369 1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -13.751 -29.769 1.464 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -12.004 -29.896 1.779 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -12.245 -32.254 3.741 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -11.226 -30.824 4.024 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -12.448 -31.298 5.228 1.00 0.00 H new ATOM 2053 N ILE A 135 -14.861 -28.025 5.577 1.00 0.00 N ATOM 2054 CA ILE A 135 -15.564 -27.889 6.830 1.00 0.00 C ATOM 2055 C ILE A 135 -17.042 -28.209 6.630 1.00 0.00 C ATOM 2056 O ILE A 135 -17.726 -27.590 5.812 1.00 0.00 O ATOM 2057 CB ILE A 135 -15.346 -26.472 7.442 1.00 0.00 C ATOM 2058 CG1 ILE A 135 -16.314 -26.191 8.606 1.00 0.00 C ATOM 2059 CG2 ILE A 135 -15.454 -25.391 6.371 1.00 0.00 C ATOM 2060 CD1 ILE A 135 -17.627 -25.564 8.183 1.00 0.00 C ATOM 0 H ILE A 135 -15.176 -27.386 4.847 1.00 0.00 H new ATOM 0 HA ILE A 135 -15.160 -28.604 7.547 1.00 0.00 H new ATOM 0 HB ILE A 135 -14.335 -26.450 7.850 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -16.521 -27.127 9.125 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -15.823 -25.531 9.321 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -15.298 -24.412 6.825 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -14.697 -25.561 5.605 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -16.444 -25.427 5.917 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -18.251 -25.399 9.061 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -17.433 -24.611 7.691 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -18.143 -26.231 7.492 1.00 0.00 H new ATOM 2072 N GLY A 136 -17.514 -29.215 7.344 1.00 0.00 N ATOM 2073 CA GLY A 136 -18.906 -29.594 7.263 1.00 0.00 C ATOM 2074 C GLY A 136 -19.716 -28.977 8.380 1.00 0.00 C ATOM 2075 O GLY A 136 -19.735 -29.492 9.498 1.00 0.00 O ATOM 0 H GLY A 136 -16.954 -29.780 7.983 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -19.314 -29.281 6.302 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -18.991 -30.680 7.308 1.00 0.00 H new ATOM 2079 N GLU A 137 -20.362 -27.858 8.090 1.00 0.00 N ATOM 2080 CA GLU A 137 -21.181 -27.171 9.074 1.00 0.00 C ATOM 2081 C GLU A 137 -22.494 -27.919 9.270 1.00 0.00 C ATOM 2082 O GLU A 137 -23.438 -27.744 8.500 1.00 0.00 O ATOM 2083 CB GLU A 137 -21.452 -25.735 8.621 1.00 0.00 C ATOM 2084 CG GLU A 137 -22.257 -24.911 9.611 1.00 0.00 C ATOM 2085 CD GLU A 137 -22.747 -23.614 9.006 1.00 0.00 C ATOM 2086 OE1 GLU A 137 -22.017 -22.602 9.073 1.00 0.00 O ATOM 2087 OE2 GLU A 137 -23.860 -23.607 8.441 1.00 0.00 O ATOM 0 H GLU A 137 -20.334 -27.405 7.176 1.00 0.00 H new ATOM 0 HA GLU A 137 -20.647 -27.143 10.024 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -20.499 -25.237 8.441 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -21.983 -25.760 7.670 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -23.110 -25.494 9.958 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -21.643 -24.694 10.485 1.00 0.00 H new ATOM 2094 N VAL A 138 -22.541 -28.776 10.277 1.00 0.00 N ATOM 2095 CA VAL A 138 -23.727 -29.572 10.535 1.00 0.00 C ATOM 2096 C VAL A 138 -24.769 -28.784 11.327 1.00 0.00 C ATOM 2097 O VAL A 138 -24.697 -28.671 12.551 1.00 0.00 O ATOM 2098 CB VAL A 138 -23.391 -30.898 11.260 1.00 0.00 C ATOM 2099 CG1 VAL A 138 -22.737 -31.874 10.295 1.00 0.00 C ATOM 2100 CG2 VAL A 138 -22.480 -30.658 12.457 1.00 0.00 C ATOM 0 H VAL A 138 -21.772 -28.937 10.928 1.00 0.00 H new ATOM 0 HA VAL A 138 -24.150 -29.822 9.562 1.00 0.00 H new ATOM 0 HB VAL A 138 -24.325 -31.326 11.625 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -22.506 -32.802 10.817 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -23.419 -32.082 9.470 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -21.817 -31.439 9.905 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -22.262 -31.608 12.945 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -21.549 -30.201 12.120 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -22.976 -29.992 13.164 1.00 0.00 H new ATOM 2110 N LEU A 139 -25.724 -28.214 10.610 1.00 0.00 N ATOM 2111 CA LEU A 139 -26.821 -27.498 11.236 1.00 0.00 C ATOM 2112 C LEU A 139 -28.004 -28.448 11.379 1.00 0.00 C ATOM 2113 O LEU A 139 -28.687 -28.753 10.401 1.00 0.00 O ATOM 2114 CB LEU A 139 -27.196 -26.265 10.393 1.00 0.00 C ATOM 2115 CG LEU A 139 -27.991 -25.159 11.110 1.00 0.00 C ATOM 2116 CD1 LEU A 139 -29.412 -25.602 11.433 1.00 0.00 C ATOM 2117 CD2 LEU A 139 -27.267 -24.719 12.374 1.00 0.00 C ATOM 0 H LEU A 139 -25.760 -28.234 9.591 1.00 0.00 H new ATOM 0 HA LEU A 139 -26.526 -27.145 12.224 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -26.278 -25.827 10.002 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -27.778 -26.602 9.535 1.00 0.00 H new ATOM 0 HG LEU A 139 -28.061 -24.310 10.430 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -29.939 -24.793 11.938 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -29.933 -25.854 10.510 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -29.382 -26.477 12.083 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -27.842 -23.937 12.869 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -27.159 -25.570 13.046 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -26.281 -24.335 12.113 1.00 0.00 H new ATOM 2129 N ALA A 140 -28.222 -28.940 12.588 1.00 0.00 N ATOM 2130 CA ALA A 140 -29.282 -29.906 12.833 1.00 0.00 C ATOM 2131 C ALA A 140 -30.502 -29.230 13.442 1.00 0.00 C ATOM 2132 O ALA A 140 -30.490 -28.829 14.607 1.00 0.00 O ATOM 2133 CB ALA A 140 -28.779 -31.021 13.734 1.00 0.00 C ATOM 0 H ALA A 140 -27.680 -28.687 13.414 1.00 0.00 H new ATOM 0 HA ALA A 140 -29.581 -30.339 11.878 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -29.582 -31.737 13.910 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -27.941 -31.526 13.254 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -28.453 -30.601 14.686 1.00 0.00 H new ATOM 2139 N GLU A 141 -31.544 -29.094 12.640 1.00 0.00 N ATOM 2140 CA GLU A 141 -32.775 -28.459 13.075 1.00 0.00 C ATOM 2141 C GLU A 141 -33.587 -29.411 13.947 1.00 0.00 C ATOM 2142 O GLU A 141 -33.530 -30.627 13.756 1.00 0.00 O ATOM 2143 CB GLU A 141 -33.591 -28.031 11.853 1.00 0.00 C ATOM 2144 CG GLU A 141 -34.837 -27.231 12.190 1.00 0.00 C ATOM 2145 CD GLU A 141 -35.590 -26.799 10.952 1.00 0.00 C ATOM 2146 OE1 GLU A 141 -35.140 -25.842 10.285 1.00 0.00 O ATOM 2147 OE2 GLU A 141 -36.633 -27.408 10.634 1.00 0.00 O ATOM 0 H GLU A 141 -31.560 -29.419 11.673 1.00 0.00 H new ATOM 0 HA GLU A 141 -32.530 -27.578 13.668 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -32.957 -27.436 11.196 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -33.883 -28.920 11.295 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -35.492 -27.831 12.821 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -34.556 -26.351 12.768 1.00 0.00 H new ATOM 2154 N VAL A 142 -34.311 -28.829 14.909 1.00 0.00 N ATOM 2155 CA VAL A 142 -35.203 -29.549 15.825 1.00 0.00 C ATOM 2156 C VAL A 142 -34.566 -30.835 16.377 1.00 0.00 C ATOM 2157 O VAL A 142 -34.822 -31.940 15.857 1.00 0.00 O ATOM 2158 CB VAL A 142 -36.614 -29.808 15.207 1.00 0.00 C ATOM 2159 CG1 VAL A 142 -36.567 -30.675 13.952 1.00 0.00 C ATOM 2160 CG2 VAL A 142 -37.551 -30.408 16.243 1.00 0.00 C ATOM 2161 OXT VAL A 142 -33.790 -30.719 17.346 1.00 0.00 O ATOM 0 H VAL A 142 -34.293 -27.823 15.076 1.00 0.00 H new ATOM 0 HA VAL A 142 -35.356 -28.889 16.678 1.00 0.00 H new ATOM 0 HB VAL A 142 -37.001 -28.837 14.897 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -37.578 -30.818 13.571 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -35.959 -30.183 13.193 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -36.130 -31.644 14.195 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -38.528 -30.581 15.793 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -37.143 -31.354 16.598 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -37.655 -29.720 17.082 1.00 0.00 H new TER 2171 VAL A 142