USER MOD reduce.3.24.130724 H: found=0, std=0, add=947, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 947 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 Single : A 1 MET CE :methyl -177:sc=-0.00383 (180deg=-0.00602) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.0897 (180deg=0) USER MOD Single : A 6 SER OG : rot -106:sc= 1.12 USER MOD Single : A 8 SER OG : rot -91:sc= 1.67 USER MOD Single : A 12 LYS NZ :NH3+ 173:sc= 2.5 (180deg=2.42) USER MOD Single : A 14 LYS NZ :NH3+ 164:sc= 1.26 (180deg=1.07) USER MOD Single : A 19 SER OG : rot 84:sc= 1.21 USER MOD Single : A 20 ASN : amide:sc= -4.67! C(o=-4.7!,f=-5.4!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.169 K(o=-0.17,f=-0.85) USER MOD Single : A 23 TYR OH : rot 67:sc= 1.24 USER MOD Single : A 24 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.972) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.185 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.122 USER MOD Single : A 33 SER OG : rot 88:sc= 1.26 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 88:sc= 1.1 USER MOD Single : A 44 SER OG : rot 150:sc= -0.0313 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 HIS : no HE2:sc= 1.22 K(o=1.2,f=-4.7!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0354) USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= -1.86 K(o=-1.9,f=-7.2!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 74 MET CE :methyl 133:sc= -0.961 (180deg=-3.42!) USER MOD Single : A 80 ASN : amide:sc= 0.00602 X(o=0.006,f=0) USER MOD Single : A 88 LYS NZ :NH3+ -160:sc= 1.25 (180deg=1.02) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 LYS NZ :NH3+ -164:sc= -0.0845 (180deg=-0.47) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.0331 K(o=-0.033,f=-0.97) USER MOD Single : A 110 SER OG : rot 76:sc= 1.23 USER MOD Single : A 111 SER OG : rot 21:sc= 0.254 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 115 HIS : no HD1:sc= -0.353 X(o=-0.35,f=-0.019) USER MOD Single : A 116 HIS : no HD1:sc=-0.00974 X(o=-0.0097,f=0) USER MOD Single : A 117 HIS : no HE2:sc= 0.773 K(o=0.77,f=-5.5!) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HE2:sc=-0.00596 K(o=-0.006,f=-0.58) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.922 -11.092 -10.335 1.00 0.00 N ATOM 2 CA MET A 1 0.668 -11.277 -8.907 1.00 0.00 C ATOM 3 C MET A 1 -0.510 -10.414 -8.511 1.00 0.00 C ATOM 4 O MET A 1 -0.709 -9.324 -9.085 1.00 0.00 O ATOM 5 CB MET A 1 1.912 -10.895 -8.075 1.00 0.00 C ATOM 6 CG MET A 1 1.781 -11.189 -6.588 1.00 0.00 C ATOM 7 SD MET A 1 3.249 -10.754 -5.632 1.00 0.00 S ATOM 8 CE MET A 1 2.756 -11.370 -4.018 1.00 0.00 C ATOM 0 H1 MET A 1 1.948 -11.074 -10.506 1.00 0.00 H new ATOM 0 H2 MET A 1 0.496 -11.877 -10.868 1.00 0.00 H new ATOM 0 H3 MET A 1 0.503 -10.193 -10.649 1.00 0.00 H new ATOM 0 HA MET A 1 0.445 -12.326 -8.711 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.776 -11.433 -8.466 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.112 -9.832 -8.208 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.925 -10.642 -6.192 1.00 0.00 H new ATOM 0 HG3 MET A 1 1.571 -12.250 -6.453 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.530 -11.135 -3.287 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.820 -10.899 -3.719 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.619 -12.450 -4.067 1.00 0.00 H new ATOM 20 N PHE A 2 -1.285 -10.875 -7.556 1.00 0.00 N ATOM 21 CA PHE A 2 -2.433 -10.141 -7.102 1.00 0.00 C ATOM 22 C PHE A 2 -2.037 -9.203 -5.968 1.00 0.00 C ATOM 23 O PHE A 2 -1.027 -9.430 -5.272 1.00 0.00 O ATOM 24 CB PHE A 2 -3.543 -11.099 -6.626 1.00 0.00 C ATOM 25 CG PHE A 2 -4.072 -12.036 -7.686 1.00 0.00 C ATOM 26 CD1 PHE A 2 -4.970 -11.587 -8.637 1.00 0.00 C ATOM 27 CD2 PHE A 2 -3.667 -13.365 -7.730 1.00 0.00 C ATOM 28 CE1 PHE A 2 -5.459 -12.436 -9.610 1.00 0.00 C ATOM 29 CE2 PHE A 2 -4.152 -14.220 -8.702 1.00 0.00 C ATOM 30 CZ PHE A 2 -5.049 -13.755 -9.643 1.00 0.00 C ATOM 0 H PHE A 2 -1.135 -11.763 -7.078 1.00 0.00 H new ATOM 0 HA PHE A 2 -2.817 -9.555 -7.937 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -3.159 -11.692 -5.796 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -4.372 -10.507 -6.238 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -5.294 -10.557 -8.618 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -2.965 -13.734 -6.996 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -6.161 -12.069 -10.344 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -3.830 -15.251 -8.725 1.00 0.00 H new ATOM 0 HZ PHE A 2 -5.429 -14.421 -10.403 1.00 0.00 H new ATOM 40 N ALA A 3 -2.790 -8.153 -5.806 1.00 0.00 N ATOM 41 CA ALA A 3 -2.602 -7.222 -4.725 1.00 0.00 C ATOM 42 C ALA A 3 -3.952 -6.913 -4.119 1.00 0.00 C ATOM 43 O ALA A 3 -4.776 -6.262 -4.736 1.00 0.00 O ATOM 44 CB ALA A 3 -1.924 -5.950 -5.214 1.00 0.00 C ATOM 0 H ALA A 3 -3.562 -7.914 -6.428 1.00 0.00 H new ATOM 0 HA ALA A 3 -1.952 -7.664 -3.970 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -1.793 -5.263 -4.378 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -0.950 -6.196 -5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -2.542 -5.479 -5.978 1.00 0.00 H new ATOM 50 N VAL A 4 -4.171 -7.374 -2.930 1.00 0.00 N ATOM 51 CA VAL A 4 -5.445 -7.236 -2.281 1.00 0.00 C ATOM 52 C VAL A 4 -5.440 -5.968 -1.463 1.00 0.00 C ATOM 53 O VAL A 4 -4.508 -5.709 -0.704 1.00 0.00 O ATOM 54 CB VAL A 4 -5.755 -8.453 -1.358 1.00 0.00 C ATOM 55 CG1 VAL A 4 -7.153 -8.348 -0.749 1.00 0.00 C ATOM 56 CG2 VAL A 4 -5.600 -9.766 -2.114 1.00 0.00 C ATOM 0 H VAL A 4 -3.469 -7.861 -2.373 1.00 0.00 H new ATOM 0 HA VAL A 4 -6.220 -7.195 -3.046 1.00 0.00 H new ATOM 0 HB VAL A 4 -5.031 -8.438 -0.544 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -7.338 -9.212 -0.111 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.224 -7.437 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -7.896 -8.320 -1.546 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -5.822 -10.599 -1.447 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -6.290 -9.784 -2.958 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -4.577 -9.857 -2.479 1.00 0.00 H new ATOM 66 N ILE A 5 -6.439 -5.177 -1.652 1.00 0.00 N ATOM 67 CA ILE A 5 -6.574 -3.942 -0.960 1.00 0.00 C ATOM 68 C ILE A 5 -7.410 -4.168 0.284 1.00 0.00 C ATOM 69 O ILE A 5 -8.495 -4.759 0.218 1.00 0.00 O ATOM 70 CB ILE A 5 -7.254 -2.884 -1.857 1.00 0.00 C ATOM 71 CG1 ILE A 5 -6.470 -2.732 -3.176 1.00 0.00 C ATOM 72 CG2 ILE A 5 -7.327 -1.549 -1.122 1.00 0.00 C ATOM 73 CD1 ILE A 5 -7.127 -1.820 -4.189 1.00 0.00 C ATOM 0 H ILE A 5 -7.199 -5.374 -2.304 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.584 -3.575 -0.688 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.268 -3.209 -2.090 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -5.475 -2.349 -2.951 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -6.339 -3.718 -3.623 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.808 -0.808 -1.761 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.906 -1.669 -0.206 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.320 -1.215 -0.873 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -6.510 -1.769 -5.086 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -8.111 -2.211 -4.447 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.233 -0.822 -3.765 1.00 0.00 H new ATOM 85 N SER A 6 -6.905 -3.746 1.395 1.00 0.00 N ATOM 86 CA SER A 6 -7.611 -3.871 2.619 1.00 0.00 C ATOM 87 C SER A 6 -8.394 -2.569 2.842 1.00 0.00 C ATOM 88 O SER A 6 -7.887 -1.491 2.527 1.00 0.00 O ATOM 89 CB SER A 6 -6.616 -4.127 3.754 1.00 0.00 C ATOM 90 OG SER A 6 -7.254 -4.641 4.908 1.00 0.00 O ATOM 0 H SER A 6 -5.989 -3.304 1.476 1.00 0.00 H new ATOM 0 HA SER A 6 -8.307 -4.710 2.593 1.00 0.00 H new ATOM 0 HB2 SER A 6 -5.854 -4.829 3.417 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.105 -3.198 4.005 1.00 0.00 H new ATOM 0 HG SER A 6 -7.307 -3.941 5.592 1.00 0.00 H new ATOM 96 N PRO A 7 -9.654 -2.668 3.314 1.00 0.00 N ATOM 97 CA PRO A 7 -10.551 -1.520 3.596 1.00 0.00 C ATOM 98 C PRO A 7 -9.903 -0.257 4.231 1.00 0.00 C ATOM 99 O PRO A 7 -10.352 0.855 3.964 1.00 0.00 O ATOM 100 CB PRO A 7 -11.586 -2.133 4.516 1.00 0.00 C ATOM 101 CG PRO A 7 -11.738 -3.515 3.983 1.00 0.00 C ATOM 102 CD PRO A 7 -10.359 -3.945 3.547 1.00 0.00 C ATOM 0 HA PRO A 7 -10.933 -1.106 2.663 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -11.251 -2.136 5.553 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -12.527 -1.584 4.486 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -12.133 -4.186 4.745 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -12.436 -3.536 3.146 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -9.864 -4.542 4.313 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.396 -4.553 2.643 1.00 0.00 H new ATOM 110 N SER A 8 -8.869 -0.415 5.042 1.00 0.00 N ATOM 111 CA SER A 8 -8.192 0.734 5.639 1.00 0.00 C ATOM 112 C SER A 8 -7.480 1.606 4.583 1.00 0.00 C ATOM 113 O SER A 8 -7.265 2.808 4.789 1.00 0.00 O ATOM 114 CB SER A 8 -7.205 0.266 6.714 1.00 0.00 C ATOM 115 OG SER A 8 -6.337 -0.761 6.215 1.00 0.00 O ATOM 0 H SER A 8 -8.479 -1.321 5.303 1.00 0.00 H new ATOM 0 HA SER A 8 -8.954 1.359 6.104 1.00 0.00 H new ATOM 0 HB2 SER A 8 -6.610 1.112 7.057 1.00 0.00 H new ATOM 0 HB3 SER A 8 -7.755 -0.108 7.577 1.00 0.00 H new ATOM 0 HG SER A 8 -6.736 -1.639 6.389 1.00 0.00 H new ATOM 121 N ALA A 9 -7.175 1.009 3.440 1.00 0.00 N ATOM 122 CA ALA A 9 -6.427 1.654 2.371 1.00 0.00 C ATOM 123 C ALA A 9 -7.346 2.403 1.394 1.00 0.00 C ATOM 124 O ALA A 9 -6.908 2.873 0.333 1.00 0.00 O ATOM 125 CB ALA A 9 -5.603 0.601 1.638 1.00 0.00 C ATOM 0 H ALA A 9 -7.444 0.049 3.226 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.767 2.400 2.812 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.039 1.075 0.835 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.913 0.128 2.336 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -6.268 -0.154 1.218 1.00 0.00 H new ATOM 131 N PHE A 10 -8.603 2.537 1.758 1.00 0.00 N ATOM 132 CA PHE A 10 -9.578 3.211 0.912 1.00 0.00 C ATOM 133 C PHE A 10 -9.315 4.709 0.793 1.00 0.00 C ATOM 134 O PHE A 10 -8.702 5.324 1.666 1.00 0.00 O ATOM 135 CB PHE A 10 -11.009 2.943 1.371 1.00 0.00 C ATOM 136 CG PHE A 10 -11.524 1.553 1.086 1.00 0.00 C ATOM 137 CD1 PHE A 10 -10.678 0.536 0.658 1.00 0.00 C ATOM 138 CD2 PHE A 10 -12.863 1.272 1.236 1.00 0.00 C ATOM 139 CE1 PHE A 10 -11.167 -0.720 0.395 1.00 0.00 C ATOM 140 CE2 PHE A 10 -13.354 0.018 0.974 1.00 0.00 C ATOM 141 CZ PHE A 10 -12.509 -0.978 0.554 1.00 0.00 C ATOM 0 H PHE A 10 -8.980 2.187 2.639 1.00 0.00 H new ATOM 0 HA PHE A 10 -9.460 2.785 -0.084 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -11.069 3.123 2.444 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.669 3.664 0.889 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -9.624 0.736 0.531 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -13.537 2.050 1.565 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -10.500 -1.503 0.064 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -14.407 -0.185 1.099 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.897 -1.965 0.348 1.00 0.00 H new ATOM 151 N GLY A 11 -9.746 5.277 -0.325 1.00 0.00 N ATOM 152 CA GLY A 11 -9.551 6.698 -0.599 1.00 0.00 C ATOM 153 C GLY A 11 -8.237 6.959 -1.307 1.00 0.00 C ATOM 154 O GLY A 11 -8.136 7.817 -2.185 1.00 0.00 O ATOM 0 H GLY A 11 -10.237 4.773 -1.063 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.374 7.066 -1.212 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.577 7.256 0.337 1.00 0.00 H new ATOM 158 N LYS A 12 -7.250 6.172 -0.971 1.00 0.00 N ATOM 159 CA LYS A 12 -5.942 6.267 -1.571 1.00 0.00 C ATOM 160 C LYS A 12 -5.796 5.184 -2.640 1.00 0.00 C ATOM 161 O LYS A 12 -4.732 4.984 -3.225 1.00 0.00 O ATOM 162 CB LYS A 12 -4.892 6.142 -0.486 1.00 0.00 C ATOM 163 CG LYS A 12 -4.960 7.265 0.545 1.00 0.00 C ATOM 164 CD LYS A 12 -4.046 7.019 1.737 1.00 0.00 C ATOM 165 CE LYS A 12 -2.572 6.952 1.352 1.00 0.00 C ATOM 166 NZ LYS A 12 -1.693 6.813 2.537 1.00 0.00 N ATOM 0 H LYS A 12 -7.330 5.439 -0.266 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.809 7.233 -2.059 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -5.013 5.184 0.020 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -3.903 6.137 -0.944 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.686 8.207 0.070 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -5.987 7.371 0.895 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -4.189 7.814 2.468 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -4.332 6.085 2.221 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -2.411 6.109 0.681 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -2.300 7.853 0.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.714 6.652 2.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -1.737 7.682 3.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -2.010 6.007 3.112 1.00 0.00 H new ATOM 180 N LEU A 13 -6.920 4.506 -2.889 1.00 0.00 N ATOM 181 CA LEU A 13 -7.071 3.448 -3.906 1.00 0.00 C ATOM 182 C LEU A 13 -6.573 3.929 -5.256 1.00 0.00 C ATOM 183 O LEU A 13 -5.778 3.289 -5.917 1.00 0.00 O ATOM 184 CB LEU A 13 -8.565 3.118 -4.073 1.00 0.00 C ATOM 185 CG LEU A 13 -9.323 2.664 -2.832 1.00 0.00 C ATOM 186 CD1 LEU A 13 -10.805 2.523 -3.139 1.00 0.00 C ATOM 187 CD2 LEU A 13 -8.773 1.354 -2.337 1.00 0.00 C ATOM 0 H LEU A 13 -7.782 4.681 -2.373 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.499 2.580 -3.579 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.064 4.003 -4.468 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.656 2.337 -4.828 1.00 0.00 H new ATOM 0 HG LEU A 13 -9.196 3.417 -2.054 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.333 2.198 -2.243 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -11.202 3.484 -3.466 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.944 1.786 -3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.323 1.040 -1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.878 0.598 -3.115 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -7.719 1.473 -2.087 1.00 0.00 H new ATOM 199 N LYS A 14 -7.033 5.084 -5.631 1.00 0.00 N ATOM 200 CA LYS A 14 -6.748 5.647 -6.925 1.00 0.00 C ATOM 201 C LYS A 14 -5.291 6.080 -7.070 1.00 0.00 C ATOM 202 O LYS A 14 -4.770 6.177 -8.188 1.00 0.00 O ATOM 203 CB LYS A 14 -7.761 6.740 -7.237 1.00 0.00 C ATOM 204 CG LYS A 14 -9.164 6.154 -7.373 1.00 0.00 C ATOM 205 CD LYS A 14 -10.268 7.192 -7.521 1.00 0.00 C ATOM 206 CE LYS A 14 -10.543 7.949 -6.229 1.00 0.00 C ATOM 207 NZ LYS A 14 -11.763 8.783 -6.339 1.00 0.00 N ATOM 0 H LYS A 14 -7.624 5.672 -5.044 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.863 4.873 -7.684 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -7.750 7.489 -6.446 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -7.483 7.248 -8.161 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -9.186 5.492 -8.239 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.374 5.540 -6.497 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.991 7.902 -8.301 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.183 6.699 -7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -10.657 7.241 -5.408 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -9.689 8.582 -5.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -12.076 9.067 -5.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -11.554 9.632 -6.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -12.516 8.237 -6.803 1.00 0.00 H new ATOM 221 N GLU A 15 -4.625 6.284 -5.943 1.00 0.00 N ATOM 222 CA GLU A 15 -3.222 6.633 -5.950 1.00 0.00 C ATOM 223 C GLU A 15 -2.400 5.409 -6.322 1.00 0.00 C ATOM 224 O GLU A 15 -1.657 5.435 -7.302 1.00 0.00 O ATOM 225 CB GLU A 15 -2.762 7.184 -4.595 1.00 0.00 C ATOM 226 CG GLU A 15 -3.558 8.379 -4.128 1.00 0.00 C ATOM 227 CD GLU A 15 -2.965 9.049 -2.921 1.00 0.00 C ATOM 228 OE1 GLU A 15 -2.956 8.470 -1.828 1.00 0.00 O ATOM 229 OE2 GLU A 15 -2.486 10.182 -3.055 1.00 0.00 O ATOM 0 H GLU A 15 -5.039 6.212 -5.014 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.073 7.421 -6.688 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.835 6.394 -3.847 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -1.710 7.462 -4.663 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.626 9.102 -4.941 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -4.575 8.062 -3.897 1.00 0.00 H new ATOM 236 N ILE A 16 -2.578 4.322 -5.569 1.00 0.00 N ATOM 237 CA ILE A 16 -1.837 3.069 -5.804 1.00 0.00 C ATOM 238 C ILE A 16 -2.104 2.492 -7.194 1.00 0.00 C ATOM 239 O ILE A 16 -1.170 2.067 -7.892 1.00 0.00 O ATOM 240 CB ILE A 16 -2.103 1.996 -4.700 1.00 0.00 C ATOM 241 CG1 ILE A 16 -3.609 1.760 -4.501 1.00 0.00 C ATOM 242 CG2 ILE A 16 -1.447 2.409 -3.405 1.00 0.00 C ATOM 243 CD1 ILE A 16 -3.972 0.745 -3.441 1.00 0.00 C ATOM 0 H ILE A 16 -3.231 4.279 -4.786 1.00 0.00 H new ATOM 0 HA ILE A 16 -0.782 3.336 -5.750 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.665 1.053 -5.028 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -4.078 2.710 -4.246 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -4.038 1.438 -5.450 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.639 1.654 -2.643 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -0.372 2.506 -3.557 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -1.856 3.366 -3.079 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -5.057 0.654 -3.381 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.540 -0.222 -3.700 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -3.581 1.070 -2.477 1.00 0.00 H new ATOM 255 N LEU A 17 -3.368 2.527 -7.599 1.00 0.00 N ATOM 256 CA LEU A 17 -3.810 2.058 -8.912 1.00 0.00 C ATOM 257 C LEU A 17 -3.044 2.736 -10.039 1.00 0.00 C ATOM 258 O LEU A 17 -2.466 2.067 -10.904 1.00 0.00 O ATOM 259 CB LEU A 17 -5.323 2.319 -9.075 1.00 0.00 C ATOM 260 CG LEU A 17 -6.313 1.200 -8.652 1.00 0.00 C ATOM 261 CD1 LEU A 17 -5.899 0.512 -7.383 1.00 0.00 C ATOM 262 CD2 LEU A 17 -7.682 1.789 -8.428 1.00 0.00 C ATOM 0 H LEU A 17 -4.126 2.886 -7.019 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.610 0.988 -8.971 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -5.569 3.214 -8.504 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -5.510 2.549 -10.124 1.00 0.00 H new ATOM 0 HG LEU A 17 -6.318 0.468 -9.460 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -6.626 -0.261 -7.134 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.918 0.057 -7.519 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -5.852 1.240 -6.573 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -8.373 1.000 -8.131 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -7.630 2.541 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -8.034 2.252 -9.350 1.00 0.00 H new ATOM 274 N GLY A 18 -3.007 4.054 -10.006 1.00 0.00 N ATOM 275 CA GLY A 18 -2.389 4.806 -11.075 1.00 0.00 C ATOM 276 C GLY A 18 -0.893 4.899 -10.973 1.00 0.00 C ATOM 277 O GLY A 18 -0.210 4.922 -11.986 1.00 0.00 O ATOM 0 H GLY A 18 -3.396 4.622 -9.253 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -2.650 4.345 -12.027 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -2.805 5.813 -11.084 1.00 0.00 H new ATOM 281 N SER A 19 -0.377 4.941 -9.769 1.00 0.00 N ATOM 282 CA SER A 19 1.050 5.089 -9.588 1.00 0.00 C ATOM 283 C SER A 19 1.802 3.817 -9.968 1.00 0.00 C ATOM 284 O SER A 19 2.869 3.883 -10.601 1.00 0.00 O ATOM 285 CB SER A 19 1.381 5.502 -8.149 1.00 0.00 C ATOM 286 OG SER A 19 0.678 6.693 -7.786 1.00 0.00 O ATOM 0 H SER A 19 -0.916 4.876 -8.906 1.00 0.00 H new ATOM 0 HA SER A 19 1.381 5.882 -10.259 1.00 0.00 H new ATOM 0 HB2 SER A 19 1.116 4.696 -7.465 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.454 5.664 -8.051 1.00 0.00 H new ATOM 0 HG SER A 19 -0.224 6.460 -7.481 1.00 0.00 H new ATOM 292 N ASN A 20 1.245 2.665 -9.654 1.00 0.00 N ATOM 293 CA ASN A 20 1.989 1.453 -9.886 1.00 0.00 C ATOM 294 C ASN A 20 1.526 0.713 -11.124 1.00 0.00 C ATOM 295 O ASN A 20 2.315 0.560 -12.075 1.00 0.00 O ATOM 296 CB ASN A 20 1.931 0.519 -8.677 1.00 0.00 C ATOM 297 CG ASN A 20 3.067 -0.509 -8.669 1.00 0.00 C ATOM 298 OD1 ASN A 20 3.609 -0.897 -9.709 1.00 0.00 O ATOM 299 ND2 ASN A 20 3.458 -0.931 -7.493 1.00 0.00 N ATOM 0 H ASN A 20 0.315 2.546 -9.253 1.00 0.00 H new ATOM 0 HA ASN A 20 3.021 1.763 -10.048 1.00 0.00 H new ATOM 0 HB2 ASN A 20 1.976 1.111 -7.763 1.00 0.00 H new ATOM 0 HB3 ASN A 20 0.974 -0.003 -8.672 1.00 0.00 H new ATOM 0 HD21 ASN A 20 4.228 -1.596 -7.420 1.00 0.00 H new ATOM 0 HD22 ASN A 20 2.993 -0.594 -6.650 1.00 0.00 H new ATOM 306 N LYS A 21 0.230 0.322 -11.147 1.00 0.00 N ATOM 307 CA LYS A 21 -0.300 -0.611 -12.162 1.00 0.00 C ATOM 308 C LYS A 21 0.419 -1.963 -12.018 1.00 0.00 C ATOM 309 O LYS A 21 1.042 -2.220 -10.990 1.00 0.00 O ATOM 310 CB LYS A 21 -0.155 -0.061 -13.605 1.00 0.00 C ATOM 311 CG LYS A 21 -1.057 1.113 -13.935 1.00 0.00 C ATOM 312 CD LYS A 21 -0.876 1.549 -15.383 1.00 0.00 C ATOM 313 CE LYS A 21 -1.857 2.648 -15.763 1.00 0.00 C ATOM 314 NZ LYS A 21 -1.676 3.093 -17.156 1.00 0.00 N ATOM 0 H LYS A 21 -0.466 0.640 -10.473 1.00 0.00 H new ATOM 0 HA LYS A 21 -1.369 -0.736 -11.988 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.881 0.240 -13.761 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.361 -0.868 -14.308 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -2.097 0.837 -13.762 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -0.833 1.947 -13.270 1.00 0.00 H new ATOM 0 HD2 LYS A 21 0.144 1.903 -15.532 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.015 0.692 -16.042 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.876 2.287 -15.628 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -1.728 3.497 -15.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -2.364 3.842 -17.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -0.712 3.462 -17.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.824 2.289 -17.799 1.00 0.00 H new ATOM 328 N ASN A 22 0.254 -2.854 -12.993 1.00 0.00 N ATOM 329 CA ASN A 22 1.001 -4.146 -13.070 1.00 0.00 C ATOM 330 C ASN A 22 0.604 -5.198 -12.040 1.00 0.00 C ATOM 331 O ASN A 22 1.007 -6.354 -12.151 1.00 0.00 O ATOM 332 CB ASN A 22 2.520 -3.929 -13.045 1.00 0.00 C ATOM 333 CG ASN A 22 3.062 -3.370 -14.335 1.00 0.00 C ATOM 334 OD1 ASN A 22 2.581 -3.689 -15.412 1.00 0.00 O ATOM 335 ND2 ASN A 22 4.033 -2.506 -14.240 1.00 0.00 N ATOM 0 H ASN A 22 -0.400 -2.717 -13.764 1.00 0.00 H new ATOM 0 HA ASN A 22 0.703 -4.556 -14.035 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.770 -3.251 -12.229 1.00 0.00 H new ATOM 0 HB3 ASN A 22 3.012 -4.878 -12.833 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.415 -2.073 -15.081 1.00 0.00 H new ATOM 0 HD22 ASN A 22 4.411 -2.262 -13.325 1.00 0.00 H new ATOM 342 N TYR A 23 -0.126 -4.819 -11.043 1.00 0.00 N ATOM 343 CA TYR A 23 -0.644 -5.770 -10.090 1.00 0.00 C ATOM 344 C TYR A 23 -2.098 -5.916 -10.330 1.00 0.00 C ATOM 345 O TYR A 23 -2.764 -4.943 -10.700 1.00 0.00 O ATOM 346 CB TYR A 23 -0.407 -5.332 -8.640 1.00 0.00 C ATOM 347 CG TYR A 23 1.038 -5.334 -8.217 1.00 0.00 C ATOM 348 CD1 TYR A 23 1.646 -6.502 -7.771 1.00 0.00 C ATOM 349 CD2 TYR A 23 1.794 -4.176 -8.256 1.00 0.00 C ATOM 350 CE1 TYR A 23 2.968 -6.510 -7.382 1.00 0.00 C ATOM 351 CE2 TYR A 23 3.114 -4.175 -7.868 1.00 0.00 C ATOM 352 CZ TYR A 23 3.699 -5.338 -7.436 1.00 0.00 C ATOM 353 OH TYR A 23 5.021 -5.331 -7.056 1.00 0.00 O ATOM 0 H TYR A 23 -0.384 -3.850 -10.858 1.00 0.00 H new ATOM 0 HA TYR A 23 -0.121 -6.716 -10.228 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -0.811 -4.328 -8.506 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -0.968 -5.992 -7.978 1.00 0.00 H new ATOM 0 HD1 TYR A 23 1.074 -7.417 -7.729 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.340 -3.257 -8.597 1.00 0.00 H new ATOM 0 HE1 TYR A 23 3.429 -7.424 -7.038 1.00 0.00 H new ATOM 0 HE2 TYR A 23 3.688 -3.261 -7.903 1.00 0.00 H new ATOM 0 HH TYR A 23 5.545 -5.868 -7.686 1.00 0.00 H new ATOM 363 N LYS A 24 -2.611 -7.094 -10.166 1.00 0.00 N ATOM 364 CA LYS A 24 -4.013 -7.266 -10.337 1.00 0.00 C ATOM 365 C LYS A 24 -4.607 -6.999 -8.985 1.00 0.00 C ATOM 366 O LYS A 24 -4.459 -7.807 -8.062 1.00 0.00 O ATOM 367 CB LYS A 24 -4.365 -8.674 -10.822 1.00 0.00 C ATOM 368 CG LYS A 24 -5.652 -8.752 -11.663 1.00 0.00 C ATOM 369 CD LYS A 24 -5.439 -8.054 -13.010 1.00 0.00 C ATOM 370 CE LYS A 24 -6.585 -8.256 -13.995 1.00 0.00 C ATOM 371 NZ LYS A 24 -7.817 -7.548 -13.617 1.00 0.00 N ATOM 0 H LYS A 24 -2.090 -7.935 -9.919 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.403 -6.593 -11.100 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.535 -9.060 -11.413 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.471 -9.328 -9.956 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.929 -9.794 -11.823 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.476 -8.282 -11.126 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -5.304 -6.986 -12.838 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.517 -8.424 -13.459 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.269 -7.917 -14.982 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.799 -9.322 -14.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.628 -8.193 -13.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.740 -7.219 -12.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.955 -6.731 -14.246 1.00 0.00 H new ATOM 385 N PHE A 25 -5.189 -5.849 -8.844 1.00 0.00 N ATOM 386 CA PHE A 25 -5.695 -5.419 -7.580 1.00 0.00 C ATOM 387 C PHE A 25 -6.970 -6.158 -7.265 1.00 0.00 C ATOM 388 O PHE A 25 -7.786 -6.402 -8.143 1.00 0.00 O ATOM 389 CB PHE A 25 -5.910 -3.911 -7.573 1.00 0.00 C ATOM 390 CG PHE A 25 -4.660 -3.101 -7.816 1.00 0.00 C ATOM 391 CD1 PHE A 25 -3.760 -2.863 -6.789 1.00 0.00 C ATOM 392 CD2 PHE A 25 -4.387 -2.577 -9.075 1.00 0.00 C ATOM 393 CE1 PHE A 25 -2.613 -2.120 -7.011 1.00 0.00 C ATOM 394 CE2 PHE A 25 -3.243 -1.833 -9.301 1.00 0.00 C ATOM 395 CZ PHE A 25 -2.354 -1.606 -8.267 1.00 0.00 C ATOM 0 H PHE A 25 -5.326 -5.182 -9.603 1.00 0.00 H new ATOM 0 HA PHE A 25 -4.964 -5.648 -6.804 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -6.646 -3.658 -8.336 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.335 -3.621 -6.612 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -3.956 -3.262 -5.805 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.077 -2.753 -9.887 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -1.920 -1.942 -6.202 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -3.045 -1.430 -10.283 1.00 0.00 H new ATOM 0 HZ PHE A 25 -1.458 -1.028 -8.441 1.00 0.00 H new ATOM 405 N VAL A 26 -7.102 -6.554 -6.039 1.00 0.00 N ATOM 406 CA VAL A 26 -8.208 -7.348 -5.585 1.00 0.00 C ATOM 407 C VAL A 26 -8.876 -6.671 -4.401 1.00 0.00 C ATOM 408 O VAL A 26 -8.199 -6.167 -3.506 1.00 0.00 O ATOM 409 CB VAL A 26 -7.715 -8.753 -5.128 1.00 0.00 C ATOM 410 CG1 VAL A 26 -8.861 -9.630 -4.676 1.00 0.00 C ATOM 411 CG2 VAL A 26 -6.907 -9.450 -6.210 1.00 0.00 C ATOM 0 H VAL A 26 -6.430 -6.331 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.913 -7.454 -6.409 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.059 -8.588 -4.274 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -8.475 -10.601 -4.365 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.372 -9.157 -3.837 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.563 -9.765 -5.499 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -6.583 -10.426 -5.850 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.524 -9.578 -7.099 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.034 -8.846 -6.458 1.00 0.00 H new ATOM 421 N ILE A 27 -10.170 -6.633 -4.413 1.00 0.00 N ATOM 422 CA ILE A 27 -10.924 -6.133 -3.311 1.00 0.00 C ATOM 423 C ILE A 27 -11.914 -7.225 -2.900 1.00 0.00 C ATOM 424 O ILE A 27 -12.271 -8.087 -3.716 1.00 0.00 O ATOM 425 CB ILE A 27 -11.651 -4.790 -3.661 1.00 0.00 C ATOM 426 CG1 ILE A 27 -12.280 -4.151 -2.417 1.00 0.00 C ATOM 427 CG2 ILE A 27 -12.708 -4.995 -4.738 1.00 0.00 C ATOM 428 CD1 ILE A 27 -11.284 -3.838 -1.324 1.00 0.00 C ATOM 0 H ILE A 27 -10.738 -6.952 -5.198 1.00 0.00 H new ATOM 0 HA ILE A 27 -10.259 -5.897 -2.480 1.00 0.00 H new ATOM 0 HB ILE A 27 -10.893 -4.109 -4.049 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.786 -3.231 -2.709 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -13.042 -4.822 -2.021 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -13.193 -4.044 -4.957 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.236 -5.379 -5.643 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -13.452 -5.709 -4.386 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -11.802 -3.388 -0.477 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.795 -4.758 -1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.536 -3.142 -1.702 1.00 0.00 H new ATOM 440 N THR A 28 -12.318 -7.226 -1.668 1.00 0.00 N ATOM 441 CA THR A 28 -13.187 -8.244 -1.171 1.00 0.00 C ATOM 442 C THR A 28 -14.648 -7.810 -1.233 1.00 0.00 C ATOM 443 O THR A 28 -14.955 -6.640 -1.514 1.00 0.00 O ATOM 444 CB THR A 28 -12.811 -8.579 0.275 1.00 0.00 C ATOM 445 OG1 THR A 28 -12.841 -7.375 1.065 1.00 0.00 O ATOM 446 CG2 THR A 28 -11.422 -9.169 0.333 1.00 0.00 C ATOM 0 H THR A 28 -12.054 -6.521 -0.980 1.00 0.00 H new ATOM 0 HA THR A 28 -13.070 -9.126 -1.800 1.00 0.00 H new ATOM 0 HB THR A 28 -13.525 -9.304 0.666 1.00 0.00 H new ATOM 0 HG1 THR A 28 -12.602 -7.586 1.992 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.169 -9.402 1.367 1.00 0.00 H new ATOM 0 HG22 THR A 28 -11.389 -10.081 -0.263 1.00 0.00 H new ATOM 0 HG23 THR A 28 -10.705 -8.450 -0.063 1.00 0.00 H new ATOM 454 N THR A 29 -15.533 -8.737 -0.951 1.00 0.00 N ATOM 455 CA THR A 29 -16.948 -8.493 -0.914 1.00 0.00 C ATOM 456 C THR A 29 -17.291 -7.535 0.229 1.00 0.00 C ATOM 457 O THR A 29 -18.051 -6.576 0.061 1.00 0.00 O ATOM 458 CB THR A 29 -17.646 -9.826 -0.718 1.00 0.00 C ATOM 459 OG1 THR A 29 -16.871 -10.577 0.233 1.00 0.00 O ATOM 460 CG2 THR A 29 -17.726 -10.585 -2.030 1.00 0.00 C ATOM 0 H THR A 29 -15.279 -9.701 -0.737 1.00 0.00 H new ATOM 0 HA THR A 29 -17.277 -8.031 -1.845 1.00 0.00 H new ATOM 0 HB THR A 29 -18.664 -9.671 -0.360 1.00 0.00 H new ATOM 0 HG1 THR A 29 -17.295 -11.447 0.386 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.230 -11.538 -1.869 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.286 -9.997 -2.757 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.720 -10.766 -2.408 1.00 0.00 H new ATOM 468 N LEU A 30 -16.697 -7.772 1.384 1.00 0.00 N ATOM 469 CA LEU A 30 -16.881 -6.885 2.515 1.00 0.00 C ATOM 470 C LEU A 30 -16.179 -5.557 2.274 1.00 0.00 C ATOM 471 O LEU A 30 -16.574 -4.533 2.823 1.00 0.00 O ATOM 472 CB LEU A 30 -16.418 -7.525 3.828 1.00 0.00 C ATOM 473 CG LEU A 30 -17.193 -8.763 4.295 1.00 0.00 C ATOM 474 CD1 LEU A 30 -16.684 -9.238 5.646 1.00 0.00 C ATOM 475 CD2 LEU A 30 -18.684 -8.475 4.364 1.00 0.00 C ATOM 0 H LEU A 30 -16.085 -8.569 1.562 1.00 0.00 H new ATOM 0 HA LEU A 30 -17.950 -6.697 2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.368 -7.799 3.723 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.473 -6.771 4.613 1.00 0.00 H new ATOM 0 HG LEU A 30 -17.030 -9.556 3.565 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -17.248 -10.117 5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -15.627 -9.493 5.567 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.812 -8.445 6.382 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -19.212 -9.368 4.698 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -18.865 -7.662 5.067 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -19.045 -8.188 3.377 1.00 0.00 H new ATOM 487 N GLY A 31 -15.153 -5.584 1.431 1.00 0.00 N ATOM 488 CA GLY A 31 -14.453 -4.385 1.050 1.00 0.00 C ATOM 489 C GLY A 31 -15.327 -3.474 0.215 1.00 0.00 C ATOM 490 O GLY A 31 -15.500 -2.308 0.552 1.00 0.00 O ATOM 0 H GLY A 31 -14.793 -6.436 1.001 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.123 -3.855 1.944 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -13.558 -4.648 0.487 1.00 0.00 H new ATOM 494 N VAL A 32 -15.913 -4.012 -0.855 1.00 0.00 N ATOM 495 CA VAL A 32 -16.792 -3.210 -1.713 1.00 0.00 C ATOM 496 C VAL A 32 -18.002 -2.696 -0.925 1.00 0.00 C ATOM 497 O VAL A 32 -18.428 -1.557 -1.098 1.00 0.00 O ATOM 498 CB VAL A 32 -17.251 -3.951 -3.023 1.00 0.00 C ATOM 499 CG1 VAL A 32 -16.064 -4.365 -3.859 1.00 0.00 C ATOM 500 CG2 VAL A 32 -18.133 -5.157 -2.737 1.00 0.00 C ATOM 0 H VAL A 32 -15.800 -4.983 -1.147 1.00 0.00 H new ATOM 0 HA VAL A 32 -16.193 -2.362 -2.044 1.00 0.00 H new ATOM 0 HB VAL A 32 -17.850 -3.234 -3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -16.412 -4.875 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -15.492 -3.481 -4.141 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -15.430 -5.039 -3.282 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -18.420 -5.629 -3.677 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -17.584 -5.872 -2.124 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -19.028 -4.835 -2.205 1.00 0.00 H new ATOM 510 N SER A 33 -18.494 -3.520 -0.008 1.00 0.00 N ATOM 511 CA SER A 33 -19.616 -3.160 0.832 1.00 0.00 C ATOM 512 C SER A 33 -19.221 -2.029 1.794 1.00 0.00 C ATOM 513 O SER A 33 -20.002 -1.097 2.030 1.00 0.00 O ATOM 514 CB SER A 33 -20.093 -4.390 1.606 1.00 0.00 C ATOM 515 OG SER A 33 -20.394 -5.459 0.706 1.00 0.00 O ATOM 0 H SER A 33 -18.123 -4.453 0.170 1.00 0.00 H new ATOM 0 HA SER A 33 -20.433 -2.801 0.206 1.00 0.00 H new ATOM 0 HB2 SER A 33 -19.323 -4.705 2.311 1.00 0.00 H new ATOM 0 HB3 SER A 33 -20.978 -4.139 2.191 1.00 0.00 H new ATOM 0 HG SER A 33 -19.583 -5.982 0.536 1.00 0.00 H new ATOM 521 N PHE A 34 -17.991 -2.099 2.310 1.00 0.00 N ATOM 522 CA PHE A 34 -17.470 -1.093 3.220 1.00 0.00 C ATOM 523 C PHE A 34 -17.345 0.239 2.503 1.00 0.00 C ATOM 524 O PHE A 34 -17.638 1.289 3.077 1.00 0.00 O ATOM 525 CB PHE A 34 -16.113 -1.528 3.808 1.00 0.00 C ATOM 526 CG PHE A 34 -15.509 -0.540 4.774 1.00 0.00 C ATOM 527 CD1 PHE A 34 -16.048 -0.367 6.036 1.00 0.00 C ATOM 528 CD2 PHE A 34 -14.406 0.220 4.414 1.00 0.00 C ATOM 529 CE1 PHE A 34 -15.501 0.540 6.919 1.00 0.00 C ATOM 530 CE2 PHE A 34 -13.854 1.128 5.292 1.00 0.00 C ATOM 531 CZ PHE A 34 -14.401 1.289 6.546 1.00 0.00 C ATOM 0 H PHE A 34 -17.336 -2.854 2.106 1.00 0.00 H new ATOM 0 HA PHE A 34 -18.168 -0.981 4.049 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.240 -2.484 4.316 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.412 -1.693 2.990 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -16.908 -0.949 6.333 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -13.974 0.099 3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -15.932 0.665 7.901 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -12.995 1.712 4.997 1.00 0.00 H new ATOM 0 HZ PHE A 34 -13.971 1.999 7.237 1.00 0.00 H new ATOM 541 N ALA A 35 -16.935 0.186 1.249 1.00 0.00 N ATOM 542 CA ALA A 35 -16.825 1.377 0.430 1.00 0.00 C ATOM 543 C ALA A 35 -18.191 2.022 0.256 1.00 0.00 C ATOM 544 O ALA A 35 -18.359 3.202 0.547 1.00 0.00 O ATOM 545 CB ALA A 35 -16.220 1.044 -0.926 1.00 0.00 C ATOM 0 H ALA A 35 -16.671 -0.677 0.773 1.00 0.00 H new ATOM 0 HA ALA A 35 -16.165 2.083 0.934 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.147 1.952 -1.525 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -15.226 0.620 -0.787 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.854 0.321 -1.440 1.00 0.00 H new ATOM 551 N ILE A 36 -19.169 1.218 -0.154 1.00 0.00 N ATOM 552 CA ILE A 36 -20.542 1.690 -0.392 1.00 0.00 C ATOM 553 C ILE A 36 -21.131 2.378 0.849 1.00 0.00 C ATOM 554 O ILE A 36 -21.616 3.512 0.770 1.00 0.00 O ATOM 555 CB ILE A 36 -21.489 0.522 -0.824 1.00 0.00 C ATOM 556 CG1 ILE A 36 -20.986 -0.165 -2.101 1.00 0.00 C ATOM 557 CG2 ILE A 36 -22.927 1.005 -1.014 1.00 0.00 C ATOM 558 CD1 ILE A 36 -20.849 0.747 -3.302 1.00 0.00 C ATOM 0 H ILE A 36 -19.039 0.222 -0.332 1.00 0.00 H new ATOM 0 HA ILE A 36 -20.477 2.415 -1.203 1.00 0.00 H new ATOM 0 HB ILE A 36 -21.480 -0.209 -0.015 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -20.017 -0.619 -1.895 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -21.670 -0.975 -2.354 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -23.556 0.167 -1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -23.298 1.420 -0.077 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -22.954 1.773 -1.787 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -20.488 0.173 -4.155 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -21.819 1.182 -3.541 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -20.141 1.544 -3.075 1.00 0.00 H new ATOM 570 N LYS A 37 -21.041 1.712 1.991 1.00 0.00 N ATOM 571 CA LYS A 37 -21.633 2.226 3.232 1.00 0.00 C ATOM 572 C LYS A 37 -20.871 3.439 3.783 1.00 0.00 C ATOM 573 O LYS A 37 -21.411 4.220 4.566 1.00 0.00 O ATOM 574 CB LYS A 37 -21.740 1.118 4.291 1.00 0.00 C ATOM 575 CG LYS A 37 -20.400 0.546 4.725 1.00 0.00 C ATOM 576 CD LYS A 37 -20.545 -0.595 5.719 1.00 0.00 C ATOM 577 CE LYS A 37 -21.244 -1.815 5.112 1.00 0.00 C ATOM 578 NZ LYS A 37 -21.365 -2.923 6.086 1.00 0.00 N ATOM 0 H LYS A 37 -20.566 0.815 2.091 1.00 0.00 H new ATOM 0 HA LYS A 37 -22.639 2.566 2.986 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -22.255 1.515 5.166 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -22.357 0.311 3.897 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.859 0.192 3.847 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -19.799 1.338 5.172 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.558 -0.887 6.079 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -21.110 -0.249 6.584 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -22.236 -1.529 4.763 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -20.686 -2.157 4.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -21.843 -3.730 5.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -20.417 -3.214 6.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -21.919 -2.605 6.906 1.00 0.00 H new ATOM 592 N SER A 38 -19.630 3.589 3.392 1.00 0.00 N ATOM 593 CA SER A 38 -18.846 4.725 3.837 1.00 0.00 C ATOM 594 C SER A 38 -18.891 5.874 2.812 1.00 0.00 C ATOM 595 O SER A 38 -18.362 6.952 3.057 1.00 0.00 O ATOM 596 CB SER A 38 -17.407 4.295 4.108 1.00 0.00 C ATOM 597 OG SER A 38 -17.367 3.201 5.026 1.00 0.00 O ATOM 0 H SER A 38 -19.139 2.946 2.771 1.00 0.00 H new ATOM 0 HA SER A 38 -19.281 5.097 4.764 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.927 4.008 3.173 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.842 5.135 4.512 1.00 0.00 H new ATOM 0 HG SER A 38 -17.437 2.357 4.533 1.00 0.00 H new ATOM 603 N GLY A 39 -19.534 5.638 1.674 1.00 0.00 N ATOM 604 CA GLY A 39 -19.636 6.662 0.650 1.00 0.00 C ATOM 605 C GLY A 39 -18.346 6.820 -0.129 1.00 0.00 C ATOM 606 O GLY A 39 -18.014 7.910 -0.593 1.00 0.00 O ATOM 0 H GLY A 39 -19.987 4.754 1.442 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -20.444 6.409 -0.036 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.898 7.613 1.114 1.00 0.00 H new ATOM 610 N ILE A 40 -17.631 5.739 -0.264 1.00 0.00 N ATOM 611 CA ILE A 40 -16.359 5.719 -0.948 1.00 0.00 C ATOM 612 C ILE A 40 -16.559 5.109 -2.321 1.00 0.00 C ATOM 613 O ILE A 40 -17.223 4.073 -2.457 1.00 0.00 O ATOM 614 CB ILE A 40 -15.316 4.890 -0.138 1.00 0.00 C ATOM 615 CG1 ILE A 40 -15.163 5.489 1.273 1.00 0.00 C ATOM 616 CG2 ILE A 40 -13.964 4.846 -0.857 1.00 0.00 C ATOM 617 CD1 ILE A 40 -14.245 4.714 2.195 1.00 0.00 C ATOM 0 H ILE A 40 -17.916 4.830 0.102 1.00 0.00 H new ATOM 0 HA ILE A 40 -15.979 6.736 -1.044 1.00 0.00 H new ATOM 0 HB ILE A 40 -15.676 3.865 -0.054 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -14.787 6.508 1.181 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -16.149 5.553 1.734 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -13.258 4.261 -0.268 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -14.088 4.386 -1.837 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -13.583 5.860 -0.978 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -14.199 5.210 3.164 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -14.628 3.702 2.323 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -13.246 4.671 1.762 1.00 0.00 H new ATOM 629 N ASP A 41 -16.014 5.751 -3.325 1.00 0.00 N ATOM 630 CA ASP A 41 -16.159 5.305 -4.690 1.00 0.00 C ATOM 631 C ASP A 41 -15.268 4.103 -4.985 1.00 0.00 C ATOM 632 O ASP A 41 -14.040 4.197 -5.061 1.00 0.00 O ATOM 633 CB ASP A 41 -15.947 6.457 -5.694 1.00 0.00 C ATOM 634 CG ASP A 41 -14.572 7.117 -5.658 1.00 0.00 C ATOM 635 OD1 ASP A 41 -14.188 7.681 -4.606 1.00 0.00 O ATOM 636 OD2 ASP A 41 -13.874 7.128 -6.699 1.00 0.00 O ATOM 0 H ASP A 41 -15.457 6.599 -3.219 1.00 0.00 H new ATOM 0 HA ASP A 41 -17.188 4.970 -4.817 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -16.121 6.075 -6.700 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -16.702 7.221 -5.508 1.00 0.00 H new ATOM 641 N ILE A 42 -15.901 2.965 -5.127 1.00 0.00 N ATOM 642 CA ILE A 42 -15.202 1.723 -5.362 1.00 0.00 C ATOM 643 C ILE A 42 -15.215 1.373 -6.862 1.00 0.00 C ATOM 644 O ILE A 42 -14.333 0.669 -7.359 1.00 0.00 O ATOM 645 CB ILE A 42 -15.812 0.555 -4.507 1.00 0.00 C ATOM 646 CG1 ILE A 42 -14.989 -0.737 -4.620 1.00 0.00 C ATOM 647 CG2 ILE A 42 -17.273 0.289 -4.859 1.00 0.00 C ATOM 648 CD1 ILE A 42 -13.591 -0.637 -4.043 1.00 0.00 C ATOM 0 H ILE A 42 -16.916 2.872 -5.083 1.00 0.00 H new ATOM 0 HA ILE A 42 -14.166 1.853 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.771 0.887 -3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.523 -1.540 -4.112 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.917 -1.018 -5.671 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -17.653 -0.526 -4.243 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -17.861 1.188 -4.674 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -17.350 0.015 -5.911 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -13.078 -1.591 -4.164 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -13.036 0.142 -4.567 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.652 -0.389 -2.983 1.00 0.00 H new ATOM 660 N ASP A 43 -16.181 1.925 -7.594 1.00 0.00 N ATOM 661 CA ASP A 43 -16.309 1.644 -9.032 1.00 0.00 C ATOM 662 C ASP A 43 -15.142 2.237 -9.791 1.00 0.00 C ATOM 663 O ASP A 43 -14.731 1.714 -10.822 1.00 0.00 O ATOM 664 CB ASP A 43 -17.648 2.138 -9.636 1.00 0.00 C ATOM 665 CG ASP A 43 -17.792 3.651 -9.735 1.00 0.00 C ATOM 666 OD1 ASP A 43 -17.330 4.243 -10.745 1.00 0.00 O ATOM 667 OD2 ASP A 43 -18.410 4.267 -8.830 1.00 0.00 O ATOM 0 H ASP A 43 -16.884 2.565 -7.224 1.00 0.00 H new ATOM 0 HA ASP A 43 -16.302 0.559 -9.136 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -17.758 1.712 -10.633 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -18.467 1.749 -9.031 1.00 0.00 H new ATOM 672 N SER A 44 -14.580 3.296 -9.241 1.00 0.00 N ATOM 673 CA SER A 44 -13.442 3.951 -9.829 1.00 0.00 C ATOM 674 C SER A 44 -12.225 3.039 -9.682 1.00 0.00 C ATOM 675 O SER A 44 -11.362 2.985 -10.549 1.00 0.00 O ATOM 676 CB SER A 44 -13.226 5.308 -9.141 1.00 0.00 C ATOM 677 OG SER A 44 -12.271 6.131 -9.805 1.00 0.00 O ATOM 0 H SER A 44 -14.905 3.722 -8.373 1.00 0.00 H new ATOM 0 HA SER A 44 -13.605 4.139 -10.890 1.00 0.00 H new ATOM 0 HB2 SER A 44 -14.178 5.837 -9.089 1.00 0.00 H new ATOM 0 HB3 SER A 44 -12.899 5.139 -8.115 1.00 0.00 H new ATOM 0 HG SER A 44 -12.498 7.074 -9.665 1.00 0.00 H new ATOM 683 N ALA A 45 -12.204 2.273 -8.610 1.00 0.00 N ATOM 684 CA ALA A 45 -11.138 1.342 -8.371 1.00 0.00 C ATOM 685 C ALA A 45 -11.288 0.157 -9.320 1.00 0.00 C ATOM 686 O ALA A 45 -10.329 -0.237 -10.015 1.00 0.00 O ATOM 687 CB ALA A 45 -11.145 0.889 -6.919 1.00 0.00 C ATOM 0 H ALA A 45 -12.925 2.283 -7.888 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.179 1.825 -8.559 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.331 0.183 -6.754 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.014 1.753 -6.268 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -12.095 0.405 -6.693 1.00 0.00 H new ATOM 693 N LEU A 46 -12.510 -0.366 -9.387 1.00 0.00 N ATOM 694 CA LEU A 46 -12.847 -1.493 -10.258 1.00 0.00 C ATOM 695 C LEU A 46 -12.459 -1.182 -11.701 1.00 0.00 C ATOM 696 O LEU A 46 -11.861 -2.011 -12.388 1.00 0.00 O ATOM 697 CB LEU A 46 -14.352 -1.802 -10.183 1.00 0.00 C ATOM 698 CG LEU A 46 -14.926 -2.132 -8.794 1.00 0.00 C ATOM 699 CD1 LEU A 46 -16.415 -2.412 -8.887 1.00 0.00 C ATOM 700 CD2 LEU A 46 -14.202 -3.311 -8.161 1.00 0.00 C ATOM 0 H LEU A 46 -13.297 -0.021 -8.838 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.289 -2.365 -9.918 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -14.895 -0.944 -10.579 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -14.559 -2.643 -10.844 1.00 0.00 H new ATOM 0 HG LEU A 46 -14.772 -1.263 -8.155 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -16.804 -2.644 -7.896 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -16.926 -1.534 -9.282 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -16.585 -3.260 -9.551 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -14.632 -3.518 -7.181 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -14.311 -4.189 -8.798 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -13.144 -3.072 -8.050 1.00 0.00 H new ATOM 712 N ASP A 47 -12.764 0.033 -12.127 1.00 0.00 N ATOM 713 CA ASP A 47 -12.446 0.517 -13.477 1.00 0.00 C ATOM 714 C ASP A 47 -10.947 0.531 -13.752 1.00 0.00 C ATOM 715 O ASP A 47 -10.514 0.261 -14.875 1.00 0.00 O ATOM 716 CB ASP A 47 -13.041 1.919 -13.702 1.00 0.00 C ATOM 717 CG ASP A 47 -12.608 2.574 -15.012 1.00 0.00 C ATOM 718 OD1 ASP A 47 -12.796 1.968 -16.102 1.00 0.00 O ATOM 719 OD2 ASP A 47 -12.119 3.740 -14.973 1.00 0.00 O ATOM 0 H ASP A 47 -13.243 0.723 -11.548 1.00 0.00 H new ATOM 0 HA ASP A 47 -12.897 -0.183 -14.180 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -14.129 1.848 -13.685 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -12.751 2.563 -12.872 1.00 0.00 H new ATOM 724 N ARG A 48 -10.146 0.806 -12.739 1.00 0.00 N ATOM 725 CA ARG A 48 -8.708 0.887 -12.953 1.00 0.00 C ATOM 726 C ARG A 48 -8.033 -0.482 -12.866 1.00 0.00 C ATOM 727 O ARG A 48 -6.831 -0.605 -13.105 1.00 0.00 O ATOM 728 CB ARG A 48 -8.081 1.902 -12.023 1.00 0.00 C ATOM 729 CG ARG A 48 -8.836 3.202 -12.089 1.00 0.00 C ATOM 730 CD ARG A 48 -8.253 4.309 -11.270 1.00 0.00 C ATOM 731 NE ARG A 48 -9.258 5.373 -11.119 1.00 0.00 N ATOM 732 CZ ARG A 48 -9.077 6.684 -11.308 1.00 0.00 C ATOM 733 NH1 ARG A 48 -7.885 7.176 -11.600 1.00 0.00 N ATOM 734 NH2 ARG A 48 -10.104 7.494 -11.186 1.00 0.00 N ATOM 0 H ARG A 48 -10.454 0.974 -11.781 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.544 1.236 -13.973 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.085 1.522 -11.001 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.039 2.064 -12.298 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.884 3.525 -13.129 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.861 3.028 -11.761 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -7.951 3.935 -10.292 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.358 4.702 -11.751 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.194 5.079 -10.840 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -7.083 6.552 -11.685 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.768 8.179 -11.740 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.023 7.120 -10.950 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.982 8.497 -11.327 1.00 0.00 H new ATOM 748 N GLY A 49 -8.802 -1.504 -12.534 1.00 0.00 N ATOM 749 CA GLY A 49 -8.261 -2.850 -12.585 1.00 0.00 C ATOM 750 C GLY A 49 -8.380 -3.618 -11.297 1.00 0.00 C ATOM 751 O GLY A 49 -7.677 -4.621 -11.102 1.00 0.00 O ATOM 0 H GLY A 49 -9.775 -1.433 -12.235 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.772 -3.404 -13.372 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.209 -2.795 -12.865 1.00 0.00 H new ATOM 755 N VAL A 50 -9.240 -3.170 -10.415 1.00 0.00 N ATOM 756 CA VAL A 50 -9.463 -3.880 -9.174 1.00 0.00 C ATOM 757 C VAL A 50 -10.575 -4.911 -9.378 1.00 0.00 C ATOM 758 O VAL A 50 -11.666 -4.573 -9.841 1.00 0.00 O ATOM 759 CB VAL A 50 -9.824 -2.918 -8.003 1.00 0.00 C ATOM 760 CG1 VAL A 50 -10.030 -3.682 -6.714 1.00 0.00 C ATOM 761 CG2 VAL A 50 -8.737 -1.880 -7.805 1.00 0.00 C ATOM 0 H VAL A 50 -9.795 -2.322 -10.530 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.535 -4.381 -8.898 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.755 -2.416 -8.268 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -10.281 -2.985 -5.914 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -10.843 -4.397 -6.841 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.115 -4.215 -6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.010 -1.219 -6.982 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -7.796 -2.378 -7.573 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.622 -1.295 -8.717 1.00 0.00 H new ATOM 771 N ILE A 51 -10.278 -6.156 -9.088 1.00 0.00 N ATOM 772 CA ILE A 51 -11.237 -7.240 -9.221 1.00 0.00 C ATOM 773 C ILE A 51 -11.832 -7.548 -7.855 1.00 0.00 C ATOM 774 O ILE A 51 -11.258 -7.181 -6.833 1.00 0.00 O ATOM 775 CB ILE A 51 -10.590 -8.546 -9.803 1.00 0.00 C ATOM 776 CG1 ILE A 51 -9.561 -9.157 -8.831 1.00 0.00 C ATOM 777 CG2 ILE A 51 -9.930 -8.261 -11.146 1.00 0.00 C ATOM 778 CD1 ILE A 51 -8.985 -10.483 -9.299 1.00 0.00 C ATOM 0 H ILE A 51 -9.362 -6.452 -8.751 1.00 0.00 H new ATOM 0 HA ILE A 51 -12.007 -6.914 -9.920 1.00 0.00 H new ATOM 0 HB ILE A 51 -11.392 -9.271 -9.942 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -8.746 -8.448 -8.688 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -10.034 -9.300 -7.859 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -9.486 -9.177 -11.535 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -10.678 -7.893 -11.848 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.153 -7.508 -11.017 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.269 -10.849 -8.563 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -9.790 -11.209 -9.415 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.482 -10.344 -10.256 1.00 0.00 H new ATOM 790 N VAL A 52 -12.952 -8.207 -7.833 1.00 0.00 N ATOM 791 CA VAL A 52 -13.600 -8.559 -6.588 1.00 0.00 C ATOM 792 C VAL A 52 -13.416 -10.048 -6.349 1.00 0.00 C ATOM 793 O VAL A 52 -13.703 -10.864 -7.236 1.00 0.00 O ATOM 794 CB VAL A 52 -15.126 -8.225 -6.603 1.00 0.00 C ATOM 795 CG1 VAL A 52 -15.772 -8.526 -5.251 1.00 0.00 C ATOM 796 CG2 VAL A 52 -15.364 -6.771 -6.994 1.00 0.00 C ATOM 0 H VAL A 52 -13.447 -8.518 -8.669 1.00 0.00 H new ATOM 0 HA VAL A 52 -13.143 -7.973 -5.790 1.00 0.00 H new ATOM 0 HB VAL A 52 -15.594 -8.863 -7.353 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -16.834 -8.283 -5.293 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -15.650 -9.584 -5.017 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.293 -7.926 -4.477 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -16.434 -6.565 -6.997 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.870 -6.116 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -14.958 -6.591 -7.989 1.00 0.00 H new ATOM 806 N ARG A 53 -12.917 -10.398 -5.193 1.00 0.00 N ATOM 807 CA ARG A 53 -12.710 -11.787 -4.834 1.00 0.00 C ATOM 808 C ARG A 53 -13.262 -12.033 -3.446 1.00 0.00 C ATOM 809 O ARG A 53 -12.927 -11.327 -2.489 1.00 0.00 O ATOM 810 CB ARG A 53 -11.205 -12.119 -4.890 1.00 0.00 C ATOM 811 CG ARG A 53 -10.757 -13.545 -4.484 1.00 0.00 C ATOM 812 CD ARG A 53 -11.294 -14.660 -5.389 1.00 0.00 C ATOM 813 NE ARG A 53 -12.658 -15.082 -5.034 1.00 0.00 N ATOM 814 CZ ARG A 53 -13.641 -15.374 -5.900 1.00 0.00 C ATOM 815 NH1 ARG A 53 -13.514 -15.084 -7.188 1.00 0.00 N ATOM 816 NH2 ARG A 53 -14.770 -15.903 -5.450 1.00 0.00 N ATOM 0 H ARG A 53 -12.641 -9.733 -4.470 1.00 0.00 H new ATOM 0 HA ARG A 53 -13.232 -12.434 -5.539 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -10.862 -11.939 -5.909 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -10.683 -11.410 -4.248 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.668 -13.585 -4.487 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -11.081 -13.737 -3.461 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -11.283 -14.317 -6.424 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.627 -15.520 -5.331 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.876 -15.160 -4.041 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.664 -14.635 -7.528 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -14.267 -15.310 -7.838 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -14.886 -16.085 -4.453 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -15.523 -16.128 -6.101 1.00 0.00 H new ATOM 830 N ALA A 54 -14.122 -12.994 -3.357 1.00 0.00 N ATOM 831 CA ALA A 54 -14.674 -13.426 -2.113 1.00 0.00 C ATOM 832 C ALA A 54 -13.884 -14.605 -1.621 1.00 0.00 C ATOM 833 O ALA A 54 -13.436 -15.442 -2.429 1.00 0.00 O ATOM 834 CB ALA A 54 -16.123 -13.831 -2.304 1.00 0.00 C ATOM 0 H ALA A 54 -14.469 -13.513 -4.164 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.628 -12.614 -1.387 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.538 -14.159 -1.351 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -16.693 -12.979 -2.673 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -16.181 -14.646 -3.025 1.00 0.00 H new ATOM 840 N PHE A 55 -13.669 -14.666 -0.346 1.00 0.00 N ATOM 841 CA PHE A 55 -12.994 -15.775 0.258 1.00 0.00 C ATOM 842 C PHE A 55 -14.012 -16.906 0.383 1.00 0.00 C ATOM 843 O PHE A 55 -14.962 -16.801 1.146 1.00 0.00 O ATOM 844 CB PHE A 55 -12.443 -15.317 1.620 1.00 0.00 C ATOM 845 CG PHE A 55 -11.645 -16.309 2.408 1.00 0.00 C ATOM 846 CD1 PHE A 55 -10.518 -16.906 1.879 1.00 0.00 C ATOM 847 CD2 PHE A 55 -12.000 -16.597 3.708 1.00 0.00 C ATOM 848 CE1 PHE A 55 -9.763 -17.779 2.639 1.00 0.00 C ATOM 849 CE2 PHE A 55 -11.258 -17.470 4.469 1.00 0.00 C ATOM 850 CZ PHE A 55 -10.133 -18.061 3.935 1.00 0.00 C ATOM 0 H PHE A 55 -13.958 -13.943 0.313 1.00 0.00 H new ATOM 0 HA PHE A 55 -12.150 -16.133 -0.332 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -11.819 -14.439 1.453 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -13.285 -14.998 2.234 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.224 -16.689 0.863 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -12.875 -16.130 4.136 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -8.883 -18.240 2.216 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -11.556 -17.692 5.483 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.544 -18.743 4.531 1.00 0.00 H new ATOM 860 N SER A 56 -13.844 -17.944 -0.432 1.00 0.00 N ATOM 861 CA SER A 56 -14.785 -19.065 -0.498 1.00 0.00 C ATOM 862 C SER A 56 -14.811 -19.857 0.813 1.00 0.00 C ATOM 863 O SER A 56 -15.799 -20.519 1.144 1.00 0.00 O ATOM 864 CB SER A 56 -14.403 -19.969 -1.664 1.00 0.00 C ATOM 865 OG SER A 56 -14.194 -19.198 -2.853 1.00 0.00 O ATOM 0 H SER A 56 -13.051 -18.034 -1.067 1.00 0.00 H new ATOM 0 HA SER A 56 -15.789 -18.670 -0.654 1.00 0.00 H new ATOM 0 HB2 SER A 56 -13.497 -20.523 -1.420 1.00 0.00 H new ATOM 0 HB3 SER A 56 -15.190 -20.704 -1.834 1.00 0.00 H new ATOM 0 HG SER A 56 -13.948 -19.794 -3.591 1.00 0.00 H new ATOM 871 N HIS A 57 -13.722 -19.786 1.547 1.00 0.00 N ATOM 872 CA HIS A 57 -13.637 -20.415 2.849 1.00 0.00 C ATOM 873 C HIS A 57 -14.322 -19.523 3.867 1.00 0.00 C ATOM 874 O HIS A 57 -14.618 -18.363 3.575 1.00 0.00 O ATOM 875 CB HIS A 57 -12.173 -20.639 3.257 1.00 0.00 C ATOM 876 CG HIS A 57 -11.457 -21.714 2.506 1.00 0.00 C ATOM 877 ND1 HIS A 57 -10.592 -21.491 1.449 1.00 0.00 N ATOM 878 CD2 HIS A 57 -11.464 -23.035 2.697 1.00 0.00 C ATOM 879 CE1 HIS A 57 -10.113 -22.640 1.033 1.00 0.00 C ATOM 880 NE2 HIS A 57 -10.625 -23.592 1.776 1.00 0.00 N ATOM 0 H HIS A 57 -12.875 -19.294 1.262 1.00 0.00 H new ATOM 0 HA HIS A 57 -14.128 -21.387 2.807 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -11.629 -19.703 3.126 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -12.142 -20.879 4.320 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -10.363 -20.578 1.056 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -12.032 -23.567 3.446 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -9.417 -22.778 0.219 1.00 0.00 H new ATOM 889 N LYS A 58 -14.591 -20.038 5.028 1.00 0.00 N ATOM 890 CA LYS A 58 -15.203 -19.241 6.050 1.00 0.00 C ATOM 891 C LYS A 58 -14.119 -18.639 6.928 1.00 0.00 C ATOM 892 O LYS A 58 -13.325 -19.373 7.549 1.00 0.00 O ATOM 893 CB LYS A 58 -16.194 -20.055 6.876 1.00 0.00 C ATOM 894 CG LYS A 58 -16.935 -19.231 7.927 1.00 0.00 C ATOM 895 CD LYS A 58 -17.968 -20.055 8.670 1.00 0.00 C ATOM 896 CE LYS A 58 -17.326 -21.192 9.437 1.00 0.00 C ATOM 897 NZ LYS A 58 -18.322 -22.006 10.143 1.00 0.00 N ATOM 0 H LYS A 58 -14.397 -21.004 5.292 1.00 0.00 H new ATOM 0 HA LYS A 58 -15.771 -18.438 5.580 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -16.922 -20.514 6.207 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -15.661 -20.866 7.372 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -16.218 -18.822 8.638 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -17.425 -18.385 7.445 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -18.518 -19.415 9.360 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -18.692 -20.456 7.961 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -16.764 -21.823 8.748 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -16.612 -20.788 10.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -17.843 -22.773 10.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -18.842 -21.410 10.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -18.989 -22.412 9.456 1.00 0.00 H new ATOM 911 N PRO A 59 -14.039 -17.309 6.964 1.00 0.00 N ATOM 912 CA PRO A 59 -13.025 -16.600 7.719 1.00 0.00 C ATOM 913 C PRO A 59 -13.288 -16.645 9.226 1.00 0.00 C ATOM 914 O PRO A 59 -14.446 -16.594 9.671 1.00 0.00 O ATOM 915 CB PRO A 59 -13.130 -15.163 7.196 1.00 0.00 C ATOM 916 CG PRO A 59 -14.544 -15.024 6.763 1.00 0.00 C ATOM 917 CD PRO A 59 -14.966 -16.377 6.277 1.00 0.00 C ATOM 0 HA PRO A 59 -12.036 -17.041 7.590 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -12.880 -14.440 7.972 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -12.443 -14.992 6.367 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -15.174 -14.693 7.589 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -14.638 -14.279 5.972 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -16.005 -16.587 6.532 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.881 -16.456 5.193 1.00 0.00 H new ATOM 925 N PRO A 60 -12.231 -16.783 10.031 1.00 0.00 N ATOM 926 CA PRO A 60 -12.353 -16.763 11.474 1.00 0.00 C ATOM 927 C PRO A 60 -12.667 -15.352 11.972 1.00 0.00 C ATOM 928 O PRO A 60 -12.344 -14.346 11.306 1.00 0.00 O ATOM 929 CB PRO A 60 -10.972 -17.213 11.965 1.00 0.00 C ATOM 930 CG PRO A 60 -10.041 -16.857 10.861 1.00 0.00 C ATOM 931 CD PRO A 60 -10.833 -16.982 9.592 1.00 0.00 C ATOM 0 HA PRO A 60 -13.160 -17.400 11.837 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -10.698 -16.708 12.892 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -10.954 -18.284 12.168 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -9.660 -15.843 10.984 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.178 -17.523 10.849 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -10.533 -16.234 8.858 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -10.694 -17.958 9.128 1.00 0.00 H new ATOM 939 N LYS A 61 -13.303 -15.272 13.102 1.00 0.00 N ATOM 940 CA LYS A 61 -13.652 -14.009 13.674 1.00 0.00 C ATOM 941 C LYS A 61 -12.480 -13.499 14.487 1.00 0.00 C ATOM 942 O LYS A 61 -12.013 -14.173 15.421 1.00 0.00 O ATOM 943 CB LYS A 61 -14.898 -14.141 14.551 1.00 0.00 C ATOM 944 CG LYS A 61 -15.460 -12.816 15.032 1.00 0.00 C ATOM 945 CD LYS A 61 -16.687 -13.017 15.904 1.00 0.00 C ATOM 946 CE LYS A 61 -17.350 -11.691 16.255 1.00 0.00 C ATOM 947 NZ LYS A 61 -16.462 -10.784 17.014 1.00 0.00 N ATOM 0 H LYS A 61 -13.594 -16.080 13.652 1.00 0.00 H new ATOM 0 HA LYS A 61 -13.880 -13.300 12.878 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -15.670 -14.669 13.990 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -14.656 -14.757 15.417 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -14.697 -12.278 15.594 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -15.720 -12.196 14.174 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.402 -13.656 15.385 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -16.402 -13.535 16.820 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -17.668 -11.196 15.337 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -18.249 -11.884 16.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -16.988 -9.928 17.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -16.124 -11.266 17.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -15.649 -10.519 16.422 1.00 0.00 H new ATOM 961 N VAL A 62 -11.974 -12.363 14.106 1.00 0.00 N ATOM 962 CA VAL A 62 -10.873 -11.759 14.809 1.00 0.00 C ATOM 963 C VAL A 62 -11.383 -10.845 15.919 1.00 0.00 C ATOM 964 O VAL A 62 -12.541 -10.409 15.891 1.00 0.00 O ATOM 965 CB VAL A 62 -9.888 -11.027 13.858 1.00 0.00 C ATOM 966 CG1 VAL A 62 -9.145 -12.040 12.998 1.00 0.00 C ATOM 967 CG2 VAL A 62 -10.623 -10.048 12.964 1.00 0.00 C ATOM 0 H VAL A 62 -12.308 -11.829 13.304 1.00 0.00 H new ATOM 0 HA VAL A 62 -10.299 -12.563 15.270 1.00 0.00 H new ATOM 0 HB VAL A 62 -9.176 -10.473 14.470 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -8.456 -11.518 12.334 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -8.585 -12.721 13.639 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -9.861 -12.608 12.404 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -9.910 -9.549 12.308 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -11.356 -10.585 12.362 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -11.132 -9.306 13.579 1.00 0.00 H new ATOM 977 N GLY A 63 -10.536 -10.574 16.885 1.00 0.00 N ATOM 978 CA GLY A 63 -10.952 -9.831 18.050 1.00 0.00 C ATOM 979 C GLY A 63 -10.952 -8.331 17.862 1.00 0.00 C ATOM 980 O GLY A 63 -12.013 -7.694 17.833 1.00 0.00 O ATOM 0 H GLY A 63 -9.556 -10.857 16.887 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -11.955 -10.150 18.331 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -10.293 -10.082 18.881 1.00 0.00 H new ATOM 984 N ASN A 64 -9.782 -7.764 17.747 1.00 0.00 N ATOM 985 CA ASN A 64 -9.647 -6.320 17.629 1.00 0.00 C ATOM 986 C ASN A 64 -9.846 -5.821 16.202 1.00 0.00 C ATOM 987 O ASN A 64 -10.374 -4.722 15.985 1.00 0.00 O ATOM 988 CB ASN A 64 -8.321 -5.840 18.246 1.00 0.00 C ATOM 989 CG ASN A 64 -7.988 -4.386 17.939 1.00 0.00 C ATOM 990 OD1 ASN A 64 -8.418 -3.471 18.643 1.00 0.00 O ATOM 991 ND2 ASN A 64 -7.184 -4.166 16.924 1.00 0.00 N ATOM 0 H ASN A 64 -8.899 -8.274 17.731 1.00 0.00 H new ATOM 0 HA ASN A 64 -10.457 -5.872 18.205 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -8.366 -5.972 19.327 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -7.512 -6.473 17.881 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -6.897 -3.214 16.698 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -6.847 -4.947 16.362 1.00 0.00 H new ATOM 998 N LEU A 65 -9.465 -6.619 15.238 1.00 0.00 N ATOM 999 CA LEU A 65 -9.633 -6.238 13.853 1.00 0.00 C ATOM 1000 C LEU A 65 -11.068 -6.479 13.415 1.00 0.00 C ATOM 1001 O LEU A 65 -11.775 -7.298 14.005 1.00 0.00 O ATOM 1002 CB LEU A 65 -8.663 -6.996 12.926 1.00 0.00 C ATOM 1003 CG LEU A 65 -7.177 -6.687 13.079 1.00 0.00 C ATOM 1004 CD1 LEU A 65 -6.365 -7.480 12.076 1.00 0.00 C ATOM 1005 CD2 LEU A 65 -6.908 -5.197 12.929 1.00 0.00 C ATOM 0 H LEU A 65 -9.038 -7.534 15.382 1.00 0.00 H new ATOM 0 HA LEU A 65 -9.402 -5.176 13.774 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.805 -8.065 13.087 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.948 -6.788 11.895 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.872 -6.982 14.083 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -5.307 -7.247 12.199 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -6.524 -8.546 12.241 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.679 -7.218 11.066 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -5.841 -5.007 13.043 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.232 -4.866 11.942 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.458 -4.649 13.694 1.00 0.00 H new ATOM 1017 N PRO A 66 -11.543 -5.733 12.432 1.00 0.00 N ATOM 1018 CA PRO A 66 -12.860 -5.942 11.878 1.00 0.00 C ATOM 1019 C PRO A 66 -12.859 -7.069 10.831 1.00 0.00 C ATOM 1020 O PRO A 66 -11.850 -7.297 10.134 1.00 0.00 O ATOM 1021 CB PRO A 66 -13.172 -4.600 11.228 1.00 0.00 C ATOM 1022 CG PRO A 66 -11.845 -4.051 10.827 1.00 0.00 C ATOM 1023 CD PRO A 66 -10.849 -4.584 11.808 1.00 0.00 C ATOM 0 HA PRO A 66 -13.592 -6.245 12.626 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -13.827 -4.722 10.365 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -13.682 -3.933 11.923 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -11.590 -4.355 9.812 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -11.857 -2.961 10.840 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -9.928 -4.894 11.314 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -10.576 -3.832 12.548 1.00 0.00 H new ATOM 1031 N GLN A 67 -13.987 -7.734 10.694 1.00 0.00 N ATOM 1032 CA GLN A 67 -14.139 -8.846 9.768 1.00 0.00 C ATOM 1033 C GLN A 67 -13.953 -8.427 8.323 1.00 0.00 C ATOM 1034 O GLN A 67 -13.490 -9.221 7.509 1.00 0.00 O ATOM 1035 CB GLN A 67 -15.474 -9.560 9.943 1.00 0.00 C ATOM 1036 CG GLN A 67 -15.570 -10.403 11.201 1.00 0.00 C ATOM 1037 CD GLN A 67 -14.494 -11.476 11.253 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -13.415 -11.272 11.811 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -14.744 -12.592 10.619 1.00 0.00 N ATOM 0 H GLN A 67 -14.832 -7.520 11.224 1.00 0.00 H new ATOM 0 HA GLN A 67 -13.343 -9.548 10.016 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.271 -8.817 9.956 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -15.647 -10.199 9.077 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -15.482 -9.759 12.076 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -16.552 -10.873 11.248 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.648 -12.730 10.167 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -14.035 -13.324 10.577 1.00 0.00 H new ATOM 1048 N TYR A 68 -14.290 -7.182 7.999 1.00 0.00 N ATOM 1049 CA TYR A 68 -14.093 -6.703 6.638 1.00 0.00 C ATOM 1050 C TYR A 68 -12.612 -6.687 6.229 1.00 0.00 C ATOM 1051 O TYR A 68 -12.271 -6.958 5.069 1.00 0.00 O ATOM 1052 CB TYR A 68 -14.837 -5.370 6.322 1.00 0.00 C ATOM 1053 CG TYR A 68 -14.630 -4.214 7.285 1.00 0.00 C ATOM 1054 CD1 TYR A 68 -13.472 -3.454 7.271 1.00 0.00 C ATOM 1055 CD2 TYR A 68 -15.620 -3.868 8.186 1.00 0.00 C ATOM 1056 CE1 TYR A 68 -13.304 -2.391 8.132 1.00 0.00 C ATOM 1057 CE2 TYR A 68 -15.463 -2.807 9.053 1.00 0.00 C ATOM 1058 CZ TYR A 68 -14.303 -2.075 9.023 1.00 0.00 C ATOM 1059 OH TYR A 68 -14.137 -1.026 9.888 1.00 0.00 O ATOM 0 H TYR A 68 -14.691 -6.502 8.644 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.576 -7.441 5.998 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -14.533 -5.041 5.329 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.905 -5.582 6.274 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.686 -3.699 6.572 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.535 -4.441 8.211 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -12.394 -1.810 8.107 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.248 -2.554 9.751 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.935 -0.935 10.449 1.00 0.00 H new ATOM 1069 N GLU A 69 -11.724 -6.433 7.181 1.00 0.00 N ATOM 1070 CA GLU A 69 -10.313 -6.473 6.863 1.00 0.00 C ATOM 1071 C GLU A 69 -9.757 -7.864 7.069 1.00 0.00 C ATOM 1072 O GLU A 69 -8.791 -8.247 6.431 1.00 0.00 O ATOM 1073 CB GLU A 69 -9.495 -5.404 7.579 1.00 0.00 C ATOM 1074 CG GLU A 69 -9.941 -4.003 7.216 1.00 0.00 C ATOM 1075 CD GLU A 69 -8.879 -2.967 7.412 1.00 0.00 C ATOM 1076 OE1 GLU A 69 -8.114 -2.703 6.448 1.00 0.00 O ATOM 1077 OE2 GLU A 69 -8.803 -2.384 8.500 1.00 0.00 O ATOM 0 H GLU A 69 -11.950 -6.204 8.149 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.222 -6.228 5.805 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.582 -5.543 8.657 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.442 -5.525 7.326 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.261 -3.991 6.174 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.810 -3.739 7.819 1.00 0.00 H new ATOM 1084 N SER A 70 -10.403 -8.636 7.934 1.00 0.00 N ATOM 1085 CA SER A 70 -10.047 -10.034 8.118 1.00 0.00 C ATOM 1086 C SER A 70 -10.281 -10.768 6.779 1.00 0.00 C ATOM 1087 O SER A 70 -9.463 -11.571 6.349 1.00 0.00 O ATOM 1088 CB SER A 70 -10.889 -10.658 9.254 1.00 0.00 C ATOM 1089 OG SER A 70 -10.477 -11.981 9.563 1.00 0.00 O ATOM 0 H SER A 70 -11.176 -8.316 8.518 1.00 0.00 H new ATOM 0 HA SER A 70 -9.000 -10.126 8.405 1.00 0.00 H new ATOM 0 HB2 SER A 70 -10.809 -10.037 10.146 1.00 0.00 H new ATOM 0 HB3 SER A 70 -11.940 -10.665 8.963 1.00 0.00 H new ATOM 0 HG SER A 70 -11.034 -12.337 10.287 1.00 0.00 H new ATOM 1095 N GLU A 71 -11.386 -10.406 6.108 1.00 0.00 N ATOM 1096 CA GLU A 71 -11.750 -10.920 4.784 1.00 0.00 C ATOM 1097 C GLU A 71 -10.601 -10.620 3.809 1.00 0.00 C ATOM 1098 O GLU A 71 -10.144 -11.497 3.082 1.00 0.00 O ATOM 1099 CB GLU A 71 -13.013 -10.176 4.318 1.00 0.00 C ATOM 1100 CG GLU A 71 -13.688 -10.690 3.049 1.00 0.00 C ATOM 1101 CD GLU A 71 -14.410 -12.006 3.238 1.00 0.00 C ATOM 1102 OE1 GLU A 71 -15.147 -12.144 4.239 1.00 0.00 O ATOM 1103 OE2 GLU A 71 -14.326 -12.887 2.354 1.00 0.00 O ATOM 0 H GLU A 71 -12.061 -9.737 6.479 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.933 -11.994 4.820 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.743 -10.207 5.127 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -12.752 -9.129 4.164 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -14.399 -9.942 2.697 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.936 -10.807 2.269 1.00 0.00 H new ATOM 1110 N ALA A 72 -10.119 -9.366 3.842 1.00 0.00 N ATOM 1111 CA ALA A 72 -9.014 -8.928 2.987 1.00 0.00 C ATOM 1112 C ALA A 72 -7.754 -9.746 3.251 1.00 0.00 C ATOM 1113 O ALA A 72 -7.120 -10.241 2.314 1.00 0.00 O ATOM 1114 CB ALA A 72 -8.744 -7.444 3.179 1.00 0.00 C ATOM 0 H ALA A 72 -10.483 -8.638 4.457 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.306 -9.093 1.950 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.920 -7.138 2.535 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -9.637 -6.875 2.920 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.482 -7.254 4.220 1.00 0.00 H new ATOM 1120 N ILE A 73 -7.423 -9.914 4.527 1.00 0.00 N ATOM 1121 CA ILE A 73 -6.270 -10.712 4.935 1.00 0.00 C ATOM 1122 C ILE A 73 -6.424 -12.153 4.448 1.00 0.00 C ATOM 1123 O ILE A 73 -5.496 -12.733 3.894 1.00 0.00 O ATOM 1124 CB ILE A 73 -6.078 -10.713 6.484 1.00 0.00 C ATOM 1125 CG1 ILE A 73 -5.845 -9.287 7.004 1.00 0.00 C ATOM 1126 CG2 ILE A 73 -4.919 -11.630 6.892 1.00 0.00 C ATOM 1127 CD1 ILE A 73 -5.662 -9.200 8.505 1.00 0.00 C ATOM 0 H ILE A 73 -7.942 -9.504 5.304 1.00 0.00 H new ATOM 0 HA ILE A 73 -5.389 -10.257 4.482 1.00 0.00 H new ATOM 0 HB ILE A 73 -6.992 -11.099 6.936 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.962 -8.873 6.516 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.691 -8.663 6.715 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.806 -11.613 7.976 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.128 -12.648 6.565 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.998 -11.281 6.426 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.503 -8.161 8.792 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.553 -9.582 9.003 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.798 -9.795 8.801 1.00 0.00 H new ATOM 1139 N MET A 74 -7.611 -12.701 4.626 1.00 0.00 N ATOM 1140 CA MET A 74 -7.905 -14.069 4.231 1.00 0.00 C ATOM 1141 C MET A 74 -7.800 -14.264 2.726 1.00 0.00 C ATOM 1142 O MET A 74 -7.273 -15.267 2.276 1.00 0.00 O ATOM 1143 CB MET A 74 -9.261 -14.529 4.750 1.00 0.00 C ATOM 1144 CG MET A 74 -9.406 -14.663 6.281 1.00 0.00 C ATOM 1145 SD MET A 74 -8.463 -16.029 7.057 1.00 0.00 S ATOM 1146 CE MET A 74 -6.778 -15.405 7.118 1.00 0.00 C ATOM 0 H MET A 74 -8.400 -12.212 5.048 1.00 0.00 H new ATOM 0 HA MET A 74 -7.144 -14.697 4.694 1.00 0.00 H new ATOM 0 HB2 MET A 74 -10.017 -13.828 4.396 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.488 -15.496 4.300 1.00 0.00 H new ATOM 0 HG2 MET A 74 -9.093 -13.725 6.740 1.00 0.00 H new ATOM 0 HG3 MET A 74 -10.462 -14.797 6.516 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.360 -15.583 8.109 1.00 0.00 H new ATOM 0 HE2 MET A 74 -6.173 -15.919 6.371 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.779 -14.335 6.911 1.00 0.00 H new ATOM 1156 N VAL A 75 -8.275 -13.305 1.953 1.00 0.00 N ATOM 1157 CA VAL A 75 -8.155 -13.378 0.498 1.00 0.00 C ATOM 1158 C VAL A 75 -6.687 -13.257 0.069 1.00 0.00 C ATOM 1159 O VAL A 75 -6.217 -13.997 -0.817 1.00 0.00 O ATOM 1160 CB VAL A 75 -9.043 -12.320 -0.223 1.00 0.00 C ATOM 1161 CG1 VAL A 75 -8.767 -12.283 -1.721 1.00 0.00 C ATOM 1162 CG2 VAL A 75 -10.508 -12.640 0.012 1.00 0.00 C ATOM 0 H VAL A 75 -8.746 -12.469 2.300 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.524 -14.357 0.191 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.801 -11.341 0.191 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -9.405 -11.534 -2.190 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -7.721 -12.028 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -8.977 -13.261 -2.154 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -11.128 -11.899 -0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -10.732 -13.631 -0.383 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.718 -12.620 1.081 1.00 0.00 H new ATOM 1172 N ALA A 76 -5.957 -12.368 0.725 1.00 0.00 N ATOM 1173 CA ALA A 76 -4.539 -12.192 0.457 1.00 0.00 C ATOM 1174 C ALA A 76 -3.766 -13.448 0.836 1.00 0.00 C ATOM 1175 O ALA A 76 -2.754 -13.760 0.238 1.00 0.00 O ATOM 1176 CB ALA A 76 -4.001 -10.983 1.201 1.00 0.00 C ATOM 0 H ALA A 76 -6.327 -11.754 1.451 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.408 -12.019 -0.611 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.938 -10.868 0.988 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.535 -10.089 0.878 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.143 -11.122 2.273 1.00 0.00 H new ATOM 1182 N PHE A 77 -4.274 -14.160 1.818 1.00 0.00 N ATOM 1183 CA PHE A 77 -3.704 -15.416 2.285 1.00 0.00 C ATOM 1184 C PHE A 77 -4.060 -16.553 1.316 1.00 0.00 C ATOM 1185 O PHE A 77 -3.214 -17.388 0.986 1.00 0.00 O ATOM 1186 CB PHE A 77 -4.245 -15.708 3.700 1.00 0.00 C ATOM 1187 CG PHE A 77 -3.760 -16.976 4.345 1.00 0.00 C ATOM 1188 CD1 PHE A 77 -2.524 -17.023 4.965 1.00 0.00 C ATOM 1189 CD2 PHE A 77 -4.553 -18.115 4.351 1.00 0.00 C ATOM 1190 CE1 PHE A 77 -2.085 -18.181 5.575 1.00 0.00 C ATOM 1191 CE2 PHE A 77 -4.121 -19.274 4.961 1.00 0.00 C ATOM 1192 CZ PHE A 77 -2.885 -19.306 5.573 1.00 0.00 C ATOM 0 H PHE A 77 -5.112 -13.881 2.328 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.617 -15.341 2.323 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.982 -14.871 4.347 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.333 -15.743 3.651 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.896 -16.144 4.972 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.521 -18.093 3.872 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.117 -18.207 6.053 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -4.748 -20.153 4.960 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.543 -20.212 6.051 1.00 0.00 H new ATOM 1202 N GLU A 78 -5.310 -16.554 0.867 1.00 0.00 N ATOM 1203 CA GLU A 78 -5.852 -17.540 -0.064 1.00 0.00 C ATOM 1204 C GLU A 78 -5.056 -17.520 -1.376 1.00 0.00 C ATOM 1205 O GLU A 78 -4.617 -18.555 -1.870 1.00 0.00 O ATOM 1206 CB GLU A 78 -7.319 -17.183 -0.363 1.00 0.00 C ATOM 1207 CG GLU A 78 -8.089 -18.192 -1.206 1.00 0.00 C ATOM 1208 CD GLU A 78 -8.523 -19.421 -0.433 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -7.685 -20.302 -0.149 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -9.738 -19.534 -0.116 1.00 0.00 O ATOM 0 H GLU A 78 -5.994 -15.851 1.147 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.784 -18.533 0.380 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -7.842 -17.055 0.585 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.342 -16.220 -0.872 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.970 -17.706 -1.625 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.467 -18.502 -2.046 1.00 0.00 H new ATOM 1217 N LEU A 79 -4.860 -16.329 -1.915 1.00 0.00 N ATOM 1218 CA LEU A 79 -4.165 -16.159 -3.190 1.00 0.00 C ATOM 1219 C LEU A 79 -2.661 -16.041 -3.005 1.00 0.00 C ATOM 1220 O LEU A 79 -1.898 -16.250 -3.957 1.00 0.00 O ATOM 1221 CB LEU A 79 -4.673 -14.896 -3.902 1.00 0.00 C ATOM 1222 CG LEU A 79 -6.157 -14.864 -4.269 1.00 0.00 C ATOM 1223 CD1 LEU A 79 -6.518 -13.522 -4.884 1.00 0.00 C ATOM 1224 CD2 LEU A 79 -6.491 -15.990 -5.233 1.00 0.00 C ATOM 0 H LEU A 79 -5.173 -15.456 -1.490 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.373 -17.045 -3.790 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.462 -14.038 -3.264 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.094 -14.764 -4.816 1.00 0.00 H new ATOM 0 HG LEU A 79 -6.741 -15.002 -3.359 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -7.577 -13.513 -5.141 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -6.311 -12.726 -4.168 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.925 -13.363 -5.785 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.551 -15.952 -5.483 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.899 -15.879 -6.142 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.262 -16.948 -4.766 1.00 0.00 H new ATOM 1236 N ASN A 80 -2.253 -15.718 -1.788 1.00 0.00 N ATOM 1237 CA ASN A 80 -0.862 -15.405 -1.431 1.00 0.00 C ATOM 1238 C ASN A 80 -0.436 -14.227 -2.272 1.00 0.00 C ATOM 1239 O ASN A 80 0.315 -14.339 -3.255 1.00 0.00 O ATOM 1240 CB ASN A 80 0.120 -16.583 -1.561 1.00 0.00 C ATOM 1241 CG ASN A 80 1.440 -16.308 -0.841 1.00 0.00 C ATOM 1242 OD1 ASN A 80 1.585 -16.627 0.333 1.00 0.00 O ATOM 1243 ND2 ASN A 80 2.393 -15.710 -1.513 1.00 0.00 N ATOM 0 H ASN A 80 -2.891 -15.662 -0.994 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.831 -15.168 -0.368 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -0.337 -17.483 -1.150 1.00 0.00 H new ATOM 0 HB3 ASN A 80 0.316 -16.778 -2.615 1.00 0.00 H new ATOM 0 HD21 ASN A 80 3.282 -15.499 -1.059 1.00 0.00 H new ATOM 0 HD22 ASN A 80 2.246 -15.455 -2.490 1.00 0.00 H new ATOM 1250 N ALA A 81 -1.030 -13.136 -1.954 1.00 0.00 N ATOM 1251 CA ALA A 81 -0.882 -11.922 -2.698 1.00 0.00 C ATOM 1252 C ALA A 81 -0.309 -10.833 -1.823 1.00 0.00 C ATOM 1253 O ALA A 81 0.028 -11.076 -0.662 1.00 0.00 O ATOM 1254 CB ALA A 81 -2.248 -11.514 -3.216 1.00 0.00 C ATOM 0 H ALA A 81 -1.651 -13.052 -1.149 1.00 0.00 H new ATOM 0 HA ALA A 81 -0.196 -12.078 -3.530 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.159 -10.590 -3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.643 -12.301 -3.858 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -2.924 -11.358 -2.375 1.00 0.00 H new ATOM 1260 N LEU A 82 -0.177 -9.648 -2.376 1.00 0.00 N ATOM 1261 CA LEU A 82 0.261 -8.516 -1.597 1.00 0.00 C ATOM 1262 C LEU A 82 -0.933 -7.946 -0.911 1.00 0.00 C ATOM 1263 O LEU A 82 -1.994 -7.876 -1.506 1.00 0.00 O ATOM 1264 CB LEU A 82 0.897 -7.416 -2.466 1.00 0.00 C ATOM 1265 CG LEU A 82 2.221 -7.738 -3.155 1.00 0.00 C ATOM 1266 CD1 LEU A 82 2.751 -6.508 -3.865 1.00 0.00 C ATOM 1267 CD2 LEU A 82 3.228 -8.236 -2.144 1.00 0.00 C ATOM 0 H LEU A 82 -0.366 -9.445 -3.358 1.00 0.00 H new ATOM 0 HA LEU A 82 1.018 -8.858 -0.892 1.00 0.00 H new ATOM 0 HB2 LEU A 82 0.177 -7.137 -3.235 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.049 -6.538 -1.838 1.00 0.00 H new ATOM 0 HG LEU A 82 2.053 -8.522 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.696 -6.748 -4.353 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.029 -6.180 -4.613 1.00 0.00 H new ATOM 0 HD13 LEU A 82 2.910 -5.710 -3.140 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.168 -8.462 -2.648 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.396 -7.468 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.847 -9.138 -1.665 1.00 0.00 H new ATOM 1279 N LEU A 83 -0.802 -7.586 0.318 1.00 0.00 N ATOM 1280 CA LEU A 83 -1.896 -6.950 0.988 1.00 0.00 C ATOM 1281 C LEU A 83 -1.568 -5.493 1.197 1.00 0.00 C ATOM 1282 O LEU A 83 -0.610 -5.155 1.882 1.00 0.00 O ATOM 1283 CB LEU A 83 -2.238 -7.628 2.318 1.00 0.00 C ATOM 1284 CG LEU A 83 -3.451 -7.047 3.067 1.00 0.00 C ATOM 1285 CD1 LEU A 83 -4.733 -7.246 2.274 1.00 0.00 C ATOM 1286 CD2 LEU A 83 -3.579 -7.655 4.442 1.00 0.00 C ATOM 0 H LEU A 83 0.039 -7.716 0.880 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.781 -7.043 0.359 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.422 -8.686 2.130 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.367 -7.568 2.971 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.286 -5.976 3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.572 -6.826 2.828 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -4.646 -6.744 1.310 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.901 -8.311 2.114 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.444 -7.227 4.950 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.708 -8.734 4.352 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -2.678 -7.444 5.019 1.00 0.00 H new ATOM 1298 N ILE A 84 -2.329 -4.650 0.582 1.00 0.00 N ATOM 1299 CA ILE A 84 -2.145 -3.235 0.706 1.00 0.00 C ATOM 1300 C ILE A 84 -3.084 -2.749 1.788 1.00 0.00 C ATOM 1301 O ILE A 84 -4.310 -2.776 1.617 1.00 0.00 O ATOM 1302 CB ILE A 84 -2.462 -2.509 -0.628 1.00 0.00 C ATOM 1303 CG1 ILE A 84 -1.641 -3.123 -1.777 1.00 0.00 C ATOM 1304 CG2 ILE A 84 -2.160 -1.016 -0.498 1.00 0.00 C ATOM 1305 CD1 ILE A 84 -1.967 -2.560 -3.146 1.00 0.00 C ATOM 0 H ILE A 84 -3.102 -4.921 -0.026 1.00 0.00 H new ATOM 0 HA ILE A 84 -1.107 -3.019 0.958 1.00 0.00 H new ATOM 0 HB ILE A 84 -3.521 -2.634 -0.853 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.581 -2.966 -1.575 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -1.807 -4.200 -1.791 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -2.386 -0.516 -1.440 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.773 -0.589 0.296 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -1.106 -0.878 -0.257 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.345 -3.046 -3.897 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.018 -2.741 -3.373 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.773 -1.487 -3.154 1.00 0.00 H new ATOM 1317 N ALA A 85 -2.535 -2.352 2.898 1.00 0.00 N ATOM 1318 CA ALA A 85 -3.333 -1.935 4.019 1.00 0.00 C ATOM 1319 C ALA A 85 -2.747 -0.703 4.643 1.00 0.00 C ATOM 1320 O ALA A 85 -1.539 -0.528 4.653 1.00 0.00 O ATOM 1321 CB ALA A 85 -3.423 -3.053 5.049 1.00 0.00 C ATOM 0 H ALA A 85 -1.528 -2.307 3.054 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.338 -1.705 3.665 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.030 -2.723 5.892 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.881 -3.931 4.594 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -2.422 -3.306 5.400 1.00 0.00 H new ATOM 1327 N GLU A 86 -3.593 0.142 5.158 1.00 0.00 N ATOM 1328 CA GLU A 86 -3.143 1.343 5.815 1.00 0.00 C ATOM 1329 C GLU A 86 -3.107 1.162 7.308 1.00 0.00 C ATOM 1330 O GLU A 86 -2.381 1.870 8.008 1.00 0.00 O ATOM 1331 CB GLU A 86 -3.993 2.539 5.431 1.00 0.00 C ATOM 1332 CG GLU A 86 -3.675 3.085 4.059 1.00 0.00 C ATOM 1333 CD GLU A 86 -2.317 3.729 4.020 1.00 0.00 C ATOM 1334 OE1 GLU A 86 -2.232 4.938 4.303 1.00 0.00 O ATOM 1335 OE2 GLU A 86 -1.313 3.054 3.724 1.00 0.00 O ATOM 0 H GLU A 86 -4.606 0.023 5.137 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.126 1.541 5.476 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.045 2.254 5.466 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.852 3.328 6.170 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.717 2.278 3.327 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.433 3.815 3.773 1.00 0.00 H new ATOM 1342 N ASP A 87 -3.877 0.218 7.803 1.00 0.00 N ATOM 1343 CA ASP A 87 -3.882 -0.067 9.225 1.00 0.00 C ATOM 1344 C ASP A 87 -2.738 -1.018 9.521 1.00 0.00 C ATOM 1345 O ASP A 87 -2.650 -2.097 8.933 1.00 0.00 O ATOM 1346 CB ASP A 87 -5.201 -0.687 9.667 1.00 0.00 C ATOM 1347 CG ASP A 87 -5.321 -0.759 11.169 1.00 0.00 C ATOM 1348 OD1 ASP A 87 -4.639 -1.598 11.799 1.00 0.00 O ATOM 1349 OD2 ASP A 87 -6.074 0.068 11.753 1.00 0.00 O ATOM 0 H ASP A 87 -4.505 -0.363 7.248 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.761 0.866 9.776 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.028 -0.102 9.266 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.288 -1.690 9.249 1.00 0.00 H new ATOM 1354 N LYS A 88 -1.879 -0.634 10.435 1.00 0.00 N ATOM 1355 CA LYS A 88 -0.653 -1.380 10.699 1.00 0.00 C ATOM 1356 C LYS A 88 -0.861 -2.676 11.457 1.00 0.00 C ATOM 1357 O LYS A 88 0.027 -3.534 11.467 1.00 0.00 O ATOM 1358 CB LYS A 88 0.456 -0.516 11.347 1.00 0.00 C ATOM 1359 CG LYS A 88 1.161 0.460 10.388 1.00 0.00 C ATOM 1360 CD LYS A 88 0.222 1.516 9.835 1.00 0.00 C ATOM 1361 CE LYS A 88 0.891 2.375 8.782 1.00 0.00 C ATOM 1362 NZ LYS A 88 -0.044 3.362 8.222 1.00 0.00 N ATOM 0 H LYS A 88 -2.000 0.195 11.016 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.302 -1.668 9.708 1.00 0.00 H new ATOM 0 HB2 LYS A 88 0.019 0.055 12.167 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.204 -1.178 11.783 1.00 0.00 H new ATOM 0 HG2 LYS A 88 1.983 0.948 10.912 1.00 0.00 H new ATOM 0 HG3 LYS A 88 1.598 -0.101 9.562 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -0.655 1.032 9.405 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -0.131 2.149 10.649 1.00 0.00 H new ATOM 0 HE2 LYS A 88 1.747 2.889 9.220 1.00 0.00 H new ATOM 0 HE3 LYS A 88 1.275 1.741 7.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 0.311 3.694 7.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -0.978 2.922 8.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -0.128 4.169 8.873 1.00 0.00 H new ATOM 1376 N ASP A 89 -2.004 -2.852 12.082 1.00 0.00 N ATOM 1377 CA ASP A 89 -2.231 -4.098 12.796 1.00 0.00 C ATOM 1378 C ASP A 89 -2.659 -5.148 11.800 1.00 0.00 C ATOM 1379 O ASP A 89 -2.263 -6.303 11.891 1.00 0.00 O ATOM 1380 CB ASP A 89 -3.243 -3.960 13.934 1.00 0.00 C ATOM 1381 CG ASP A 89 -3.303 -5.216 14.791 1.00 0.00 C ATOM 1382 OD1 ASP A 89 -2.511 -5.329 15.770 1.00 0.00 O ATOM 1383 OD2 ASP A 89 -4.117 -6.106 14.525 1.00 0.00 O ATOM 0 H ASP A 89 -2.769 -2.178 12.114 1.00 0.00 H new ATOM 0 HA ASP A 89 -1.299 -4.395 13.276 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.975 -3.107 14.557 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -4.230 -3.755 13.520 1.00 0.00 H new ATOM 1388 N VAL A 90 -3.419 -4.703 10.801 1.00 0.00 N ATOM 1389 CA VAL A 90 -3.830 -5.547 9.677 1.00 0.00 C ATOM 1390 C VAL A 90 -2.581 -6.031 8.946 1.00 0.00 C ATOM 1391 O VAL A 90 -2.451 -7.220 8.613 1.00 0.00 O ATOM 1392 CB VAL A 90 -4.738 -4.752 8.688 1.00 0.00 C ATOM 1393 CG1 VAL A 90 -5.117 -5.585 7.472 1.00 0.00 C ATOM 1394 CG2 VAL A 90 -5.985 -4.275 9.392 1.00 0.00 C ATOM 0 H VAL A 90 -3.768 -3.746 10.747 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.400 -6.394 10.058 1.00 0.00 H new ATOM 0 HB VAL A 90 -4.166 -3.893 8.339 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -5.749 -4.994 6.809 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.214 -5.885 6.940 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -5.660 -6.474 7.794 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.610 -3.722 8.691 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -6.539 -5.133 9.772 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.708 -3.625 10.222 1.00 0.00 H new ATOM 1404 N ILE A 91 -1.654 -5.099 8.736 1.00 0.00 N ATOM 1405 CA ILE A 91 -0.374 -5.384 8.112 1.00 0.00 C ATOM 1406 C ILE A 91 0.390 -6.437 8.916 1.00 0.00 C ATOM 1407 O ILE A 91 0.813 -7.462 8.369 1.00 0.00 O ATOM 1408 CB ILE A 91 0.480 -4.091 7.990 1.00 0.00 C ATOM 1409 CG1 ILE A 91 -0.227 -3.080 7.084 1.00 0.00 C ATOM 1410 CG2 ILE A 91 1.881 -4.399 7.465 1.00 0.00 C ATOM 1411 CD1 ILE A 91 0.468 -1.746 6.985 1.00 0.00 C ATOM 0 H ILE A 91 -1.775 -4.121 8.997 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.565 -5.772 7.111 1.00 0.00 H new ATOM 0 HB ILE A 91 0.589 -3.658 8.984 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.316 -3.505 6.084 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.240 -2.923 7.455 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.453 -3.474 7.391 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.384 -5.083 8.149 1.00 0.00 H new ATOM 0 HG23 ILE A 91 1.807 -4.860 6.480 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.098 -1.089 6.325 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.534 -1.296 7.975 1.00 0.00 H new ATOM 0 HD13 ILE A 91 1.471 -1.887 6.583 1.00 0.00 H new ATOM 1423 N ASN A 92 0.526 -6.197 10.215 1.00 0.00 N ATOM 1424 CA ASN A 92 1.247 -7.109 11.105 1.00 0.00 C ATOM 1425 C ASN A 92 0.616 -8.499 11.099 1.00 0.00 C ATOM 1426 O ASN A 92 1.317 -9.496 10.939 1.00 0.00 O ATOM 1427 CB ASN A 92 1.306 -6.548 12.543 1.00 0.00 C ATOM 1428 CG ASN A 92 2.097 -7.437 13.505 1.00 0.00 C ATOM 1429 OD1 ASN A 92 3.321 -7.324 13.603 1.00 0.00 O ATOM 1430 ND2 ASN A 92 1.419 -8.279 14.251 1.00 0.00 N ATOM 0 H ASN A 92 0.145 -5.374 10.681 1.00 0.00 H new ATOM 0 HA ASN A 92 2.267 -7.198 10.730 1.00 0.00 H new ATOM 0 HB2 ASN A 92 1.757 -5.556 12.521 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.291 -6.428 12.921 1.00 0.00 H new ATOM 0 HD21 ASN A 92 1.905 -8.861 14.934 1.00 0.00 H new ATOM 0 HD22 ASN A 92 0.407 -8.351 14.148 1.00 0.00 H new ATOM 1437 N LYS A 93 -0.707 -8.531 11.208 1.00 0.00 N ATOM 1438 CA LYS A 93 -1.503 -9.760 11.271 1.00 0.00 C ATOM 1439 C LYS A 93 -1.259 -10.617 10.014 1.00 0.00 C ATOM 1440 O LYS A 93 -0.973 -11.828 10.102 1.00 0.00 O ATOM 1441 CB LYS A 93 -2.993 -9.351 11.362 1.00 0.00 C ATOM 1442 CG LYS A 93 -3.977 -10.382 11.933 1.00 0.00 C ATOM 1443 CD LYS A 93 -4.158 -11.626 11.088 1.00 0.00 C ATOM 1444 CE LYS A 93 -5.160 -12.574 11.730 1.00 0.00 C ATOM 1445 NZ LYS A 93 -4.780 -12.934 13.112 1.00 0.00 N ATOM 0 H LYS A 93 -1.274 -7.684 11.257 1.00 0.00 H new ATOM 0 HA LYS A 93 -1.219 -10.354 12.140 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.058 -8.450 11.972 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.330 -9.083 10.361 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -3.634 -10.680 12.924 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.948 -9.904 12.062 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.501 -11.348 10.092 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.200 -12.131 10.966 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -6.146 -12.109 11.735 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.238 -13.480 11.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.319 -13.770 13.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.763 -13.147 13.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -4.990 -12.139 13.748 1.00 0.00 H new ATOM 1459 N ALA A 94 -1.361 -9.988 8.861 1.00 0.00 N ATOM 1460 CA ALA A 94 -1.189 -10.674 7.597 1.00 0.00 C ATOM 1461 C ALA A 94 0.248 -11.121 7.411 1.00 0.00 C ATOM 1462 O ALA A 94 0.507 -12.209 6.885 1.00 0.00 O ATOM 1463 CB ALA A 94 -1.620 -9.785 6.460 1.00 0.00 C ATOM 0 H ALA A 94 -1.564 -8.992 8.774 1.00 0.00 H new ATOM 0 HA ALA A 94 -1.818 -11.565 7.603 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -1.486 -10.312 5.515 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -2.670 -9.521 6.582 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.016 -8.878 6.458 1.00 0.00 H new ATOM 1469 N LYS A 95 1.174 -10.305 7.880 1.00 0.00 N ATOM 1470 CA LYS A 95 2.585 -10.608 7.775 1.00 0.00 C ATOM 1471 C LYS A 95 2.916 -11.858 8.611 1.00 0.00 C ATOM 1472 O LYS A 95 3.734 -12.685 8.205 1.00 0.00 O ATOM 1473 CB LYS A 95 3.424 -9.408 8.217 1.00 0.00 C ATOM 1474 CG LYS A 95 4.909 -9.529 7.902 1.00 0.00 C ATOM 1475 CD LYS A 95 5.724 -8.392 8.510 1.00 0.00 C ATOM 1476 CE LYS A 95 5.267 -7.012 8.038 1.00 0.00 C ATOM 1477 NZ LYS A 95 6.069 -5.933 8.660 1.00 0.00 N ATOM 0 H LYS A 95 0.969 -9.419 8.342 1.00 0.00 H new ATOM 0 HA LYS A 95 2.829 -10.818 6.734 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.035 -8.511 7.736 1.00 0.00 H new ATOM 0 HB3 LYS A 95 3.303 -9.271 9.292 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.282 -10.482 8.278 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.050 -9.536 6.821 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.652 -8.441 9.596 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.775 -8.528 8.254 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.352 -6.951 6.953 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.214 -6.872 8.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.733 -5.010 8.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.968 -5.977 9.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.070 -6.053 8.405 1.00 0.00 H new ATOM 1491 N GLU A 96 2.225 -12.014 9.754 1.00 0.00 N ATOM 1492 CA GLU A 96 2.385 -13.197 10.617 1.00 0.00 C ATOM 1493 C GLU A 96 1.985 -14.452 9.852 1.00 0.00 C ATOM 1494 O GLU A 96 2.566 -15.528 10.028 1.00 0.00 O ATOM 1495 CB GLU A 96 1.497 -13.115 11.868 1.00 0.00 C ATOM 1496 CG GLU A 96 1.730 -11.927 12.777 1.00 0.00 C ATOM 1497 CD GLU A 96 0.847 -11.972 14.006 1.00 0.00 C ATOM 1498 OE1 GLU A 96 -0.337 -11.567 13.936 1.00 0.00 O ATOM 1499 OE2 GLU A 96 1.320 -12.433 15.066 1.00 0.00 O ATOM 0 H GLU A 96 1.549 -11.334 10.102 1.00 0.00 H new ATOM 0 HA GLU A 96 3.432 -13.233 10.919 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.455 -13.102 11.548 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.641 -14.025 12.450 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.776 -11.904 13.083 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.538 -11.006 12.226 1.00 0.00 H new ATOM 1506 N LEU A 97 0.997 -14.300 8.991 1.00 0.00 N ATOM 1507 CA LEU A 97 0.461 -15.409 8.226 1.00 0.00 C ATOM 1508 C LEU A 97 1.289 -15.713 6.972 1.00 0.00 C ATOM 1509 O LEU A 97 0.982 -16.644 6.238 1.00 0.00 O ATOM 1510 CB LEU A 97 -1.000 -15.142 7.852 1.00 0.00 C ATOM 1511 CG LEU A 97 -1.975 -14.946 9.022 1.00 0.00 C ATOM 1512 CD1 LEU A 97 -3.363 -14.635 8.504 1.00 0.00 C ATOM 1513 CD2 LEU A 97 -2.009 -16.180 9.917 1.00 0.00 C ATOM 0 H LEU A 97 0.544 -13.406 8.802 1.00 0.00 H new ATOM 0 HA LEU A 97 0.514 -16.292 8.863 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -1.036 -14.252 7.224 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.356 -15.975 7.245 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.624 -14.103 9.618 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.043 -14.499 9.345 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.333 -13.722 7.910 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.713 -15.460 7.884 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -2.707 -16.015 10.738 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -2.331 -17.043 9.335 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -1.013 -16.365 10.319 1.00 0.00 H new ATOM 1525 N GLY A 98 2.330 -14.939 6.732 1.00 0.00 N ATOM 1526 CA GLY A 98 3.182 -15.195 5.582 1.00 0.00 C ATOM 1527 C GLY A 98 2.763 -14.403 4.366 1.00 0.00 C ATOM 1528 O GLY A 98 3.224 -14.656 3.254 1.00 0.00 O ATOM 0 H GLY A 98 2.605 -14.141 7.305 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.213 -14.948 5.835 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.158 -16.259 5.345 1.00 0.00 H new ATOM 1532 N VAL A 99 1.889 -13.454 4.570 1.00 0.00 N ATOM 1533 CA VAL A 99 1.422 -12.602 3.504 1.00 0.00 C ATOM 1534 C VAL A 99 2.236 -11.324 3.550 1.00 0.00 C ATOM 1535 O VAL A 99 2.592 -10.853 4.640 1.00 0.00 O ATOM 1536 CB VAL A 99 -0.088 -12.262 3.690 1.00 0.00 C ATOM 1537 CG1 VAL A 99 -0.612 -11.356 2.580 1.00 0.00 C ATOM 1538 CG2 VAL A 99 -0.918 -13.534 3.773 1.00 0.00 C ATOM 0 H VAL A 99 1.479 -13.248 5.481 1.00 0.00 H new ATOM 0 HA VAL A 99 1.538 -13.109 2.546 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.182 -11.716 4.629 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.668 -11.145 2.750 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.051 -10.421 2.578 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.492 -11.853 1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.969 -13.275 3.903 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.797 -14.108 2.855 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.584 -14.132 4.621 1.00 0.00 H new ATOM 1548 N ASN A 100 2.578 -10.779 2.414 1.00 0.00 N ATOM 1549 CA ASN A 100 3.308 -9.537 2.424 1.00 0.00 C ATOM 1550 C ASN A 100 2.340 -8.394 2.425 1.00 0.00 C ATOM 1551 O ASN A 100 1.755 -8.044 1.393 1.00 0.00 O ATOM 1552 CB ASN A 100 4.298 -9.400 1.266 1.00 0.00 C ATOM 1553 CG ASN A 100 5.146 -8.131 1.397 1.00 0.00 C ATOM 1554 OD1 ASN A 100 5.410 -7.655 2.501 1.00 0.00 O ATOM 1555 ND2 ASN A 100 5.605 -7.605 0.293 1.00 0.00 N ATOM 0 H ASN A 100 2.371 -11.161 1.491 1.00 0.00 H new ATOM 0 HA ASN A 100 3.910 -9.526 3.333 1.00 0.00 H new ATOM 0 HB2 ASN A 100 4.950 -10.273 1.239 1.00 0.00 H new ATOM 0 HB3 ASN A 100 3.754 -9.379 0.322 1.00 0.00 H new ATOM 0 HD21 ASN A 100 6.200 -6.777 0.331 1.00 0.00 H new ATOM 0 HD22 ASN A 100 5.369 -8.022 -0.607 1.00 0.00 H new ATOM 1562 N ALA A 101 2.105 -7.880 3.583 1.00 0.00 N ATOM 1563 CA ALA A 101 1.248 -6.760 3.747 1.00 0.00 C ATOM 1564 C ALA A 101 2.098 -5.538 3.907 1.00 0.00 C ATOM 1565 O ALA A 101 3.056 -5.547 4.683 1.00 0.00 O ATOM 1566 CB ALA A 101 0.347 -6.951 4.947 1.00 0.00 C ATOM 0 H ALA A 101 2.508 -8.231 4.452 1.00 0.00 H new ATOM 0 HA ALA A 101 0.606 -6.650 2.873 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -0.302 -6.082 5.056 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -0.262 -7.844 4.806 1.00 0.00 H new ATOM 0 HB3 ALA A 101 0.955 -7.064 5.844 1.00 0.00 H new ATOM 1572 N ILE A 102 1.783 -4.520 3.169 1.00 0.00 N ATOM 1573 CA ILE A 102 2.532 -3.298 3.182 1.00 0.00 C ATOM 1574 C ILE A 102 1.604 -2.086 3.120 1.00 0.00 C ATOM 1575 O ILE A 102 0.473 -2.192 2.614 1.00 0.00 O ATOM 1576 CB ILE A 102 3.635 -3.244 2.040 1.00 0.00 C ATOM 1577 CG1 ILE A 102 3.123 -3.724 0.649 1.00 0.00 C ATOM 1578 CG2 ILE A 102 4.897 -3.999 2.438 1.00 0.00 C ATOM 1579 CD1 ILE A 102 2.153 -2.794 -0.057 1.00 0.00 C ATOM 0 H ILE A 102 0.987 -4.512 2.531 1.00 0.00 H new ATOM 0 HA ILE A 102 3.069 -3.267 4.130 1.00 0.00 H new ATOM 0 HB ILE A 102 3.880 -2.188 1.930 1.00 0.00 H new ATOM 0 HG12 ILE A 102 3.985 -3.879 -0.000 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.640 -4.693 0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 102 5.627 -3.939 1.631 1.00 0.00 H new ATOM 0 HG22 ILE A 102 5.317 -3.555 3.341 1.00 0.00 H new ATOM 0 HG23 ILE A 102 4.651 -5.044 2.628 1.00 0.00 H new ATOM 0 HD11 ILE A 102 1.864 -3.228 -1.014 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.266 -2.656 0.562 1.00 0.00 H new ATOM 0 HD13 ILE A 102 2.632 -1.829 -0.226 1.00 0.00 H new ATOM 1591 N PRO A 103 2.024 -0.946 3.691 1.00 0.00 N ATOM 1592 CA PRO A 103 1.268 0.294 3.596 1.00 0.00 C ATOM 1593 C PRO A 103 1.342 0.877 2.184 1.00 0.00 C ATOM 1594 O PRO A 103 2.220 0.493 1.376 1.00 0.00 O ATOM 1595 CB PRO A 103 1.959 1.245 4.582 1.00 0.00 C ATOM 1596 CG PRO A 103 2.950 0.425 5.329 1.00 0.00 C ATOM 1597 CD PRO A 103 3.231 -0.790 4.503 1.00 0.00 C ATOM 0 HA PRO A 103 0.212 0.140 3.819 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.450 2.063 4.054 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.235 1.694 5.262 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.865 0.992 5.504 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.558 0.144 6.306 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.117 -0.656 3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.409 -1.666 5.127 1.00 0.00 H new ATOM 1605 N ILE A 104 0.478 1.829 1.903 1.00 0.00 N ATOM 1606 CA ILE A 104 0.394 2.444 0.590 1.00 0.00 C ATOM 1607 C ILE A 104 1.696 3.097 0.128 1.00 0.00 C ATOM 1608 O ILE A 104 2.098 2.929 -1.029 1.00 0.00 O ATOM 1609 CB ILE A 104 -0.815 3.403 0.500 1.00 0.00 C ATOM 1610 CG1 ILE A 104 -2.092 2.564 0.434 1.00 0.00 C ATOM 1611 CG2 ILE A 104 -0.705 4.385 -0.675 1.00 0.00 C ATOM 1612 CD1 ILE A 104 -3.353 3.361 0.374 1.00 0.00 C ATOM 0 H ILE A 104 -0.189 2.201 2.579 1.00 0.00 H new ATOM 0 HA ILE A 104 0.228 1.632 -0.117 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.837 4.031 1.390 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.043 1.919 -0.443 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.130 1.913 1.307 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.581 5.034 -0.690 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.194 4.991 -0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.650 3.828 -1.611 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.208 2.686 0.329 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.431 3.987 1.263 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.342 3.992 -0.514 1.00 0.00 H new ATOM 1624 N GLU A 105 2.391 3.769 1.028 1.00 0.00 N ATOM 1625 CA GLU A 105 3.645 4.435 0.665 1.00 0.00 C ATOM 1626 C GLU A 105 4.717 3.428 0.217 1.00 0.00 C ATOM 1627 O GLU A 105 5.635 3.772 -0.530 1.00 0.00 O ATOM 1628 CB GLU A 105 4.193 5.338 1.780 1.00 0.00 C ATOM 1629 CG GLU A 105 3.315 6.535 2.170 1.00 0.00 C ATOM 1630 CD GLU A 105 2.025 6.146 2.844 1.00 0.00 C ATOM 1631 OE1 GLU A 105 2.079 5.527 3.924 1.00 0.00 O ATOM 1632 OE2 GLU A 105 0.941 6.476 2.333 1.00 0.00 O ATOM 0 H GLU A 105 2.119 3.872 2.006 1.00 0.00 H new ATOM 0 HA GLU A 105 3.400 5.080 -0.179 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.355 4.727 2.668 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.168 5.714 1.469 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.880 7.187 2.836 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.087 7.114 1.275 1.00 0.00 H new ATOM 1639 N GLU A 106 4.587 2.180 0.640 1.00 0.00 N ATOM 1640 CA GLU A 106 5.521 1.148 0.225 1.00 0.00 C ATOM 1641 C GLU A 106 5.191 0.696 -1.174 1.00 0.00 C ATOM 1642 O GLU A 106 6.078 0.401 -1.971 1.00 0.00 O ATOM 1643 CB GLU A 106 5.499 -0.038 1.173 1.00 0.00 C ATOM 1644 CG GLU A 106 5.938 0.298 2.575 1.00 0.00 C ATOM 1645 CD GLU A 106 7.285 0.932 2.606 1.00 0.00 C ATOM 1646 OE1 GLU A 106 8.295 0.230 2.433 1.00 0.00 O ATOM 1647 OE2 GLU A 106 7.359 2.158 2.774 1.00 0.00 O ATOM 0 H GLU A 106 3.848 1.860 1.266 1.00 0.00 H new ATOM 0 HA GLU A 106 6.525 1.572 0.246 1.00 0.00 H new ATOM 0 HB2 GLU A 106 4.489 -0.446 1.206 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.146 -0.820 0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 106 5.211 0.971 3.030 1.00 0.00 H new ATOM 0 HG3 GLU A 106 5.952 -0.611 3.177 1.00 0.00 H new ATOM 1654 N LEU A 107 3.909 0.674 -1.480 1.00 0.00 N ATOM 1655 CA LEU A 107 3.439 0.298 -2.798 1.00 0.00 C ATOM 1656 C LEU A 107 3.824 1.416 -3.784 1.00 0.00 C ATOM 1657 O LEU A 107 4.217 1.147 -4.924 1.00 0.00 O ATOM 1658 CB LEU A 107 1.903 0.034 -2.754 1.00 0.00 C ATOM 1659 CG LEU A 107 1.219 -0.641 -3.981 1.00 0.00 C ATOM 1660 CD1 LEU A 107 1.137 0.274 -5.187 1.00 0.00 C ATOM 1661 CD2 LEU A 107 1.921 -1.945 -4.343 1.00 0.00 C ATOM 0 H LEU A 107 3.166 0.915 -0.824 1.00 0.00 H new ATOM 0 HA LEU A 107 3.905 -0.628 -3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 107 1.700 -0.587 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 107 1.409 0.991 -2.587 1.00 0.00 H new ATOM 0 HG LEU A 107 0.194 -0.861 -3.683 1.00 0.00 H new ATOM 0 HD11 LEU A 107 0.651 -0.251 -6.010 1.00 0.00 H new ATOM 0 HD12 LEU A 107 0.559 1.162 -4.931 1.00 0.00 H new ATOM 0 HD13 LEU A 107 2.142 0.570 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU A 107 1.426 -2.398 -5.202 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.963 -1.741 -4.590 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.877 -2.629 -3.496 1.00 0.00 H new ATOM 1673 N LEU A 108 3.745 2.658 -3.320 1.00 0.00 N ATOM 1674 CA LEU A 108 4.152 3.816 -4.116 1.00 0.00 C ATOM 1675 C LEU A 108 5.659 3.751 -4.395 1.00 0.00 C ATOM 1676 O LEU A 108 6.110 4.000 -5.508 1.00 0.00 O ATOM 1677 CB LEU A 108 3.807 5.130 -3.391 1.00 0.00 C ATOM 1678 CG LEU A 108 2.326 5.368 -3.047 1.00 0.00 C ATOM 1679 CD1 LEU A 108 2.157 6.684 -2.302 1.00 0.00 C ATOM 1680 CD2 LEU A 108 1.453 5.346 -4.300 1.00 0.00 C ATOM 0 H LEU A 108 3.400 2.892 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 108 3.608 3.794 -5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.380 5.167 -2.465 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.149 5.959 -4.011 1.00 0.00 H new ATOM 0 HG LEU A 108 1.999 4.555 -2.399 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.104 6.836 -2.067 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.735 6.656 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 108 2.511 7.504 -2.927 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.413 5.517 -4.022 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.779 6.129 -4.985 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.543 4.376 -4.789 1.00 0.00 H new ATOM 1692 N ALA A 109 6.420 3.350 -3.388 1.00 0.00 N ATOM 1693 CA ALA A 109 7.870 3.209 -3.510 1.00 0.00 C ATOM 1694 C ALA A 109 8.243 2.000 -4.372 1.00 0.00 C ATOM 1695 O ALA A 109 9.356 1.905 -4.881 1.00 0.00 O ATOM 1696 CB ALA A 109 8.499 3.087 -2.135 1.00 0.00 C ATOM 0 H ALA A 109 6.055 3.113 -2.465 1.00 0.00 H new ATOM 0 HA ALA A 109 8.255 4.102 -4.003 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.579 2.982 -2.237 1.00 0.00 H new ATOM 0 HB2 ALA A 109 8.274 3.980 -1.552 1.00 0.00 H new ATOM 0 HB3 ALA A 109 8.096 2.211 -1.627 1.00 0.00 H new ATOM 1702 N SER A 110 7.309 1.097 -4.542 1.00 0.00 N ATOM 1703 CA SER A 110 7.536 -0.094 -5.327 1.00 0.00 C ATOM 1704 C SER A 110 6.823 0.007 -6.672 1.00 0.00 C ATOM 1705 O SER A 110 6.649 -1.001 -7.371 1.00 0.00 O ATOM 1706 CB SER A 110 7.044 -1.315 -4.553 1.00 0.00 C ATOM 1707 OG SER A 110 7.679 -1.382 -3.276 1.00 0.00 O ATOM 0 H SER A 110 6.373 1.165 -4.142 1.00 0.00 H new ATOM 0 HA SER A 110 8.604 -0.197 -5.517 1.00 0.00 H new ATOM 0 HB2 SER A 110 5.963 -1.262 -4.427 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.255 -2.222 -5.119 1.00 0.00 H new ATOM 0 HG SER A 110 7.274 -0.723 -2.674 1.00 0.00 H new ATOM 1713 N SER A 111 6.428 1.221 -7.040 1.00 0.00 N ATOM 1714 CA SER A 111 5.742 1.442 -8.285 1.00 0.00 C ATOM 1715 C SER A 111 6.649 1.189 -9.473 1.00 0.00 C ATOM 1716 O SER A 111 7.869 1.361 -9.379 1.00 0.00 O ATOM 1717 CB SER A 111 5.130 2.832 -8.330 1.00 0.00 C ATOM 1718 OG SER A 111 4.127 2.963 -7.328 1.00 0.00 O ATOM 0 H SER A 111 6.577 2.063 -6.484 1.00 0.00 H new ATOM 0 HA SER A 111 4.927 0.721 -8.348 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.905 3.583 -8.179 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.697 3.015 -9.314 1.00 0.00 H new ATOM 0 HG SER A 111 4.269 2.287 -6.632 1.00 0.00 H new ATOM 1724 N LEU A 112 6.034 0.757 -10.566 1.00 0.00 N ATOM 1725 CA LEU A 112 6.703 0.385 -11.800 1.00 0.00 C ATOM 1726 C LEU A 112 7.355 -0.973 -11.641 1.00 0.00 C ATOM 1727 O LEU A 112 8.573 -1.104 -11.573 1.00 0.00 O ATOM 1728 CB LEU A 112 7.696 1.449 -12.340 1.00 0.00 C ATOM 1729 CG LEU A 112 7.114 2.832 -12.663 1.00 0.00 C ATOM 1730 CD1 LEU A 112 8.215 3.769 -13.129 1.00 0.00 C ATOM 1731 CD2 LEU A 112 6.024 2.731 -13.721 1.00 0.00 C ATOM 0 H LEU A 112 5.021 0.653 -10.617 1.00 0.00 H new ATOM 0 HA LEU A 112 5.932 0.328 -12.568 1.00 0.00 H new ATOM 0 HB2 LEU A 112 8.491 1.577 -11.605 1.00 0.00 H new ATOM 0 HB3 LEU A 112 8.159 1.055 -13.245 1.00 0.00 H new ATOM 0 HG LEU A 112 6.668 3.235 -11.754 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.789 4.747 -13.355 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.962 3.872 -12.342 1.00 0.00 H new ATOM 0 HD13 LEU A 112 8.684 3.362 -14.025 1.00 0.00 H new ATOM 0 HD21 LEU A 112 5.628 3.725 -13.932 1.00 0.00 H new ATOM 0 HD22 LEU A 112 6.441 2.306 -14.634 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.221 2.090 -13.356 1.00 0.00 H new ATOM 1743 N GLU A 113 6.494 -1.970 -11.491 1.00 0.00 N ATOM 1744 CA GLU A 113 6.857 -3.393 -11.382 1.00 0.00 C ATOM 1745 C GLU A 113 7.738 -3.853 -12.561 1.00 0.00 C ATOM 1746 O GLU A 113 8.561 -4.747 -12.410 1.00 0.00 O ATOM 1747 CB GLU A 113 5.548 -4.201 -11.319 1.00 0.00 C ATOM 1748 CG GLU A 113 5.663 -5.718 -11.414 1.00 0.00 C ATOM 1749 CD GLU A 113 6.439 -6.359 -10.301 1.00 0.00 C ATOM 1750 OE1 GLU A 113 5.890 -6.540 -9.218 1.00 0.00 O ATOM 1751 OE2 GLU A 113 7.598 -6.743 -10.521 1.00 0.00 O ATOM 0 H GLU A 113 5.487 -1.815 -11.439 1.00 0.00 H new ATOM 0 HA GLU A 113 7.450 -3.555 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 113 5.045 -3.958 -10.383 1.00 0.00 H new ATOM 0 HB3 GLU A 113 4.901 -3.860 -12.127 1.00 0.00 H new ATOM 0 HG2 GLU A 113 4.660 -6.144 -11.432 1.00 0.00 H new ATOM 0 HG3 GLU A 113 6.135 -5.974 -12.362 1.00 0.00 H new ATOM 1758 N HIS A 114 7.568 -3.196 -13.713 1.00 0.00 N ATOM 1759 CA HIS A 114 8.299 -3.503 -14.951 1.00 0.00 C ATOM 1760 C HIS A 114 7.799 -4.786 -15.587 1.00 0.00 C ATOM 1761 O HIS A 114 8.164 -5.882 -15.184 1.00 0.00 O ATOM 1762 CB HIS A 114 9.844 -3.565 -14.771 1.00 0.00 C ATOM 1763 CG HIS A 114 10.489 -2.291 -14.316 1.00 0.00 C ATOM 1764 ND1 HIS A 114 11.046 -2.129 -13.069 1.00 0.00 N ATOM 1765 CD2 HIS A 114 10.691 -1.127 -14.962 1.00 0.00 C ATOM 1766 CE1 HIS A 114 11.559 -0.925 -12.969 1.00 0.00 C ATOM 1767 NE2 HIS A 114 11.359 -0.294 -14.107 1.00 0.00 N ATOM 0 H HIS A 114 6.909 -2.424 -13.815 1.00 0.00 H new ATOM 0 HA HIS A 114 8.094 -2.665 -15.617 1.00 0.00 H new ATOM 0 HB2 HIS A 114 10.078 -4.349 -14.050 1.00 0.00 H new ATOM 0 HB3 HIS A 114 10.292 -3.861 -15.720 1.00 0.00 H new ATOM 0 HD2 HIS A 114 10.382 -0.894 -15.970 1.00 0.00 H new ATOM 0 HE1 HIS A 114 12.060 -0.521 -12.101 1.00 0.00 H new ATOM 0 HE2 HIS A 114 11.654 0.660 -14.317 1.00 0.00 H new ATOM 1776 N HIS A 115 6.914 -4.640 -16.526 1.00 0.00 N ATOM 1777 CA HIS A 115 6.423 -5.743 -17.312 1.00 0.00 C ATOM 1778 C HIS A 115 6.389 -5.361 -18.746 1.00 0.00 C ATOM 1779 O HIS A 115 5.627 -4.474 -19.142 1.00 0.00 O ATOM 1780 CB HIS A 115 5.025 -6.227 -16.893 1.00 0.00 C ATOM 1781 CG HIS A 115 5.004 -7.195 -15.758 1.00 0.00 C ATOM 1782 ND1 HIS A 115 5.182 -8.543 -15.929 1.00 0.00 N ATOM 1783 CD2 HIS A 115 4.802 -7.012 -14.442 1.00 0.00 C ATOM 1784 CE1 HIS A 115 5.094 -9.150 -14.772 1.00 0.00 C ATOM 1785 NE2 HIS A 115 4.860 -8.244 -13.843 1.00 0.00 N ATOM 0 H HIS A 115 6.503 -3.740 -16.775 1.00 0.00 H new ATOM 0 HA HIS A 115 7.113 -6.569 -17.139 1.00 0.00 H new ATOM 0 HB2 HIS A 115 4.424 -5.359 -16.621 1.00 0.00 H new ATOM 0 HB3 HIS A 115 4.545 -6.691 -17.755 1.00 0.00 H new ATOM 0 HD2 HIS A 115 4.626 -6.068 -13.947 1.00 0.00 H new ATOM 0 HE1 HIS A 115 5.196 -10.212 -14.607 1.00 0.00 H new ATOM 0 HE2 HIS A 115 4.742 -8.429 -12.847 1.00 0.00 H new ATOM 1794 N HIS A 116 7.228 -5.971 -19.532 1.00 0.00 N ATOM 1795 CA HIS A 116 7.166 -5.759 -20.951 1.00 0.00 C ATOM 1796 C HIS A 116 6.115 -6.674 -21.527 1.00 0.00 C ATOM 1797 O HIS A 116 6.392 -7.777 -21.988 1.00 0.00 O ATOM 1798 CB HIS A 116 8.528 -5.905 -21.647 1.00 0.00 C ATOM 1799 CG HIS A 116 9.488 -4.807 -21.305 1.00 0.00 C ATOM 1800 ND1 HIS A 116 10.716 -5.026 -20.739 1.00 0.00 N ATOM 1801 CD2 HIS A 116 9.386 -3.465 -21.459 1.00 0.00 C ATOM 1802 CE1 HIS A 116 11.328 -3.878 -20.550 1.00 0.00 C ATOM 1803 NE2 HIS A 116 10.544 -2.913 -20.981 1.00 0.00 N ATOM 0 H HIS A 116 7.957 -6.613 -19.220 1.00 0.00 H new ATOM 0 HA HIS A 116 6.882 -4.723 -21.138 1.00 0.00 H new ATOM 0 HB2 HIS A 116 8.969 -6.863 -21.371 1.00 0.00 H new ATOM 0 HB3 HIS A 116 8.377 -5.923 -22.726 1.00 0.00 H new ATOM 0 HD2 HIS A 116 8.548 -2.930 -21.880 1.00 0.00 H new ATOM 0 HE1 HIS A 116 12.308 -3.749 -20.115 1.00 0.00 H new ATOM 0 HE2 HIS A 116 10.763 -1.917 -20.962 1.00 0.00 H new ATOM 1812 N HIS A 117 4.902 -6.230 -21.382 1.00 0.00 N ATOM 1813 CA HIS A 117 3.725 -6.948 -21.768 1.00 0.00 C ATOM 1814 C HIS A 117 2.945 -5.972 -22.630 1.00 0.00 C ATOM 1815 O HIS A 117 2.976 -4.772 -22.344 1.00 0.00 O ATOM 1816 CB HIS A 117 2.953 -7.281 -20.471 1.00 0.00 C ATOM 1817 CG HIS A 117 1.949 -8.393 -20.548 1.00 0.00 C ATOM 1818 ND1 HIS A 117 0.605 -8.220 -20.312 1.00 0.00 N ATOM 1819 CD2 HIS A 117 2.121 -9.716 -20.737 1.00 0.00 C ATOM 1820 CE1 HIS A 117 -0.001 -9.388 -20.350 1.00 0.00 C ATOM 1821 NE2 HIS A 117 0.893 -10.309 -20.609 1.00 0.00 N ATOM 0 H HIS A 117 4.698 -5.318 -20.974 1.00 0.00 H new ATOM 0 HA HIS A 117 3.916 -7.875 -22.308 1.00 0.00 H new ATOM 0 HB2 HIS A 117 3.680 -7.532 -19.698 1.00 0.00 H new ATOM 0 HB3 HIS A 117 2.437 -6.379 -20.142 1.00 0.00 H new ATOM 0 HD1 HIS A 117 0.149 -7.325 -20.135 1.00 0.00 H new ATOM 0 HD2 HIS A 117 3.054 -10.216 -20.950 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -1.056 -9.558 -20.194 1.00 0.00 H new ATOM 1830 N HIS A 118 2.286 -6.439 -23.683 1.00 0.00 N ATOM 1831 CA HIS A 118 1.599 -5.515 -24.607 1.00 0.00 C ATOM 1832 C HIS A 118 0.441 -4.793 -23.935 1.00 0.00 C ATOM 1833 O HIS A 118 0.141 -3.653 -24.261 1.00 0.00 O ATOM 1834 CB HIS A 118 1.182 -6.175 -25.956 1.00 0.00 C ATOM 1835 CG HIS A 118 0.108 -7.239 -25.911 1.00 0.00 C ATOM 1836 ND1 HIS A 118 0.375 -8.586 -25.981 1.00 0.00 N ATOM 1837 CD2 HIS A 118 -1.242 -7.136 -25.871 1.00 0.00 C ATOM 1838 CE1 HIS A 118 -0.756 -9.255 -25.988 1.00 0.00 C ATOM 1839 NE2 HIS A 118 -1.749 -8.402 -25.923 1.00 0.00 N ATOM 0 H HIS A 118 2.207 -7.427 -23.924 1.00 0.00 H new ATOM 0 HA HIS A 118 2.339 -4.760 -24.873 1.00 0.00 H new ATOM 0 HB2 HIS A 118 0.845 -5.385 -26.627 1.00 0.00 H new ATOM 0 HB3 HIS A 118 2.073 -6.615 -26.404 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -1.812 -6.221 -25.809 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -0.851 -10.330 -26.039 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -2.740 -8.645 -25.913 1.00 0.00 H new ATOM 1848 N HIS A 119 -0.188 -5.459 -23.006 1.00 0.00 N ATOM 1849 CA HIS A 119 -1.234 -4.887 -22.203 1.00 0.00 C ATOM 1850 C HIS A 119 -1.428 -5.819 -21.035 1.00 0.00 C ATOM 1851 O HIS A 119 -2.366 -6.619 -21.051 1.00 0.00 O ATOM 1852 CB HIS A 119 -2.548 -4.738 -23.003 1.00 0.00 C ATOM 1853 CG HIS A 119 -3.641 -4.039 -22.244 1.00 0.00 C ATOM 1854 ND1 HIS A 119 -4.495 -4.689 -21.390 1.00 0.00 N ATOM 1855 CD2 HIS A 119 -4.008 -2.740 -22.216 1.00 0.00 C ATOM 1856 CE1 HIS A 119 -5.338 -3.830 -20.868 1.00 0.00 C ATOM 1857 NE2 HIS A 119 -5.065 -2.638 -21.354 1.00 0.00 N ATOM 1858 OXT HIS A 119 -0.563 -5.853 -20.177 1.00 0.00 O ATOM 0 H HIS A 119 0.016 -6.433 -22.782 1.00 0.00 H new ATOM 0 HA HIS A 119 -0.960 -3.884 -21.875 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -2.344 -4.186 -23.920 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -2.898 -5.727 -23.298 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -4.477 -5.689 -21.191 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -3.552 -1.933 -22.770 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -6.121 -4.061 -20.161 1.00 0.00 H new TER 1867 HIS A 119