USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 998 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 LYS NZ :NH3+ -122:sc= 1.22 (180deg=0.504) USER MOD Set 1.2: A 120 THR OG1 : rot -123:sc= 0.73 USER MOD Set 2.1: A 116 LYS NZ :NH3+ -176:sc= -0.436 (180deg=-0.537) USER MOD Set 2.2: A 119 ASN : amide:sc= 1.19 K(o=0.75,f=-2.5) USER MOD Set 3.1: A 27 TYR OH : rot 180:sc= -0.0937 USER MOD Set 3.2: A 28 LYS NZ :NH3+ 176:sc= 1.29 (180deg=1.16) USER MOD Single : A 8 HIS : no HE2:sc= -0.603! C(o=-0.6!,f=-8.6!) USER MOD Single : A 9 LYS NZ :NH3+ -153:sc= 1.25 (180deg=1.1) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.078 USER MOD Single : A 16 LYS NZ :NH3+ 165:sc= -0.0867 (180deg=-0.353) USER MOD Single : A 22 THR OG1 : rot -19:sc= -1.2 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 138:sc= -0.0942 (180deg=-1.02) USER MOD Single : A 30 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.7) USER MOD Single : A 32 MET CE :methyl -177:sc= -0.25 (180deg=-0.264) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.0015 USER MOD Single : A 41 THR OG1 : rot -65:sc= 1.36 USER MOD Single : A 59 SER OG : rot 84:sc= 1.18 USER MOD Single : A 62 THR OG1 : rot 163:sc= 0.506 USER MOD Single : A 63 LYS NZ :NH3+ -157:sc= 1.29 (180deg=1.03) USER MOD Single : A 64 LYS NZ :NH3+ -168:sc= -0.0193 (180deg=-0.211) USER MOD Single : A 65 MET CE :methyl -168:sc= -1.06 (180deg=-1.11) USER MOD Single : A 68 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 147:sc= 0.422 (180deg=-0.688) USER MOD Single : A 80 GLN : amide:sc= -1.22 X(o=-1.2,f=-1.6!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -117:sc= 0.31 (180deg=0.0521) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 13:sc= 1.81 USER MOD Single : A 93 TYR OH : rot 65:sc= 1.21 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 2.07 (180deg=2.07) USER MOD Single : A 98 MET CE :methyl 160:sc= -0.179 (180deg=-0.718) USER MOD Single : A 100 ASN : amide:sc= -0.706 K(o=-0.71,f=-6.2!) USER MOD Single : A 106 GLN :FLIP amide:sc= -0.18 F(o=-1.2,f=-0.18) USER MOD Single : A 110 LYS NZ :NH3+ -156:sc= -0.089 (180deg=-0.495) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 59:sc= 1.18 USER MOD Single : A 118 ASN : amide:sc= 0.294 K(o=0.29,f=-5.8!) USER MOD Single : A 121 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 LYS NZ :NH3+ -166:sc= -0.0254 (180deg=-0.274) USER MOD Single : A 128 SER OG : rot 75:sc= 1.02 USER MOD Single : A 131 GLN : amide:sc= 0.623 K(o=0.62,f=-6.3!) USER MOD Single : A 133 LYS NZ :NH3+ 178:sc= 1.1 (180deg=1.03) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 135:sc= -0.726 (180deg=-2.82!) USER MOD Single : A 138 ASN : amide:sc= 0.852 K(o=0.85,f=-0.015) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 115 N HIS A 8 -4.905 -16.709 2.627 1.00 0.00 N ATOM 116 CA HIS A 8 -5.071 -17.368 1.331 1.00 0.00 C ATOM 117 C HIS A 8 -4.948 -16.415 0.150 1.00 0.00 C ATOM 118 O HIS A 8 -5.722 -15.454 0.034 1.00 0.00 O ATOM 119 CB HIS A 8 -6.400 -18.175 1.254 1.00 0.00 C ATOM 120 CG HIS A 8 -7.676 -17.358 1.278 1.00 0.00 C ATOM 121 ND1 HIS A 8 -8.525 -17.291 0.217 1.00 0.00 N ATOM 122 CD2 HIS A 8 -8.246 -16.609 2.245 1.00 0.00 C ATOM 123 CE1 HIS A 8 -9.560 -16.551 0.511 1.00 0.00 C ATOM 124 NE2 HIS A 8 -9.424 -16.121 1.740 1.00 0.00 N ATOM 0 HA HIS A 8 -4.241 -18.070 1.255 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -6.389 -18.768 0.340 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -6.425 -18.876 2.088 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -8.375 -17.753 -0.680 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -7.849 -16.428 3.233 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -10.387 -16.331 -0.148 1.00 0.00 H new ATOM 133 N LYS A 9 -3.948 -16.660 -0.693 1.00 0.00 N ATOM 134 CA LYS A 9 -3.797 -15.942 -1.936 1.00 0.00 C ATOM 135 C LYS A 9 -4.719 -16.484 -2.973 1.00 0.00 C ATOM 136 O LYS A 9 -4.818 -17.708 -3.175 1.00 0.00 O ATOM 137 CB LYS A 9 -2.403 -16.059 -2.486 1.00 0.00 C ATOM 138 CG LYS A 9 -1.379 -15.178 -1.882 1.00 0.00 C ATOM 139 CD LYS A 9 -0.034 -15.594 -2.407 1.00 0.00 C ATOM 140 CE LYS A 9 1.083 -14.676 -1.985 1.00 0.00 C ATOM 141 NZ LYS A 9 2.325 -14.973 -2.735 1.00 0.00 N ATOM 0 H LYS A 9 -3.227 -17.361 -0.526 1.00 0.00 H new ATOM 0 HA LYS A 9 -4.023 -14.899 -1.713 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -2.076 -17.092 -2.369 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -2.440 -15.855 -3.556 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.579 -14.136 -2.132 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.404 -15.256 -0.795 1.00 0.00 H new ATOM 0 HD2 LYS A 9 0.186 -16.604 -2.062 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.073 -15.631 -3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.791 -13.640 -2.154 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.264 -14.785 -0.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 3.150 -14.696 -2.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.372 -15.992 -2.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.327 -14.440 -3.628 1.00 0.00 H new ATOM 155 N GLU A 10 -5.361 -15.602 -3.618 1.00 0.00 N ATOM 156 CA GLU A 10 -6.230 -15.903 -4.714 1.00 0.00 C ATOM 157 C GLU A 10 -5.674 -15.171 -5.939 1.00 0.00 C ATOM 158 O GLU A 10 -5.227 -14.025 -5.808 1.00 0.00 O ATOM 159 CB GLU A 10 -7.644 -15.408 -4.413 1.00 0.00 C ATOM 160 CG GLU A 10 -8.278 -15.952 -3.133 1.00 0.00 C ATOM 161 CD GLU A 10 -8.426 -17.454 -3.108 1.00 0.00 C ATOM 162 OE1 GLU A 10 -9.103 -18.019 -3.971 1.00 0.00 O ATOM 163 OE2 GLU A 10 -7.911 -18.095 -2.184 1.00 0.00 O ATOM 0 H GLU A 10 -5.306 -14.606 -3.403 1.00 0.00 H new ATOM 0 HA GLU A 10 -6.278 -16.978 -4.887 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -7.623 -14.320 -4.352 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.287 -15.668 -5.254 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -7.672 -15.643 -2.281 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -9.261 -15.499 -3.006 1.00 0.00 H new ATOM 170 N PRO A 11 -5.638 -15.814 -7.113 1.00 0.00 N ATOM 171 CA PRO A 11 -5.106 -15.192 -8.335 1.00 0.00 C ATOM 172 C PRO A 11 -5.994 -14.050 -8.861 1.00 0.00 C ATOM 173 O PRO A 11 -7.239 -14.154 -8.868 1.00 0.00 O ATOM 174 CB PRO A 11 -5.056 -16.350 -9.339 1.00 0.00 C ATOM 175 CG PRO A 11 -6.060 -17.337 -8.841 1.00 0.00 C ATOM 176 CD PRO A 11 -6.087 -17.199 -7.345 1.00 0.00 C ATOM 0 HA PRO A 11 -4.137 -14.725 -8.158 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -5.302 -16.011 -10.345 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -4.060 -16.790 -9.385 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -7.044 -17.139 -9.267 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -5.785 -18.351 -9.132 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -7.087 -17.368 -6.945 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -5.426 -17.920 -6.864 1.00 0.00 H new ATOM 184 N ALA A 12 -5.355 -12.973 -9.281 1.00 0.00 N ATOM 185 CA ALA A 12 -6.031 -11.811 -9.798 1.00 0.00 C ATOM 186 C ALA A 12 -5.202 -11.152 -10.900 1.00 0.00 C ATOM 187 O ALA A 12 -4.070 -11.560 -11.185 1.00 0.00 O ATOM 188 CB ALA A 12 -6.278 -10.821 -8.676 1.00 0.00 C ATOM 0 H ALA A 12 -4.339 -12.886 -9.270 1.00 0.00 H new ATOM 0 HA ALA A 12 -6.985 -12.123 -10.223 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.790 -9.943 -9.071 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -6.897 -11.287 -7.909 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -5.325 -10.520 -8.240 1.00 0.00 H new ATOM 194 N THR A 13 -5.785 -10.180 -11.555 1.00 0.00 N ATOM 195 CA THR A 13 -5.125 -9.405 -12.595 1.00 0.00 C ATOM 196 C THR A 13 -5.753 -8.025 -12.599 1.00 0.00 C ATOM 197 O THR A 13 -6.951 -7.928 -12.422 1.00 0.00 O ATOM 198 CB THR A 13 -5.334 -10.081 -13.966 1.00 0.00 C ATOM 199 OG1 THR A 13 -4.840 -11.427 -13.870 1.00 0.00 O ATOM 200 CG2 THR A 13 -4.569 -9.353 -15.069 1.00 0.00 C ATOM 0 H THR A 13 -6.749 -9.894 -11.383 1.00 0.00 H new ATOM 0 HA THR A 13 -4.053 -9.340 -12.406 1.00 0.00 H new ATOM 0 HB THR A 13 -6.394 -10.057 -14.218 1.00 0.00 H new ATOM 0 HG1 THR A 13 -4.962 -11.882 -14.729 1.00 0.00 H new ATOM 0 HG21 THR A 13 -4.738 -9.855 -16.021 1.00 0.00 H new ATOM 0 HG22 THR A 13 -4.918 -8.323 -15.135 1.00 0.00 H new ATOM 0 HG23 THR A 13 -3.504 -9.361 -14.839 1.00 0.00 H new ATOM 208 N LEU A 14 -4.980 -6.972 -12.784 1.00 0.00 N ATOM 209 CA LEU A 14 -5.548 -5.636 -12.708 1.00 0.00 C ATOM 210 C LEU A 14 -6.399 -5.323 -13.933 1.00 0.00 C ATOM 211 O LEU A 14 -6.163 -5.854 -15.032 1.00 0.00 O ATOM 212 CB LEU A 14 -4.468 -4.552 -12.562 1.00 0.00 C ATOM 213 CG LEU A 14 -5.018 -3.140 -12.300 1.00 0.00 C ATOM 214 CD1 LEU A 14 -5.588 -3.035 -10.907 1.00 0.00 C ATOM 215 CD2 LEU A 14 -3.992 -2.064 -12.545 1.00 0.00 C ATOM 0 H LEU A 14 -3.980 -7.010 -12.983 1.00 0.00 H new ATOM 0 HA LEU A 14 -6.175 -5.626 -11.816 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -3.802 -4.827 -11.744 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -3.866 -4.532 -13.470 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.822 -2.976 -13.018 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.971 -2.027 -10.745 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.399 -3.754 -10.790 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -4.807 -3.248 -10.177 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.434 -1.088 -12.345 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -3.138 -2.218 -11.885 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -3.661 -2.107 -13.583 1.00 0.00 H new ATOM 227 N ILE A 15 -7.418 -4.520 -13.723 1.00 0.00 N ATOM 228 CA ILE A 15 -8.193 -3.982 -14.795 1.00 0.00 C ATOM 229 C ILE A 15 -7.828 -2.516 -14.902 1.00 0.00 C ATOM 230 O ILE A 15 -7.279 -2.084 -15.916 1.00 0.00 O ATOM 231 CB ILE A 15 -9.710 -4.147 -14.545 1.00 0.00 C ATOM 232 CG1 ILE A 15 -10.039 -5.634 -14.410 1.00 0.00 C ATOM 233 CG2 ILE A 15 -10.520 -3.509 -15.682 1.00 0.00 C ATOM 234 CD1 ILE A 15 -11.473 -5.929 -14.083 1.00 0.00 C ATOM 0 H ILE A 15 -7.726 -4.226 -12.796 1.00 0.00 H new ATOM 0 HA ILE A 15 -7.976 -4.515 -15.721 1.00 0.00 H new ATOM 0 HB ILE A 15 -9.980 -3.636 -13.621 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.782 -6.136 -15.343 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -9.407 -6.063 -13.633 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -11.585 -3.636 -15.486 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -10.287 -2.446 -15.743 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -10.264 -3.991 -16.626 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.614 -7.007 -14.006 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.734 -5.461 -13.134 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -12.115 -5.534 -14.871 1.00 0.00 H new ATOM 246 N LYS A 16 -8.055 -1.768 -13.819 1.00 0.00 N ATOM 247 CA LYS A 16 -7.674 -0.365 -13.752 1.00 0.00 C ATOM 248 C LYS A 16 -7.307 0.007 -12.333 1.00 0.00 C ATOM 249 O LYS A 16 -7.946 -0.451 -11.380 1.00 0.00 O ATOM 250 CB LYS A 16 -8.796 0.585 -14.217 1.00 0.00 C ATOM 251 CG LYS A 16 -9.189 0.481 -15.682 1.00 0.00 C ATOM 252 CD LYS A 16 -10.103 1.627 -16.108 1.00 0.00 C ATOM 253 CE LYS A 16 -9.378 2.975 -16.088 1.00 0.00 C ATOM 254 NZ LYS A 16 -8.193 2.984 -16.978 1.00 0.00 N ATOM 0 H LYS A 16 -8.505 -2.119 -12.973 1.00 0.00 H new ATOM 0 HA LYS A 16 -6.824 -0.249 -14.424 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.681 0.396 -13.609 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.484 1.610 -14.016 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -8.291 0.484 -16.300 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.693 -0.470 -15.856 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -10.483 1.434 -17.111 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.966 1.669 -15.443 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -10.067 3.761 -16.395 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -9.067 3.204 -15.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -7.884 3.965 -17.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.422 2.444 -16.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.440 2.550 -17.890 1.00 0.00 H new ATOM 268 N ALA A 17 -6.268 0.788 -12.187 1.00 0.00 N ATOM 269 CA ALA A 17 -5.914 1.336 -10.904 1.00 0.00 C ATOM 270 C ALA A 17 -6.846 2.499 -10.643 1.00 0.00 C ATOM 271 O ALA A 17 -7.123 3.298 -11.561 1.00 0.00 O ATOM 272 CB ALA A 17 -4.468 1.793 -10.889 1.00 0.00 C ATOM 0 H ALA A 17 -5.647 1.061 -12.949 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.014 0.579 -10.126 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.226 2.203 -9.908 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -3.816 0.945 -11.099 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.321 2.560 -11.649 1.00 0.00 H new ATOM 278 N ILE A 18 -7.344 2.594 -9.444 1.00 0.00 N ATOM 279 CA ILE A 18 -8.338 3.585 -9.131 1.00 0.00 C ATOM 280 C ILE A 18 -7.733 4.743 -8.345 1.00 0.00 C ATOM 281 O ILE A 18 -7.899 5.905 -8.715 1.00 0.00 O ATOM 282 CB ILE A 18 -9.508 2.961 -8.324 1.00 0.00 C ATOM 283 CG1 ILE A 18 -10.170 1.794 -9.090 1.00 0.00 C ATOM 284 CG2 ILE A 18 -10.540 4.014 -7.927 1.00 0.00 C ATOM 285 CD1 ILE A 18 -10.764 2.169 -10.438 1.00 0.00 C ATOM 0 H ILE A 18 -7.078 1.995 -8.662 1.00 0.00 H new ATOM 0 HA ILE A 18 -8.724 3.968 -10.076 1.00 0.00 H new ATOM 0 HB ILE A 18 -9.083 2.553 -7.407 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.428 1.011 -9.242 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -10.958 1.370 -8.467 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -11.344 3.541 -7.364 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -10.064 4.776 -7.310 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -10.950 4.478 -8.824 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -11.205 1.286 -10.900 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -11.534 2.928 -10.298 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -9.980 2.563 -11.084 1.00 0.00 H new ATOM 297 N ASP A 19 -7.015 4.419 -7.296 1.00 0.00 N ATOM 298 CA ASP A 19 -6.437 5.412 -6.398 1.00 0.00 C ATOM 299 C ASP A 19 -5.157 4.798 -5.831 1.00 0.00 C ATOM 300 O ASP A 19 -4.580 3.938 -6.494 1.00 0.00 O ATOM 301 CB ASP A 19 -7.453 5.748 -5.286 1.00 0.00 C ATOM 302 CG ASP A 19 -7.112 6.996 -4.501 1.00 0.00 C ATOM 303 OD1 ASP A 19 -7.351 8.107 -4.998 1.00 0.00 O ATOM 304 OD2 ASP A 19 -6.587 6.884 -3.385 1.00 0.00 O ATOM 0 H ASP A 19 -6.809 3.455 -7.033 1.00 0.00 H new ATOM 0 HA ASP A 19 -6.203 6.345 -6.911 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -8.439 5.870 -5.733 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -7.517 4.904 -4.599 1.00 0.00 H new ATOM 309 N GLY A 20 -4.724 5.211 -4.640 1.00 0.00 N ATOM 310 CA GLY A 20 -3.486 4.716 -4.067 1.00 0.00 C ATOM 311 C GLY A 20 -3.517 3.231 -3.798 1.00 0.00 C ATOM 312 O GLY A 20 -2.824 2.463 -4.446 1.00 0.00 O ATOM 0 H GLY A 20 -5.217 5.888 -4.058 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.662 4.940 -4.745 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -3.285 5.245 -3.135 1.00 0.00 H new ATOM 316 N ASP A 21 -4.313 2.840 -2.843 1.00 0.00 N ATOM 317 CA ASP A 21 -4.470 1.428 -2.505 1.00 0.00 C ATOM 318 C ASP A 21 -5.688 0.882 -3.200 1.00 0.00 C ATOM 319 O ASP A 21 -5.982 -0.299 -3.132 1.00 0.00 O ATOM 320 CB ASP A 21 -4.575 1.194 -0.968 1.00 0.00 C ATOM 321 CG ASP A 21 -5.836 1.768 -0.322 1.00 0.00 C ATOM 322 OD1 ASP A 21 -5.875 2.991 -0.041 1.00 0.00 O ATOM 323 OD2 ASP A 21 -6.782 1.013 -0.084 1.00 0.00 O ATOM 0 H ASP A 21 -4.873 3.474 -2.273 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.578 0.902 -2.845 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.539 0.122 -0.774 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.703 1.635 -0.486 1.00 0.00 H new ATOM 328 N THR A 22 -6.378 1.751 -3.905 1.00 0.00 N ATOM 329 CA THR A 22 -7.571 1.355 -4.570 1.00 0.00 C ATOM 330 C THR A 22 -7.253 0.903 -5.973 1.00 0.00 C ATOM 331 O THR A 22 -6.753 1.679 -6.800 1.00 0.00 O ATOM 332 CB THR A 22 -8.522 2.532 -4.641 1.00 0.00 C ATOM 333 OG1 THR A 22 -8.487 3.183 -3.385 1.00 0.00 O ATOM 334 CG2 THR A 22 -9.944 2.074 -4.935 1.00 0.00 C ATOM 0 H THR A 22 -6.123 2.731 -4.025 1.00 0.00 H new ATOM 0 HA THR A 22 -8.029 0.535 -4.017 1.00 0.00 H new ATOM 0 HB THR A 22 -8.217 3.202 -5.445 1.00 0.00 H new ATOM 0 HG1 THR A 22 -8.123 2.573 -2.710 1.00 0.00 H new ATOM 0 HG21 THR A 22 -10.603 2.941 -4.980 1.00 0.00 H new ATOM 0 HG22 THR A 22 -9.967 1.550 -5.891 1.00 0.00 H new ATOM 0 HG23 THR A 22 -10.281 1.403 -4.145 1.00 0.00 H new ATOM 342 N VAL A 23 -7.586 -0.302 -6.252 1.00 0.00 N ATOM 343 CA VAL A 23 -7.396 -0.879 -7.547 1.00 0.00 C ATOM 344 C VAL A 23 -8.601 -1.706 -7.877 1.00 0.00 C ATOM 345 O VAL A 23 -9.261 -2.232 -6.976 1.00 0.00 O ATOM 346 CB VAL A 23 -6.109 -1.772 -7.635 1.00 0.00 C ATOM 347 CG1 VAL A 23 -4.838 -0.937 -7.527 1.00 0.00 C ATOM 348 CG2 VAL A 23 -6.113 -2.864 -6.566 1.00 0.00 C ATOM 0 H VAL A 23 -8.009 -0.937 -5.576 1.00 0.00 H new ATOM 0 HA VAL A 23 -7.264 -0.065 -8.260 1.00 0.00 H new ATOM 0 HB VAL A 23 -6.122 -2.249 -8.615 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.967 -1.590 -7.592 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.809 -0.211 -8.340 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.828 -0.412 -6.572 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.207 -3.464 -6.656 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -6.148 -2.406 -5.578 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -6.986 -3.502 -6.701 1.00 0.00 H new ATOM 358 N LYS A 24 -8.938 -1.778 -9.120 1.00 0.00 N ATOM 359 CA LYS A 24 -10.009 -2.611 -9.515 1.00 0.00 C ATOM 360 C LYS A 24 -9.448 -3.686 -10.375 1.00 0.00 C ATOM 361 O LYS A 24 -8.958 -3.431 -11.495 1.00 0.00 O ATOM 362 CB LYS A 24 -11.109 -1.841 -10.223 1.00 0.00 C ATOM 363 CG LYS A 24 -12.372 -2.675 -10.402 1.00 0.00 C ATOM 364 CD LYS A 24 -13.561 -1.842 -10.851 1.00 0.00 C ATOM 365 CE LYS A 24 -13.324 -1.145 -12.173 1.00 0.00 C ATOM 366 NZ LYS A 24 -14.476 -0.308 -12.546 1.00 0.00 N ATOM 0 H LYS A 24 -8.483 -1.267 -9.877 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.482 -3.042 -8.633 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -11.346 -0.943 -9.653 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.751 -1.513 -11.199 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -12.185 -3.459 -11.135 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -12.613 -3.169 -9.461 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -14.437 -2.485 -10.936 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -13.785 -1.097 -10.088 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.428 -0.527 -12.106 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -13.143 -1.887 -12.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -14.286 0.158 -13.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.324 -0.903 -12.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.632 0.414 -11.814 1.00 0.00 H new ATOM 380 N LEU A 25 -9.461 -4.859 -9.861 1.00 0.00 N ATOM 381 CA LEU A 25 -8.875 -5.954 -10.530 1.00 0.00 C ATOM 382 C LEU A 25 -9.892 -7.020 -10.851 1.00 0.00 C ATOM 383 O LEU A 25 -11.026 -6.991 -10.358 1.00 0.00 O ATOM 384 CB LEU A 25 -7.653 -6.487 -9.738 1.00 0.00 C ATOM 385 CG LEU A 25 -7.844 -6.828 -8.246 1.00 0.00 C ATOM 386 CD1 LEU A 25 -8.704 -8.066 -8.044 1.00 0.00 C ATOM 387 CD2 LEU A 25 -6.498 -6.983 -7.559 1.00 0.00 C ATOM 0 H LEU A 25 -9.881 -5.086 -8.960 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.498 -5.611 -11.494 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -7.296 -7.385 -10.242 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -6.859 -5.744 -9.811 1.00 0.00 H new ATOM 0 HG LEU A 25 -8.377 -5.995 -7.788 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -8.810 -8.266 -6.978 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -9.689 -7.900 -8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -8.231 -8.921 -8.528 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.652 -7.223 -6.507 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.936 -7.786 -8.036 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.939 -6.051 -7.640 1.00 0.00 H new ATOM 399 N MET A 26 -9.492 -7.922 -11.680 1.00 0.00 N ATOM 400 CA MET A 26 -10.303 -9.017 -12.086 1.00 0.00 C ATOM 401 C MET A 26 -10.095 -10.113 -11.080 1.00 0.00 C ATOM 402 O MET A 26 -9.005 -10.689 -10.994 1.00 0.00 O ATOM 403 CB MET A 26 -9.867 -9.514 -13.469 1.00 0.00 C ATOM 404 CG MET A 26 -10.809 -10.536 -14.092 1.00 0.00 C ATOM 405 SD MET A 26 -10.257 -11.105 -15.719 1.00 0.00 S ATOM 406 CE MET A 26 -8.711 -11.912 -15.297 1.00 0.00 C ATOM 0 H MET A 26 -8.565 -7.918 -12.106 1.00 0.00 H new ATOM 0 HA MET A 26 -11.350 -8.718 -12.142 1.00 0.00 H new ATOM 0 HB2 MET A 26 -9.782 -8.659 -14.140 1.00 0.00 H new ATOM 0 HB3 MET A 26 -8.874 -9.955 -13.387 1.00 0.00 H new ATOM 0 HG2 MET A 26 -10.899 -11.393 -13.425 1.00 0.00 H new ATOM 0 HG3 MET A 26 -11.803 -10.098 -14.184 1.00 0.00 H new ATOM 0 HE1 MET A 26 -8.625 -12.846 -15.853 1.00 0.00 H new ATOM 0 HE2 MET A 26 -7.877 -11.258 -15.554 1.00 0.00 H new ATOM 0 HE3 MET A 26 -8.691 -12.123 -14.228 1.00 0.00 H new ATOM 416 N TYR A 27 -11.079 -10.333 -10.282 1.00 0.00 N ATOM 417 CA TYR A 27 -11.039 -11.349 -9.294 1.00 0.00 C ATOM 418 C TYR A 27 -11.975 -12.467 -9.688 1.00 0.00 C ATOM 419 O TYR A 27 -13.193 -12.313 -9.634 1.00 0.00 O ATOM 420 CB TYR A 27 -11.413 -10.777 -7.922 1.00 0.00 C ATOM 421 CG TYR A 27 -11.421 -11.809 -6.827 1.00 0.00 C ATOM 422 CD1 TYR A 27 -10.250 -12.395 -6.406 1.00 0.00 C ATOM 423 CD2 TYR A 27 -12.605 -12.213 -6.230 1.00 0.00 C ATOM 424 CE1 TYR A 27 -10.253 -13.347 -5.422 1.00 0.00 C ATOM 425 CE2 TYR A 27 -12.619 -13.171 -5.243 1.00 0.00 C ATOM 426 CZ TYR A 27 -11.439 -13.735 -4.841 1.00 0.00 C ATOM 427 OH TYR A 27 -11.439 -14.705 -3.855 1.00 0.00 O ATOM 0 H TYR A 27 -11.950 -9.802 -10.299 1.00 0.00 H new ATOM 0 HA TYR A 27 -10.026 -11.746 -9.223 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -10.709 -9.987 -7.662 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.399 -10.317 -7.985 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -9.315 -12.100 -6.858 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -13.536 -11.766 -6.546 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -9.324 -13.794 -5.101 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -13.551 -13.475 -4.790 1.00 0.00 H new ATOM 0 HH TYR A 27 -12.357 -14.861 -3.550 1.00 0.00 H new ATOM 437 N LYS A 28 -11.400 -13.553 -10.161 1.00 0.00 N ATOM 438 CA LYS A 28 -12.129 -14.768 -10.528 1.00 0.00 C ATOM 439 C LYS A 28 -13.153 -14.509 -11.626 1.00 0.00 C ATOM 440 O LYS A 28 -14.212 -15.152 -11.709 1.00 0.00 O ATOM 441 CB LYS A 28 -12.742 -15.432 -9.286 1.00 0.00 C ATOM 442 CG LYS A 28 -11.678 -15.827 -8.281 1.00 0.00 C ATOM 443 CD LYS A 28 -12.215 -16.629 -7.127 1.00 0.00 C ATOM 444 CE LYS A 28 -11.063 -17.038 -6.235 1.00 0.00 C ATOM 445 NZ LYS A 28 -11.484 -17.855 -5.096 1.00 0.00 N ATOM 0 H LYS A 28 -10.393 -13.626 -10.307 1.00 0.00 H new ATOM 0 HA LYS A 28 -11.415 -15.475 -10.950 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -13.449 -14.747 -8.818 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -13.306 -16.315 -9.586 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -10.906 -16.406 -8.788 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -11.200 -14.926 -7.897 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.938 -16.040 -6.563 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.740 -17.511 -7.493 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -10.334 -17.594 -6.824 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -10.560 -16.144 -5.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.647 -18.161 -4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.105 -17.295 -4.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.999 -18.690 -5.440 1.00 0.00 H new ATOM 459 N GLY A 29 -12.784 -13.624 -12.515 1.00 0.00 N ATOM 460 CA GLY A 29 -13.607 -13.317 -13.655 1.00 0.00 C ATOM 461 C GLY A 29 -14.543 -12.154 -13.433 1.00 0.00 C ATOM 462 O GLY A 29 -15.335 -11.817 -14.320 1.00 0.00 O ATOM 0 H GLY A 29 -11.911 -13.099 -12.470 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -12.964 -13.097 -14.507 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -14.193 -14.198 -13.917 1.00 0.00 H new ATOM 466 N GLN A 30 -14.483 -11.538 -12.276 1.00 0.00 N ATOM 467 CA GLN A 30 -15.327 -10.395 -12.017 1.00 0.00 C ATOM 468 C GLN A 30 -14.516 -9.222 -11.480 1.00 0.00 C ATOM 469 O GLN A 30 -13.572 -9.418 -10.718 1.00 0.00 O ATOM 470 CB GLN A 30 -16.551 -10.774 -11.135 1.00 0.00 C ATOM 471 CG GLN A 30 -16.263 -11.366 -9.753 1.00 0.00 C ATOM 472 CD GLN A 30 -15.850 -10.342 -8.719 1.00 0.00 C ATOM 473 OE1 GLN A 30 -16.251 -9.189 -8.772 1.00 0.00 O ATOM 474 NE2 GLN A 30 -15.083 -10.755 -7.768 1.00 0.00 N ATOM 0 H GLN A 30 -13.867 -11.804 -11.508 1.00 0.00 H new ATOM 0 HA GLN A 30 -15.749 -10.056 -12.963 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -17.159 -9.879 -10.999 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -17.158 -11.490 -11.689 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.153 -11.886 -9.399 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -15.474 -12.112 -9.846 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -14.766 -11.724 -7.753 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -14.794 -10.112 -7.031 1.00 0.00 H new ATOM 483 N PRO A 31 -14.817 -8.005 -11.929 1.00 0.00 N ATOM 484 CA PRO A 31 -14.114 -6.815 -11.478 1.00 0.00 C ATOM 485 C PRO A 31 -14.506 -6.433 -10.053 1.00 0.00 C ATOM 486 O PRO A 31 -15.685 -6.163 -9.763 1.00 0.00 O ATOM 487 CB PRO A 31 -14.572 -5.740 -12.461 1.00 0.00 C ATOM 488 CG PRO A 31 -15.922 -6.186 -12.892 1.00 0.00 C ATOM 489 CD PRO A 31 -15.859 -7.683 -12.925 1.00 0.00 C ATOM 0 HA PRO A 31 -13.033 -6.956 -11.457 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -14.610 -4.759 -11.988 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -13.891 -5.660 -13.308 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -16.689 -5.841 -12.199 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -16.174 -5.782 -13.873 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -16.817 -8.131 -12.663 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -15.595 -8.052 -13.916 1.00 0.00 H new ATOM 497 N MET A 32 -13.549 -6.429 -9.173 1.00 0.00 N ATOM 498 CA MET A 32 -13.799 -6.070 -7.827 1.00 0.00 C ATOM 499 C MET A 32 -12.764 -5.051 -7.381 1.00 0.00 C ATOM 500 O MET A 32 -11.556 -5.223 -7.617 1.00 0.00 O ATOM 501 CB MET A 32 -13.807 -7.313 -6.930 1.00 0.00 C ATOM 502 CG MET A 32 -14.404 -7.045 -5.562 1.00 0.00 C ATOM 503 SD MET A 32 -14.747 -8.549 -4.596 1.00 0.00 S ATOM 504 CE MET A 32 -13.111 -9.220 -4.382 1.00 0.00 C ATOM 0 H MET A 32 -12.580 -6.675 -9.376 1.00 0.00 H new ATOM 0 HA MET A 32 -14.786 -5.614 -7.743 1.00 0.00 H new ATOM 0 HB2 MET A 32 -14.373 -8.105 -7.420 1.00 0.00 H new ATOM 0 HB3 MET A 32 -12.786 -7.677 -6.811 1.00 0.00 H new ATOM 0 HG2 MET A 32 -13.721 -6.411 -4.997 1.00 0.00 H new ATOM 0 HG3 MET A 32 -15.331 -6.485 -5.685 1.00 0.00 H new ATOM 0 HE1 MET A 32 -13.174 -10.171 -3.853 1.00 0.00 H new ATOM 0 HE2 MET A 32 -12.652 -9.377 -5.358 1.00 0.00 H new ATOM 0 HE3 MET A 32 -12.505 -8.523 -3.804 1.00 0.00 H new ATOM 514 N THR A 33 -13.237 -3.977 -6.805 1.00 0.00 N ATOM 515 CA THR A 33 -12.392 -2.909 -6.338 1.00 0.00 C ATOM 516 C THR A 33 -11.877 -3.231 -4.946 1.00 0.00 C ATOM 517 O THR A 33 -12.638 -3.645 -4.095 1.00 0.00 O ATOM 518 CB THR A 33 -13.188 -1.590 -6.271 1.00 0.00 C ATOM 519 OG1 THR A 33 -13.825 -1.340 -7.539 1.00 0.00 O ATOM 520 CG2 THR A 33 -12.272 -0.420 -5.951 1.00 0.00 C ATOM 0 H THR A 33 -14.232 -3.817 -6.645 1.00 0.00 H new ATOM 0 HA THR A 33 -11.558 -2.802 -7.032 1.00 0.00 H new ATOM 0 HB THR A 33 -13.935 -1.687 -5.484 1.00 0.00 H new ATOM 0 HG1 THR A 33 -14.331 -0.502 -7.491 1.00 0.00 H new ATOM 0 HG21 THR A 33 -12.857 0.499 -5.909 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.790 -0.588 -4.988 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.511 -0.331 -6.726 1.00 0.00 H new ATOM 528 N PHE A 34 -10.611 -3.063 -4.741 1.00 0.00 N ATOM 529 CA PHE A 34 -9.977 -3.279 -3.450 1.00 0.00 C ATOM 530 C PHE A 34 -9.509 -1.951 -2.875 1.00 0.00 C ATOM 531 O PHE A 34 -8.807 -1.211 -3.561 1.00 0.00 O ATOM 532 CB PHE A 34 -8.779 -4.228 -3.600 1.00 0.00 C ATOM 533 CG PHE A 34 -9.130 -5.680 -3.795 1.00 0.00 C ATOM 534 CD1 PHE A 34 -9.794 -6.121 -4.927 1.00 0.00 C ATOM 535 CD2 PHE A 34 -8.775 -6.610 -2.838 1.00 0.00 C ATOM 536 CE1 PHE A 34 -10.095 -7.448 -5.088 1.00 0.00 C ATOM 537 CE2 PHE A 34 -9.076 -7.937 -3.001 1.00 0.00 C ATOM 538 CZ PHE A 34 -9.736 -8.357 -4.127 1.00 0.00 C ATOM 0 H PHE A 34 -9.963 -2.766 -5.471 1.00 0.00 H new ATOM 0 HA PHE A 34 -10.703 -3.729 -2.773 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -8.179 -3.899 -4.449 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -8.152 -4.138 -2.713 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -10.078 -5.412 -5.691 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -8.253 -6.287 -1.949 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -10.616 -7.778 -5.974 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -8.793 -8.652 -2.242 1.00 0.00 H new ATOM 0 HZ PHE A 34 -9.973 -9.403 -4.257 1.00 0.00 H new ATOM 548 N ARG A 35 -10.003 -1.598 -1.689 1.00 0.00 N ATOM 549 CA ARG A 35 -9.535 -0.403 -0.968 1.00 0.00 C ATOM 550 C ARG A 35 -9.673 -0.620 0.523 1.00 0.00 C ATOM 551 O ARG A 35 -10.497 -1.438 0.930 1.00 0.00 O ATOM 552 CB ARG A 35 -10.263 0.921 -1.366 1.00 0.00 C ATOM 553 CG ARG A 35 -9.697 2.124 -0.596 1.00 0.00 C ATOM 554 CD ARG A 35 -10.252 3.476 -0.946 1.00 0.00 C ATOM 555 NE ARG A 35 -9.596 4.487 -0.091 1.00 0.00 N ATOM 556 CZ ARG A 35 -8.566 5.288 -0.450 1.00 0.00 C ATOM 557 NH1 ARG A 35 -8.128 5.313 -1.705 1.00 0.00 N ATOM 558 NH2 ARG A 35 -7.963 6.038 0.471 1.00 0.00 N ATOM 0 H ARG A 35 -10.730 -2.121 -1.201 1.00 0.00 H new ATOM 0 HA ARG A 35 -8.491 -0.274 -1.255 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -10.155 1.089 -2.438 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.330 0.827 -1.164 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -9.862 1.954 0.468 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -8.618 2.149 -0.751 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -10.075 3.697 -1.998 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -11.331 3.494 -0.794 1.00 0.00 H new ATOM 0 HE ARG A 35 -9.953 4.591 0.859 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -8.569 4.724 -2.411 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -7.351 5.922 -1.962 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.278 6.007 1.441 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -7.186 6.644 0.207 1.00 0.00 H new ATOM 572 N LEU A 36 -8.849 0.094 1.315 1.00 0.00 N ATOM 573 CA LEU A 36 -9.002 0.209 2.765 1.00 0.00 C ATOM 574 C LEU A 36 -8.714 -1.127 3.410 1.00 0.00 C ATOM 575 O LEU A 36 -9.255 -1.482 4.444 1.00 0.00 O ATOM 576 CB LEU A 36 -10.422 0.768 3.072 1.00 0.00 C ATOM 577 CG LEU A 36 -10.747 1.200 4.503 1.00 0.00 C ATOM 578 CD1 LEU A 36 -9.714 2.195 5.022 1.00 0.00 C ATOM 579 CD2 LEU A 36 -12.133 1.832 4.530 1.00 0.00 C ATOM 0 H LEU A 36 -8.049 0.612 0.952 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.285 0.910 3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -10.587 1.627 2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.147 0.006 2.784 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.725 0.322 5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -9.969 2.486 6.041 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -8.727 1.733 5.013 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -9.707 3.079 4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.372 2.142 5.547 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.150 2.701 3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -12.871 1.105 4.190 1.00 0.00 H new ATOM 591 N LEU A 37 -7.771 -1.804 2.773 1.00 0.00 N ATOM 592 CA LEU A 37 -7.299 -3.132 3.121 1.00 0.00 C ATOM 593 C LEU A 37 -6.878 -3.167 4.613 1.00 0.00 C ATOM 594 O LEU A 37 -7.617 -3.627 5.467 1.00 0.00 O ATOM 595 CB LEU A 37 -6.099 -3.467 2.192 1.00 0.00 C ATOM 596 CG LEU A 37 -6.277 -3.087 0.695 1.00 0.00 C ATOM 597 CD1 LEU A 37 -5.001 -3.312 -0.089 1.00 0.00 C ATOM 598 CD2 LEU A 37 -7.404 -3.857 0.060 1.00 0.00 C ATOM 0 H LEU A 37 -7.291 -1.421 1.958 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.086 -3.873 2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.214 -2.957 2.574 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.903 -4.537 2.255 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.522 -2.025 0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.161 -3.036 -1.131 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.203 -2.699 0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.719 -4.363 -0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.500 -3.566 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.195 -4.925 0.122 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.335 -3.638 0.584 1.00 0.00 H new ATOM 610 N LEU A 38 -5.665 -2.739 4.882 1.00 0.00 N ATOM 611 CA LEU A 38 -5.188 -2.478 6.242 1.00 0.00 C ATOM 612 C LEU A 38 -4.794 -1.021 6.305 1.00 0.00 C ATOM 613 O LEU A 38 -4.417 -0.481 7.350 1.00 0.00 O ATOM 614 CB LEU A 38 -3.953 -3.350 6.603 1.00 0.00 C ATOM 615 CG LEU A 38 -4.179 -4.777 7.157 1.00 0.00 C ATOM 616 CD1 LEU A 38 -4.853 -4.738 8.516 1.00 0.00 C ATOM 617 CD2 LEU A 38 -4.966 -5.649 6.197 1.00 0.00 C ATOM 0 H LEU A 38 -4.966 -2.557 4.162 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.979 -2.722 6.951 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.339 -3.438 5.707 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.366 -2.800 7.339 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.193 -5.227 7.272 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.998 -5.755 8.879 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.226 -4.188 9.218 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.820 -4.242 8.429 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -5.098 -6.640 6.631 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.942 -5.200 6.014 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.424 -5.735 5.255 1.00 0.00 H new ATOM 629 N VAL A 39 -4.901 -0.382 5.161 1.00 0.00 N ATOM 630 CA VAL A 39 -4.364 0.929 4.963 1.00 0.00 C ATOM 631 C VAL A 39 -5.334 1.802 4.214 1.00 0.00 C ATOM 632 O VAL A 39 -6.274 1.310 3.603 1.00 0.00 O ATOM 633 CB VAL A 39 -3.015 0.878 4.163 1.00 0.00 C ATOM 634 CG1 VAL A 39 -1.942 0.128 4.935 1.00 0.00 C ATOM 635 CG2 VAL A 39 -3.206 0.250 2.778 1.00 0.00 C ATOM 0 H VAL A 39 -5.368 -0.768 4.341 1.00 0.00 H new ATOM 0 HA VAL A 39 -4.181 1.349 5.952 1.00 0.00 H new ATOM 0 HB VAL A 39 -2.686 1.908 4.028 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.020 0.111 4.353 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.761 0.628 5.886 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.274 -0.894 5.120 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.251 0.231 2.252 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.580 -0.768 2.888 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -3.923 0.840 2.207 1.00 0.00 H new ATOM 645 N ASP A 40 -5.085 3.068 4.276 1.00 0.00 N ATOM 646 CA ASP A 40 -5.834 4.075 3.573 1.00 0.00 C ATOM 647 C ASP A 40 -4.831 5.000 2.940 1.00 0.00 C ATOM 648 O ASP A 40 -3.981 5.580 3.640 1.00 0.00 O ATOM 649 CB ASP A 40 -6.750 4.846 4.545 1.00 0.00 C ATOM 650 CG ASP A 40 -7.483 6.026 3.910 1.00 0.00 C ATOM 651 OD1 ASP A 40 -8.399 5.823 3.084 1.00 0.00 O ATOM 652 OD2 ASP A 40 -7.186 7.185 4.267 1.00 0.00 O ATOM 0 H ASP A 40 -4.325 3.452 4.838 1.00 0.00 H new ATOM 0 HA ASP A 40 -6.477 3.625 2.816 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.485 4.156 4.959 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.151 5.211 5.379 1.00 0.00 H new ATOM 657 N THR A 41 -4.828 5.050 1.645 1.00 0.00 N ATOM 658 CA THR A 41 -3.921 5.920 0.950 1.00 0.00 C ATOM 659 C THR A 41 -4.466 7.335 0.858 1.00 0.00 C ATOM 660 O THR A 41 -5.687 7.540 0.848 1.00 0.00 O ATOM 661 CB THR A 41 -3.581 5.392 -0.443 1.00 0.00 C ATOM 662 OG1 THR A 41 -4.780 5.007 -1.140 1.00 0.00 O ATOM 663 CG2 THR A 41 -2.617 4.225 -0.350 1.00 0.00 C ATOM 0 H THR A 41 -5.442 4.500 1.044 1.00 0.00 H new ATOM 0 HA THR A 41 -3.001 5.944 1.535 1.00 0.00 H new ATOM 0 HB THR A 41 -3.097 6.189 -1.007 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.197 4.249 -0.679 1.00 0.00 H new ATOM 0 HG21 THR A 41 -2.387 3.863 -1.352 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.698 4.550 0.138 1.00 0.00 H new ATOM 0 HG23 THR A 41 -3.072 3.422 0.230 1.00 0.00 H new ATOM 671 N PRO A 42 -3.578 8.337 0.823 1.00 0.00 N ATOM 672 CA PRO A 42 -3.983 9.707 0.710 1.00 0.00 C ATOM 673 C PRO A 42 -4.586 9.985 -0.644 1.00 0.00 C ATOM 674 O PRO A 42 -3.916 9.946 -1.683 1.00 0.00 O ATOM 675 CB PRO A 42 -2.704 10.515 0.905 1.00 0.00 C ATOM 676 CG PRO A 42 -1.606 9.576 0.595 1.00 0.00 C ATOM 677 CD PRO A 42 -2.120 8.196 0.875 1.00 0.00 C ATOM 0 HA PRO A 42 -4.748 9.964 1.443 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -2.680 11.382 0.244 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -2.626 10.890 1.925 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -1.300 9.670 -0.447 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -0.729 9.792 1.205 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -1.763 7.480 0.135 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -1.789 7.838 1.850 1.00 0.00 H new ATOM 910 N GLU A 57 3.304 9.754 -6.360 1.00 0.00 N ATOM 911 CA GLU A 57 2.336 9.511 -5.325 1.00 0.00 C ATOM 912 C GLU A 57 1.881 8.044 -5.300 1.00 0.00 C ATOM 913 O GLU A 57 2.367 7.222 -6.088 1.00 0.00 O ATOM 914 CB GLU A 57 1.179 10.546 -5.351 1.00 0.00 C ATOM 915 CG GLU A 57 0.369 10.649 -6.644 1.00 0.00 C ATOM 916 CD GLU A 57 -0.509 9.454 -6.898 1.00 0.00 C ATOM 917 OE1 GLU A 57 -1.349 9.118 -6.028 1.00 0.00 O ATOM 918 OE2 GLU A 57 -0.403 8.845 -7.968 1.00 0.00 O ATOM 0 HA GLU A 57 2.827 9.670 -4.365 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.492 10.307 -4.539 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.598 11.529 -5.135 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -0.252 11.544 -6.604 1.00 0.00 H new ATOM 0 HG3 GLU A 57 1.053 10.772 -7.483 1.00 0.00 H new ATOM 925 N ALA A 58 0.959 7.745 -4.408 1.00 0.00 N ATOM 926 CA ALA A 58 0.519 6.384 -4.123 1.00 0.00 C ATOM 927 C ALA A 58 -0.110 5.674 -5.317 1.00 0.00 C ATOM 928 O ALA A 58 0.252 4.542 -5.617 1.00 0.00 O ATOM 929 CB ALA A 58 -0.451 6.393 -2.955 1.00 0.00 C ATOM 0 H ALA A 58 0.482 8.451 -3.847 1.00 0.00 H new ATOM 0 HA ALA A 58 1.416 5.817 -3.873 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.777 5.374 -2.745 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.043 6.804 -2.075 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -1.316 7.007 -3.205 1.00 0.00 H new ATOM 935 N SER A 59 -1.006 6.351 -6.010 1.00 0.00 N ATOM 936 CA SER A 59 -1.781 5.736 -7.081 1.00 0.00 C ATOM 937 C SER A 59 -0.876 5.268 -8.208 1.00 0.00 C ATOM 938 O SER A 59 -0.935 4.111 -8.627 1.00 0.00 O ATOM 939 CB SER A 59 -2.769 6.742 -7.637 1.00 0.00 C ATOM 940 OG SER A 59 -3.431 7.456 -6.592 1.00 0.00 O ATOM 0 H SER A 59 -1.219 7.336 -5.851 1.00 0.00 H new ATOM 0 HA SER A 59 -2.307 4.876 -6.667 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.248 7.445 -8.286 1.00 0.00 H new ATOM 0 HB3 SER A 59 -3.507 6.227 -8.252 1.00 0.00 H new ATOM 0 HG SER A 59 -2.872 8.208 -6.305 1.00 0.00 H new ATOM 946 N ALA A 60 -0.026 6.172 -8.684 1.00 0.00 N ATOM 947 CA ALA A 60 0.879 5.883 -9.780 1.00 0.00 C ATOM 948 C ALA A 60 1.890 4.805 -9.413 1.00 0.00 C ATOM 949 O ALA A 60 2.263 3.986 -10.264 1.00 0.00 O ATOM 950 CB ALA A 60 1.582 7.147 -10.240 1.00 0.00 C ATOM 0 H ALA A 60 0.051 7.121 -8.319 1.00 0.00 H new ATOM 0 HA ALA A 60 0.280 5.497 -10.605 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.256 6.909 -11.063 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.842 7.873 -10.576 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.153 7.567 -9.412 1.00 0.00 H new ATOM 956 N PHE A 61 2.310 4.789 -8.148 1.00 0.00 N ATOM 957 CA PHE A 61 3.270 3.808 -7.665 1.00 0.00 C ATOM 958 C PHE A 61 2.669 2.407 -7.771 1.00 0.00 C ATOM 959 O PHE A 61 3.271 1.495 -8.383 1.00 0.00 O ATOM 960 CB PHE A 61 3.633 4.111 -6.206 1.00 0.00 C ATOM 961 CG PHE A 61 4.712 3.225 -5.613 1.00 0.00 C ATOM 962 CD1 PHE A 61 4.394 2.022 -5.002 1.00 0.00 C ATOM 963 CD2 PHE A 61 6.038 3.617 -5.644 1.00 0.00 C ATOM 964 CE1 PHE A 61 5.376 1.232 -4.439 1.00 0.00 C ATOM 965 CE2 PHE A 61 7.024 2.828 -5.083 1.00 0.00 C ATOM 966 CZ PHE A 61 6.691 1.635 -4.481 1.00 0.00 C ATOM 0 H PHE A 61 1.995 5.451 -7.438 1.00 0.00 H new ATOM 0 HA PHE A 61 4.173 3.858 -8.273 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.959 5.149 -6.137 1.00 0.00 H new ATOM 0 HB3 PHE A 61 2.733 4.018 -5.597 1.00 0.00 H new ATOM 0 HD1 PHE A 61 3.364 1.699 -4.966 1.00 0.00 H new ATOM 0 HD2 PHE A 61 6.306 4.552 -6.113 1.00 0.00 H new ATOM 0 HE1 PHE A 61 5.112 0.298 -3.966 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.055 3.147 -5.117 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.461 1.017 -4.043 1.00 0.00 H new ATOM 976 N THR A 62 1.475 2.258 -7.204 1.00 0.00 N ATOM 977 CA THR A 62 0.739 1.015 -7.215 1.00 0.00 C ATOM 978 C THR A 62 0.437 0.586 -8.645 1.00 0.00 C ATOM 979 O THR A 62 0.695 -0.568 -9.026 1.00 0.00 O ATOM 980 CB THR A 62 -0.591 1.190 -6.460 1.00 0.00 C ATOM 981 OG1 THR A 62 -0.329 1.675 -5.153 1.00 0.00 O ATOM 982 CG2 THR A 62 -1.354 -0.123 -6.366 1.00 0.00 C ATOM 0 H THR A 62 0.992 3.014 -6.719 1.00 0.00 H new ATOM 0 HA THR A 62 1.348 0.252 -6.730 1.00 0.00 H new ATOM 0 HB THR A 62 -1.205 1.902 -7.012 1.00 0.00 H new ATOM 0 HG1 THR A 62 -1.154 2.036 -4.766 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.288 0.037 -5.827 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.572 -0.490 -7.369 1.00 0.00 H new ATOM 0 HG23 THR A 62 -0.749 -0.858 -5.834 1.00 0.00 H new ATOM 990 N LYS A 63 -0.052 1.545 -9.430 1.00 0.00 N ATOM 991 CA LYS A 63 -0.472 1.336 -10.805 1.00 0.00 C ATOM 992 C LYS A 63 0.618 0.646 -11.608 1.00 0.00 C ATOM 993 O LYS A 63 0.390 -0.401 -12.219 1.00 0.00 O ATOM 994 CB LYS A 63 -0.801 2.687 -11.442 1.00 0.00 C ATOM 995 CG LYS A 63 -1.399 2.593 -12.820 1.00 0.00 C ATOM 996 CD LYS A 63 -1.626 3.966 -13.425 1.00 0.00 C ATOM 997 CE LYS A 63 -2.415 3.884 -14.726 1.00 0.00 C ATOM 998 NZ LYS A 63 -1.782 2.996 -15.728 1.00 0.00 N ATOM 0 H LYS A 63 -0.168 2.508 -9.116 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.355 0.697 -10.807 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -1.495 3.222 -10.793 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.110 3.283 -11.494 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -0.738 2.015 -13.466 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.346 2.055 -12.770 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.162 4.594 -12.713 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.665 4.445 -13.612 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -3.421 3.524 -14.513 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -2.517 4.884 -15.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -2.106 3.261 -16.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.748 3.093 -15.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -2.047 2.009 -15.534 1.00 0.00 H new ATOM 1012 N LYS A 64 1.801 1.218 -11.569 1.00 0.00 N ATOM 1013 CA LYS A 64 2.934 0.680 -12.288 1.00 0.00 C ATOM 1014 C LYS A 64 3.305 -0.714 -11.812 1.00 0.00 C ATOM 1015 O LYS A 64 3.365 -1.644 -12.611 1.00 0.00 O ATOM 1016 CB LYS A 64 4.134 1.615 -12.200 1.00 0.00 C ATOM 1017 CG LYS A 64 3.932 2.931 -12.917 1.00 0.00 C ATOM 1018 CD LYS A 64 5.138 3.842 -12.777 1.00 0.00 C ATOM 1019 CE LYS A 64 4.939 5.147 -13.533 1.00 0.00 C ATOM 1020 NZ LYS A 64 4.804 4.936 -14.991 1.00 0.00 N ATOM 0 H LYS A 64 2.004 2.066 -11.040 1.00 0.00 H new ATOM 0 HA LYS A 64 2.635 0.598 -13.333 1.00 0.00 H new ATOM 0 HB2 LYS A 64 4.353 1.813 -11.151 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.006 1.113 -12.619 1.00 0.00 H new ATOM 0 HG2 LYS A 64 3.739 2.743 -13.973 1.00 0.00 H new ATOM 0 HG3 LYS A 64 3.050 3.431 -12.516 1.00 0.00 H new ATOM 0 HD2 LYS A 64 5.315 4.054 -11.723 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.026 3.333 -13.153 1.00 0.00 H new ATOM 0 HE2 LYS A 64 4.048 5.650 -13.157 1.00 0.00 H new ATOM 0 HE3 LYS A 64 5.784 5.808 -13.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.875 5.850 -15.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 5.562 4.306 -15.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.880 4.504 -15.195 1.00 0.00 H new ATOM 1034 N MET A 65 3.479 -0.877 -10.516 1.00 0.00 N ATOM 1035 CA MET A 65 3.954 -2.152 -9.977 1.00 0.00 C ATOM 1036 C MET A 65 2.985 -3.302 -10.237 1.00 0.00 C ATOM 1037 O MET A 65 3.416 -4.407 -10.552 1.00 0.00 O ATOM 1038 CB MET A 65 4.346 -2.069 -8.485 1.00 0.00 C ATOM 1039 CG MET A 65 3.202 -1.848 -7.505 1.00 0.00 C ATOM 1040 SD MET A 65 3.757 -1.699 -5.786 1.00 0.00 S ATOM 1041 CE MET A 65 4.590 -3.269 -5.528 1.00 0.00 C ATOM 0 H MET A 65 3.303 -0.156 -9.816 1.00 0.00 H new ATOM 0 HA MET A 65 4.867 -2.374 -10.530 1.00 0.00 H new ATOM 0 HB2 MET A 65 4.858 -2.992 -8.213 1.00 0.00 H new ATOM 0 HB3 MET A 65 5.064 -1.258 -8.363 1.00 0.00 H new ATOM 0 HG2 MET A 65 2.661 -0.944 -7.785 1.00 0.00 H new ATOM 0 HG3 MET A 65 2.499 -2.678 -7.583 1.00 0.00 H new ATOM 0 HE1 MET A 65 4.791 -3.404 -4.465 1.00 0.00 H new ATOM 0 HE2 MET A 65 3.955 -4.081 -5.883 1.00 0.00 H new ATOM 0 HE3 MET A 65 5.530 -3.277 -6.079 1.00 0.00 H new ATOM 1051 N VAL A 66 1.695 -3.041 -10.162 1.00 0.00 N ATOM 1052 CA VAL A 66 0.720 -4.102 -10.382 1.00 0.00 C ATOM 1053 C VAL A 66 0.521 -4.409 -11.883 1.00 0.00 C ATOM 1054 O VAL A 66 0.300 -5.554 -12.260 1.00 0.00 O ATOM 1055 CB VAL A 66 -0.654 -3.855 -9.685 1.00 0.00 C ATOM 1056 CG1 VAL A 66 -0.490 -3.748 -8.178 1.00 0.00 C ATOM 1057 CG2 VAL A 66 -1.349 -2.629 -10.231 1.00 0.00 C ATOM 0 H VAL A 66 1.299 -2.124 -9.955 1.00 0.00 H new ATOM 0 HA VAL A 66 1.155 -4.980 -9.904 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.284 -4.717 -9.904 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.463 -3.576 -7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.064 -4.674 -7.792 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.175 -2.917 -7.942 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -2.302 -2.493 -9.719 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.721 -1.753 -10.069 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.526 -2.756 -11.299 1.00 0.00 H new ATOM 1067 N GLU A 67 0.614 -3.400 -12.746 1.00 0.00 N ATOM 1068 CA GLU A 67 0.482 -3.643 -14.182 1.00 0.00 C ATOM 1069 C GLU A 67 1.742 -4.291 -14.751 1.00 0.00 C ATOM 1070 O GLU A 67 1.701 -5.020 -15.760 1.00 0.00 O ATOM 1071 CB GLU A 67 0.150 -2.370 -14.943 1.00 0.00 C ATOM 1072 CG GLU A 67 -1.218 -1.815 -14.629 1.00 0.00 C ATOM 1073 CD GLU A 67 -1.588 -0.656 -15.511 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -1.618 -0.820 -16.737 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -1.829 0.451 -15.006 1.00 0.00 O ATOM 0 H GLU A 67 0.776 -2.427 -12.486 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.350 -4.335 -14.312 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.901 -1.614 -14.714 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.215 -2.569 -16.013 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.961 -2.604 -14.742 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.247 -1.497 -13.587 1.00 0.00 H new ATOM 1082 N ASN A 68 2.858 -4.032 -14.108 1.00 0.00 N ATOM 1083 CA ASN A 68 4.136 -4.613 -14.511 1.00 0.00 C ATOM 1084 C ASN A 68 4.330 -5.979 -13.875 1.00 0.00 C ATOM 1085 O ASN A 68 5.280 -6.713 -14.202 1.00 0.00 O ATOM 1086 CB ASN A 68 5.308 -3.681 -14.158 1.00 0.00 C ATOM 1087 CG ASN A 68 5.327 -2.395 -14.991 1.00 0.00 C ATOM 1088 OD1 ASN A 68 4.894 -2.379 -16.152 1.00 0.00 O ATOM 1089 ND2 ASN A 68 5.811 -1.318 -14.427 1.00 0.00 N ATOM 0 H ASN A 68 2.915 -3.418 -13.295 1.00 0.00 H new ATOM 0 HA ASN A 68 4.119 -4.735 -15.594 1.00 0.00 H new ATOM 0 HB2 ASN A 68 5.252 -3.421 -13.101 1.00 0.00 H new ATOM 0 HB3 ASN A 68 6.246 -4.216 -14.305 1.00 0.00 H new ATOM 0 HD21 ASN A 68 5.838 -0.439 -14.944 1.00 0.00 H new ATOM 0 HD22 ASN A 68 6.161 -1.357 -13.470 1.00 0.00 H new ATOM 1096 N ALA A 69 3.431 -6.322 -12.982 1.00 0.00 N ATOM 1097 CA ALA A 69 3.467 -7.576 -12.300 1.00 0.00 C ATOM 1098 C ALA A 69 3.052 -8.700 -13.222 1.00 0.00 C ATOM 1099 O ALA A 69 2.082 -8.569 -13.990 1.00 0.00 O ATOM 1100 CB ALA A 69 2.566 -7.545 -11.085 1.00 0.00 C ATOM 0 H ALA A 69 2.649 -5.725 -12.712 1.00 0.00 H new ATOM 0 HA ALA A 69 4.492 -7.754 -11.974 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.606 -8.509 -10.578 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.900 -6.762 -10.404 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.542 -7.341 -11.397 1.00 0.00 H new ATOM 1106 N LYS A 70 3.776 -9.791 -13.159 1.00 0.00 N ATOM 1107 CA LYS A 70 3.468 -10.966 -13.947 1.00 0.00 C ATOM 1108 C LYS A 70 2.232 -11.637 -13.406 1.00 0.00 C ATOM 1109 O LYS A 70 1.438 -12.204 -14.142 1.00 0.00 O ATOM 1110 CB LYS A 70 4.632 -11.952 -13.922 1.00 0.00 C ATOM 1111 CG LYS A 70 5.878 -11.511 -14.694 1.00 0.00 C ATOM 1112 CD LYS A 70 5.596 -11.298 -16.182 1.00 0.00 C ATOM 1113 CE LYS A 70 5.056 -12.560 -16.845 1.00 0.00 C ATOM 1114 NZ LYS A 70 4.814 -12.368 -18.285 1.00 0.00 N ATOM 0 H LYS A 70 4.596 -9.892 -12.561 1.00 0.00 H new ATOM 0 HA LYS A 70 3.294 -10.653 -14.976 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.912 -12.132 -12.884 1.00 0.00 H new ATOM 0 HB3 LYS A 70 4.290 -12.903 -14.329 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.261 -10.586 -14.263 1.00 0.00 H new ATOM 0 HG3 LYS A 70 6.659 -12.263 -14.579 1.00 0.00 H new ATOM 0 HD2 LYS A 70 4.876 -10.488 -16.303 1.00 0.00 H new ATOM 0 HD3 LYS A 70 6.512 -10.988 -16.684 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.765 -13.376 -16.702 1.00 0.00 H new ATOM 0 HE3 LYS A 70 4.127 -12.856 -16.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 4.448 -13.250 -18.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 4.118 -11.607 -18.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 5.705 -12.111 -18.756 1.00 0.00 H new ATOM 1128 N LYS A 71 2.091 -11.570 -12.126 1.00 0.00 N ATOM 1129 CA LYS A 71 0.957 -12.119 -11.440 1.00 0.00 C ATOM 1130 C LYS A 71 0.539 -11.178 -10.342 1.00 0.00 C ATOM 1131 O LYS A 71 1.364 -10.454 -9.794 1.00 0.00 O ATOM 1132 CB LYS A 71 1.286 -13.477 -10.814 1.00 0.00 C ATOM 1133 CG LYS A 71 2.455 -13.451 -9.852 1.00 0.00 C ATOM 1134 CD LYS A 71 2.522 -14.711 -9.021 1.00 0.00 C ATOM 1135 CE LYS A 71 3.667 -14.635 -8.042 1.00 0.00 C ATOM 1136 NZ LYS A 71 3.670 -15.749 -7.082 1.00 0.00 N ATOM 0 H LYS A 71 2.771 -11.125 -11.509 1.00 0.00 H new ATOM 0 HA LYS A 71 0.156 -12.252 -12.167 1.00 0.00 H new ATOM 0 HB2 LYS A 71 0.405 -13.845 -10.288 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.502 -14.189 -11.611 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.384 -13.334 -10.411 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.367 -12.586 -9.195 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.584 -14.850 -8.483 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.648 -15.577 -9.671 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.609 -14.632 -8.591 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.612 -13.692 -7.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.651 -15.992 -6.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.156 -15.468 -6.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 3.206 -16.576 -7.508 1.00 0.00 H new ATOM 1150 N ILE A 72 -0.718 -11.159 -10.049 1.00 0.00 N ATOM 1151 CA ILE A 72 -1.235 -10.412 -8.947 1.00 0.00 C ATOM 1152 C ILE A 72 -1.979 -11.381 -8.064 1.00 0.00 C ATOM 1153 O ILE A 72 -2.798 -12.160 -8.551 1.00 0.00 O ATOM 1154 CB ILE A 72 -2.175 -9.275 -9.419 1.00 0.00 C ATOM 1155 CG1 ILE A 72 -1.403 -8.390 -10.398 1.00 0.00 C ATOM 1156 CG2 ILE A 72 -2.688 -8.464 -8.223 1.00 0.00 C ATOM 1157 CD1 ILE A 72 -2.108 -7.132 -10.821 1.00 0.00 C ATOM 0 H ILE A 72 -1.428 -11.669 -10.575 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.419 -9.935 -8.405 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.048 -9.695 -9.918 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.451 -8.118 -9.942 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.174 -8.976 -11.288 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.346 -7.671 -8.577 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.239 -9.119 -7.549 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.843 -8.025 -7.692 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.476 -6.577 -11.514 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.047 -7.388 -11.311 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.312 -6.517 -9.944 1.00 0.00 H new ATOM 1169 N GLU A 73 -1.655 -11.399 -6.806 1.00 0.00 N ATOM 1170 CA GLU A 73 -2.299 -12.310 -5.898 1.00 0.00 C ATOM 1171 C GLU A 73 -2.939 -11.491 -4.805 1.00 0.00 C ATOM 1172 O GLU A 73 -2.359 -10.501 -4.354 1.00 0.00 O ATOM 1173 CB GLU A 73 -1.265 -13.284 -5.285 1.00 0.00 C ATOM 1174 CG GLU A 73 -0.345 -13.948 -6.321 1.00 0.00 C ATOM 1175 CD GLU A 73 0.733 -14.825 -5.713 1.00 0.00 C ATOM 1176 OE1 GLU A 73 1.787 -14.306 -5.291 1.00 0.00 O ATOM 1177 OE2 GLU A 73 0.569 -16.046 -5.668 1.00 0.00 O ATOM 0 H GLU A 73 -0.950 -10.796 -6.382 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.047 -12.901 -6.427 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.653 -12.742 -4.564 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.795 -14.061 -4.733 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.951 -14.551 -6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.128 -13.172 -6.923 1.00 0.00 H new ATOM 1184 N VAL A 74 -4.107 -11.870 -4.395 1.00 0.00 N ATOM 1185 CA VAL A 74 -4.788 -11.183 -3.330 1.00 0.00 C ATOM 1186 C VAL A 74 -4.943 -12.141 -2.153 1.00 0.00 C ATOM 1187 O VAL A 74 -5.508 -13.221 -2.290 1.00 0.00 O ATOM 1188 CB VAL A 74 -6.173 -10.584 -3.787 1.00 0.00 C ATOM 1189 CG1 VAL A 74 -5.980 -9.592 -4.913 1.00 0.00 C ATOM 1190 CG2 VAL A 74 -7.140 -11.655 -4.246 1.00 0.00 C ATOM 0 H VAL A 74 -4.620 -12.662 -4.784 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.189 -10.325 -3.024 1.00 0.00 H new ATOM 0 HB VAL A 74 -6.596 -10.087 -2.914 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -6.948 -9.190 -5.214 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -5.338 -8.778 -4.575 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.515 -10.092 -5.763 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -8.079 -11.192 -4.550 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -6.711 -12.195 -5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.327 -12.351 -3.428 1.00 0.00 H new ATOM 1200 N GLU A 75 -4.391 -11.793 -1.035 1.00 0.00 N ATOM 1201 CA GLU A 75 -4.427 -12.665 0.105 1.00 0.00 C ATOM 1202 C GLU A 75 -5.404 -12.102 1.125 1.00 0.00 C ATOM 1203 O GLU A 75 -5.166 -11.055 1.707 1.00 0.00 O ATOM 1204 CB GLU A 75 -3.004 -12.818 0.680 1.00 0.00 C ATOM 1205 CG GLU A 75 -2.833 -13.918 1.713 1.00 0.00 C ATOM 1206 CD GLU A 75 -1.394 -14.051 2.221 1.00 0.00 C ATOM 1207 OE1 GLU A 75 -0.467 -14.265 1.416 1.00 0.00 O ATOM 1208 OE2 GLU A 75 -1.157 -13.964 3.444 1.00 0.00 O ATOM 0 H GLU A 75 -3.907 -10.908 -0.882 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.772 -13.659 -0.178 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.316 -13.007 -0.144 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -2.709 -11.871 1.131 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -3.493 -13.720 2.558 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.147 -14.867 1.279 1.00 0.00 H new ATOM 1215 N PHE A 76 -6.517 -12.769 1.292 1.00 0.00 N ATOM 1216 CA PHE A 76 -7.549 -12.309 2.216 1.00 0.00 C ATOM 1217 C PHE A 76 -7.249 -12.803 3.606 1.00 0.00 C ATOM 1218 O PHE A 76 -6.721 -13.926 3.768 1.00 0.00 O ATOM 1219 CB PHE A 76 -8.930 -12.797 1.785 1.00 0.00 C ATOM 1220 CG PHE A 76 -9.364 -12.290 0.447 1.00 0.00 C ATOM 1221 CD1 PHE A 76 -9.895 -11.022 0.316 1.00 0.00 C ATOM 1222 CD2 PHE A 76 -9.244 -13.080 -0.676 1.00 0.00 C ATOM 1223 CE1 PHE A 76 -10.300 -10.551 -0.913 1.00 0.00 C ATOM 1224 CE2 PHE A 76 -9.645 -12.615 -1.903 1.00 0.00 C ATOM 1225 CZ PHE A 76 -10.173 -11.350 -2.025 1.00 0.00 C ATOM 0 H PHE A 76 -6.742 -13.636 0.804 1.00 0.00 H new ATOM 0 HA PHE A 76 -7.551 -11.219 2.207 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -8.929 -13.887 1.766 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -9.662 -12.491 2.533 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.994 -10.392 1.188 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -8.831 -14.074 -0.589 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.716 -9.558 -1.003 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.546 -13.244 -2.776 1.00 0.00 H new ATOM 0 HZ PHE A 76 -10.487 -10.986 -2.992 1.00 0.00 H new ATOM 1235 N ASP A 77 -7.601 -11.994 4.603 1.00 0.00 N ATOM 1236 CA ASP A 77 -7.309 -12.306 5.998 1.00 0.00 C ATOM 1237 C ASP A 77 -8.381 -13.280 6.552 1.00 0.00 C ATOM 1238 O ASP A 77 -9.192 -13.816 5.790 1.00 0.00 O ATOM 1239 CB ASP A 77 -7.211 -11.006 6.839 1.00 0.00 C ATOM 1240 CG ASP A 77 -6.346 -11.147 8.107 1.00 0.00 C ATOM 1241 OD1 ASP A 77 -6.761 -11.826 9.061 1.00 0.00 O ATOM 1242 OD2 ASP A 77 -5.230 -10.562 8.169 1.00 0.00 O ATOM 0 H ASP A 77 -8.093 -11.111 4.467 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.340 -12.801 6.064 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.799 -10.212 6.216 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.215 -10.695 7.128 1.00 0.00 H new ATOM 1247 N LYS A 78 -8.403 -13.483 7.847 1.00 0.00 N ATOM 1248 CA LYS A 78 -9.245 -14.502 8.485 1.00 0.00 C ATOM 1249 C LYS A 78 -10.644 -13.967 8.858 1.00 0.00 C ATOM 1250 O LYS A 78 -11.409 -14.623 9.602 1.00 0.00 O ATOM 1251 CB LYS A 78 -8.524 -15.017 9.739 1.00 0.00 C ATOM 1252 CG LYS A 78 -8.437 -13.991 10.865 1.00 0.00 C ATOM 1253 CD LYS A 78 -7.519 -14.439 11.986 1.00 0.00 C ATOM 1254 CE LYS A 78 -6.058 -14.274 11.605 1.00 0.00 C ATOM 1255 NZ LYS A 78 -5.718 -12.851 11.374 1.00 0.00 N ATOM 0 H LYS A 78 -7.837 -12.948 8.506 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.402 -15.310 7.771 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -9.042 -15.903 10.107 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -7.516 -15.328 9.465 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -8.079 -13.043 10.463 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.434 -13.810 11.266 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -7.730 -13.859 12.885 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -7.718 -15.483 12.226 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -5.426 -14.677 12.396 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -5.848 -14.851 10.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -5.348 -12.735 10.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -6.571 -12.267 11.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.996 -12.551 12.060 1.00 0.00 H new ATOM 1269 N GLY A 79 -10.975 -12.808 8.369 1.00 0.00 N ATOM 1270 CA GLY A 79 -12.255 -12.240 8.665 1.00 0.00 C ATOM 1271 C GLY A 79 -13.012 -11.865 7.426 1.00 0.00 C ATOM 1272 O GLY A 79 -13.163 -12.689 6.504 1.00 0.00 O ATOM 0 H GLY A 79 -10.379 -12.241 7.766 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -12.841 -12.953 9.244 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -12.122 -11.356 9.288 1.00 0.00 H new ATOM 1276 N GLN A 80 -13.445 -10.625 7.379 1.00 0.00 N ATOM 1277 CA GLN A 80 -14.245 -10.116 6.302 1.00 0.00 C ATOM 1278 C GLN A 80 -13.439 -9.958 5.034 1.00 0.00 C ATOM 1279 O GLN A 80 -12.286 -9.529 5.064 1.00 0.00 O ATOM 1280 CB GLN A 80 -14.912 -8.797 6.692 1.00 0.00 C ATOM 1281 CG GLN A 80 -13.974 -7.740 7.265 1.00 0.00 C ATOM 1282 CD GLN A 80 -14.664 -6.410 7.529 1.00 0.00 C ATOM 1283 OE1 GLN A 80 -14.305 -5.682 8.447 1.00 0.00 O ATOM 1284 NE2 GLN A 80 -15.629 -6.062 6.717 1.00 0.00 N ATOM 0 H GLN A 80 -13.244 -9.935 8.103 1.00 0.00 H new ATOM 0 HA GLN A 80 -15.027 -10.848 6.103 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -15.405 -8.384 5.812 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -15.691 -9.005 7.426 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -13.544 -8.110 8.196 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -13.147 -7.582 6.572 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -15.909 -6.686 5.960 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -16.101 -5.166 6.840 1.00 0.00 H new ATOM 1293 N ARG A 81 -14.034 -10.332 3.944 1.00 0.00 N ATOM 1294 CA ARG A 81 -13.393 -10.245 2.658 1.00 0.00 C ATOM 1295 C ARG A 81 -13.638 -8.888 1.991 1.00 0.00 C ATOM 1296 O ARG A 81 -12.802 -8.413 1.220 1.00 0.00 O ATOM 1297 CB ARG A 81 -13.857 -11.408 1.773 1.00 0.00 C ATOM 1298 CG ARG A 81 -13.382 -11.371 0.349 1.00 0.00 C ATOM 1299 CD ARG A 81 -13.747 -12.649 -0.358 1.00 0.00 C ATOM 1300 NE ARG A 81 -15.191 -12.895 -0.347 1.00 0.00 N ATOM 1301 CZ ARG A 81 -15.755 -14.099 -0.193 1.00 0.00 C ATOM 1302 NH1 ARG A 81 -14.999 -15.178 0.053 1.00 0.00 N ATOM 1303 NH2 ARG A 81 -17.063 -14.216 -0.239 1.00 0.00 N ATOM 0 H ARG A 81 -14.982 -10.708 3.915 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.315 -10.325 2.800 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -13.521 -12.341 2.225 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -14.947 -11.428 1.773 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -13.828 -10.521 -0.168 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -12.302 -11.229 0.323 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -13.396 -12.605 -1.389 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -13.234 -13.485 0.118 1.00 0.00 H new ATOM 0 HE ARG A 81 -15.810 -12.093 -0.465 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -13.986 -15.085 0.124 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -15.437 -16.092 0.169 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.644 -13.391 -0.392 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -17.498 -15.131 -0.122 1.00 0.00 H new ATOM 1317 N THR A 82 -14.763 -8.262 2.283 1.00 0.00 N ATOM 1318 CA THR A 82 -15.077 -6.985 1.668 1.00 0.00 C ATOM 1319 C THR A 82 -15.579 -5.956 2.674 1.00 0.00 C ATOM 1320 O THR A 82 -16.121 -6.305 3.742 1.00 0.00 O ATOM 1321 CB THR A 82 -16.130 -7.115 0.526 1.00 0.00 C ATOM 1322 OG1 THR A 82 -17.291 -7.813 0.993 1.00 0.00 O ATOM 1323 CG2 THR A 82 -15.563 -7.823 -0.696 1.00 0.00 C ATOM 0 H THR A 82 -15.467 -8.611 2.934 1.00 0.00 H new ATOM 0 HA THR A 82 -14.132 -6.640 1.247 1.00 0.00 H new ATOM 0 HB THR A 82 -16.407 -6.104 0.229 1.00 0.00 H new ATOM 0 HG1 THR A 82 -17.944 -7.885 0.266 1.00 0.00 H new ATOM 0 HG21 THR A 82 -16.331 -7.891 -1.466 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.713 -7.260 -1.081 1.00 0.00 H new ATOM 0 HG23 THR A 82 -15.238 -8.826 -0.418 1.00 0.00 H new ATOM 1331 N ASP A 83 -15.346 -4.712 2.334 1.00 0.00 N ATOM 1332 CA ASP A 83 -15.858 -3.542 3.029 1.00 0.00 C ATOM 1333 C ASP A 83 -17.339 -3.352 2.670 1.00 0.00 C ATOM 1334 O ASP A 83 -17.835 -3.955 1.704 1.00 0.00 O ATOM 1335 CB ASP A 83 -15.018 -2.299 2.598 1.00 0.00 C ATOM 1336 CG ASP A 83 -15.653 -0.952 2.918 1.00 0.00 C ATOM 1337 OD1 ASP A 83 -15.586 -0.488 4.058 1.00 0.00 O ATOM 1338 OD2 ASP A 83 -16.267 -0.356 2.024 1.00 0.00 O ATOM 0 H ASP A 83 -14.768 -4.470 1.529 1.00 0.00 H new ATOM 0 HA ASP A 83 -15.777 -3.668 4.109 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -14.045 -2.350 3.086 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -14.840 -2.354 1.524 1.00 0.00 H new ATOM 1343 N LYS A 84 -18.009 -2.514 3.427 1.00 0.00 N ATOM 1344 CA LYS A 84 -19.418 -2.168 3.262 1.00 0.00 C ATOM 1345 C LYS A 84 -19.753 -1.667 1.832 1.00 0.00 C ATOM 1346 O LYS A 84 -20.861 -1.869 1.358 1.00 0.00 O ATOM 1347 CB LYS A 84 -19.753 -1.084 4.289 1.00 0.00 C ATOM 1348 CG LYS A 84 -18.851 0.136 4.174 1.00 0.00 C ATOM 1349 CD LYS A 84 -18.962 1.073 5.352 1.00 0.00 C ATOM 1350 CE LYS A 84 -18.029 2.263 5.167 1.00 0.00 C ATOM 1351 NZ LYS A 84 -16.598 1.862 5.012 1.00 0.00 N ATOM 0 H LYS A 84 -17.575 -2.029 4.212 1.00 0.00 H new ATOM 0 HA LYS A 84 -20.017 -3.065 3.417 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -20.791 -0.776 4.160 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -19.666 -1.501 5.292 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -17.817 -0.193 4.077 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -19.100 0.679 3.262 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -19.990 1.420 5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -18.711 0.544 6.272 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -18.340 2.829 4.289 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -18.123 2.929 6.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -16.042 2.247 5.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -16.526 0.824 5.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -16.228 2.235 4.115 1.00 0.00 H new ATOM 1365 N TYR A 85 -18.793 -1.045 1.143 1.00 0.00 N ATOM 1366 CA TYR A 85 -19.044 -0.551 -0.207 1.00 0.00 C ATOM 1367 C TYR A 85 -18.565 -1.523 -1.278 1.00 0.00 C ATOM 1368 O TYR A 85 -18.411 -1.149 -2.449 1.00 0.00 O ATOM 1369 CB TYR A 85 -18.438 0.839 -0.423 1.00 0.00 C ATOM 1370 CG TYR A 85 -19.114 1.922 0.382 1.00 0.00 C ATOM 1371 CD1 TYR A 85 -20.466 2.180 0.217 1.00 0.00 C ATOM 1372 CD2 TYR A 85 -18.412 2.676 1.310 1.00 0.00 C ATOM 1373 CE1 TYR A 85 -21.099 3.157 0.948 1.00 0.00 C ATOM 1374 CE2 TYR A 85 -19.042 3.657 2.048 1.00 0.00 C ATOM 1375 CZ TYR A 85 -20.387 3.891 1.861 1.00 0.00 C ATOM 1376 OH TYR A 85 -21.024 4.862 2.600 1.00 0.00 O ATOM 0 H TYR A 85 -17.850 -0.875 1.493 1.00 0.00 H new ATOM 0 HA TYR A 85 -20.126 -0.466 -0.307 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.380 0.810 -0.162 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -18.498 1.093 -1.481 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -21.032 1.603 -0.499 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -17.358 2.493 1.457 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -22.153 3.346 0.804 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -18.484 4.238 2.768 1.00 0.00 H new ATOM 0 HH TYR A 85 -20.380 5.290 3.202 1.00 0.00 H new ATOM 1386 N GLY A 86 -18.348 -2.764 -0.887 1.00 0.00 N ATOM 1387 CA GLY A 86 -17.949 -3.782 -1.836 1.00 0.00 C ATOM 1388 C GLY A 86 -16.527 -3.602 -2.290 1.00 0.00 C ATOM 1389 O GLY A 86 -16.202 -3.752 -3.467 1.00 0.00 O ATOM 0 H GLY A 86 -18.441 -3.089 0.075 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -18.063 -4.766 -1.381 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -18.612 -3.752 -2.700 1.00 0.00 H new ATOM 1393 N ARG A 87 -15.693 -3.188 -1.389 1.00 0.00 N ATOM 1394 CA ARG A 87 -14.296 -3.038 -1.667 1.00 0.00 C ATOM 1395 C ARG A 87 -13.589 -4.217 -1.014 1.00 0.00 C ATOM 1396 O ARG A 87 -13.856 -4.516 0.133 1.00 0.00 O ATOM 1397 CB ARG A 87 -13.760 -1.715 -1.084 1.00 0.00 C ATOM 1398 CG ARG A 87 -14.589 -0.439 -1.381 1.00 0.00 C ATOM 1399 CD ARG A 87 -14.660 -0.035 -2.867 1.00 0.00 C ATOM 1400 NE ARG A 87 -15.458 -0.953 -3.710 1.00 0.00 N ATOM 1401 CZ ARG A 87 -16.073 -0.624 -4.869 1.00 0.00 C ATOM 1402 NH1 ARG A 87 -16.053 0.630 -5.319 1.00 0.00 N ATOM 1403 NH2 ARG A 87 -16.733 -1.549 -5.550 1.00 0.00 N ATOM 0 H ARG A 87 -15.961 -2.943 -0.436 1.00 0.00 H new ATOM 0 HA ARG A 87 -14.121 -3.015 -2.743 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -13.682 -1.826 -0.003 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -12.750 -1.561 -1.463 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -15.604 -0.590 -1.013 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -14.165 0.391 -0.815 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -15.084 0.967 -2.939 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -13.647 0.018 -3.266 1.00 0.00 H new ATOM 0 HE ARG A 87 -15.552 -1.917 -3.389 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -15.570 1.355 -4.788 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -16.521 0.865 -6.194 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -16.776 -2.506 -5.200 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -17.198 -1.304 -6.424 1.00 0.00 H new ATOM 1417 N GLY A 88 -12.751 -4.899 -1.748 1.00 0.00 N ATOM 1418 CA GLY A 88 -12.043 -6.042 -1.215 1.00 0.00 C ATOM 1419 C GLY A 88 -11.022 -5.641 -0.184 1.00 0.00 C ATOM 1420 O GLY A 88 -10.432 -4.561 -0.295 1.00 0.00 O ATOM 0 H GLY A 88 -12.538 -4.685 -2.722 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -12.756 -6.735 -0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -11.548 -6.574 -2.028 1.00 0.00 H new ATOM 1424 N LEU A 89 -10.823 -6.496 0.806 1.00 0.00 N ATOM 1425 CA LEU A 89 -9.883 -6.266 1.872 1.00 0.00 C ATOM 1426 C LEU A 89 -8.887 -7.407 1.860 1.00 0.00 C ATOM 1427 O LEU A 89 -9.166 -8.497 2.372 1.00 0.00 O ATOM 1428 CB LEU A 89 -10.602 -6.232 3.235 1.00 0.00 C ATOM 1429 CG LEU A 89 -11.773 -5.249 3.379 1.00 0.00 C ATOM 1430 CD1 LEU A 89 -12.387 -5.353 4.758 1.00 0.00 C ATOM 1431 CD2 LEU A 89 -11.331 -3.826 3.110 1.00 0.00 C ATOM 0 H LEU A 89 -11.322 -7.382 0.886 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.386 -5.307 1.726 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -10.973 -7.235 3.448 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.864 -5.995 4.002 1.00 0.00 H new ATOM 0 HG LEU A 89 -12.525 -5.517 2.637 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -13.215 -4.649 4.842 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.755 -6.367 4.917 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -11.634 -5.118 5.510 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -12.182 -3.154 3.220 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.553 -3.546 3.821 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -10.939 -3.752 2.096 1.00 0.00 H new ATOM 1443 N ALA A 90 -7.767 -7.192 1.229 1.00 0.00 N ATOM 1444 CA ALA A 90 -6.776 -8.227 1.086 1.00 0.00 C ATOM 1445 C ALA A 90 -5.393 -7.647 1.059 1.00 0.00 C ATOM 1446 O ALA A 90 -5.214 -6.432 0.963 1.00 0.00 O ATOM 1447 CB ALA A 90 -7.016 -9.001 -0.204 1.00 0.00 C ATOM 0 H ALA A 90 -7.514 -6.301 0.801 1.00 0.00 H new ATOM 0 HA ALA A 90 -6.861 -8.896 1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -6.263 -9.782 -0.305 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.007 -9.454 -0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -6.950 -8.321 -1.054 1.00 0.00 H new ATOM 1453 N TYR A 91 -4.437 -8.506 1.171 1.00 0.00 N ATOM 1454 CA TYR A 91 -3.065 -8.162 1.026 1.00 0.00 C ATOM 1455 C TYR A 91 -2.719 -8.468 -0.407 1.00 0.00 C ATOM 1456 O TYR A 91 -2.763 -9.619 -0.829 1.00 0.00 O ATOM 1457 CB TYR A 91 -2.193 -8.992 1.966 1.00 0.00 C ATOM 1458 CG TYR A 91 -2.539 -8.862 3.440 1.00 0.00 C ATOM 1459 CD1 TYR A 91 -3.575 -9.598 3.993 1.00 0.00 C ATOM 1460 CD2 TYR A 91 -1.814 -8.031 4.279 1.00 0.00 C ATOM 1461 CE1 TYR A 91 -3.880 -9.514 5.329 1.00 0.00 C ATOM 1462 CE2 TYR A 91 -2.121 -7.939 5.623 1.00 0.00 C ATOM 1463 CZ TYR A 91 -3.159 -8.686 6.139 1.00 0.00 C ATOM 1464 OH TYR A 91 -3.449 -8.630 7.487 1.00 0.00 O ATOM 0 H TYR A 91 -4.594 -9.494 1.371 1.00 0.00 H new ATOM 0 HA TYR A 91 -2.891 -7.115 1.274 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -2.272 -10.041 1.680 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -1.152 -8.701 1.825 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -4.155 -10.252 3.359 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -0.999 -7.448 3.877 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -4.689 -10.102 5.738 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -1.551 -7.285 6.266 1.00 0.00 H new ATOM 0 HH TYR A 91 -4.037 -9.377 7.726 1.00 0.00 H new ATOM 1474 N ILE A 92 -2.440 -7.464 -1.156 1.00 0.00 N ATOM 1475 CA ILE A 92 -2.226 -7.622 -2.558 1.00 0.00 C ATOM 1476 C ILE A 92 -0.751 -7.729 -2.872 1.00 0.00 C ATOM 1477 O ILE A 92 0.075 -6.945 -2.378 1.00 0.00 O ATOM 1478 CB ILE A 92 -2.909 -6.482 -3.357 1.00 0.00 C ATOM 1479 CG1 ILE A 92 -4.418 -6.501 -3.049 1.00 0.00 C ATOM 1480 CG2 ILE A 92 -2.663 -6.636 -4.865 1.00 0.00 C ATOM 1481 CD1 ILE A 92 -5.211 -5.419 -3.725 1.00 0.00 C ATOM 0 H ILE A 92 -2.352 -6.505 -0.819 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.691 -8.557 -2.871 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.481 -5.526 -3.056 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -4.823 -7.469 -3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -4.556 -6.414 -1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.154 -5.822 -5.399 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -1.592 -6.606 -5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.068 -7.589 -5.204 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.262 -5.512 -3.450 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.838 -4.444 -3.411 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -5.110 -5.515 -4.806 1.00 0.00 H new ATOM 1493 N TYR A 93 -0.428 -8.724 -3.636 1.00 0.00 N ATOM 1494 CA TYR A 93 0.909 -8.990 -4.047 1.00 0.00 C ATOM 1495 C TYR A 93 1.045 -8.711 -5.522 1.00 0.00 C ATOM 1496 O TYR A 93 0.319 -9.280 -6.340 1.00 0.00 O ATOM 1497 CB TYR A 93 1.280 -10.460 -3.792 1.00 0.00 C ATOM 1498 CG TYR A 93 1.276 -10.896 -2.342 1.00 0.00 C ATOM 1499 CD1 TYR A 93 0.089 -11.102 -1.660 1.00 0.00 C ATOM 1500 CD2 TYR A 93 2.463 -11.134 -1.669 1.00 0.00 C ATOM 1501 CE1 TYR A 93 0.085 -11.529 -0.353 1.00 0.00 C ATOM 1502 CE2 TYR A 93 2.465 -11.558 -0.356 1.00 0.00 C ATOM 1503 CZ TYR A 93 1.271 -11.756 0.296 1.00 0.00 C ATOM 1504 OH TYR A 93 1.259 -12.200 1.600 1.00 0.00 O ATOM 0 H TYR A 93 -1.108 -9.391 -4.000 1.00 0.00 H new ATOM 0 HA TYR A 93 1.576 -8.348 -3.471 1.00 0.00 H new ATOM 0 HB2 TYR A 93 0.585 -11.092 -4.344 1.00 0.00 H new ATOM 0 HB3 TYR A 93 2.272 -10.642 -4.204 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -0.850 -10.924 -2.163 1.00 0.00 H new ATOM 0 HD2 TYR A 93 3.403 -10.985 -2.180 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -0.851 -11.685 0.162 1.00 0.00 H new ATOM 0 HE2 TYR A 93 3.399 -11.733 0.157 1.00 0.00 H new ATOM 0 HH TYR A 93 0.857 -13.093 1.638 1.00 0.00 H new ATOM 1514 N ALA A 94 1.973 -7.875 -5.855 1.00 0.00 N ATOM 1515 CA ALA A 94 2.275 -7.579 -7.208 1.00 0.00 C ATOM 1516 C ALA A 94 3.512 -8.323 -7.526 1.00 0.00 C ATOM 1517 O ALA A 94 4.584 -8.043 -6.965 1.00 0.00 O ATOM 1518 CB ALA A 94 2.499 -6.096 -7.411 1.00 0.00 C ATOM 0 H ALA A 94 2.549 -7.373 -5.180 1.00 0.00 H new ATOM 0 HA ALA A 94 1.448 -7.866 -7.857 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.728 -5.903 -8.459 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.598 -5.550 -7.130 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.332 -5.766 -6.790 1.00 0.00 H new ATOM 1524 N ASP A 95 3.335 -9.361 -8.324 1.00 0.00 N ATOM 1525 CA ASP A 95 4.412 -10.230 -8.786 1.00 0.00 C ATOM 1526 C ASP A 95 5.019 -10.954 -7.570 1.00 0.00 C ATOM 1527 O ASP A 95 6.151 -11.389 -7.571 1.00 0.00 O ATOM 1528 CB ASP A 95 5.455 -9.375 -9.525 1.00 0.00 C ATOM 1529 CG ASP A 95 6.357 -10.138 -10.433 1.00 0.00 C ATOM 1530 OD1 ASP A 95 6.014 -10.262 -11.617 1.00 0.00 O ATOM 1531 OD2 ASP A 95 7.449 -10.566 -10.001 1.00 0.00 O ATOM 0 H ASP A 95 2.418 -9.633 -8.679 1.00 0.00 H new ATOM 0 HA ASP A 95 4.042 -10.985 -9.479 1.00 0.00 H new ATOM 0 HB2 ASP A 95 4.934 -8.615 -10.107 1.00 0.00 H new ATOM 0 HB3 ASP A 95 6.063 -8.851 -8.788 1.00 0.00 H new ATOM 1536 N GLY A 96 4.225 -11.078 -6.530 1.00 0.00 N ATOM 1537 CA GLY A 96 4.668 -11.744 -5.330 1.00 0.00 C ATOM 1538 C GLY A 96 5.197 -10.790 -4.267 1.00 0.00 C ATOM 1539 O GLY A 96 5.498 -11.216 -3.155 1.00 0.00 O ATOM 0 H GLY A 96 3.269 -10.725 -6.493 1.00 0.00 H new ATOM 0 HA2 GLY A 96 3.839 -12.316 -4.914 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.450 -12.458 -5.588 1.00 0.00 H new ATOM 1543 N LYS A 97 5.331 -9.517 -4.596 1.00 0.00 N ATOM 1544 CA LYS A 97 5.749 -8.521 -3.631 1.00 0.00 C ATOM 1545 C LYS A 97 4.534 -7.839 -3.040 1.00 0.00 C ATOM 1546 O LYS A 97 3.594 -7.533 -3.757 1.00 0.00 O ATOM 1547 CB LYS A 97 6.679 -7.485 -4.278 1.00 0.00 C ATOM 1548 CG LYS A 97 8.139 -7.919 -4.402 1.00 0.00 C ATOM 1549 CD LYS A 97 8.386 -9.126 -5.305 1.00 0.00 C ATOM 1550 CE LYS A 97 8.145 -8.830 -6.776 1.00 0.00 C ATOM 1551 NZ LYS A 97 8.457 -10.012 -7.608 1.00 0.00 N ATOM 0 H LYS A 97 5.155 -9.149 -5.531 1.00 0.00 H new ATOM 0 HA LYS A 97 6.303 -9.020 -2.836 1.00 0.00 H new ATOM 0 HB2 LYS A 97 6.300 -7.249 -5.272 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.637 -6.566 -3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 97 8.720 -7.078 -4.780 1.00 0.00 H new ATOM 0 HG3 LYS A 97 8.519 -8.147 -3.406 1.00 0.00 H new ATOM 0 HD2 LYS A 97 9.413 -9.467 -5.173 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.736 -9.944 -4.994 1.00 0.00 H new ATOM 0 HE2 LYS A 97 7.106 -8.537 -6.927 1.00 0.00 H new ATOM 0 HE3 LYS A 97 8.762 -7.987 -7.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 8.285 -9.787 -8.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 9.455 -10.274 -7.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 7.850 -10.807 -7.323 1.00 0.00 H new ATOM 1565 N MET A 98 4.545 -7.594 -1.749 1.00 0.00 N ATOM 1566 CA MET A 98 3.406 -6.978 -1.098 1.00 0.00 C ATOM 1567 C MET A 98 3.291 -5.523 -1.461 1.00 0.00 C ATOM 1568 O MET A 98 4.140 -4.709 -1.081 1.00 0.00 O ATOM 1569 CB MET A 98 3.448 -7.113 0.430 1.00 0.00 C ATOM 1570 CG MET A 98 3.235 -8.511 0.952 1.00 0.00 C ATOM 1571 SD MET A 98 3.243 -8.608 2.764 1.00 0.00 S ATOM 1572 CE MET A 98 1.858 -7.550 3.188 1.00 0.00 C ATOM 0 H MET A 98 5.326 -7.810 -1.129 1.00 0.00 H new ATOM 0 HA MET A 98 2.531 -7.518 -1.460 1.00 0.00 H new ATOM 0 HB2 MET A 98 4.413 -6.752 0.785 1.00 0.00 H new ATOM 0 HB3 MET A 98 2.686 -6.461 0.858 1.00 0.00 H new ATOM 0 HG2 MET A 98 2.284 -8.890 0.579 1.00 0.00 H new ATOM 0 HG3 MET A 98 4.015 -9.162 0.557 1.00 0.00 H new ATOM 0 HE1 MET A 98 1.519 -7.782 4.198 1.00 0.00 H new ATOM 0 HE2 MET A 98 2.169 -6.507 3.141 1.00 0.00 H new ATOM 0 HE3 MET A 98 1.043 -7.718 2.484 1.00 0.00 H new ATOM 1582 N VAL A 99 2.229 -5.198 -2.175 1.00 0.00 N ATOM 1583 CA VAL A 99 1.934 -3.827 -2.549 1.00 0.00 C ATOM 1584 C VAL A 99 1.698 -3.051 -1.277 1.00 0.00 C ATOM 1585 O VAL A 99 2.220 -1.963 -1.095 1.00 0.00 O ATOM 1586 CB VAL A 99 0.660 -3.741 -3.435 1.00 0.00 C ATOM 1587 CG1 VAL A 99 0.365 -2.309 -3.842 1.00 0.00 C ATOM 1588 CG2 VAL A 99 0.795 -4.617 -4.663 1.00 0.00 C ATOM 0 H VAL A 99 1.547 -5.877 -2.512 1.00 0.00 H new ATOM 0 HA VAL A 99 2.768 -3.422 -3.122 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.177 -4.104 -2.839 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.532 -2.284 -4.461 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.208 -1.702 -2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.207 -1.911 -4.408 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.109 -4.539 -5.267 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.653 -4.290 -5.251 1.00 0.00 H new ATOM 0 HG23 VAL A 99 0.939 -5.653 -4.357 1.00 0.00 H new ATOM 1598 N ASN A 100 0.961 -3.692 -0.365 1.00 0.00 N ATOM 1599 CA ASN A 100 0.643 -3.131 0.949 1.00 0.00 C ATOM 1600 C ASN A 100 1.901 -2.698 1.649 1.00 0.00 C ATOM 1601 O ASN A 100 1.998 -1.576 2.119 1.00 0.00 O ATOM 1602 CB ASN A 100 -0.060 -4.170 1.833 1.00 0.00 C ATOM 1603 CG ASN A 100 -1.404 -4.600 1.318 1.00 0.00 C ATOM 1604 OD1 ASN A 100 -1.495 -5.498 0.508 1.00 0.00 O ATOM 1605 ND2 ASN A 100 -2.453 -3.998 1.809 1.00 0.00 N ATOM 0 H ASN A 100 0.567 -4.620 -0.520 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.016 -2.277 0.790 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.580 -5.047 1.925 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -0.181 -3.758 2.835 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -3.388 -4.279 1.513 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -2.338 -3.246 2.489 1.00 0.00 H new ATOM 1612 N GLU A 101 2.879 -3.593 1.674 1.00 0.00 N ATOM 1613 CA GLU A 101 4.132 -3.347 2.353 1.00 0.00 C ATOM 1614 C GLU A 101 4.846 -2.188 1.711 1.00 0.00 C ATOM 1615 O GLU A 101 5.217 -1.229 2.389 1.00 0.00 O ATOM 1616 CB GLU A 101 5.021 -4.583 2.309 1.00 0.00 C ATOM 1617 CG GLU A 101 6.316 -4.434 3.077 1.00 0.00 C ATOM 1618 CD GLU A 101 7.315 -5.507 2.720 1.00 0.00 C ATOM 1619 OE1 GLU A 101 8.044 -5.345 1.707 1.00 0.00 O ATOM 1620 OE2 GLU A 101 7.404 -6.520 3.414 1.00 0.00 O ATOM 0 H GLU A 101 2.821 -4.506 1.224 1.00 0.00 H new ATOM 0 HA GLU A 101 3.916 -3.109 3.395 1.00 0.00 H new ATOM 0 HB2 GLU A 101 4.467 -5.431 2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 101 5.251 -4.816 1.269 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.748 -3.455 2.872 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.109 -4.473 4.146 1.00 0.00 H new ATOM 1627 N ALA A 102 4.980 -2.255 0.401 1.00 0.00 N ATOM 1628 CA ALA A 102 5.705 -1.258 -0.349 1.00 0.00 C ATOM 1629 C ALA A 102 5.101 0.110 -0.185 1.00 0.00 C ATOM 1630 O ALA A 102 5.824 1.060 0.059 1.00 0.00 O ATOM 1631 CB ALA A 102 5.817 -1.644 -1.815 1.00 0.00 C ATOM 0 H ALA A 102 4.588 -3.004 -0.170 1.00 0.00 H new ATOM 0 HA ALA A 102 6.715 -1.215 0.059 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.368 -0.873 -2.353 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.344 -2.594 -1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.819 -1.742 -2.243 1.00 0.00 H new ATOM 1637 N LEU A 103 3.784 0.200 -0.256 1.00 0.00 N ATOM 1638 CA LEU A 103 3.100 1.477 -0.119 1.00 0.00 C ATOM 1639 C LEU A 103 3.377 2.083 1.223 1.00 0.00 C ATOM 1640 O LEU A 103 3.677 3.268 1.333 1.00 0.00 O ATOM 1641 CB LEU A 103 1.589 1.338 -0.298 1.00 0.00 C ATOM 1642 CG LEU A 103 1.111 0.815 -1.638 1.00 0.00 C ATOM 1643 CD1 LEU A 103 -0.404 0.837 -1.712 1.00 0.00 C ATOM 1644 CD2 LEU A 103 1.730 1.605 -2.765 1.00 0.00 C ATOM 0 H LEU A 103 3.165 -0.596 -0.408 1.00 0.00 H new ATOM 0 HA LEU A 103 3.484 2.126 -0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.213 0.674 0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.135 2.315 -0.131 1.00 0.00 H new ATOM 0 HG LEU A 103 1.432 -0.222 -1.742 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.726 0.458 -2.682 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.816 0.210 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.760 1.860 -1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.376 1.216 -3.720 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.447 2.653 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.815 1.517 -2.718 1.00 0.00 H new ATOM 1656 N VAL A 104 3.311 1.280 2.240 1.00 0.00 N ATOM 1657 CA VAL A 104 3.505 1.778 3.556 1.00 0.00 C ATOM 1658 C VAL A 104 4.980 2.151 3.813 1.00 0.00 C ATOM 1659 O VAL A 104 5.262 3.262 4.239 1.00 0.00 O ATOM 1660 CB VAL A 104 2.948 0.835 4.637 1.00 0.00 C ATOM 1661 CG1 VAL A 104 3.014 1.507 5.964 1.00 0.00 C ATOM 1662 CG2 VAL A 104 1.513 0.477 4.342 1.00 0.00 C ATOM 0 H VAL A 104 3.124 0.279 2.179 1.00 0.00 H new ATOM 0 HA VAL A 104 2.923 2.697 3.629 1.00 0.00 H new ATOM 0 HB VAL A 104 3.548 -0.075 4.645 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.620 0.839 6.730 1.00 0.00 H new ATOM 0 HG12 VAL A 104 4.050 1.753 6.196 1.00 0.00 H new ATOM 0 HG13 VAL A 104 2.421 2.421 5.939 1.00 0.00 H new ATOM 0 HG21 VAL A 104 1.138 -0.190 5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 104 0.909 1.384 4.320 1.00 0.00 H new ATOM 0 HG23 VAL A 104 1.454 -0.022 3.375 1.00 0.00 H new ATOM 1672 N ARG A 105 5.932 1.266 3.469 1.00 0.00 N ATOM 1673 CA ARG A 105 7.351 1.585 3.726 1.00 0.00 C ATOM 1674 C ARG A 105 7.985 2.548 2.739 1.00 0.00 C ATOM 1675 O ARG A 105 9.118 2.976 2.925 1.00 0.00 O ATOM 1676 CB ARG A 105 8.265 0.374 4.089 1.00 0.00 C ATOM 1677 CG ARG A 105 8.125 -0.919 3.304 1.00 0.00 C ATOM 1678 CD ARG A 105 8.656 -0.856 1.887 1.00 0.00 C ATOM 1679 NE ARG A 105 8.597 -2.193 1.280 1.00 0.00 N ATOM 1680 CZ ARG A 105 8.831 -2.509 0.004 1.00 0.00 C ATOM 1681 NH1 ARG A 105 9.193 -1.574 -0.879 1.00 0.00 N ATOM 1682 NH2 ARG A 105 8.715 -3.776 -0.376 1.00 0.00 N ATOM 0 H ARG A 105 5.759 0.361 3.031 1.00 0.00 H new ATOM 0 HA ARG A 105 7.284 2.148 4.657 1.00 0.00 H new ATOM 0 HB2 ARG A 105 9.300 0.704 3.997 1.00 0.00 H new ATOM 0 HB3 ARG A 105 8.098 0.140 5.140 1.00 0.00 H new ATOM 0 HG2 ARG A 105 8.647 -1.712 3.839 1.00 0.00 H new ATOM 0 HG3 ARG A 105 7.072 -1.197 3.271 1.00 0.00 H new ATOM 0 HD2 ARG A 105 8.068 -0.152 1.298 1.00 0.00 H new ATOM 0 HD3 ARG A 105 9.683 -0.491 1.888 1.00 0.00 H new ATOM 0 HE ARG A 105 8.350 -2.964 1.901 1.00 0.00 H new ATOM 0 HH11 ARG A 105 9.294 -0.604 -0.582 1.00 0.00 H new ATOM 0 HH12 ARG A 105 9.368 -1.831 -1.850 1.00 0.00 H new ATOM 0 HH21 ARG A 105 8.451 -4.490 0.303 1.00 0.00 H new ATOM 0 HH22 ARG A 105 8.890 -4.035 -1.347 1.00 0.00 H new ATOM 1696 N GLN A 106 7.266 2.895 1.701 1.00 0.00 N ATOM 1697 CA GLN A 106 7.732 3.910 0.779 1.00 0.00 C ATOM 1698 C GLN A 106 7.073 5.246 1.161 1.00 0.00 C ATOM 1699 O GLN A 106 7.378 6.309 0.598 1.00 0.00 O ATOM 1700 CB GLN A 106 7.392 3.521 -0.665 1.00 0.00 C ATOM 1701 CG GLN A 106 8.022 4.398 -1.731 1.00 0.00 C ATOM 1702 CD GLN A 106 9.539 4.377 -1.684 1.00 0.00 C ATOM 1703 OE1 GLN A 106 10.119 5.303 -0.966 1.00 0.00 O flip ATOM 1704 NE2 GLN A 106 10.186 3.535 -2.312 1.00 0.00 N flip ATOM 0 H GLN A 106 6.357 2.493 1.470 1.00 0.00 H new ATOM 0 HA GLN A 106 8.816 4.006 0.842 1.00 0.00 H new ATOM 0 HB2 GLN A 106 7.706 2.491 -0.831 1.00 0.00 H new ATOM 0 HB3 GLN A 106 6.309 3.548 -0.787 1.00 0.00 H new ATOM 0 HG2 GLN A 106 7.688 4.065 -2.714 1.00 0.00 H new ATOM 0 HG3 GLN A 106 7.673 5.423 -1.606 1.00 0.00 H new ATOM 0 HE21 GLN A 106 9.701 2.826 -2.863 1.00 0.00 H new ATOM 0 HE22 GLN A 106 11.205 3.548 -2.281 1.00 0.00 H new ATOM 1713 N GLY A 107 6.186 5.168 2.135 1.00 0.00 N ATOM 1714 CA GLY A 107 5.483 6.319 2.632 1.00 0.00 C ATOM 1715 C GLY A 107 4.468 6.821 1.659 1.00 0.00 C ATOM 1716 O GLY A 107 4.520 7.976 1.244 1.00 0.00 O ATOM 0 H GLY A 107 5.937 4.296 2.601 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.990 6.065 3.570 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.197 7.112 2.852 1.00 0.00 H new ATOM 1720 N LEU A 108 3.584 5.946 1.259 1.00 0.00 N ATOM 1721 CA LEU A 108 2.519 6.268 0.335 1.00 0.00 C ATOM 1722 C LEU A 108 1.164 5.828 0.887 1.00 0.00 C ATOM 1723 O LEU A 108 0.132 6.152 0.328 1.00 0.00 O ATOM 1724 CB LEU A 108 2.792 5.597 -1.003 1.00 0.00 C ATOM 1725 CG LEU A 108 4.067 6.048 -1.714 1.00 0.00 C ATOM 1726 CD1 LEU A 108 4.445 5.055 -2.744 1.00 0.00 C ATOM 1727 CD2 LEU A 108 3.865 7.389 -2.379 1.00 0.00 C ATOM 0 H LEU A 108 3.580 4.974 1.568 1.00 0.00 H new ATOM 0 HA LEU A 108 2.486 7.349 0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 108 2.846 4.520 -0.846 1.00 0.00 H new ATOM 0 HB3 LEU A 108 1.944 5.781 -1.662 1.00 0.00 H new ATOM 0 HG LEU A 108 4.858 6.135 -0.969 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.355 5.382 -3.248 1.00 0.00 H new ATOM 0 HD12 LEU A 108 4.619 4.089 -2.271 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.640 4.962 -3.473 1.00 0.00 H new ATOM 0 HD21 LEU A 108 4.786 7.690 -2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.062 7.314 -3.112 1.00 0.00 H new ATOM 0 HD23 LEU A 108 3.601 8.132 -1.627 1.00 0.00 H new ATOM 1739 N ALA A 109 1.173 5.107 1.994 1.00 0.00 N ATOM 1740 CA ALA A 109 -0.063 4.649 2.612 1.00 0.00 C ATOM 1741 C ALA A 109 -0.001 4.812 4.120 1.00 0.00 C ATOM 1742 O ALA A 109 1.087 4.795 4.702 1.00 0.00 O ATOM 1743 CB ALA A 109 -0.320 3.193 2.260 1.00 0.00 C ATOM 0 H ALA A 109 2.021 4.825 2.485 1.00 0.00 H new ATOM 0 HA ALA A 109 -0.882 5.258 2.229 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.247 2.864 2.729 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -0.403 3.089 1.178 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.506 2.580 2.620 1.00 0.00 H new ATOM 1749 N LYS A 110 -1.157 5.015 4.732 1.00 0.00 N ATOM 1750 CA LYS A 110 -1.271 5.090 6.180 1.00 0.00 C ATOM 1751 C LYS A 110 -1.953 3.844 6.662 1.00 0.00 C ATOM 1752 O LYS A 110 -2.867 3.371 5.985 1.00 0.00 O ATOM 1753 CB LYS A 110 -2.175 6.241 6.631 1.00 0.00 C ATOM 1754 CG LYS A 110 -1.756 7.634 6.247 1.00 0.00 C ATOM 1755 CD LYS A 110 -2.200 8.032 4.874 1.00 0.00 C ATOM 1756 CE LYS A 110 -2.084 9.531 4.702 1.00 0.00 C ATOM 1757 NZ LYS A 110 -3.059 10.280 5.537 1.00 0.00 N ATOM 0 H LYS A 110 -2.042 5.132 4.239 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.264 5.226 6.575 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.173 6.065 6.228 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.258 6.200 7.717 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -2.163 8.340 6.971 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -0.670 7.708 6.305 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -1.591 7.524 4.126 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.231 7.719 4.712 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.073 9.845 4.961 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.238 9.786 3.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -3.232 11.214 5.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.953 9.751 5.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.675 10.400 6.496 1.00 0.00 H new ATOM 1771 N VAL A 111 -1.556 3.301 7.793 1.00 0.00 N ATOM 1772 CA VAL A 111 -2.297 2.199 8.361 1.00 0.00 C ATOM 1773 C VAL A 111 -3.565 2.793 8.949 1.00 0.00 C ATOM 1774 O VAL A 111 -3.520 3.844 9.619 1.00 0.00 O ATOM 1775 CB VAL A 111 -1.484 1.425 9.445 1.00 0.00 C ATOM 1776 CG1 VAL A 111 -2.313 0.308 10.077 1.00 0.00 C ATOM 1777 CG2 VAL A 111 -0.223 0.846 8.830 1.00 0.00 C ATOM 0 H VAL A 111 -0.740 3.598 8.328 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.520 1.462 7.590 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.217 2.131 10.231 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.715 -0.209 10.827 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.198 0.734 10.550 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.619 -0.399 9.306 1.00 0.00 H new ATOM 0 HG21 VAL A 111 0.339 0.307 9.593 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -0.492 0.161 8.026 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.390 1.653 8.430 1.00 0.00 H new ATOM 1787 N ALA A 112 -4.673 2.175 8.701 1.00 0.00 N ATOM 1788 CA ALA A 112 -5.938 2.737 9.094 1.00 0.00 C ATOM 1789 C ALA A 112 -6.537 1.935 10.216 1.00 0.00 C ATOM 1790 O ALA A 112 -5.906 1.001 10.715 1.00 0.00 O ATOM 1791 CB ALA A 112 -6.880 2.777 7.898 1.00 0.00 C ATOM 0 H ALA A 112 -4.735 1.275 8.225 1.00 0.00 H new ATOM 0 HA ALA A 112 -5.782 3.756 9.448 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -7.836 3.203 8.202 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -6.443 3.391 7.111 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -7.037 1.765 7.524 1.00 0.00 H new ATOM 1797 N TYR A 113 -7.720 2.340 10.648 1.00 0.00 N ATOM 1798 CA TYR A 113 -8.459 1.646 11.688 1.00 0.00 C ATOM 1799 C TYR A 113 -8.683 0.183 11.304 1.00 0.00 C ATOM 1800 O TYR A 113 -9.413 -0.131 10.362 1.00 0.00 O ATOM 1801 CB TYR A 113 -9.763 2.408 12.060 1.00 0.00 C ATOM 1802 CG TYR A 113 -10.570 2.936 10.878 1.00 0.00 C ATOM 1803 CD1 TYR A 113 -10.227 4.141 10.264 1.00 0.00 C ATOM 1804 CD2 TYR A 113 -11.660 2.246 10.381 1.00 0.00 C ATOM 1805 CE1 TYR A 113 -10.941 4.630 9.192 1.00 0.00 C ATOM 1806 CE2 TYR A 113 -12.382 2.735 9.309 1.00 0.00 C ATOM 1807 CZ TYR A 113 -12.017 3.925 8.717 1.00 0.00 C ATOM 1808 OH TYR A 113 -12.731 4.405 7.631 1.00 0.00 O ATOM 0 H TYR A 113 -8.197 3.165 10.284 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.863 1.632 12.600 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -10.399 1.743 12.644 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -9.502 3.247 12.705 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.383 4.703 10.637 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -11.951 1.311 10.837 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -10.655 5.563 8.729 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -13.233 2.185 8.935 1.00 0.00 H new ATOM 0 HH TYR A 113 -13.461 3.786 7.420 1.00 0.00 H new ATOM 1818 N VAL A 114 -8.010 -0.670 12.041 1.00 0.00 N ATOM 1819 CA VAL A 114 -7.897 -2.087 11.765 1.00 0.00 C ATOM 1820 C VAL A 114 -9.216 -2.812 11.971 1.00 0.00 C ATOM 1821 O VAL A 114 -9.882 -2.634 12.993 1.00 0.00 O ATOM 1822 CB VAL A 114 -6.811 -2.713 12.681 1.00 0.00 C ATOM 1823 CG1 VAL A 114 -6.643 -4.191 12.419 1.00 0.00 C ATOM 1824 CG2 VAL A 114 -5.482 -1.986 12.516 1.00 0.00 C ATOM 0 H VAL A 114 -7.506 -0.387 12.882 1.00 0.00 H new ATOM 0 HA VAL A 114 -7.615 -2.199 10.718 1.00 0.00 H new ATOM 0 HB VAL A 114 -7.147 -2.597 13.712 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -5.874 -4.593 13.079 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -7.587 -4.703 12.607 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -6.347 -4.345 11.381 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -4.735 -2.441 13.167 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -5.153 -2.060 11.479 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -5.606 -0.937 12.784 1.00 0.00 H new ATOM 1834 N TYR A 115 -9.582 -3.635 11.022 1.00 0.00 N ATOM 1835 CA TYR A 115 -10.799 -4.386 11.118 1.00 0.00 C ATOM 1836 C TYR A 115 -10.503 -5.782 11.581 1.00 0.00 C ATOM 1837 O TYR A 115 -10.305 -6.655 10.772 1.00 0.00 O ATOM 1838 CB TYR A 115 -11.514 -4.472 9.775 1.00 0.00 C ATOM 1839 CG TYR A 115 -11.756 -3.157 9.120 1.00 0.00 C ATOM 1840 CD1 TYR A 115 -12.591 -2.221 9.697 1.00 0.00 C ATOM 1841 CD2 TYR A 115 -11.159 -2.858 7.909 1.00 0.00 C ATOM 1842 CE1 TYR A 115 -12.822 -1.022 9.087 1.00 0.00 C ATOM 1843 CE2 TYR A 115 -11.381 -1.660 7.294 1.00 0.00 C ATOM 1844 CZ TYR A 115 -12.212 -0.747 7.886 1.00 0.00 C ATOM 1845 OH TYR A 115 -12.460 0.441 7.270 1.00 0.00 O ATOM 0 H TYR A 115 -9.047 -3.800 10.169 1.00 0.00 H new ATOM 0 HA TYR A 115 -11.442 -3.870 11.831 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -10.924 -5.096 9.103 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -12.471 -4.974 9.918 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -13.067 -2.440 10.642 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -10.508 -3.583 7.443 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -13.478 -0.296 9.544 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -10.906 -1.435 6.350 1.00 0.00 H new ATOM 0 HH TYR A 115 -12.198 1.177 7.861 1.00 0.00 H new ATOM 1855 N LYS A 116 -10.429 -5.993 12.873 1.00 0.00 N ATOM 1856 CA LYS A 116 -10.193 -7.330 13.379 1.00 0.00 C ATOM 1857 C LYS A 116 -11.348 -8.258 13.014 1.00 0.00 C ATOM 1858 O LYS A 116 -12.504 -7.807 12.918 1.00 0.00 O ATOM 1859 CB LYS A 116 -9.909 -7.342 14.881 1.00 0.00 C ATOM 1860 CG LYS A 116 -8.439 -7.185 15.220 1.00 0.00 C ATOM 1861 CD LYS A 116 -8.221 -7.236 16.717 1.00 0.00 C ATOM 1862 CE LYS A 116 -6.765 -7.454 17.067 1.00 0.00 C ATOM 1863 NZ LYS A 116 -6.262 -8.769 16.571 1.00 0.00 N ATOM 0 H LYS A 116 -10.527 -5.271 13.586 1.00 0.00 H new ATOM 0 HA LYS A 116 -9.292 -7.707 12.895 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -10.471 -6.538 15.355 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -10.273 -8.278 15.304 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.864 -7.976 14.738 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -8.070 -6.238 14.827 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -8.567 -6.305 17.166 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.822 -8.039 17.144 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -6.165 -6.651 16.639 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -6.640 -7.403 18.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -5.282 -8.908 16.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -6.860 -9.533 16.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -6.293 -8.783 15.532 1.00 0.00 H new ATOM 1877 N PRO A 117 -11.082 -9.559 12.807 1.00 0.00 N ATOM 1878 CA PRO A 117 -9.749 -10.179 12.975 1.00 0.00 C ATOM 1879 C PRO A 117 -8.771 -10.008 11.778 1.00 0.00 C ATOM 1880 O PRO A 117 -7.749 -10.701 11.713 1.00 0.00 O ATOM 1881 CB PRO A 117 -10.097 -11.648 13.179 1.00 0.00 C ATOM 1882 CG PRO A 117 -11.322 -11.856 12.361 1.00 0.00 C ATOM 1883 CD PRO A 117 -12.085 -10.555 12.390 1.00 0.00 C ATOM 0 HA PRO A 117 -9.204 -9.705 13.791 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -9.285 -12.298 12.851 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -10.279 -11.871 14.230 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -11.063 -12.131 11.338 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -11.925 -12.668 12.766 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -12.502 -10.315 11.412 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -12.919 -10.598 13.090 1.00 0.00 H new ATOM 1891 N ASN A 118 -9.059 -9.097 10.860 1.00 0.00 N ATOM 1892 CA ASN A 118 -8.171 -8.857 9.717 1.00 0.00 C ATOM 1893 C ASN A 118 -6.986 -8.015 10.150 1.00 0.00 C ATOM 1894 O ASN A 118 -7.051 -6.788 10.106 1.00 0.00 O ATOM 1895 CB ASN A 118 -8.868 -8.119 8.534 1.00 0.00 C ATOM 1896 CG ASN A 118 -10.001 -8.865 7.857 1.00 0.00 C ATOM 1897 OD1 ASN A 118 -10.715 -9.655 8.466 1.00 0.00 O ATOM 1898 ND2 ASN A 118 -10.174 -8.615 6.580 1.00 0.00 N ATOM 0 H ASN A 118 -9.894 -8.512 10.878 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.862 -9.843 9.369 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -9.255 -7.169 8.903 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -8.113 -7.886 7.783 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -10.920 -9.083 6.065 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -9.563 -7.952 6.103 1.00 0.00 H new ATOM 1905 N ASN A 119 -5.938 -8.649 10.647 1.00 0.00 N ATOM 1906 CA ASN A 119 -4.741 -7.902 11.028 1.00 0.00 C ATOM 1907 C ASN A 119 -3.502 -8.783 11.094 1.00 0.00 C ATOM 1908 O ASN A 119 -2.544 -8.458 11.802 1.00 0.00 O ATOM 1909 CB ASN A 119 -4.921 -7.117 12.361 1.00 0.00 C ATOM 1910 CG ASN A 119 -4.884 -7.921 13.656 1.00 0.00 C ATOM 1911 OD1 ASN A 119 -5.322 -9.066 13.745 1.00 0.00 O ATOM 1912 ND2 ASN A 119 -4.358 -7.294 14.685 1.00 0.00 N ATOM 0 H ASN A 119 -5.885 -9.657 10.796 1.00 0.00 H new ATOM 0 HA ASN A 119 -4.591 -7.172 10.233 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -4.141 -6.357 12.413 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -5.875 -6.592 12.317 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -4.304 -7.758 15.592 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -4.004 -6.344 14.576 1.00 0.00 H new ATOM 1919 N THR A 120 -3.467 -9.836 10.292 1.00 0.00 N ATOM 1920 CA THR A 120 -2.341 -10.782 10.301 1.00 0.00 C ATOM 1921 C THR A 120 -0.993 -10.084 10.015 1.00 0.00 C ATOM 1922 O THR A 120 0.028 -10.414 10.611 1.00 0.00 O ATOM 1923 CB THR A 120 -2.564 -11.904 9.276 1.00 0.00 C ATOM 1924 OG1 THR A 120 -3.874 -12.427 9.455 1.00 0.00 O ATOM 1925 CG2 THR A 120 -1.555 -13.031 9.457 1.00 0.00 C ATOM 0 H THR A 120 -4.202 -10.065 9.623 1.00 0.00 H new ATOM 0 HA THR A 120 -2.296 -11.208 11.303 1.00 0.00 H new ATOM 0 HB THR A 120 -2.439 -11.490 8.275 1.00 0.00 H new ATOM 0 HG1 THR A 120 -3.821 -13.391 9.625 1.00 0.00 H new ATOM 0 HG21 THR A 120 -1.741 -13.808 8.716 1.00 0.00 H new ATOM 0 HG22 THR A 120 -0.546 -12.640 9.327 1.00 0.00 H new ATOM 0 HG23 THR A 120 -1.655 -13.452 10.457 1.00 0.00 H new ATOM 1933 N HIS A 121 -0.994 -9.110 9.127 1.00 0.00 N ATOM 1934 CA HIS A 121 0.247 -8.414 8.810 1.00 0.00 C ATOM 1935 C HIS A 121 0.143 -6.927 9.084 1.00 0.00 C ATOM 1936 O HIS A 121 0.936 -6.137 8.568 1.00 0.00 O ATOM 1937 CB HIS A 121 0.738 -8.715 7.376 1.00 0.00 C ATOM 1938 CG HIS A 121 1.139 -10.152 7.171 1.00 0.00 C ATOM 1939 ND1 HIS A 121 0.424 -11.036 6.400 1.00 0.00 N ATOM 1940 CD2 HIS A 121 2.185 -10.859 7.663 1.00 0.00 C ATOM 1941 CE1 HIS A 121 1.002 -12.215 6.437 1.00 0.00 C ATOM 1942 NE2 HIS A 121 2.069 -12.133 7.190 1.00 0.00 N ATOM 0 H HIS A 121 -1.817 -8.785 8.620 1.00 0.00 H new ATOM 0 HA HIS A 121 1.011 -8.806 9.482 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.052 -8.461 6.669 1.00 0.00 H new ATOM 0 HB3 HIS A 121 1.588 -8.072 7.149 1.00 0.00 H new ATOM 0 HD2 HIS A 121 2.965 -10.484 8.309 1.00 0.00 H new ATOM 0 HE1 HIS A 121 0.655 -13.103 5.931 1.00 0.00 H new ATOM 0 HE2 HIS A 121 2.711 -12.899 7.391 1.00 0.00 H new ATOM 1951 N GLU A 122 -0.811 -6.568 9.947 1.00 0.00 N ATOM 1952 CA GLU A 122 -1.013 -5.191 10.415 1.00 0.00 C ATOM 1953 C GLU A 122 0.292 -4.614 10.959 1.00 0.00 C ATOM 1954 O GLU A 122 0.752 -3.578 10.515 1.00 0.00 O ATOM 1955 CB GLU A 122 -2.025 -5.198 11.550 1.00 0.00 C ATOM 1956 CG GLU A 122 -2.247 -3.854 12.236 1.00 0.00 C ATOM 1957 CD GLU A 122 -2.391 -4.004 13.738 1.00 0.00 C ATOM 1958 OE1 GLU A 122 -3.132 -4.897 14.198 1.00 0.00 O ATOM 1959 OE2 GLU A 122 -1.702 -3.273 14.496 1.00 0.00 O ATOM 0 H GLU A 122 -1.474 -7.232 10.346 1.00 0.00 H new ATOM 0 HA GLU A 122 -1.362 -4.588 9.577 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -2.980 -5.550 11.160 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -1.700 -5.920 12.299 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -1.410 -3.191 12.016 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -3.142 -3.383 11.831 1.00 0.00 H new ATOM 1966 N GLN A 123 0.883 -5.327 11.910 1.00 0.00 N ATOM 1967 CA GLN A 123 2.094 -4.888 12.591 1.00 0.00 C ATOM 1968 C GLN A 123 3.280 -4.724 11.651 1.00 0.00 C ATOM 1969 O GLN A 123 4.108 -3.842 11.858 1.00 0.00 O ATOM 1970 CB GLN A 123 2.429 -5.804 13.757 1.00 0.00 C ATOM 1971 CG GLN A 123 2.582 -7.266 13.399 1.00 0.00 C ATOM 1972 CD GLN A 123 2.828 -8.100 14.622 1.00 0.00 C ATOM 1973 OE1 GLN A 123 3.973 -8.315 15.026 1.00 0.00 O ATOM 1974 NE2 GLN A 123 1.774 -8.562 15.236 1.00 0.00 N ATOM 0 H GLN A 123 0.534 -6.230 12.232 1.00 0.00 H new ATOM 0 HA GLN A 123 1.884 -3.895 12.988 1.00 0.00 H new ATOM 0 HB2 GLN A 123 3.356 -5.459 14.216 1.00 0.00 H new ATOM 0 HB3 GLN A 123 1.646 -5.710 14.510 1.00 0.00 H new ATOM 0 HG2 GLN A 123 1.682 -7.615 12.892 1.00 0.00 H new ATOM 0 HG3 GLN A 123 3.409 -7.388 12.700 1.00 0.00 H new ATOM 0 HE21 GLN A 123 0.843 -8.363 14.871 1.00 0.00 H new ATOM 0 HE22 GLN A 123 1.881 -9.123 16.081 1.00 0.00 H new ATOM 1983 N LEU A 124 3.335 -5.555 10.619 1.00 0.00 N ATOM 1984 CA LEU A 124 4.368 -5.479 9.589 1.00 0.00 C ATOM 1985 C LEU A 124 4.235 -4.140 8.872 1.00 0.00 C ATOM 1986 O LEU A 124 5.201 -3.370 8.747 1.00 0.00 O ATOM 1987 CB LEU A 124 4.197 -6.689 8.611 1.00 0.00 C ATOM 1988 CG LEU A 124 5.161 -6.844 7.387 1.00 0.00 C ATOM 1989 CD1 LEU A 124 4.854 -5.870 6.257 1.00 0.00 C ATOM 1990 CD2 LEU A 124 6.622 -6.731 7.805 1.00 0.00 C ATOM 0 H LEU A 124 2.661 -6.306 10.470 1.00 0.00 H new ATOM 0 HA LEU A 124 5.367 -5.538 10.020 1.00 0.00 H new ATOM 0 HB2 LEU A 124 4.276 -7.600 9.204 1.00 0.00 H new ATOM 0 HB3 LEU A 124 3.180 -6.650 8.221 1.00 0.00 H new ATOM 0 HG LEU A 124 4.986 -7.848 6.999 1.00 0.00 H new ATOM 0 HD11 LEU A 124 5.557 -6.028 5.439 1.00 0.00 H new ATOM 0 HD12 LEU A 124 3.838 -6.036 5.899 1.00 0.00 H new ATOM 0 HD13 LEU A 124 4.947 -4.847 6.623 1.00 0.00 H new ATOM 0 HD21 LEU A 124 7.261 -6.844 6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 124 6.796 -5.755 8.258 1.00 0.00 H new ATOM 0 HD23 LEU A 124 6.855 -7.513 8.527 1.00 0.00 H new ATOM 2002 N LEU A 125 3.034 -3.856 8.444 1.00 0.00 N ATOM 2003 CA LEU A 125 2.724 -2.618 7.760 1.00 0.00 C ATOM 2004 C LEU A 125 2.900 -1.430 8.684 1.00 0.00 C ATOM 2005 O LEU A 125 3.417 -0.418 8.297 1.00 0.00 O ATOM 2006 CB LEU A 125 1.301 -2.659 7.213 1.00 0.00 C ATOM 2007 CG LEU A 125 1.025 -3.749 6.186 1.00 0.00 C ATOM 2008 CD1 LEU A 125 -0.419 -3.719 5.736 1.00 0.00 C ATOM 2009 CD2 LEU A 125 1.951 -3.599 5.006 1.00 0.00 C ATOM 0 H LEU A 125 2.234 -4.478 8.558 1.00 0.00 H new ATOM 0 HA LEU A 125 3.418 -2.505 6.927 1.00 0.00 H new ATOM 0 HB2 LEU A 125 0.613 -2.788 8.048 1.00 0.00 H new ATOM 0 HB3 LEU A 125 1.076 -1.693 6.761 1.00 0.00 H new ATOM 0 HG LEU A 125 1.209 -4.715 6.656 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -0.588 -4.508 5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -1.071 -3.876 6.595 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -0.640 -2.751 5.285 1.00 0.00 H new ATOM 0 HD21 LEU A 125 1.744 -4.384 4.279 1.00 0.00 H new ATOM 0 HD22 LEU A 125 1.795 -2.625 4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.985 -3.679 5.342 1.00 0.00 H new ATOM 2021 N ARG A 126 2.512 -1.593 9.917 1.00 0.00 N ATOM 2022 CA ARG A 126 2.594 -0.531 10.904 1.00 0.00 C ATOM 2023 C ARG A 126 4.047 -0.206 11.219 1.00 0.00 C ATOM 2024 O ARG A 126 4.406 0.940 11.486 1.00 0.00 O ATOM 2025 CB ARG A 126 1.861 -0.963 12.139 1.00 0.00 C ATOM 2026 CG ARG A 126 1.259 0.164 12.904 1.00 0.00 C ATOM 2027 CD ARG A 126 0.284 -0.376 13.895 1.00 0.00 C ATOM 2028 NE ARG A 126 -0.440 0.675 14.568 1.00 0.00 N ATOM 2029 CZ ARG A 126 -1.638 0.528 15.106 1.00 0.00 C ATOM 2030 NH1 ARG A 126 -2.228 -0.669 15.146 1.00 0.00 N ATOM 2031 NH2 ARG A 126 -2.253 1.576 15.620 1.00 0.00 N ATOM 0 H ARG A 126 2.127 -2.466 10.277 1.00 0.00 H new ATOM 0 HA ARG A 126 2.134 0.375 10.510 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.073 -1.661 11.857 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.549 -1.504 12.788 1.00 0.00 H new ATOM 0 HG2 ARG A 126 2.039 0.729 13.415 1.00 0.00 H new ATOM 0 HG3 ARG A 126 0.759 0.854 12.224 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -0.421 -1.035 13.388 1.00 0.00 H new ATOM 0 HD3 ARG A 126 0.813 -0.981 14.631 1.00 0.00 H new ATOM 0 HE ARG A 126 0.002 1.592 14.633 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -1.754 -1.485 14.758 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -3.153 -0.768 15.564 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.804 2.491 15.600 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -3.178 1.471 16.037 1.00 0.00 H new ATOM 2045 N LYS A 127 4.877 -1.223 11.162 1.00 0.00 N ATOM 2046 CA LYS A 127 6.304 -1.078 11.334 1.00 0.00 C ATOM 2047 C LYS A 127 6.867 -0.287 10.177 1.00 0.00 C ATOM 2048 O LYS A 127 7.684 0.620 10.360 1.00 0.00 O ATOM 2049 CB LYS A 127 6.930 -2.452 11.402 1.00 0.00 C ATOM 2050 CG LYS A 127 8.435 -2.477 11.508 1.00 0.00 C ATOM 2051 CD LYS A 127 8.917 -3.895 11.689 1.00 0.00 C ATOM 2052 CE LYS A 127 8.496 -4.480 13.038 1.00 0.00 C ATOM 2053 NZ LYS A 127 9.050 -3.718 14.178 1.00 0.00 N ATOM 0 H LYS A 127 4.577 -2.183 10.993 1.00 0.00 H new ATOM 0 HA LYS A 127 6.525 -0.544 12.258 1.00 0.00 H new ATOM 0 HB2 LYS A 127 6.514 -2.979 12.261 1.00 0.00 H new ATOM 0 HB3 LYS A 127 6.637 -3.010 10.513 1.00 0.00 H new ATOM 0 HG2 LYS A 127 8.878 -2.046 10.610 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.759 -1.864 12.349 1.00 0.00 H new ATOM 0 HD2 LYS A 127 8.522 -4.517 10.886 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.004 -3.921 11.607 1.00 0.00 H new ATOM 0 HE2 LYS A 127 7.408 -4.489 13.104 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.827 -5.516 13.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 8.943 -4.273 15.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.059 -3.527 14.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 8.539 -2.818 14.275 1.00 0.00 H new ATOM 2067 N SER A 128 6.387 -0.624 9.006 1.00 0.00 N ATOM 2068 CA SER A 128 6.737 0.043 7.780 1.00 0.00 C ATOM 2069 C SER A 128 6.265 1.514 7.827 1.00 0.00 C ATOM 2070 O SER A 128 6.949 2.418 7.344 1.00 0.00 O ATOM 2071 CB SER A 128 6.079 -0.713 6.622 1.00 0.00 C ATOM 2072 OG SER A 128 6.497 -2.075 6.608 1.00 0.00 O ATOM 0 H SER A 128 5.725 -1.390 8.877 1.00 0.00 H new ATOM 0 HA SER A 128 7.818 0.049 7.640 1.00 0.00 H new ATOM 0 HB2 SER A 128 4.994 -0.661 6.717 1.00 0.00 H new ATOM 0 HB3 SER A 128 6.339 -0.238 5.676 1.00 0.00 H new ATOM 0 HG SER A 128 6.040 -2.565 7.324 1.00 0.00 H new ATOM 2078 N GLU A 129 5.110 1.729 8.445 1.00 0.00 N ATOM 2079 CA GLU A 129 4.525 3.045 8.608 1.00 0.00 C ATOM 2080 C GLU A 129 5.391 3.909 9.496 1.00 0.00 C ATOM 2081 O GLU A 129 5.780 5.007 9.112 1.00 0.00 O ATOM 2082 CB GLU A 129 3.133 2.939 9.217 1.00 0.00 C ATOM 2083 CG GLU A 129 2.482 4.271 9.434 1.00 0.00 C ATOM 2084 CD GLU A 129 1.271 4.186 10.293 1.00 0.00 C ATOM 2085 OE1 GLU A 129 1.416 4.252 11.536 1.00 0.00 O ATOM 2086 OE2 GLU A 129 0.167 4.101 9.771 1.00 0.00 O ATOM 0 H GLU A 129 4.549 0.980 8.851 1.00 0.00 H new ATOM 0 HA GLU A 129 4.454 3.503 7.621 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.503 2.336 8.564 1.00 0.00 H new ATOM 0 HB3 GLU A 129 3.199 2.414 10.170 1.00 0.00 H new ATOM 0 HG2 GLU A 129 3.200 4.951 9.892 1.00 0.00 H new ATOM 0 HG3 GLU A 129 2.209 4.698 8.469 1.00 0.00 H new ATOM 2093 N ALA A 130 5.701 3.400 10.680 1.00 0.00 N ATOM 2094 CA ALA A 130 6.512 4.127 11.649 1.00 0.00 C ATOM 2095 C ALA A 130 7.894 4.442 11.075 1.00 0.00 C ATOM 2096 O ALA A 130 8.494 5.478 11.400 1.00 0.00 O ATOM 2097 CB ALA A 130 6.626 3.337 12.942 1.00 0.00 C ATOM 0 H ALA A 130 5.400 2.478 10.995 1.00 0.00 H new ATOM 0 HA ALA A 130 6.020 5.074 11.869 1.00 0.00 H new ATOM 0 HB1 ALA A 130 7.234 3.893 13.655 1.00 0.00 H new ATOM 0 HB2 ALA A 130 5.632 3.177 13.360 1.00 0.00 H new ATOM 0 HB3 ALA A 130 7.094 2.373 12.740 1.00 0.00 H new ATOM 2103 N GLN A 131 8.368 3.559 10.207 1.00 0.00 N ATOM 2104 CA GLN A 131 9.636 3.724 9.525 1.00 0.00 C ATOM 2105 C GLN A 131 9.493 4.911 8.547 1.00 0.00 C ATOM 2106 O GLN A 131 10.283 5.856 8.563 1.00 0.00 O ATOM 2107 CB GLN A 131 9.939 2.435 8.728 1.00 0.00 C ATOM 2108 CG GLN A 131 11.415 2.133 8.428 1.00 0.00 C ATOM 2109 CD GLN A 131 12.198 3.307 7.898 1.00 0.00 C ATOM 2110 OE1 GLN A 131 12.811 4.038 8.666 1.00 0.00 O ATOM 2111 NE2 GLN A 131 12.173 3.515 6.614 1.00 0.00 N ATOM 0 H GLN A 131 7.876 2.701 9.957 1.00 0.00 H new ATOM 0 HA GLN A 131 10.442 3.912 10.234 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.525 1.590 9.279 1.00 0.00 H new ATOM 0 HB3 GLN A 131 9.404 2.489 7.780 1.00 0.00 H new ATOM 0 HG2 GLN A 131 11.892 1.776 9.341 1.00 0.00 H new ATOM 0 HG3 GLN A 131 11.466 1.321 7.703 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.651 2.884 6.005 1.00 0.00 H new ATOM 0 HE22 GLN A 131 12.675 4.309 6.216 1.00 0.00 H new ATOM 2120 N ALA A 132 8.437 4.870 7.754 1.00 0.00 N ATOM 2121 CA ALA A 132 8.171 5.882 6.751 1.00 0.00 C ATOM 2122 C ALA A 132 7.933 7.258 7.378 1.00 0.00 C ATOM 2123 O ALA A 132 8.327 8.294 6.817 1.00 0.00 O ATOM 2124 CB ALA A 132 6.994 5.467 5.893 1.00 0.00 C ATOM 0 H ALA A 132 7.737 4.129 7.789 1.00 0.00 H new ATOM 0 HA ALA A 132 9.055 5.969 6.119 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.802 6.234 5.143 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.220 4.523 5.397 1.00 0.00 H new ATOM 0 HB3 ALA A 132 6.111 5.345 6.521 1.00 0.00 H new ATOM 2130 N LYS A 133 7.294 7.254 8.541 1.00 0.00 N ATOM 2131 CA LYS A 133 7.019 8.453 9.291 1.00 0.00 C ATOM 2132 C LYS A 133 8.299 9.106 9.808 1.00 0.00 C ATOM 2133 O LYS A 133 8.471 10.315 9.689 1.00 0.00 O ATOM 2134 CB LYS A 133 6.057 8.149 10.457 1.00 0.00 C ATOM 2135 CG LYS A 133 4.600 7.926 10.036 1.00 0.00 C ATOM 2136 CD LYS A 133 3.693 7.524 11.211 1.00 0.00 C ATOM 2137 CE LYS A 133 2.221 7.552 10.785 1.00 0.00 C ATOM 2138 NZ LYS A 133 1.286 7.000 11.802 1.00 0.00 N ATOM 0 H LYS A 133 6.952 6.403 8.987 1.00 0.00 H new ATOM 0 HA LYS A 133 6.542 9.162 8.615 1.00 0.00 H new ATOM 0 HB2 LYS A 133 6.411 7.261 10.981 1.00 0.00 H new ATOM 0 HB3 LYS A 133 6.095 8.975 11.167 1.00 0.00 H new ATOM 0 HG2 LYS A 133 4.215 8.839 9.582 1.00 0.00 H new ATOM 0 HG3 LYS A 133 4.562 7.149 9.272 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.959 6.526 11.558 1.00 0.00 H new ATOM 0 HD3 LYS A 133 3.849 8.205 12.048 1.00 0.00 H new ATOM 0 HE2 LYS A 133 1.936 8.581 10.566 1.00 0.00 H new ATOM 0 HE3 LYS A 133 2.110 6.986 9.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 0.309 7.084 11.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 1.509 5.998 11.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 1.386 7.531 12.690 1.00 0.00 H new ATOM 2152 N LYS A 134 9.218 8.302 10.327 1.00 0.00 N ATOM 2153 CA LYS A 134 10.426 8.852 10.934 1.00 0.00 C ATOM 2154 C LYS A 134 11.419 9.392 9.905 1.00 0.00 C ATOM 2155 O LYS A 134 12.199 10.304 10.211 1.00 0.00 O ATOM 2156 CB LYS A 134 11.106 7.863 11.902 1.00 0.00 C ATOM 2157 CG LYS A 134 11.676 6.594 11.278 1.00 0.00 C ATOM 2158 CD LYS A 134 12.311 5.717 12.345 1.00 0.00 C ATOM 2159 CE LYS A 134 12.914 4.444 11.773 1.00 0.00 C ATOM 2160 NZ LYS A 134 13.523 3.602 12.826 1.00 0.00 N ATOM 0 H LYS A 134 9.154 7.284 10.341 1.00 0.00 H new ATOM 0 HA LYS A 134 10.089 9.704 11.525 1.00 0.00 H new ATOM 0 HB2 LYS A 134 11.914 8.386 12.414 1.00 0.00 H new ATOM 0 HB3 LYS A 134 10.380 7.575 12.663 1.00 0.00 H new ATOM 0 HG2 LYS A 134 10.884 6.044 10.770 1.00 0.00 H new ATOM 0 HG3 LYS A 134 12.418 6.854 10.523 1.00 0.00 H new ATOM 0 HD2 LYS A 134 13.087 6.283 12.860 1.00 0.00 H new ATOM 0 HD3 LYS A 134 11.559 5.456 13.090 1.00 0.00 H new ATOM 0 HE2 LYS A 134 12.141 3.876 11.256 1.00 0.00 H new ATOM 0 HE3 LYS A 134 13.670 4.702 11.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 13.923 2.744 12.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.278 4.135 13.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 12.796 3.335 13.520 1.00 0.00 H new ATOM 2174 N GLU A 135 11.406 8.845 8.698 1.00 0.00 N ATOM 2175 CA GLU A 135 12.313 9.329 7.672 1.00 0.00 C ATOM 2176 C GLU A 135 11.633 10.364 6.790 1.00 0.00 C ATOM 2177 O GLU A 135 12.263 10.925 5.890 1.00 0.00 O ATOM 2178 CB GLU A 135 12.857 8.205 6.816 1.00 0.00 C ATOM 2179 CG GLU A 135 13.542 7.103 7.582 1.00 0.00 C ATOM 2180 CD GLU A 135 14.219 6.124 6.661 1.00 0.00 C ATOM 2181 OE1 GLU A 135 13.601 5.693 5.671 1.00 0.00 O ATOM 2182 OE2 GLU A 135 15.391 5.756 6.913 1.00 0.00 O ATOM 0 H GLU A 135 10.792 8.083 8.411 1.00 0.00 H new ATOM 0 HA GLU A 135 13.152 9.794 8.189 1.00 0.00 H new ATOM 0 HB2 GLU A 135 12.036 7.774 6.242 1.00 0.00 H new ATOM 0 HB3 GLU A 135 13.563 8.623 6.098 1.00 0.00 H new ATOM 0 HG2 GLU A 135 14.279 7.534 8.260 1.00 0.00 H new ATOM 0 HG3 GLU A 135 12.811 6.578 8.197 1.00 0.00 H new ATOM 2189 N LYS A 136 10.341 10.599 7.048 1.00 0.00 N ATOM 2190 CA LYS A 136 9.554 11.602 6.332 1.00 0.00 C ATOM 2191 C LYS A 136 9.448 11.291 4.834 1.00 0.00 C ATOM 2192 O LYS A 136 9.792 12.120 3.978 1.00 0.00 O ATOM 2193 CB LYS A 136 10.083 13.024 6.593 1.00 0.00 C ATOM 2194 CG LYS A 136 10.081 13.402 8.073 1.00 0.00 C ATOM 2195 CD LYS A 136 10.603 14.821 8.361 1.00 0.00 C ATOM 2196 CE LYS A 136 12.122 14.992 8.142 1.00 0.00 C ATOM 2197 NZ LYS A 136 12.536 15.014 6.712 1.00 0.00 N ATOM 0 H LYS A 136 9.813 10.096 7.762 1.00 0.00 H new ATOM 0 HA LYS A 136 8.540 11.558 6.728 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.098 13.104 6.205 1.00 0.00 H new ATOM 0 HB3 LYS A 136 9.473 13.739 6.041 1.00 0.00 H new ATOM 0 HG2 LYS A 136 9.065 13.316 8.457 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.691 12.684 8.621 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.073 15.528 7.722 1.00 0.00 H new ATOM 0 HD3 LYS A 136 10.364 15.082 9.392 1.00 0.00 H new ATOM 0 HE2 LYS A 136 12.443 15.920 8.616 1.00 0.00 H new ATOM 0 HE3 LYS A 136 12.644 14.179 8.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 13.214 15.787 6.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 12.983 14.108 6.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 11.700 15.162 6.111 1.00 0.00 H new ATOM 2211 N LEU A 137 9.034 10.064 4.532 1.00 0.00 N ATOM 2212 CA LEU A 137 8.842 9.591 3.143 1.00 0.00 C ATOM 2213 C LEU A 137 7.772 10.407 2.399 1.00 0.00 C ATOM 2214 O LEU A 137 7.217 11.308 2.957 1.00 0.00 O ATOM 2215 CB LEU A 137 8.493 8.107 3.120 1.00 0.00 C ATOM 2216 CG LEU A 137 9.657 7.083 3.187 1.00 0.00 C ATOM 2217 CD1 LEU A 137 10.492 7.156 1.926 1.00 0.00 C ATOM 2218 CD2 LEU A 137 10.547 7.309 4.389 1.00 0.00 C ATOM 0 H LEU A 137 8.819 9.359 5.237 1.00 0.00 H new ATOM 0 HA LEU A 137 9.787 9.737 2.620 1.00 0.00 H new ATOM 0 HB2 LEU A 137 7.825 7.908 3.958 1.00 0.00 H new ATOM 0 HB3 LEU A 137 7.928 7.911 2.209 1.00 0.00 H new ATOM 0 HG LEU A 137 9.208 6.094 3.281 1.00 0.00 H new ATOM 0 HD11 LEU A 137 11.305 6.433 1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 137 9.867 6.929 1.062 1.00 0.00 H new ATOM 0 HD13 LEU A 137 10.906 8.159 1.821 1.00 0.00 H new ATOM 0 HD21 LEU A 137 11.347 6.569 4.394 1.00 0.00 H new ATOM 0 HD22 LEU A 137 10.978 8.309 4.340 1.00 0.00 H new ATOM 0 HD23 LEU A 137 9.958 7.212 5.301 1.00 0.00 H new ATOM 2230 N ASN A 138 7.464 10.025 1.157 1.00 0.00 N ATOM 2231 CA ASN A 138 6.590 10.818 0.223 1.00 0.00 C ATOM 2232 C ASN A 138 5.392 11.523 0.890 1.00 0.00 C ATOM 2233 O ASN A 138 5.308 12.757 0.880 1.00 0.00 O ATOM 2234 CB ASN A 138 6.051 9.927 -0.918 1.00 0.00 C ATOM 2235 CG ASN A 138 7.125 9.341 -1.815 1.00 0.00 C ATOM 2236 OD1 ASN A 138 7.526 9.951 -2.800 1.00 0.00 O ATOM 2237 ND2 ASN A 138 7.562 8.141 -1.522 1.00 0.00 N ATOM 0 H ASN A 138 7.805 9.155 0.748 1.00 0.00 H new ATOM 0 HA ASN A 138 7.249 11.599 -0.157 1.00 0.00 H new ATOM 0 HB2 ASN A 138 5.473 9.112 -0.484 1.00 0.00 H new ATOM 0 HB3 ASN A 138 5.365 10.514 -1.529 1.00 0.00 H new ATOM 0 HD21 ASN A 138 8.254 7.690 -2.120 1.00 0.00 H new ATOM 0 HD22 ASN A 138 7.210 7.658 -0.696 1.00 0.00 H new ATOM 2244 N ILE A 139 4.498 10.768 1.496 1.00 0.00 N ATOM 2245 CA ILE A 139 3.323 11.383 2.135 1.00 0.00 C ATOM 2246 C ILE A 139 3.605 11.872 3.563 1.00 0.00 C ATOM 2247 O ILE A 139 2.802 12.590 4.150 1.00 0.00 O ATOM 2248 CB ILE A 139 2.095 10.454 2.133 1.00 0.00 C ATOM 2249 CG1 ILE A 139 2.308 9.266 3.081 1.00 0.00 C ATOM 2250 CG2 ILE A 139 1.840 9.969 0.706 1.00 0.00 C ATOM 2251 CD1 ILE A 139 1.104 8.378 3.239 1.00 0.00 C ATOM 0 H ILE A 139 4.547 9.752 1.566 1.00 0.00 H new ATOM 0 HA ILE A 139 3.094 12.254 1.522 1.00 0.00 H new ATOM 0 HB ILE A 139 1.225 11.006 2.489 1.00 0.00 H new ATOM 0 HG12 ILE A 139 3.141 8.667 2.713 1.00 0.00 H new ATOM 0 HG13 ILE A 139 2.597 9.645 4.061 1.00 0.00 H new ATOM 0 HG21 ILE A 139 0.972 9.310 0.695 1.00 0.00 H new ATOM 0 HG22 ILE A 139 1.653 10.826 0.058 1.00 0.00 H new ATOM 0 HG23 ILE A 139 2.713 9.425 0.345 1.00 0.00 H new ATOM 0 HD11 ILE A 139 1.340 7.564 3.925 1.00 0.00 H new ATOM 0 HD12 ILE A 139 0.273 8.959 3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 139 0.826 7.966 2.269 1.00 0.00 H new ATOM 2263 N TRP A 140 4.747 11.499 4.097 1.00 0.00 N ATOM 2264 CA TRP A 140 5.103 11.823 5.472 1.00 0.00 C ATOM 2265 C TRP A 140 6.108 12.950 5.507 1.00 0.00 C ATOM 2266 O TRP A 140 6.655 13.292 6.561 1.00 0.00 O ATOM 2267 CB TRP A 140 5.668 10.587 6.187 1.00 0.00 C ATOM 2268 CG TRP A 140 4.709 9.441 6.213 1.00 0.00 C ATOM 2269 CD1 TRP A 140 4.850 8.232 5.610 1.00 0.00 C ATOM 2270 CD2 TRP A 140 3.439 9.426 6.848 1.00 0.00 C ATOM 2271 NE1 TRP A 140 3.745 7.452 5.856 1.00 0.00 N ATOM 2272 CE2 TRP A 140 2.865 8.169 6.608 1.00 0.00 C ATOM 2273 CE3 TRP A 140 2.734 10.355 7.602 1.00 0.00 C ATOM 2274 CZ2 TRP A 140 1.621 7.823 7.098 1.00 0.00 C ATOM 2275 CZ3 TRP A 140 1.502 10.012 8.085 1.00 0.00 C ATOM 2276 CH2 TRP A 140 0.954 8.758 7.832 1.00 0.00 C ATOM 0 H TRP A 140 5.457 10.964 3.597 1.00 0.00 H new ATOM 0 HA TRP A 140 4.201 12.144 5.992 1.00 0.00 H new ATOM 0 HB2 TRP A 140 6.586 10.274 5.690 1.00 0.00 H new ATOM 0 HB3 TRP A 140 5.934 10.855 7.210 1.00 0.00 H new ATOM 0 HD1 TRP A 140 5.705 7.928 5.024 1.00 0.00 H new ATOM 0 HE1 TRP A 140 3.607 6.496 5.530 1.00 0.00 H new ATOM 0 HE3 TRP A 140 3.151 11.331 7.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 1.193 6.850 6.907 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 0.945 10.726 8.673 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -0.023 8.520 8.227 1.00 0.00 H new ATOM 2287 N SER A 141 6.364 13.503 4.354 1.00 0.00 N ATOM 2288 CA SER A 141 7.283 14.580 4.202 1.00 0.00 C ATOM 2289 C SER A 141 6.675 15.889 4.706 1.00 0.00 C ATOM 2290 O SER A 141 6.107 16.687 3.943 1.00 0.00 O ATOM 2291 CB SER A 141 7.786 14.662 2.747 1.00 0.00 C ATOM 2292 OG SER A 141 8.754 15.687 2.558 1.00 0.00 O ATOM 0 H SER A 141 5.928 13.207 3.481 1.00 0.00 H new ATOM 0 HA SER A 141 8.159 14.393 4.822 1.00 0.00 H new ATOM 0 HB2 SER A 141 8.218 13.703 2.462 1.00 0.00 H new ATOM 0 HB3 SER A 141 6.940 14.840 2.084 1.00 0.00 H new ATOM 0 HG SER A 141 9.042 15.697 1.621 1.00 0.00 H new