USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 916 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 93 TYR OH : rot 72:sc= 1.26 USER MOD Set 1.2: A 98 MET CE :methyl 146:sc= -0.0436 (180deg=-1.34) USER MOD Set 1.3: B 134 HIS : no HD1:sc=-0.00329 X(o=1.2,f=1.1) USER MOD Set 2.1: A 13 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 26 MET CE :methyl 168:sc= -0.0206 (180deg=-0.319) USER MOD Single : A 8 HIS : no HE2:sc= 0.671 K(o=0.67,f=-6.2!) USER MOD Single : A 9 LYS NZ :NH3+ -149:sc= 0.696 (180deg=-0.849!) USER MOD Single : A 16 LYS NZ :NH3+ -164:sc= 0.97 (180deg=0.785) USER MOD Single : A 22 THR OG1 : rot 63:sc= 0.542 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -176:sc= 1.28 (180deg=1.26) USER MOD Single : A 30 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.15) USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 142:sc= 1.24 USER MOD Single : A 59 SER OG : rot -169:sc= 0.875 USER MOD Single : A 62 THR OG1 : rot 76:sc= 1.22 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -143:sc= 0 (180deg=-0.662) USER MOD Single : A 68 ASN : amide:sc= -0.0716 X(o=-0.072,f=-0.072) USER MOD Single : A 70 LYS NZ :NH3+ -119:sc= 0.848 (180deg=-0.552) USER MOD Single : A 71 LYS NZ :NH3+ -121:sc= 0.164 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.505 K(o=-0.51,f=-1.7) USER MOD Single : A 82 THR OG1 : rot 28:sc= 0.0472 USER MOD Single : A 91 TYR OH : rot 81:sc= 1.25 USER MOD Single : A 97 LYS NZ :NH3+ 160:sc= -0.409 (180deg=-0.748) USER MOD Single : A 100 ASN : amide:sc= -2.18 K(o=-2.2,f=-6.1!) USER MOD Single : A 106 GLN : amide:sc= -0.177 K(o=-0.18,f=-0.75) USER MOD Single : A 110 LYS NZ :NH3+ -170:sc= 1.26 (180deg=1.12) USER MOD Single : B 136 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 141 SER OG : rot 77:sc= 0.652 USER MOD Single : B 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 146 LYS NZ :NH3+ 166:sc= 0.695 (180deg=0.299) USER MOD Single : B 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 LYS NZ :NH3+ 158:sc= 1.18 (180deg=0.312) USER MOD Single : B 151 ASN : amide:sc= 0.812 K(o=0.81,f=0) USER MOD Single : B 154 SER OG : rot -37:sc= 0.311 USER MOD ----------------------------------------------------------------- ATOM 115 N HIS A 8 4.927 10.720 -9.513 1.00 0.00 N ATOM 116 CA HIS A 8 4.966 9.526 -10.296 1.00 0.00 C ATOM 117 C HIS A 8 6.139 8.679 -9.925 1.00 0.00 C ATOM 118 O HIS A 8 7.029 9.127 -9.185 1.00 0.00 O ATOM 119 CB HIS A 8 4.845 9.735 -11.806 1.00 0.00 C ATOM 120 CG HIS A 8 3.421 9.786 -12.263 1.00 0.00 C ATOM 121 ND1 HIS A 8 2.481 8.867 -11.862 1.00 0.00 N ATOM 122 CD2 HIS A 8 2.771 10.643 -13.077 1.00 0.00 C ATOM 123 CE1 HIS A 8 1.329 9.147 -12.408 1.00 0.00 C ATOM 124 NE2 HIS A 8 1.471 10.224 -13.151 1.00 0.00 N ATOM 0 HA HIS A 8 4.056 8.983 -10.040 1.00 0.00 H new ATOM 0 HB2 HIS A 8 5.346 10.663 -12.083 1.00 0.00 H new ATOM 0 HB3 HIS A 8 5.361 8.927 -12.324 1.00 0.00 H new ATOM 0 HD1 HIS A 8 2.657 8.084 -11.232 1.00 0.00 H new ATOM 0 HD2 HIS A 8 3.197 11.500 -13.577 1.00 0.00 H new ATOM 0 HE1 HIS A 8 0.414 8.589 -12.273 1.00 0.00 H new ATOM 133 N LYS A 9 6.140 7.480 -10.439 1.00 0.00 N ATOM 134 CA LYS A 9 7.090 6.453 -10.080 1.00 0.00 C ATOM 135 C LYS A 9 8.508 6.805 -10.485 1.00 0.00 C ATOM 136 O LYS A 9 8.744 7.437 -11.527 1.00 0.00 O ATOM 137 CB LYS A 9 6.755 5.175 -10.835 1.00 0.00 C ATOM 138 CG LYS A 9 5.322 4.680 -10.726 1.00 0.00 C ATOM 139 CD LYS A 9 5.120 3.419 -11.555 1.00 0.00 C ATOM 140 CE LYS A 9 5.409 3.640 -13.041 1.00 0.00 C ATOM 141 NZ LYS A 9 5.277 2.391 -13.809 1.00 0.00 N ATOM 0 H LYS A 9 5.463 7.178 -11.139 1.00 0.00 H new ATOM 0 HA LYS A 9 7.029 6.342 -8.997 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.983 5.332 -11.889 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.417 4.385 -10.480 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.081 4.477 -9.683 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.637 5.457 -11.066 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.770 2.631 -11.175 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.094 3.071 -11.436 1.00 0.00 H new ATOM 0 HE2 LYS A 9 4.722 4.387 -13.439 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.417 4.037 -13.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.935 2.408 -14.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 5.501 1.581 -13.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.302 2.301 -14.160 1.00 0.00 H new ATOM 155 N GLU A 10 9.427 6.414 -9.658 1.00 0.00 N ATOM 156 CA GLU A 10 10.821 6.432 -9.991 1.00 0.00 C ATOM 157 C GLU A 10 11.318 5.027 -9.710 1.00 0.00 C ATOM 158 O GLU A 10 10.669 4.293 -8.942 1.00 0.00 O ATOM 159 CB GLU A 10 11.639 7.431 -9.169 1.00 0.00 C ATOM 160 CG GLU A 10 11.087 8.850 -9.144 1.00 0.00 C ATOM 161 CD GLU A 10 12.054 9.841 -8.533 1.00 0.00 C ATOM 162 OE1 GLU A 10 12.074 10.000 -7.313 1.00 0.00 O ATOM 163 OE2 GLU A 10 12.813 10.509 -9.290 1.00 0.00 O ATOM 0 H GLU A 10 9.229 6.068 -8.719 1.00 0.00 H new ATOM 0 HA GLU A 10 10.941 6.743 -11.029 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.707 7.066 -8.144 1.00 0.00 H new ATOM 0 HB3 GLU A 10 12.654 7.459 -9.565 1.00 0.00 H new ATOM 0 HG2 GLU A 10 10.849 9.161 -10.161 1.00 0.00 H new ATOM 0 HG3 GLU A 10 10.154 8.863 -8.580 1.00 0.00 H new ATOM 170 N PRO A 11 12.419 4.608 -10.311 1.00 0.00 N ATOM 171 CA PRO A 11 12.948 3.266 -10.112 1.00 0.00 C ATOM 172 C PRO A 11 13.612 3.107 -8.746 1.00 0.00 C ATOM 173 O PRO A 11 14.203 4.056 -8.211 1.00 0.00 O ATOM 174 CB PRO A 11 14.004 3.150 -11.218 1.00 0.00 C ATOM 175 CG PRO A 11 13.706 4.282 -12.138 1.00 0.00 C ATOM 176 CD PRO A 11 13.249 5.365 -11.249 1.00 0.00 C ATOM 0 HA PRO A 11 12.168 2.505 -10.150 1.00 0.00 H new ATOM 0 HB2 PRO A 11 15.013 3.223 -10.813 1.00 0.00 H new ATOM 0 HB3 PRO A 11 13.936 2.192 -11.733 1.00 0.00 H new ATOM 0 HG2 PRO A 11 14.590 4.578 -12.703 1.00 0.00 H new ATOM 0 HG3 PRO A 11 12.939 4.013 -12.864 1.00 0.00 H new ATOM 0 HD2 PRO A 11 14.077 5.872 -10.754 1.00 0.00 H new ATOM 0 HD3 PRO A 11 12.682 6.128 -11.782 1.00 0.00 H new ATOM 184 N ALA A 12 13.521 1.929 -8.200 1.00 0.00 N ATOM 185 CA ALA A 12 14.122 1.598 -6.948 1.00 0.00 C ATOM 186 C ALA A 12 14.727 0.209 -7.033 1.00 0.00 C ATOM 187 O ALA A 12 14.315 -0.612 -7.856 1.00 0.00 O ATOM 188 CB ALA A 12 13.086 1.659 -5.841 1.00 0.00 C ATOM 0 H ALA A 12 13.013 1.155 -8.627 1.00 0.00 H new ATOM 0 HA ALA A 12 14.909 2.317 -6.721 1.00 0.00 H new ATOM 0 HB1 ALA A 12 13.554 1.405 -4.890 1.00 0.00 H new ATOM 0 HB2 ALA A 12 12.673 2.666 -5.784 1.00 0.00 H new ATOM 0 HB3 ALA A 12 12.286 0.950 -6.052 1.00 0.00 H new ATOM 194 N THR A 13 15.698 -0.043 -6.209 1.00 0.00 N ATOM 195 CA THR A 13 16.357 -1.294 -6.152 1.00 0.00 C ATOM 196 C THR A 13 15.834 -2.031 -4.932 1.00 0.00 C ATOM 197 O THR A 13 15.867 -1.499 -3.823 1.00 0.00 O ATOM 198 CB THR A 13 17.870 -1.050 -6.001 1.00 0.00 C ATOM 199 OG1 THR A 13 18.322 -0.179 -7.053 1.00 0.00 O ATOM 200 CG2 THR A 13 18.661 -2.350 -6.033 1.00 0.00 C ATOM 0 H THR A 13 16.057 0.641 -5.543 1.00 0.00 H new ATOM 0 HA THR A 13 16.176 -1.878 -7.055 1.00 0.00 H new ATOM 0 HB THR A 13 18.040 -0.585 -5.030 1.00 0.00 H new ATOM 0 HG1 THR A 13 19.284 -0.022 -6.957 1.00 0.00 H new ATOM 0 HG21 THR A 13 19.723 -2.132 -5.923 1.00 0.00 H new ATOM 0 HG22 THR A 13 18.336 -2.994 -5.216 1.00 0.00 H new ATOM 0 HG23 THR A 13 18.491 -2.856 -6.983 1.00 0.00 H new ATOM 208 N LEU A 14 15.306 -3.199 -5.131 1.00 0.00 N ATOM 209 CA LEU A 14 14.803 -3.987 -4.034 1.00 0.00 C ATOM 210 C LEU A 14 15.958 -4.472 -3.175 1.00 0.00 C ATOM 211 O LEU A 14 16.904 -5.078 -3.688 1.00 0.00 O ATOM 212 CB LEU A 14 14.035 -5.196 -4.560 1.00 0.00 C ATOM 213 CG LEU A 14 13.468 -6.144 -3.500 1.00 0.00 C ATOM 214 CD1 LEU A 14 12.339 -5.490 -2.712 1.00 0.00 C ATOM 215 CD2 LEU A 14 13.025 -7.443 -4.133 1.00 0.00 C ATOM 0 H LEU A 14 15.209 -3.636 -6.048 1.00 0.00 H new ATOM 0 HA LEU A 14 14.135 -3.364 -3.439 1.00 0.00 H new ATOM 0 HB2 LEU A 14 13.211 -4.838 -5.177 1.00 0.00 H new ATOM 0 HB3 LEU A 14 14.697 -5.766 -5.212 1.00 0.00 H new ATOM 0 HG LEU A 14 14.262 -6.370 -2.789 1.00 0.00 H new ATOM 0 HD11 LEU A 14 11.960 -6.191 -1.969 1.00 0.00 H new ATOM 0 HD12 LEU A 14 12.714 -4.598 -2.211 1.00 0.00 H new ATOM 0 HD13 LEU A 14 11.534 -5.212 -3.392 1.00 0.00 H new ATOM 0 HD21 LEU A 14 12.625 -8.104 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.253 -7.241 -4.876 1.00 0.00 H new ATOM 0 HD23 LEU A 14 13.877 -7.922 -4.616 1.00 0.00 H new ATOM 227 N ILE A 15 15.914 -4.181 -1.898 1.00 0.00 N ATOM 228 CA ILE A 15 16.908 -4.704 -1.004 1.00 0.00 C ATOM 229 C ILE A 15 16.414 -6.049 -0.526 1.00 0.00 C ATOM 230 O ILE A 15 17.112 -7.059 -0.660 1.00 0.00 O ATOM 231 CB ILE A 15 17.192 -3.757 0.202 1.00 0.00 C ATOM 232 CG1 ILE A 15 17.745 -2.401 -0.283 1.00 0.00 C ATOM 233 CG2 ILE A 15 18.157 -4.406 1.199 1.00 0.00 C ATOM 234 CD1 ILE A 15 19.058 -2.496 -1.051 1.00 0.00 C ATOM 0 H ILE A 15 15.207 -3.590 -1.461 1.00 0.00 H new ATOM 0 HA ILE A 15 17.857 -4.796 -1.533 1.00 0.00 H new ATOM 0 HB ILE A 15 16.247 -3.579 0.714 1.00 0.00 H new ATOM 0 HG12 ILE A 15 16.999 -1.925 -0.920 1.00 0.00 H new ATOM 0 HG13 ILE A 15 17.889 -1.751 0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 15 18.336 -3.723 2.029 1.00 0.00 H new ATOM 0 HG22 ILE A 15 17.721 -5.331 1.578 1.00 0.00 H new ATOM 0 HG23 ILE A 15 19.101 -4.627 0.701 1.00 0.00 H new ATOM 0 HD11 ILE A 15 19.375 -1.498 -1.355 1.00 0.00 H new ATOM 0 HD12 ILE A 15 19.821 -2.941 -0.413 1.00 0.00 H new ATOM 0 HD13 ILE A 15 18.918 -3.117 -1.936 1.00 0.00 H new ATOM 246 N LYS A 16 15.186 -6.062 -0.020 1.00 0.00 N ATOM 247 CA LYS A 16 14.528 -7.278 0.409 1.00 0.00 C ATOM 248 C LYS A 16 13.107 -6.953 0.811 1.00 0.00 C ATOM 249 O LYS A 16 12.775 -5.789 1.049 1.00 0.00 O ATOM 250 CB LYS A 16 15.253 -7.943 1.600 1.00 0.00 C ATOM 251 CG LYS A 16 15.124 -7.220 2.940 1.00 0.00 C ATOM 252 CD LYS A 16 15.890 -7.948 4.045 1.00 0.00 C ATOM 253 CE LYS A 16 15.417 -9.397 4.247 1.00 0.00 C ATOM 254 NZ LYS A 16 13.981 -9.490 4.616 1.00 0.00 N ATOM 0 H LYS A 16 14.621 -5.222 0.102 1.00 0.00 H new ATOM 0 HA LYS A 16 14.546 -7.981 -0.424 1.00 0.00 H new ATOM 0 HB2 LYS A 16 14.869 -8.956 1.716 1.00 0.00 H new ATOM 0 HB3 LYS A 16 16.312 -8.030 1.355 1.00 0.00 H new ATOM 0 HG2 LYS A 16 15.502 -6.202 2.843 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.072 -7.144 3.214 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.953 -7.949 3.803 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.776 -7.400 4.980 1.00 0.00 H new ATOM 0 HE2 LYS A 16 15.589 -9.961 3.330 1.00 0.00 H new ATOM 0 HE3 LYS A 16 16.018 -9.865 5.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 13.782 -10.436 4.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 13.760 -8.771 5.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 13.395 -9.328 3.773 1.00 0.00 H new ATOM 268 N ALA A 17 12.288 -7.942 0.871 1.00 0.00 N ATOM 269 CA ALA A 17 10.954 -7.786 1.347 1.00 0.00 C ATOM 270 C ALA A 17 10.893 -8.343 2.755 1.00 0.00 C ATOM 271 O ALA A 17 11.664 -9.254 3.101 1.00 0.00 O ATOM 272 CB ALA A 17 9.978 -8.515 0.436 1.00 0.00 C ATOM 0 H ALA A 17 12.525 -8.893 0.589 1.00 0.00 H new ATOM 0 HA ALA A 17 10.674 -6.733 1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 17 8.963 -8.387 0.813 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.045 -8.105 -0.572 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.225 -9.576 0.413 1.00 0.00 H new ATOM 278 N ILE A 18 10.063 -7.768 3.584 1.00 0.00 N ATOM 279 CA ILE A 18 9.872 -8.282 4.926 1.00 0.00 C ATOM 280 C ILE A 18 8.509 -8.944 4.967 1.00 0.00 C ATOM 281 O ILE A 18 8.387 -10.152 5.221 1.00 0.00 O ATOM 282 CB ILE A 18 9.971 -7.176 6.058 1.00 0.00 C ATOM 283 CG1 ILE A 18 11.376 -6.523 6.141 1.00 0.00 C ATOM 284 CG2 ILE A 18 9.597 -7.751 7.425 1.00 0.00 C ATOM 285 CD1 ILE A 18 11.738 -5.585 5.006 1.00 0.00 C ATOM 0 H ILE A 18 9.506 -6.944 3.360 1.00 0.00 H new ATOM 0 HA ILE A 18 10.678 -8.985 5.137 1.00 0.00 H new ATOM 0 HB ILE A 18 9.259 -6.399 5.780 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.444 -5.971 7.079 1.00 0.00 H new ATOM 0 HG13 ILE A 18 12.122 -7.316 6.183 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.674 -6.970 8.182 1.00 0.00 H new ATOM 0 HG22 ILE A 18 8.574 -8.127 7.394 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.276 -8.566 7.675 1.00 0.00 H new ATOM 0 HD11 ILE A 18 12.740 -5.188 5.168 1.00 0.00 H new ATOM 0 HD12 ILE A 18 11.712 -6.129 4.062 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.023 -4.763 4.971 1.00 0.00 H new ATOM 297 N ASP A 19 7.504 -8.159 4.653 1.00 0.00 N ATOM 298 CA ASP A 19 6.133 -8.613 4.606 1.00 0.00 C ATOM 299 C ASP A 19 5.420 -7.997 3.459 1.00 0.00 C ATOM 300 O ASP A 19 5.954 -7.101 2.795 1.00 0.00 O ATOM 301 CB ASP A 19 5.355 -8.271 5.883 1.00 0.00 C ATOM 302 CG ASP A 19 5.617 -9.209 7.015 1.00 0.00 C ATOM 303 OD1 ASP A 19 5.099 -10.337 6.983 1.00 0.00 O ATOM 304 OD2 ASP A 19 6.309 -8.849 7.967 1.00 0.00 O ATOM 0 H ASP A 19 7.618 -7.173 4.420 1.00 0.00 H new ATOM 0 HA ASP A 19 6.177 -9.697 4.501 1.00 0.00 H new ATOM 0 HB2 ASP A 19 5.612 -7.259 6.195 1.00 0.00 H new ATOM 0 HB3 ASP A 19 4.288 -8.274 5.660 1.00 0.00 H new ATOM 309 N GLY A 20 4.204 -8.440 3.243 1.00 0.00 N ATOM 310 CA GLY A 20 3.342 -7.853 2.242 1.00 0.00 C ATOM 311 C GLY A 20 2.685 -6.641 2.833 1.00 0.00 C ATOM 312 O GLY A 20 1.468 -6.577 2.967 1.00 0.00 O ATOM 0 H GLY A 20 3.784 -9.216 3.755 1.00 0.00 H new ATOM 0 HA2 GLY A 20 3.919 -7.579 1.359 1.00 0.00 H new ATOM 0 HA3 GLY A 20 2.590 -8.573 1.920 1.00 0.00 H new ATOM 316 N ASP A 21 3.522 -5.702 3.219 1.00 0.00 N ATOM 317 CA ASP A 21 3.144 -4.511 3.950 1.00 0.00 C ATOM 318 C ASP A 21 4.360 -3.625 4.094 1.00 0.00 C ATOM 319 O ASP A 21 4.368 -2.487 3.651 1.00 0.00 O ATOM 320 CB ASP A 21 2.613 -4.915 5.333 1.00 0.00 C ATOM 321 CG ASP A 21 2.413 -3.777 6.289 1.00 0.00 C ATOM 322 OD1 ASP A 21 1.338 -3.181 6.308 1.00 0.00 O ATOM 323 OD2 ASP A 21 3.330 -3.513 7.078 1.00 0.00 O ATOM 0 H ASP A 21 4.522 -5.749 3.025 1.00 0.00 H new ATOM 0 HA ASP A 21 2.363 -3.969 3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 21 1.663 -5.434 5.204 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.307 -5.627 5.779 1.00 0.00 H new ATOM 328 N THR A 22 5.397 -4.169 4.676 1.00 0.00 N ATOM 329 CA THR A 22 6.627 -3.440 4.853 1.00 0.00 C ATOM 330 C THR A 22 7.781 -4.158 4.104 1.00 0.00 C ATOM 331 O THR A 22 7.989 -5.372 4.263 1.00 0.00 O ATOM 332 CB THR A 22 6.954 -3.257 6.366 1.00 0.00 C ATOM 333 OG1 THR A 22 5.825 -2.659 7.038 1.00 0.00 O ATOM 334 CG2 THR A 22 8.124 -2.320 6.545 1.00 0.00 C ATOM 0 H THR A 22 5.414 -5.122 5.038 1.00 0.00 H new ATOM 0 HA THR A 22 6.510 -2.444 4.426 1.00 0.00 H new ATOM 0 HB THR A 22 7.186 -4.238 6.780 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.054 -3.261 6.981 1.00 0.00 H new ATOM 0 HG21 THR A 22 8.338 -2.204 7.607 1.00 0.00 H new ATOM 0 HG22 THR A 22 8.999 -2.730 6.041 1.00 0.00 H new ATOM 0 HG23 THR A 22 7.881 -1.348 6.116 1.00 0.00 H new ATOM 342 N VAL A 23 8.489 -3.410 3.277 1.00 0.00 N ATOM 343 CA VAL A 23 9.575 -3.912 2.433 1.00 0.00 C ATOM 344 C VAL A 23 10.772 -2.950 2.498 1.00 0.00 C ATOM 345 O VAL A 23 10.647 -1.852 3.011 1.00 0.00 O ATOM 346 CB VAL A 23 9.115 -4.093 0.952 1.00 0.00 C ATOM 347 CG1 VAL A 23 8.134 -5.250 0.819 1.00 0.00 C ATOM 348 CG2 VAL A 23 8.459 -2.818 0.439 1.00 0.00 C ATOM 0 H VAL A 23 8.326 -2.409 3.166 1.00 0.00 H new ATOM 0 HA VAL A 23 9.871 -4.891 2.811 1.00 0.00 H new ATOM 0 HB VAL A 23 10.001 -4.313 0.357 1.00 0.00 H new ATOM 0 HG11 VAL A 23 7.831 -5.352 -0.223 1.00 0.00 H new ATOM 0 HG12 VAL A 23 8.612 -6.172 1.150 1.00 0.00 H new ATOM 0 HG13 VAL A 23 7.256 -5.055 1.435 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.144 -2.961 -0.595 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.590 -2.583 1.054 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.173 -1.996 0.490 1.00 0.00 H new ATOM 358 N LYS A 24 11.922 -3.360 2.006 1.00 0.00 N ATOM 359 CA LYS A 24 13.111 -2.525 2.072 1.00 0.00 C ATOM 360 C LYS A 24 13.641 -2.256 0.664 1.00 0.00 C ATOM 361 O LYS A 24 14.014 -3.193 -0.060 1.00 0.00 O ATOM 362 CB LYS A 24 14.187 -3.222 2.911 1.00 0.00 C ATOM 363 CG LYS A 24 15.353 -2.328 3.293 1.00 0.00 C ATOM 364 CD LYS A 24 16.306 -3.045 4.231 1.00 0.00 C ATOM 365 CE LYS A 24 17.485 -2.165 4.590 1.00 0.00 C ATOM 366 NZ LYS A 24 18.395 -2.827 5.540 1.00 0.00 N ATOM 0 H LYS A 24 12.063 -4.264 1.556 1.00 0.00 H new ATOM 0 HA LYS A 24 12.853 -1.574 2.539 1.00 0.00 H new ATOM 0 HB2 LYS A 24 13.728 -3.610 3.820 1.00 0.00 H new ATOM 0 HB3 LYS A 24 14.567 -4.079 2.355 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.887 -2.017 2.395 1.00 0.00 H new ATOM 0 HG3 LYS A 24 14.980 -1.422 3.771 1.00 0.00 H new ATOM 0 HD2 LYS A 24 15.777 -3.337 5.138 1.00 0.00 H new ATOM 0 HD3 LYS A 24 16.663 -3.962 3.761 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.033 -1.904 3.684 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.123 -1.232 5.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.189 -2.192 5.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 17.879 -3.053 6.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.760 -3.704 5.117 1.00 0.00 H new ATOM 380 N LEU A 25 13.663 -0.999 0.264 1.00 0.00 N ATOM 381 CA LEU A 25 14.117 -0.624 -1.073 1.00 0.00 C ATOM 382 C LEU A 25 15.177 0.453 -1.021 1.00 0.00 C ATOM 383 O LEU A 25 15.322 1.159 -0.033 1.00 0.00 O ATOM 384 CB LEU A 25 12.979 -0.120 -1.988 1.00 0.00 C ATOM 385 CG LEU A 25 11.925 -1.116 -2.489 1.00 0.00 C ATOM 386 CD1 LEU A 25 11.048 -1.618 -1.380 1.00 0.00 C ATOM 387 CD2 LEU A 25 11.080 -0.464 -3.540 1.00 0.00 C ATOM 0 H LEU A 25 13.371 -0.213 0.845 1.00 0.00 H new ATOM 0 HA LEU A 25 14.524 -1.544 -1.493 1.00 0.00 H new ATOM 0 HB2 LEU A 25 12.454 0.672 -1.453 1.00 0.00 H new ATOM 0 HB3 LEU A 25 13.440 0.338 -2.863 1.00 0.00 H new ATOM 0 HG LEU A 25 12.453 -1.974 -2.905 1.00 0.00 H new ATOM 0 HD11 LEU A 25 10.318 -2.320 -1.783 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.660 -2.121 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU A 25 10.528 -0.778 -0.919 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.331 -1.172 -3.896 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.582 0.409 -3.117 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.711 -0.154 -4.373 1.00 0.00 H new ATOM 399 N MET A 26 15.912 0.546 -2.079 1.00 0.00 N ATOM 400 CA MET A 26 16.899 1.562 -2.271 1.00 0.00 C ATOM 401 C MET A 26 16.517 2.333 -3.496 1.00 0.00 C ATOM 402 O MET A 26 16.561 1.799 -4.575 1.00 0.00 O ATOM 403 CB MET A 26 18.265 0.927 -2.481 1.00 0.00 C ATOM 404 CG MET A 26 19.396 1.926 -2.609 1.00 0.00 C ATOM 405 SD MET A 26 21.032 1.173 -2.744 1.00 0.00 S ATOM 406 CE MET A 26 20.899 0.254 -4.278 1.00 0.00 C ATOM 0 H MET A 26 15.841 -0.104 -2.862 1.00 0.00 H new ATOM 0 HA MET A 26 16.949 2.213 -1.398 1.00 0.00 H new ATOM 0 HB2 MET A 26 18.476 0.260 -1.645 1.00 0.00 H new ATOM 0 HB3 MET A 26 18.234 0.312 -3.380 1.00 0.00 H new ATOM 0 HG2 MET A 26 19.220 2.547 -3.487 1.00 0.00 H new ATOM 0 HG3 MET A 26 19.382 2.587 -1.743 1.00 0.00 H new ATOM 0 HE1 MET A 26 21.889 -0.080 -4.589 1.00 0.00 H new ATOM 0 HE2 MET A 26 20.254 -0.612 -4.129 1.00 0.00 H new ATOM 0 HE3 MET A 26 20.473 0.895 -5.050 1.00 0.00 H new ATOM 416 N TYR A 27 16.121 3.556 -3.353 1.00 0.00 N ATOM 417 CA TYR A 27 15.701 4.286 -4.517 1.00 0.00 C ATOM 418 C TYR A 27 16.694 5.344 -4.838 1.00 0.00 C ATOM 419 O TYR A 27 16.953 6.222 -4.021 1.00 0.00 O ATOM 420 CB TYR A 27 14.255 4.843 -4.399 1.00 0.00 C ATOM 421 CG TYR A 27 14.026 5.895 -3.326 1.00 0.00 C ATOM 422 CD1 TYR A 27 14.100 5.571 -1.985 1.00 0.00 C ATOM 423 CD2 TYR A 27 13.718 7.209 -3.665 1.00 0.00 C ATOM 424 CE1 TYR A 27 13.882 6.513 -1.011 1.00 0.00 C ATOM 425 CE2 TYR A 27 13.499 8.162 -2.689 1.00 0.00 C ATOM 426 CZ TYR A 27 13.584 7.804 -1.363 1.00 0.00 C ATOM 427 OH TYR A 27 13.362 8.744 -0.375 1.00 0.00 O ATOM 0 H TYR A 27 16.077 4.065 -2.470 1.00 0.00 H new ATOM 0 HA TYR A 27 15.664 3.586 -5.352 1.00 0.00 H new ATOM 0 HB2 TYR A 27 13.972 5.269 -5.362 1.00 0.00 H new ATOM 0 HB3 TYR A 27 13.581 4.008 -4.209 1.00 0.00 H new ATOM 0 HD1 TYR A 27 14.334 4.557 -1.698 1.00 0.00 H new ATOM 0 HD2 TYR A 27 13.649 7.488 -4.706 1.00 0.00 H new ATOM 0 HE1 TYR A 27 13.945 6.238 0.031 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.263 9.179 -2.964 1.00 0.00 H new ATOM 0 HH TYR A 27 13.164 9.611 -0.787 1.00 0.00 H new ATOM 437 N LYS A 28 17.334 5.191 -5.991 1.00 0.00 N ATOM 438 CA LYS A 28 18.298 6.149 -6.505 1.00 0.00 C ATOM 439 C LYS A 28 19.500 6.236 -5.554 1.00 0.00 C ATOM 440 O LYS A 28 20.215 7.234 -5.503 1.00 0.00 O ATOM 441 CB LYS A 28 17.587 7.500 -6.707 1.00 0.00 C ATOM 442 CG LYS A 28 16.348 7.368 -7.603 1.00 0.00 C ATOM 443 CD LYS A 28 15.469 8.596 -7.579 1.00 0.00 C ATOM 444 CE LYS A 28 16.143 9.758 -8.220 1.00 0.00 C ATOM 445 NZ LYS A 28 15.284 10.954 -8.221 1.00 0.00 N ATOM 0 H LYS A 28 17.194 4.386 -6.602 1.00 0.00 H new ATOM 0 HA LYS A 28 18.691 5.834 -7.472 1.00 0.00 H new ATOM 0 HB2 LYS A 28 17.293 7.903 -5.738 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.282 8.213 -7.151 1.00 0.00 H new ATOM 0 HG2 LYS A 28 16.666 7.176 -8.628 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.765 6.504 -7.283 1.00 0.00 H new ATOM 0 HD2 LYS A 28 14.533 8.386 -8.096 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.215 8.844 -6.548 1.00 0.00 H new ATOM 0 HE2 LYS A 28 17.071 9.977 -7.692 1.00 0.00 H new ATOM 0 HE3 LYS A 28 16.412 9.503 -9.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 15.760 11.723 -8.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 14.381 10.733 -8.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 15.103 11.253 -7.241 1.00 0.00 H new ATOM 459 N GLY A 29 19.749 5.129 -4.867 1.00 0.00 N ATOM 460 CA GLY A 29 20.830 5.053 -3.909 1.00 0.00 C ATOM 461 C GLY A 29 20.385 5.341 -2.485 1.00 0.00 C ATOM 462 O GLY A 29 21.202 5.366 -1.575 1.00 0.00 O ATOM 0 H GLY A 29 19.209 4.269 -4.961 1.00 0.00 H new ATOM 0 HA2 GLY A 29 21.275 4.059 -3.950 1.00 0.00 H new ATOM 0 HA3 GLY A 29 21.608 5.762 -4.191 1.00 0.00 H new ATOM 466 N GLN A 30 19.099 5.561 -2.292 1.00 0.00 N ATOM 467 CA GLN A 30 18.540 5.826 -0.961 1.00 0.00 C ATOM 468 C GLN A 30 17.903 4.578 -0.365 1.00 0.00 C ATOM 469 O GLN A 30 16.803 4.208 -0.763 1.00 0.00 O ATOM 470 CB GLN A 30 17.479 6.939 -1.016 1.00 0.00 C ATOM 471 CG GLN A 30 18.002 8.364 -1.054 1.00 0.00 C ATOM 472 CD GLN A 30 18.943 8.677 -2.197 1.00 0.00 C ATOM 473 OE1 GLN A 30 18.522 9.077 -3.279 1.00 0.00 O ATOM 474 NE2 GLN A 30 20.219 8.553 -1.944 1.00 0.00 N ATOM 0 H GLN A 30 18.408 5.563 -3.042 1.00 0.00 H new ATOM 0 HA GLN A 30 19.371 6.142 -0.331 1.00 0.00 H new ATOM 0 HB2 GLN A 30 16.859 6.778 -1.898 1.00 0.00 H new ATOM 0 HB3 GLN A 30 16.829 6.836 -0.147 1.00 0.00 H new ATOM 0 HG2 GLN A 30 17.152 9.044 -1.108 1.00 0.00 H new ATOM 0 HG3 GLN A 30 18.516 8.570 -0.115 1.00 0.00 H new ATOM 0 HE21 GLN A 30 20.528 8.217 -1.032 1.00 0.00 H new ATOM 0 HE22 GLN A 30 20.906 8.792 -2.659 1.00 0.00 H new ATOM 483 N PRO A 31 18.578 3.893 0.564 1.00 0.00 N ATOM 484 CA PRO A 31 18.022 2.720 1.225 1.00 0.00 C ATOM 485 C PRO A 31 17.025 3.129 2.311 1.00 0.00 C ATOM 486 O PRO A 31 17.394 3.765 3.311 1.00 0.00 O ATOM 487 CB PRO A 31 19.249 2.024 1.849 1.00 0.00 C ATOM 488 CG PRO A 31 20.439 2.817 1.395 1.00 0.00 C ATOM 489 CD PRO A 31 19.925 4.185 1.061 1.00 0.00 C ATOM 0 HA PRO A 31 17.476 2.074 0.538 1.00 0.00 H new ATOM 0 HB2 PRO A 31 19.180 2.009 2.937 1.00 0.00 H new ATOM 0 HB3 PRO A 31 19.321 0.987 1.520 1.00 0.00 H new ATOM 0 HG2 PRO A 31 21.196 2.866 2.177 1.00 0.00 H new ATOM 0 HG3 PRO A 31 20.907 2.354 0.526 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.905 4.837 1.934 1.00 0.00 H new ATOM 0 HD3 PRO A 31 20.539 4.679 0.308 1.00 0.00 H new ATOM 497 N MET A 32 15.770 2.799 2.101 1.00 0.00 N ATOM 498 CA MET A 32 14.704 3.139 3.025 1.00 0.00 C ATOM 499 C MET A 32 13.788 1.952 3.215 1.00 0.00 C ATOM 500 O MET A 32 13.722 1.058 2.368 1.00 0.00 O ATOM 501 CB MET A 32 13.878 4.339 2.514 1.00 0.00 C ATOM 502 CG MET A 32 14.646 5.647 2.401 1.00 0.00 C ATOM 503 SD MET A 32 15.290 6.221 3.980 1.00 0.00 S ATOM 504 CE MET A 32 16.198 7.669 3.452 1.00 0.00 C ATOM 0 H MET A 32 15.455 2.283 1.279 1.00 0.00 H new ATOM 0 HA MET A 32 15.163 3.413 3.975 1.00 0.00 H new ATOM 0 HB2 MET A 32 13.470 4.089 1.535 1.00 0.00 H new ATOM 0 HB3 MET A 32 13.031 4.489 3.183 1.00 0.00 H new ATOM 0 HG2 MET A 32 15.473 5.518 1.703 1.00 0.00 H new ATOM 0 HG3 MET A 32 13.992 6.411 1.982 1.00 0.00 H new ATOM 0 HE1 MET A 32 16.661 8.144 4.317 1.00 0.00 H new ATOM 0 HE2 MET A 32 16.972 7.375 2.743 1.00 0.00 H new ATOM 0 HE3 MET A 32 15.516 8.372 2.974 1.00 0.00 H new ATOM 514 N THR A 33 13.114 1.925 4.315 1.00 0.00 N ATOM 515 CA THR A 33 12.163 0.896 4.595 1.00 0.00 C ATOM 516 C THR A 33 10.785 1.400 4.184 1.00 0.00 C ATOM 517 O THR A 33 10.265 2.338 4.768 1.00 0.00 O ATOM 518 CB THR A 33 12.207 0.566 6.086 1.00 0.00 C ATOM 519 OG1 THR A 33 13.585 0.324 6.428 1.00 0.00 O ATOM 520 CG2 THR A 33 11.389 -0.677 6.393 1.00 0.00 C ATOM 0 H THR A 33 13.207 2.622 5.054 1.00 0.00 H new ATOM 0 HA THR A 33 12.392 -0.013 4.039 1.00 0.00 H new ATOM 0 HB THR A 33 11.789 1.392 6.661 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.653 0.110 7.382 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.437 -0.890 7.461 1.00 0.00 H new ATOM 0 HG22 THR A 33 10.352 -0.511 6.103 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.791 -1.524 5.836 1.00 0.00 H new ATOM 528 N PHE A 34 10.234 0.806 3.172 1.00 0.00 N ATOM 529 CA PHE A 34 9.000 1.237 2.597 1.00 0.00 C ATOM 530 C PHE A 34 7.825 0.472 3.139 1.00 0.00 C ATOM 531 O PHE A 34 7.915 -0.717 3.439 1.00 0.00 O ATOM 532 CB PHE A 34 9.048 1.112 1.079 1.00 0.00 C ATOM 533 CG PHE A 34 9.838 2.184 0.400 1.00 0.00 C ATOM 534 CD1 PHE A 34 11.200 2.061 0.223 1.00 0.00 C ATOM 535 CD2 PHE A 34 9.204 3.319 -0.066 1.00 0.00 C ATOM 536 CE1 PHE A 34 11.916 3.053 -0.408 1.00 0.00 C ATOM 537 CE2 PHE A 34 9.912 4.313 -0.695 1.00 0.00 C ATOM 538 CZ PHE A 34 11.268 4.180 -0.867 1.00 0.00 C ATOM 0 H PHE A 34 10.639 -0.010 2.713 1.00 0.00 H new ATOM 0 HA PHE A 34 8.866 2.284 2.870 1.00 0.00 H new ATOM 0 HB2 PHE A 34 9.474 0.143 0.819 1.00 0.00 H new ATOM 0 HB3 PHE A 34 8.029 1.127 0.692 1.00 0.00 H new ATOM 0 HD1 PHE A 34 11.709 1.179 0.582 1.00 0.00 H new ATOM 0 HD2 PHE A 34 8.137 3.426 0.066 1.00 0.00 H new ATOM 0 HE1 PHE A 34 12.982 2.949 -0.543 1.00 0.00 H new ATOM 0 HE2 PHE A 34 9.404 5.196 -1.053 1.00 0.00 H new ATOM 0 HZ PHE A 34 11.828 4.959 -1.363 1.00 0.00 H new ATOM 548 N ARG A 35 6.736 1.153 3.269 1.00 0.00 N ATOM 549 CA ARG A 35 5.514 0.559 3.702 1.00 0.00 C ATOM 550 C ARG A 35 4.513 0.851 2.606 1.00 0.00 C ATOM 551 O ARG A 35 4.260 2.023 2.298 1.00 0.00 O ATOM 552 CB ARG A 35 5.089 1.168 5.050 1.00 0.00 C ATOM 553 CG ARG A 35 4.458 0.175 6.029 1.00 0.00 C ATOM 554 CD ARG A 35 3.091 -0.330 5.604 1.00 0.00 C ATOM 555 NE ARG A 35 2.056 0.713 5.699 1.00 0.00 N ATOM 556 CZ ARG A 35 0.802 0.524 6.181 1.00 0.00 C ATOM 557 NH1 ARG A 35 0.388 -0.679 6.566 1.00 0.00 N ATOM 558 NH2 ARG A 35 -0.043 1.557 6.264 1.00 0.00 N ATOM 0 H ARG A 35 6.668 2.152 3.075 1.00 0.00 H new ATOM 0 HA ARG A 35 5.600 -0.515 3.865 1.00 0.00 H new ATOM 0 HB2 ARG A 35 5.963 1.617 5.522 1.00 0.00 H new ATOM 0 HB3 ARG A 35 4.379 1.973 4.862 1.00 0.00 H new ATOM 0 HG2 ARG A 35 5.127 -0.677 6.148 1.00 0.00 H new ATOM 0 HG3 ARG A 35 4.370 0.650 7.006 1.00 0.00 H new ATOM 0 HD2 ARG A 35 3.143 -0.694 4.578 1.00 0.00 H new ATOM 0 HD3 ARG A 35 2.809 -1.177 6.229 1.00 0.00 H new ATOM 0 HE ARG A 35 2.301 1.650 5.378 1.00 0.00 H new ATOM 0 HH11 ARG A 35 1.017 -1.480 6.502 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -0.559 -0.802 6.926 1.00 0.00 H new ATOM 0 HH21 ARG A 35 0.256 2.485 5.965 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -0.986 1.417 6.626 1.00 0.00 H new ATOM 572 N LEU A 36 4.004 -0.199 1.990 1.00 0.00 N ATOM 573 CA LEU A 36 3.123 -0.086 0.832 1.00 0.00 C ATOM 574 C LEU A 36 1.857 0.678 1.149 1.00 0.00 C ATOM 575 O LEU A 36 1.057 0.257 1.973 1.00 0.00 O ATOM 576 CB LEU A 36 2.746 -1.464 0.233 1.00 0.00 C ATOM 577 CG LEU A 36 3.843 -2.284 -0.470 1.00 0.00 C ATOM 578 CD1 LEU A 36 4.853 -2.860 0.502 1.00 0.00 C ATOM 579 CD2 LEU A 36 3.231 -3.377 -1.326 1.00 0.00 C ATOM 0 H LEU A 36 4.188 -1.161 2.276 1.00 0.00 H new ATOM 0 HA LEU A 36 3.697 0.470 0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 36 2.340 -2.076 1.039 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.940 -1.305 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 36 4.388 -1.596 -1.117 1.00 0.00 H new ATOM 0 HD11 LEU A 36 5.603 -3.429 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 36 5.338 -2.049 1.046 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.345 -3.517 1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 36 4.024 -3.944 -1.814 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.641 -4.044 -0.697 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.587 -2.929 -2.083 1.00 0.00 H new ATOM 591 N LEU A 37 1.688 1.805 0.510 1.00 0.00 N ATOM 592 CA LEU A 37 0.481 2.563 0.667 1.00 0.00 C ATOM 593 C LEU A 37 -0.680 1.854 0.011 1.00 0.00 C ATOM 594 O LEU A 37 -0.534 1.261 -1.075 1.00 0.00 O ATOM 595 CB LEU A 37 0.625 3.999 0.161 1.00 0.00 C ATOM 596 CG LEU A 37 1.513 4.915 1.004 1.00 0.00 C ATOM 597 CD1 LEU A 37 1.610 6.282 0.362 1.00 0.00 C ATOM 598 CD2 LEU A 37 0.961 5.038 2.423 1.00 0.00 C ATOM 0 H LEU A 37 2.373 2.216 -0.124 1.00 0.00 H new ATOM 0 HA LEU A 37 0.277 2.635 1.735 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.025 3.969 -0.853 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.368 4.444 0.099 1.00 0.00 H new ATOM 0 HG LEU A 37 2.510 4.478 1.057 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.245 6.926 0.971 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.040 6.186 -0.635 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.615 6.720 0.287 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.606 5.693 3.009 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.045 5.456 2.387 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.928 4.052 2.887 1.00 0.00 H new ATOM 610 N LEU A 38 -1.819 1.916 0.696 1.00 0.00 N ATOM 611 CA LEU A 38 -3.073 1.240 0.332 1.00 0.00 C ATOM 612 C LEU A 38 -3.002 -0.244 0.668 1.00 0.00 C ATOM 613 O LEU A 38 -3.888 -1.007 0.330 1.00 0.00 O ATOM 614 CB LEU A 38 -3.476 1.483 -1.130 1.00 0.00 C ATOM 615 CG LEU A 38 -3.561 2.948 -1.550 1.00 0.00 C ATOM 616 CD1 LEU A 38 -3.961 3.073 -2.999 1.00 0.00 C ATOM 617 CD2 LEU A 38 -4.507 3.720 -0.655 1.00 0.00 C ATOM 0 H LEU A 38 -1.903 2.459 1.555 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.866 1.683 0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -2.758 0.978 -1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.445 1.016 -1.305 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.569 3.385 -1.438 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.014 4.127 -3.272 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.222 2.573 -3.625 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.936 2.610 -3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.547 4.760 -0.979 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.504 3.283 -0.716 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.153 3.674 0.375 1.00 0.00 H new ATOM 629 N VAL A 39 -1.969 -0.609 1.386 1.00 0.00 N ATOM 630 CA VAL A 39 -1.759 -1.951 1.865 1.00 0.00 C ATOM 631 C VAL A 39 -1.559 -1.868 3.355 1.00 0.00 C ATOM 632 O VAL A 39 -0.934 -0.931 3.832 1.00 0.00 O ATOM 633 CB VAL A 39 -0.507 -2.590 1.200 1.00 0.00 C ATOM 634 CG1 VAL A 39 -0.112 -3.907 1.846 1.00 0.00 C ATOM 635 CG2 VAL A 39 -0.753 -2.804 -0.266 1.00 0.00 C ATOM 0 H VAL A 39 -1.230 0.039 1.661 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.617 -2.575 1.616 1.00 0.00 H new ATOM 0 HB VAL A 39 0.319 -1.893 1.344 1.00 0.00 H new ATOM 0 HG11 VAL A 39 0.767 -4.310 1.343 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.116 -3.742 2.899 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.935 -4.616 1.760 1.00 0.00 H new ATOM 0 HG21 VAL A 39 0.130 -3.252 -0.722 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.606 -3.469 -0.398 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.962 -1.847 -0.743 1.00 0.00 H new ATOM 645 N ASP A 40 -2.144 -2.773 4.080 1.00 0.00 N ATOM 646 CA ASP A 40 -2.000 -2.778 5.501 1.00 0.00 C ATOM 647 C ASP A 40 -2.051 -4.200 6.007 1.00 0.00 C ATOM 648 O ASP A 40 -3.120 -4.832 5.998 1.00 0.00 O ATOM 649 CB ASP A 40 -3.165 -1.999 6.085 1.00 0.00 C ATOM 650 CG ASP A 40 -2.956 -1.553 7.511 1.00 0.00 C ATOM 651 OD1 ASP A 40 -2.092 -0.675 7.760 1.00 0.00 O ATOM 652 OD2 ASP A 40 -3.694 -2.021 8.408 1.00 0.00 O ATOM 0 H ASP A 40 -2.728 -3.521 3.707 1.00 0.00 H new ATOM 0 HA ASP A 40 -1.050 -2.330 5.791 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -3.349 -1.122 5.465 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -4.062 -2.617 6.037 1.00 0.00 H new ATOM 657 N THR A 41 -0.920 -4.720 6.402 1.00 0.00 N ATOM 658 CA THR A 41 -0.853 -6.047 6.989 1.00 0.00 C ATOM 659 C THR A 41 -0.091 -6.052 8.394 1.00 0.00 C ATOM 660 O THR A 41 0.664 -6.996 8.692 1.00 0.00 O ATOM 661 CB THR A 41 -0.185 -7.024 5.979 1.00 0.00 C ATOM 662 OG1 THR A 41 -0.679 -6.730 4.656 1.00 0.00 O ATOM 663 CG2 THR A 41 -0.558 -8.474 6.297 1.00 0.00 C ATOM 0 H THR A 41 -0.020 -4.246 6.330 1.00 0.00 H new ATOM 0 HA THR A 41 -1.870 -6.381 7.195 1.00 0.00 H new ATOM 0 HB THR A 41 0.896 -6.901 6.043 1.00 0.00 H new ATOM 0 HG1 THR A 41 0.049 -6.826 4.006 1.00 0.00 H new ATOM 0 HG21 THR A 41 -0.080 -9.139 5.578 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.221 -8.724 7.303 1.00 0.00 H new ATOM 0 HG23 THR A 41 -1.640 -8.593 6.237 1.00 0.00 H new ATOM 893 N GLY A 55 -0.928 -14.683 6.616 1.00 0.00 N ATOM 894 CA GLY A 55 0.002 -13.558 6.715 1.00 0.00 C ATOM 895 C GLY A 55 1.414 -13.841 6.141 1.00 0.00 C ATOM 896 O GLY A 55 1.897 -13.060 5.339 1.00 0.00 O ATOM 0 HA2 GLY A 55 -0.425 -12.703 6.191 1.00 0.00 H new ATOM 0 HA3 GLY A 55 0.099 -13.274 7.763 1.00 0.00 H new ATOM 900 N PRO A 56 2.111 -14.959 6.526 1.00 0.00 N ATOM 901 CA PRO A 56 3.447 -15.267 5.977 1.00 0.00 C ATOM 902 C PRO A 56 3.407 -15.557 4.469 1.00 0.00 C ATOM 903 O PRO A 56 4.390 -15.339 3.751 1.00 0.00 O ATOM 904 CB PRO A 56 3.881 -16.531 6.740 1.00 0.00 C ATOM 905 CG PRO A 56 3.001 -16.584 7.938 1.00 0.00 C ATOM 906 CD PRO A 56 1.699 -15.972 7.518 1.00 0.00 C ATOM 0 HA PRO A 56 4.128 -14.425 6.097 1.00 0.00 H new ATOM 0 HB2 PRO A 56 3.763 -17.423 6.125 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.932 -16.478 7.025 1.00 0.00 H new ATOM 0 HG2 PRO A 56 2.860 -17.611 8.274 1.00 0.00 H new ATOM 0 HG3 PRO A 56 3.441 -16.034 8.770 1.00 0.00 H new ATOM 0 HD2 PRO A 56 1.027 -16.712 7.083 1.00 0.00 H new ATOM 0 HD3 PRO A 56 1.175 -15.521 8.361 1.00 0.00 H new ATOM 914 N GLU A 57 2.269 -16.009 3.992 1.00 0.00 N ATOM 915 CA GLU A 57 2.111 -16.371 2.597 1.00 0.00 C ATOM 916 C GLU A 57 1.890 -15.133 1.746 1.00 0.00 C ATOM 917 O GLU A 57 2.249 -15.105 0.566 1.00 0.00 O ATOM 918 CB GLU A 57 0.980 -17.372 2.433 1.00 0.00 C ATOM 919 CG GLU A 57 1.220 -18.672 3.184 1.00 0.00 C ATOM 920 CD GLU A 57 2.436 -19.418 2.678 1.00 0.00 C ATOM 921 OE1 GLU A 57 3.568 -19.184 3.175 1.00 0.00 O ATOM 922 OE2 GLU A 57 2.283 -20.277 1.782 1.00 0.00 O ATOM 0 H GLU A 57 1.429 -16.137 4.556 1.00 0.00 H new ATOM 0 HA GLU A 57 3.028 -16.848 2.252 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.051 -16.923 2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.847 -17.591 1.373 1.00 0.00 H new ATOM 0 HG2 GLU A 57 1.345 -18.457 4.245 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.341 -19.310 3.090 1.00 0.00 H new ATOM 929 N ALA A 58 1.318 -14.109 2.350 1.00 0.00 N ATOM 930 CA ALA A 58 1.141 -12.824 1.707 1.00 0.00 C ATOM 931 C ALA A 58 2.507 -12.257 1.375 1.00 0.00 C ATOM 932 O ALA A 58 2.784 -11.835 0.240 1.00 0.00 O ATOM 933 CB ALA A 58 0.415 -11.893 2.648 1.00 0.00 C ATOM 0 H ALA A 58 0.962 -14.147 3.305 1.00 0.00 H new ATOM 0 HA ALA A 58 0.557 -12.935 0.793 1.00 0.00 H new ATOM 0 HB1 ALA A 58 0.279 -10.924 2.168 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -0.559 -12.314 2.897 1.00 0.00 H new ATOM 0 HB3 ALA A 58 1.000 -11.768 3.559 1.00 0.00 H new ATOM 939 N SER A 59 3.364 -12.302 2.364 1.00 0.00 N ATOM 940 CA SER A 59 4.723 -11.864 2.257 1.00 0.00 C ATOM 941 C SER A 59 5.502 -12.709 1.230 1.00 0.00 C ATOM 942 O SER A 59 6.348 -12.189 0.506 1.00 0.00 O ATOM 943 CB SER A 59 5.328 -11.951 3.639 1.00 0.00 C ATOM 944 OG SER A 59 4.458 -11.280 4.553 1.00 0.00 O ATOM 0 H SER A 59 3.123 -12.655 3.290 1.00 0.00 H new ATOM 0 HA SER A 59 4.772 -10.838 1.893 1.00 0.00 H new ATOM 0 HB2 SER A 59 5.456 -12.993 3.932 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.317 -11.493 3.650 1.00 0.00 H new ATOM 0 HG SER A 59 4.909 -11.174 5.417 1.00 0.00 H new ATOM 950 N ALA A 60 5.173 -13.997 1.148 1.00 0.00 N ATOM 951 CA ALA A 60 5.797 -14.902 0.186 1.00 0.00 C ATOM 952 C ALA A 60 5.452 -14.472 -1.237 1.00 0.00 C ATOM 953 O ALA A 60 6.328 -14.361 -2.093 1.00 0.00 O ATOM 954 CB ALA A 60 5.348 -16.334 0.433 1.00 0.00 C ATOM 0 H ALA A 60 4.472 -14.440 1.742 1.00 0.00 H new ATOM 0 HA ALA A 60 6.879 -14.856 0.313 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.823 -16.994 -0.293 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.634 -16.636 1.440 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.265 -16.399 0.329 1.00 0.00 H new ATOM 960 N PHE A 61 4.174 -14.195 -1.463 1.00 0.00 N ATOM 961 CA PHE A 61 3.687 -13.721 -2.757 1.00 0.00 C ATOM 962 C PHE A 61 4.355 -12.401 -3.110 1.00 0.00 C ATOM 963 O PHE A 61 4.764 -12.187 -4.254 1.00 0.00 O ATOM 964 CB PHE A 61 2.159 -13.556 -2.713 1.00 0.00 C ATOM 965 CG PHE A 61 1.534 -12.973 -3.964 1.00 0.00 C ATOM 966 CD1 PHE A 61 1.166 -13.785 -5.022 1.00 0.00 C ATOM 967 CD2 PHE A 61 1.304 -11.608 -4.066 1.00 0.00 C ATOM 968 CE1 PHE A 61 0.582 -13.246 -6.155 1.00 0.00 C ATOM 969 CE2 PHE A 61 0.721 -11.065 -5.188 1.00 0.00 C ATOM 970 CZ PHE A 61 0.361 -11.881 -6.235 1.00 0.00 C ATOM 0 H PHE A 61 3.445 -14.292 -0.757 1.00 0.00 H new ATOM 0 HA PHE A 61 3.936 -14.454 -3.525 1.00 0.00 H new ATOM 0 HB2 PHE A 61 1.710 -14.531 -2.523 1.00 0.00 H new ATOM 0 HB3 PHE A 61 1.903 -12.917 -1.868 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.336 -14.850 -4.963 1.00 0.00 H new ATOM 0 HD2 PHE A 61 1.588 -10.960 -3.250 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.299 -13.889 -6.976 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.547 -10.001 -5.246 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.094 -11.458 -7.119 1.00 0.00 H new ATOM 980 N THR A 62 4.477 -11.543 -2.110 1.00 0.00 N ATOM 981 CA THR A 62 5.115 -10.258 -2.267 1.00 0.00 C ATOM 982 C THR A 62 6.557 -10.441 -2.755 1.00 0.00 C ATOM 983 O THR A 62 6.954 -9.826 -3.749 1.00 0.00 O ATOM 984 CB THR A 62 5.093 -9.469 -0.938 1.00 0.00 C ATOM 985 OG1 THR A 62 3.738 -9.363 -0.480 1.00 0.00 O ATOM 986 CG2 THR A 62 5.666 -8.065 -1.121 1.00 0.00 C ATOM 0 H THR A 62 4.134 -11.724 -1.167 1.00 0.00 H new ATOM 0 HA THR A 62 4.561 -9.686 -3.011 1.00 0.00 H new ATOM 0 HB THR A 62 5.705 -10.001 -0.210 1.00 0.00 H new ATOM 0 HG1 THR A 62 3.455 -10.218 -0.095 1.00 0.00 H new ATOM 0 HG21 THR A 62 5.638 -7.534 -0.170 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.697 -8.135 -1.467 1.00 0.00 H new ATOM 0 HG23 THR A 62 5.072 -7.523 -1.857 1.00 0.00 H new ATOM 994 N LYS A 63 7.305 -11.341 -2.087 1.00 0.00 N ATOM 995 CA LYS A 63 8.687 -11.640 -2.460 1.00 0.00 C ATOM 996 C LYS A 63 8.768 -12.081 -3.901 1.00 0.00 C ATOM 997 O LYS A 63 9.514 -11.514 -4.681 1.00 0.00 O ATOM 998 CB LYS A 63 9.294 -12.738 -1.581 1.00 0.00 C ATOM 999 CG LYS A 63 9.473 -12.382 -0.114 1.00 0.00 C ATOM 1000 CD LYS A 63 10.142 -13.521 0.658 1.00 0.00 C ATOM 1001 CE LYS A 63 11.538 -13.807 0.114 1.00 0.00 C ATOM 1002 NZ LYS A 63 12.216 -14.906 0.819 1.00 0.00 N ATOM 0 H LYS A 63 6.967 -11.871 -1.284 1.00 0.00 H new ATOM 0 HA LYS A 63 9.253 -10.720 -2.316 1.00 0.00 H new ATOM 0 HB2 LYS A 63 8.661 -13.623 -1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 63 10.266 -13.011 -1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.076 -11.478 -0.028 1.00 0.00 H new ATOM 0 HG3 LYS A 63 8.502 -12.160 0.330 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.206 -13.260 1.714 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.530 -14.420 0.589 1.00 0.00 H new ATOM 0 HE2 LYS A 63 11.466 -14.052 -0.946 1.00 0.00 H new ATOM 0 HE3 LYS A 63 12.144 -12.904 0.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 13.159 -15.054 0.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 12.313 -14.665 1.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 11.656 -15.777 0.724 1.00 0.00 H new ATOM 1016 N LYS A 64 7.952 -13.057 -4.251 1.00 0.00 N ATOM 1017 CA LYS A 64 7.946 -13.621 -5.596 1.00 0.00 C ATOM 1018 C LYS A 64 7.649 -12.553 -6.640 1.00 0.00 C ATOM 1019 O LYS A 64 8.248 -12.538 -7.710 1.00 0.00 O ATOM 1020 CB LYS A 64 6.914 -14.744 -5.711 1.00 0.00 C ATOM 1021 CG LYS A 64 7.140 -15.902 -4.755 1.00 0.00 C ATOM 1022 CD LYS A 64 6.080 -16.978 -4.927 1.00 0.00 C ATOM 1023 CE LYS A 64 6.272 -18.105 -3.927 1.00 0.00 C ATOM 1024 NZ LYS A 64 5.283 -19.191 -4.114 1.00 0.00 N ATOM 0 H LYS A 64 7.276 -13.483 -3.617 1.00 0.00 H new ATOM 0 HA LYS A 64 8.940 -14.027 -5.781 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.922 -14.329 -5.532 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.921 -15.125 -6.732 1.00 0.00 H new ATOM 0 HG2 LYS A 64 8.127 -16.331 -4.927 1.00 0.00 H new ATOM 0 HG3 LYS A 64 7.126 -15.536 -3.728 1.00 0.00 H new ATOM 0 HD2 LYS A 64 5.090 -16.540 -4.799 1.00 0.00 H new ATOM 0 HD3 LYS A 64 6.124 -17.377 -5.941 1.00 0.00 H new ATOM 0 HE2 LYS A 64 7.279 -18.511 -4.028 1.00 0.00 H new ATOM 0 HE3 LYS A 64 6.188 -17.709 -2.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 5.451 -19.939 -3.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.323 -18.811 -3.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 5.380 -19.588 -5.071 1.00 0.00 H new ATOM 1038 N MET A 65 6.736 -11.664 -6.327 1.00 0.00 N ATOM 1039 CA MET A 65 6.356 -10.620 -7.242 1.00 0.00 C ATOM 1040 C MET A 65 7.472 -9.590 -7.418 1.00 0.00 C ATOM 1041 O MET A 65 7.841 -9.252 -8.547 1.00 0.00 O ATOM 1042 CB MET A 65 5.060 -9.956 -6.779 1.00 0.00 C ATOM 1043 CG MET A 65 4.525 -8.885 -7.715 1.00 0.00 C ATOM 1044 SD MET A 65 4.210 -9.507 -9.385 1.00 0.00 S ATOM 1045 CE MET A 65 3.466 -8.064 -10.149 1.00 0.00 C ATOM 0 H MET A 65 6.240 -11.646 -5.436 1.00 0.00 H new ATOM 0 HA MET A 65 6.183 -11.074 -8.218 1.00 0.00 H new ATOM 0 HB2 MET A 65 4.298 -10.725 -6.656 1.00 0.00 H new ATOM 0 HB3 MET A 65 5.226 -9.512 -5.798 1.00 0.00 H new ATOM 0 HG2 MET A 65 3.601 -8.478 -7.304 1.00 0.00 H new ATOM 0 HG3 MET A 65 5.240 -8.064 -7.767 1.00 0.00 H new ATOM 0 HE1 MET A 65 2.676 -8.380 -10.830 1.00 0.00 H new ATOM 0 HE2 MET A 65 3.044 -7.420 -9.377 1.00 0.00 H new ATOM 0 HE3 MET A 65 4.226 -7.514 -10.705 1.00 0.00 H new ATOM 1055 N VAL A 66 8.035 -9.134 -6.321 1.00 0.00 N ATOM 1056 CA VAL A 66 9.047 -8.083 -6.373 1.00 0.00 C ATOM 1057 C VAL A 66 10.431 -8.584 -6.798 1.00 0.00 C ATOM 1058 O VAL A 66 11.139 -7.884 -7.506 1.00 0.00 O ATOM 1059 CB VAL A 66 9.134 -7.222 -5.073 1.00 0.00 C ATOM 1060 CG1 VAL A 66 7.824 -6.485 -4.828 1.00 0.00 C ATOM 1061 CG2 VAL A 66 9.506 -8.061 -3.856 1.00 0.00 C ATOM 0 H VAL A 66 7.816 -9.468 -5.382 1.00 0.00 H new ATOM 0 HA VAL A 66 8.692 -7.421 -7.162 1.00 0.00 H new ATOM 0 HB VAL A 66 9.929 -6.491 -5.223 1.00 0.00 H new ATOM 0 HG11 VAL A 66 7.905 -5.891 -3.918 1.00 0.00 H new ATOM 0 HG12 VAL A 66 7.613 -5.828 -5.672 1.00 0.00 H new ATOM 0 HG13 VAL A 66 7.015 -7.207 -4.719 1.00 0.00 H new ATOM 0 HG21 VAL A 66 9.555 -7.422 -2.975 1.00 0.00 H new ATOM 0 HG22 VAL A 66 8.752 -8.833 -3.702 1.00 0.00 H new ATOM 0 HG23 VAL A 66 10.477 -8.529 -4.020 1.00 0.00 H new ATOM 1071 N GLU A 67 10.799 -9.799 -6.412 1.00 0.00 N ATOM 1072 CA GLU A 67 12.113 -10.337 -6.779 1.00 0.00 C ATOM 1073 C GLU A 67 12.124 -10.786 -8.241 1.00 0.00 C ATOM 1074 O GLU A 67 13.192 -10.956 -8.850 1.00 0.00 O ATOM 1075 CB GLU A 67 12.538 -11.495 -5.860 1.00 0.00 C ATOM 1076 CG GLU A 67 12.597 -11.131 -4.378 1.00 0.00 C ATOM 1077 CD GLU A 67 13.091 -12.264 -3.507 1.00 0.00 C ATOM 1078 OE1 GLU A 67 12.695 -13.433 -3.734 1.00 0.00 O ATOM 1079 OE2 GLU A 67 13.919 -12.014 -2.601 1.00 0.00 O ATOM 0 H GLU A 67 10.220 -10.426 -5.853 1.00 0.00 H new ATOM 0 HA GLU A 67 12.838 -9.533 -6.651 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.841 -12.323 -5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.519 -11.852 -6.174 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.251 -10.269 -4.248 1.00 0.00 H new ATOM 0 HG3 GLU A 67 11.604 -10.831 -4.044 1.00 0.00 H new ATOM 1086 N ASN A 68 10.940 -11.005 -8.795 1.00 0.00 N ATOM 1087 CA ASN A 68 10.804 -11.377 -10.210 1.00 0.00 C ATOM 1088 C ASN A 68 10.667 -10.127 -11.075 1.00 0.00 C ATOM 1089 O ASN A 68 10.761 -10.192 -12.288 1.00 0.00 O ATOM 1090 CB ASN A 68 9.579 -12.302 -10.405 1.00 0.00 C ATOM 1091 CG ASN A 68 9.338 -12.770 -11.844 1.00 0.00 C ATOM 1092 OD1 ASN A 68 9.884 -13.789 -12.282 1.00 0.00 O ATOM 1093 ND2 ASN A 68 8.480 -12.077 -12.567 1.00 0.00 N ATOM 0 H ASN A 68 10.055 -10.933 -8.292 1.00 0.00 H new ATOM 0 HA ASN A 68 11.700 -11.916 -10.517 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.702 -13.180 -9.770 1.00 0.00 H new ATOM 0 HB3 ASN A 68 8.689 -11.778 -10.056 1.00 0.00 H new ATOM 0 HD21 ASN A 68 8.251 -12.378 -13.514 1.00 0.00 H new ATOM 0 HD22 ASN A 68 8.045 -11.240 -12.179 1.00 0.00 H new ATOM 1100 N ALA A 69 10.487 -8.991 -10.442 1.00 0.00 N ATOM 1101 CA ALA A 69 10.252 -7.752 -11.154 1.00 0.00 C ATOM 1102 C ALA A 69 11.538 -7.168 -11.706 1.00 0.00 C ATOM 1103 O ALA A 69 12.560 -7.108 -11.009 1.00 0.00 O ATOM 1104 CB ALA A 69 9.568 -6.745 -10.254 1.00 0.00 C ATOM 0 H ALA A 69 10.499 -8.897 -9.426 1.00 0.00 H new ATOM 0 HA ALA A 69 9.600 -7.979 -11.997 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.399 -5.820 -10.805 1.00 0.00 H new ATOM 0 HB2 ALA A 69 8.612 -7.147 -9.919 1.00 0.00 H new ATOM 0 HB3 ALA A 69 10.200 -6.542 -9.389 1.00 0.00 H new ATOM 1110 N LYS A 70 11.493 -6.756 -12.962 1.00 0.00 N ATOM 1111 CA LYS A 70 12.622 -6.118 -13.593 1.00 0.00 C ATOM 1112 C LYS A 70 12.811 -4.718 -13.082 1.00 0.00 C ATOM 1113 O LYS A 70 13.934 -4.216 -12.980 1.00 0.00 O ATOM 1114 CB LYS A 70 12.498 -6.106 -15.112 1.00 0.00 C ATOM 1115 CG LYS A 70 11.166 -5.655 -15.690 1.00 0.00 C ATOM 1116 CD LYS A 70 11.272 -5.605 -17.197 1.00 0.00 C ATOM 1117 CE LYS A 70 9.950 -5.316 -17.907 1.00 0.00 C ATOM 1118 NZ LYS A 70 8.918 -6.355 -17.670 1.00 0.00 N ATOM 0 H LYS A 70 10.676 -6.856 -13.564 1.00 0.00 H new ATOM 0 HA LYS A 70 13.500 -6.709 -13.333 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.278 -5.457 -15.511 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.703 -7.112 -15.477 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.375 -6.342 -15.391 1.00 0.00 H new ATOM 0 HG3 LYS A 70 10.900 -4.673 -15.299 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.996 -4.839 -17.474 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.663 -6.557 -17.555 1.00 0.00 H new ATOM 0 HE2 LYS A 70 9.569 -4.352 -17.572 1.00 0.00 H new ATOM 0 HE3 LYS A 70 10.132 -5.232 -18.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 8.647 -6.788 -18.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 9.301 -7.087 -17.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.082 -5.920 -17.230 1.00 0.00 H new ATOM 1132 N LYS A 71 11.730 -4.076 -12.783 1.00 0.00 N ATOM 1133 CA LYS A 71 11.789 -2.747 -12.272 1.00 0.00 C ATOM 1134 C LYS A 71 10.921 -2.657 -11.068 1.00 0.00 C ATOM 1135 O LYS A 71 9.739 -2.971 -11.135 1.00 0.00 O ATOM 1136 CB LYS A 71 11.294 -1.707 -13.278 1.00 0.00 C ATOM 1137 CG LYS A 71 11.894 -1.742 -14.681 1.00 0.00 C ATOM 1138 CD LYS A 71 11.516 -0.463 -15.448 1.00 0.00 C ATOM 1139 CE LYS A 71 10.008 -0.199 -15.440 1.00 0.00 C ATOM 1140 NZ LYS A 71 9.669 1.107 -16.028 1.00 0.00 N ATOM 0 H LYS A 71 10.788 -4.454 -12.885 1.00 0.00 H new ATOM 0 HA LYS A 71 12.834 -2.536 -12.044 1.00 0.00 H new ATOM 0 HB2 LYS A 71 10.214 -1.817 -13.371 1.00 0.00 H new ATOM 0 HB3 LYS A 71 11.478 -0.718 -12.858 1.00 0.00 H new ATOM 0 HG2 LYS A 71 12.979 -1.832 -14.619 1.00 0.00 H new ATOM 0 HG3 LYS A 71 11.532 -2.618 -15.218 1.00 0.00 H new ATOM 0 HD2 LYS A 71 12.033 0.388 -15.005 1.00 0.00 H new ATOM 0 HD3 LYS A 71 11.862 -0.545 -16.478 1.00 0.00 H new ATOM 0 HE2 LYS A 71 9.500 -0.988 -15.994 1.00 0.00 H new ATOM 0 HE3 LYS A 71 9.639 -0.241 -14.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 9.166 1.685 -15.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 10.541 1.595 -16.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.060 0.966 -16.859 1.00 0.00 H new ATOM 1154 N ILE A 72 11.487 -2.264 -9.986 1.00 0.00 N ATOM 1155 CA ILE A 72 10.729 -2.021 -8.814 1.00 0.00 C ATOM 1156 C ILE A 72 10.587 -0.526 -8.746 1.00 0.00 C ATOM 1157 O ILE A 72 11.579 0.186 -8.794 1.00 0.00 O ATOM 1158 CB ILE A 72 11.397 -2.567 -7.517 1.00 0.00 C ATOM 1159 CG1 ILE A 72 11.705 -4.082 -7.621 1.00 0.00 C ATOM 1160 CG2 ILE A 72 10.501 -2.301 -6.326 1.00 0.00 C ATOM 1161 CD1 ILE A 72 12.984 -4.438 -8.365 1.00 0.00 C ATOM 0 H ILE A 72 12.489 -2.102 -9.888 1.00 0.00 H new ATOM 0 HA ILE A 72 9.773 -2.541 -8.870 1.00 0.00 H new ATOM 0 HB ILE A 72 12.345 -2.046 -7.387 1.00 0.00 H new ATOM 0 HG12 ILE A 72 11.764 -4.494 -6.613 1.00 0.00 H new ATOM 0 HG13 ILE A 72 10.868 -4.573 -8.117 1.00 0.00 H new ATOM 0 HG21 ILE A 72 10.974 -2.685 -5.422 1.00 0.00 H new ATOM 0 HG22 ILE A 72 10.341 -1.228 -6.224 1.00 0.00 H new ATOM 0 HG23 ILE A 72 9.542 -2.798 -6.474 1.00 0.00 H new ATOM 0 HD11 ILE A 72 13.106 -5.521 -8.381 1.00 0.00 H new ATOM 0 HD12 ILE A 72 12.926 -4.064 -9.387 1.00 0.00 H new ATOM 0 HD13 ILE A 72 13.837 -3.984 -7.860 1.00 0.00 H new ATOM 1173 N GLU A 73 9.390 -0.052 -8.735 1.00 0.00 N ATOM 1174 CA GLU A 73 9.150 1.355 -8.816 1.00 0.00 C ATOM 1175 C GLU A 73 8.423 1.852 -7.581 1.00 0.00 C ATOM 1176 O GLU A 73 7.582 1.142 -7.011 1.00 0.00 O ATOM 1177 CB GLU A 73 8.310 1.623 -10.042 1.00 0.00 C ATOM 1178 CG GLU A 73 8.794 0.903 -11.288 1.00 0.00 C ATOM 1179 CD GLU A 73 7.924 1.167 -12.480 1.00 0.00 C ATOM 1180 OE1 GLU A 73 6.828 0.570 -12.579 1.00 0.00 O ATOM 1181 OE2 GLU A 73 8.304 1.972 -13.344 1.00 0.00 O ATOM 0 H GLU A 73 8.548 -0.624 -8.670 1.00 0.00 H new ATOM 0 HA GLU A 73 10.103 1.881 -8.881 1.00 0.00 H new ATOM 0 HB2 GLU A 73 7.282 1.325 -9.838 1.00 0.00 H new ATOM 0 HB3 GLU A 73 8.299 2.696 -10.235 1.00 0.00 H new ATOM 0 HG2 GLU A 73 9.814 1.216 -11.511 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.824 -0.169 -11.095 1.00 0.00 H new ATOM 1188 N VAL A 74 8.739 3.057 -7.181 1.00 0.00 N ATOM 1189 CA VAL A 74 8.123 3.689 -6.028 1.00 0.00 C ATOM 1190 C VAL A 74 7.433 4.993 -6.429 1.00 0.00 C ATOM 1191 O VAL A 74 7.997 5.798 -7.179 1.00 0.00 O ATOM 1192 CB VAL A 74 9.150 3.960 -4.880 1.00 0.00 C ATOM 1193 CG1 VAL A 74 9.549 2.665 -4.206 1.00 0.00 C ATOM 1194 CG2 VAL A 74 10.402 4.643 -5.420 1.00 0.00 C ATOM 0 H VAL A 74 9.437 3.638 -7.646 1.00 0.00 H new ATOM 0 HA VAL A 74 7.378 2.990 -5.647 1.00 0.00 H new ATOM 0 HB VAL A 74 8.667 4.615 -4.155 1.00 0.00 H new ATOM 0 HG11 VAL A 74 10.264 2.874 -3.410 1.00 0.00 H new ATOM 0 HG12 VAL A 74 8.665 2.187 -3.783 1.00 0.00 H new ATOM 0 HG13 VAL A 74 10.006 1.999 -4.938 1.00 0.00 H new ATOM 0 HG21 VAL A 74 11.101 4.821 -4.603 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.872 4.003 -6.167 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.129 5.594 -5.877 1.00 0.00 H new ATOM 1204 N GLU A 75 6.214 5.178 -5.966 1.00 0.00 N ATOM 1205 CA GLU A 75 5.449 6.384 -6.244 1.00 0.00 C ATOM 1206 C GLU A 75 4.790 6.847 -4.962 1.00 0.00 C ATOM 1207 O GLU A 75 4.226 6.048 -4.233 1.00 0.00 O ATOM 1208 CB GLU A 75 4.409 6.101 -7.312 1.00 0.00 C ATOM 1209 CG GLU A 75 3.541 7.282 -7.719 1.00 0.00 C ATOM 1210 CD GLU A 75 2.558 6.876 -8.787 1.00 0.00 C ATOM 1211 OE1 GLU A 75 1.498 6.321 -8.444 1.00 0.00 O ATOM 1212 OE2 GLU A 75 2.831 7.067 -9.996 1.00 0.00 O ATOM 0 H GLU A 75 5.722 4.498 -5.386 1.00 0.00 H new ATOM 0 HA GLU A 75 6.108 7.170 -6.614 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.919 5.726 -8.199 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.759 5.302 -6.957 1.00 0.00 H new ATOM 0 HG2 GLU A 75 3.005 7.663 -6.850 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.170 8.093 -8.086 1.00 0.00 H new ATOM 1219 N PHE A 76 4.870 8.109 -4.691 1.00 0.00 N ATOM 1220 CA PHE A 76 4.372 8.665 -3.452 1.00 0.00 C ATOM 1221 C PHE A 76 2.965 9.204 -3.612 1.00 0.00 C ATOM 1222 O PHE A 76 2.586 9.644 -4.693 1.00 0.00 O ATOM 1223 CB PHE A 76 5.327 9.737 -2.940 1.00 0.00 C ATOM 1224 CG PHE A 76 6.720 9.208 -2.692 1.00 0.00 C ATOM 1225 CD1 PHE A 76 7.042 8.623 -1.481 1.00 0.00 C ATOM 1226 CD2 PHE A 76 7.695 9.269 -3.679 1.00 0.00 C ATOM 1227 CE1 PHE A 76 8.304 8.115 -1.251 1.00 0.00 C ATOM 1228 CE2 PHE A 76 8.961 8.757 -3.455 1.00 0.00 C ATOM 1229 CZ PHE A 76 9.264 8.178 -2.239 1.00 0.00 C ATOM 0 H PHE A 76 5.284 8.797 -5.320 1.00 0.00 H new ATOM 0 HA PHE A 76 4.322 7.867 -2.711 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.375 10.550 -3.664 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.932 10.157 -2.015 1.00 0.00 H new ATOM 0 HD1 PHE A 76 6.295 8.563 -0.704 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.463 9.721 -4.632 1.00 0.00 H new ATOM 0 HE1 PHE A 76 8.540 7.668 -0.297 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.711 8.810 -4.230 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.250 7.775 -2.062 1.00 0.00 H new ATOM 1239 N ASP A 77 2.192 9.123 -2.548 1.00 0.00 N ATOM 1240 CA ASP A 77 0.814 9.586 -2.536 1.00 0.00 C ATOM 1241 C ASP A 77 0.803 11.073 -2.213 1.00 0.00 C ATOM 1242 O ASP A 77 1.806 11.614 -1.710 1.00 0.00 O ATOM 1243 CB ASP A 77 0.012 8.793 -1.474 1.00 0.00 C ATOM 1244 CG ASP A 77 -1.459 9.170 -1.375 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -2.279 8.589 -2.095 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -1.804 10.055 -0.580 1.00 0.00 O ATOM 0 H ASP A 77 2.502 8.731 -1.659 1.00 0.00 H new ATOM 0 HA ASP A 77 0.351 9.425 -3.510 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.086 7.730 -1.702 1.00 0.00 H new ATOM 0 HB3 ASP A 77 0.478 8.943 -0.500 1.00 0.00 H new ATOM 1251 N LYS A 78 -0.306 11.732 -2.479 1.00 0.00 N ATOM 1252 CA LYS A 78 -0.458 13.153 -2.247 1.00 0.00 C ATOM 1253 C LYS A 78 -0.584 13.482 -0.745 1.00 0.00 C ATOM 1254 O LYS A 78 -0.621 14.662 -0.347 1.00 0.00 O ATOM 1255 CB LYS A 78 -1.648 13.698 -3.048 1.00 0.00 C ATOM 1256 CG LYS A 78 -2.932 12.957 -2.834 1.00 0.00 C ATOM 1257 CD LYS A 78 -4.117 13.670 -3.459 1.00 0.00 C ATOM 1258 CE LYS A 78 -4.392 15.017 -2.790 1.00 0.00 C ATOM 1259 NZ LYS A 78 -5.692 15.571 -3.200 1.00 0.00 N ATOM 0 H LYS A 78 -1.138 11.289 -2.868 1.00 0.00 H new ATOM 0 HA LYS A 78 0.447 13.650 -2.597 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -1.799 14.745 -2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -1.399 13.670 -4.109 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -2.847 11.957 -3.258 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -3.106 12.836 -1.765 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.928 13.825 -4.521 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -5.002 13.039 -3.381 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -4.373 14.896 -1.707 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -3.599 15.720 -3.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -5.845 16.484 -2.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -5.701 15.709 -4.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -6.450 14.911 -2.933 1.00 0.00 H new ATOM 1273 N GLY A 79 -0.661 12.454 0.072 1.00 0.00 N ATOM 1274 CA GLY A 79 -0.681 12.629 1.494 1.00 0.00 C ATOM 1275 C GLY A 79 0.698 12.459 2.092 1.00 0.00 C ATOM 1276 O GLY A 79 1.542 13.370 2.011 1.00 0.00 O ATOM 0 H GLY A 79 -0.711 11.483 -0.235 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.063 13.621 1.734 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -1.364 11.907 1.941 1.00 0.00 H new ATOM 1280 N GLN A 80 0.962 11.297 2.631 1.00 0.00 N ATOM 1281 CA GLN A 80 2.220 11.048 3.308 1.00 0.00 C ATOM 1282 C GLN A 80 3.237 10.438 2.364 1.00 0.00 C ATOM 1283 O GLN A 80 2.917 9.558 1.573 1.00 0.00 O ATOM 1284 CB GLN A 80 2.061 10.124 4.529 1.00 0.00 C ATOM 1285 CG GLN A 80 1.047 10.556 5.601 1.00 0.00 C ATOM 1286 CD GLN A 80 -0.406 10.403 5.183 1.00 0.00 C ATOM 1287 OE1 GLN A 80 -0.761 9.521 4.386 1.00 0.00 O ATOM 1288 NE2 GLN A 80 -1.253 11.233 5.722 1.00 0.00 N ATOM 0 H GLN A 80 0.323 10.502 2.617 1.00 0.00 H new ATOM 0 HA GLN A 80 2.571 12.020 3.655 1.00 0.00 H new ATOM 0 HB2 GLN A 80 1.775 9.135 4.171 1.00 0.00 H new ATOM 0 HB3 GLN A 80 3.036 10.021 5.006 1.00 0.00 H new ATOM 0 HG2 GLN A 80 1.217 9.969 6.503 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.231 11.599 5.860 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.924 11.946 6.374 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.245 11.170 5.493 1.00 0.00 H new ATOM 1297 N ARG A 81 4.439 10.956 2.425 1.00 0.00 N ATOM 1298 CA ARG A 81 5.554 10.454 1.673 1.00 0.00 C ATOM 1299 C ARG A 81 6.583 9.814 2.624 1.00 0.00 C ATOM 1300 O ARG A 81 7.337 8.904 2.249 1.00 0.00 O ATOM 1301 CB ARG A 81 6.203 11.608 0.924 1.00 0.00 C ATOM 1302 CG ARG A 81 5.324 12.267 -0.129 1.00 0.00 C ATOM 1303 CD ARG A 81 6.011 13.470 -0.764 1.00 0.00 C ATOM 1304 NE ARG A 81 5.120 14.207 -1.688 1.00 0.00 N ATOM 1305 CZ ARG A 81 5.466 14.698 -2.896 1.00 0.00 C ATOM 1306 NH1 ARG A 81 6.659 14.428 -3.417 1.00 0.00 N ATOM 1307 NH2 ARG A 81 4.598 15.440 -3.588 1.00 0.00 N ATOM 0 H ARG A 81 4.671 11.756 3.013 1.00 0.00 H new ATOM 0 HA ARG A 81 5.208 9.700 0.967 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.508 12.365 1.647 1.00 0.00 H new ATOM 0 HB3 ARG A 81 7.110 11.244 0.442 1.00 0.00 H new ATOM 0 HG2 ARG A 81 5.075 11.540 -0.902 1.00 0.00 H new ATOM 0 HG3 ARG A 81 4.385 12.582 0.326 1.00 0.00 H new ATOM 0 HD2 ARG A 81 6.354 14.145 0.020 1.00 0.00 H new ATOM 0 HD3 ARG A 81 6.895 13.135 -1.306 1.00 0.00 H new ATOM 0 HE ARG A 81 4.158 14.357 -1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 81 7.320 13.846 -2.903 1.00 0.00 H new ATOM 0 HH12 ARG A 81 6.913 14.803 -4.331 1.00 0.00 H new ATOM 0 HH21 ARG A 81 3.674 15.635 -3.203 1.00 0.00 H new ATOM 0 HH22 ARG A 81 4.859 15.811 -4.501 1.00 0.00 H new ATOM 1321 N THR A 82 6.608 10.294 3.858 1.00 0.00 N ATOM 1322 CA THR A 82 7.570 9.840 4.855 1.00 0.00 C ATOM 1323 C THR A 82 6.911 9.712 6.209 1.00 0.00 C ATOM 1324 O THR A 82 6.189 10.615 6.627 1.00 0.00 O ATOM 1325 CB THR A 82 8.742 10.845 4.992 1.00 0.00 C ATOM 1326 OG1 THR A 82 8.219 12.199 5.081 1.00 0.00 O ATOM 1327 CG2 THR A 82 9.725 10.739 3.830 1.00 0.00 C ATOM 0 H THR A 82 5.964 11.008 4.198 1.00 0.00 H new ATOM 0 HA THR A 82 7.946 8.872 4.523 1.00 0.00 H new ATOM 0 HB THR A 82 9.287 10.599 5.903 1.00 0.00 H new ATOM 0 HG1 THR A 82 7.320 12.178 5.472 1.00 0.00 H new ATOM 0 HG21 THR A 82 10.530 11.461 3.967 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.142 9.733 3.797 1.00 0.00 H new ATOM 0 HG23 THR A 82 9.206 10.947 2.894 1.00 0.00 H new ATOM 1397 N ARG A 87 9.968 5.451 7.865 1.00 0.00 N ATOM 1398 CA ARG A 87 9.466 4.580 6.831 1.00 0.00 C ATOM 1399 C ARG A 87 9.174 5.418 5.610 1.00 0.00 C ATOM 1400 O ARG A 87 8.726 6.572 5.735 1.00 0.00 O ATOM 1401 CB ARG A 87 8.150 3.875 7.207 1.00 0.00 C ATOM 1402 CG ARG A 87 8.067 3.197 8.563 1.00 0.00 C ATOM 1403 CD ARG A 87 6.759 2.423 8.645 1.00 0.00 C ATOM 1404 NE ARG A 87 6.383 2.019 10.006 1.00 0.00 N ATOM 1405 CZ ARG A 87 5.714 0.893 10.317 1.00 0.00 C ATOM 1406 NH1 ARG A 87 5.639 -0.113 9.438 1.00 0.00 N ATOM 1407 NH2 ARG A 87 5.167 0.760 11.526 1.00 0.00 N ATOM 0 HA ARG A 87 10.227 3.818 6.665 1.00 0.00 H new ATOM 0 HB2 ARG A 87 7.349 4.612 7.153 1.00 0.00 H new ATOM 0 HB3 ARG A 87 7.944 3.124 6.445 1.00 0.00 H new ATOM 0 HG2 ARG A 87 8.913 2.524 8.701 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.117 3.939 9.360 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.961 3.035 8.226 1.00 0.00 H new ATOM 0 HD3 ARG A 87 6.837 1.532 8.022 1.00 0.00 H new ATOM 0 HE ARG A 87 6.648 2.637 10.772 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.090 -0.029 8.527 1.00 0.00 H new ATOM 0 HH12 ARG A 87 5.131 -0.964 9.679 1.00 0.00 H new ATOM 0 HH21 ARG A 87 5.256 1.510 12.211 1.00 0.00 H new ATOM 0 HH22 ARG A 87 4.659 -0.092 11.765 1.00 0.00 H new ATOM 1421 N GLY A 88 9.418 4.864 4.465 1.00 0.00 N ATOM 1422 CA GLY A 88 9.065 5.504 3.245 1.00 0.00 C ATOM 1423 C GLY A 88 7.677 5.074 2.876 1.00 0.00 C ATOM 1424 O GLY A 88 7.406 3.875 2.767 1.00 0.00 O ATOM 0 H GLY A 88 9.868 3.955 4.353 1.00 0.00 H new ATOM 0 HA2 GLY A 88 9.110 6.587 3.357 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.769 5.235 2.457 1.00 0.00 H new ATOM 1428 N LEU A 89 6.793 6.003 2.741 1.00 0.00 N ATOM 1429 CA LEU A 89 5.429 5.680 2.440 1.00 0.00 C ATOM 1430 C LEU A 89 5.178 5.911 0.981 1.00 0.00 C ATOM 1431 O LEU A 89 5.130 7.049 0.523 1.00 0.00 O ATOM 1432 CB LEU A 89 4.470 6.498 3.310 1.00 0.00 C ATOM 1433 CG LEU A 89 4.566 6.254 4.827 1.00 0.00 C ATOM 1434 CD1 LEU A 89 3.571 7.120 5.568 1.00 0.00 C ATOM 1435 CD2 LEU A 89 4.336 4.786 5.161 1.00 0.00 C ATOM 0 H LEU A 89 6.986 7.000 2.834 1.00 0.00 H new ATOM 0 HA LEU A 89 5.248 4.629 2.665 1.00 0.00 H new ATOM 0 HB2 LEU A 89 4.650 7.556 3.119 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.450 6.286 2.991 1.00 0.00 H new ATOM 0 HG LEU A 89 5.573 6.523 5.146 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.653 6.934 6.639 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.781 8.170 5.365 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.561 6.881 5.235 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.410 4.642 6.239 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.344 4.487 4.822 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.089 4.177 4.662 1.00 0.00 H new ATOM 1447 N ALA A 90 5.048 4.839 0.248 1.00 0.00 N ATOM 1448 CA ALA A 90 4.884 4.915 -1.173 1.00 0.00 C ATOM 1449 C ALA A 90 4.149 3.703 -1.684 1.00 0.00 C ATOM 1450 O ALA A 90 3.944 2.723 -0.956 1.00 0.00 O ATOM 1451 CB ALA A 90 6.247 5.015 -1.854 1.00 0.00 C ATOM 0 H ALA A 90 5.053 3.890 0.621 1.00 0.00 H new ATOM 0 HA ALA A 90 4.300 5.806 -1.406 1.00 0.00 H new ATOM 0 HB1 ALA A 90 6.111 5.072 -2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.763 5.910 -1.505 1.00 0.00 H new ATOM 0 HB3 ALA A 90 6.841 4.135 -1.609 1.00 0.00 H new ATOM 1457 N TYR A 91 3.724 3.787 -2.903 1.00 0.00 N ATOM 1458 CA TYR A 91 3.128 2.690 -3.592 1.00 0.00 C ATOM 1459 C TYR A 91 4.266 1.919 -4.225 1.00 0.00 C ATOM 1460 O TYR A 91 5.228 2.537 -4.708 1.00 0.00 O ATOM 1461 CB TYR A 91 2.258 3.168 -4.742 1.00 0.00 C ATOM 1462 CG TYR A 91 1.160 4.162 -4.456 1.00 0.00 C ATOM 1463 CD1 TYR A 91 0.128 3.888 -3.576 1.00 0.00 C ATOM 1464 CD2 TYR A 91 1.124 5.363 -5.149 1.00 0.00 C ATOM 1465 CE1 TYR A 91 -0.907 4.790 -3.403 1.00 0.00 C ATOM 1466 CE2 TYR A 91 0.112 6.265 -4.966 1.00 0.00 C ATOM 1467 CZ TYR A 91 -0.903 5.976 -4.099 1.00 0.00 C ATOM 1468 OH TYR A 91 -1.950 6.847 -3.977 1.00 0.00 O ATOM 0 H TYR A 91 3.783 4.640 -3.459 1.00 0.00 H new ATOM 0 HA TYR A 91 2.525 2.110 -2.893 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.915 3.608 -5.492 1.00 0.00 H new ATOM 0 HB3 TYR A 91 1.799 2.290 -5.196 1.00 0.00 H new ATOM 0 HD1 TYR A 91 0.130 2.962 -3.020 1.00 0.00 H new ATOM 0 HD2 TYR A 91 1.914 5.591 -5.850 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -1.715 4.563 -2.724 1.00 0.00 H new ATOM 0 HE2 TYR A 91 0.116 7.201 -5.505 1.00 0.00 H new ATOM 0 HH TYR A 91 -1.844 7.373 -3.157 1.00 0.00 H new ATOM 1478 N ILE A 92 4.177 0.622 -4.244 1.00 0.00 N ATOM 1479 CA ILE A 92 5.204 -0.177 -4.865 1.00 0.00 C ATOM 1480 C ILE A 92 4.656 -0.763 -6.161 1.00 0.00 C ATOM 1481 O ILE A 92 3.601 -1.432 -6.164 1.00 0.00 O ATOM 1482 CB ILE A 92 5.685 -1.328 -3.925 1.00 0.00 C ATOM 1483 CG1 ILE A 92 6.197 -0.767 -2.576 1.00 0.00 C ATOM 1484 CG2 ILE A 92 6.765 -2.182 -4.596 1.00 0.00 C ATOM 1485 CD1 ILE A 92 7.373 0.177 -2.680 1.00 0.00 C ATOM 0 H ILE A 92 3.407 0.091 -3.838 1.00 0.00 H new ATOM 0 HA ILE A 92 6.064 0.461 -5.070 1.00 0.00 H new ATOM 0 HB ILE A 92 4.825 -1.968 -3.726 1.00 0.00 H new ATOM 0 HG12 ILE A 92 5.376 -0.247 -2.081 1.00 0.00 H new ATOM 0 HG13 ILE A 92 6.477 -1.603 -1.935 1.00 0.00 H new ATOM 0 HG21 ILE A 92 7.078 -2.974 -3.915 1.00 0.00 H new ATOM 0 HG22 ILE A 92 6.364 -2.625 -5.508 1.00 0.00 H new ATOM 0 HG23 ILE A 92 7.622 -1.556 -4.843 1.00 0.00 H new ATOM 0 HD11 ILE A 92 7.657 0.515 -1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 92 8.214 -0.340 -3.142 1.00 0.00 H new ATOM 0 HD13 ILE A 92 7.096 1.037 -3.290 1.00 0.00 H new ATOM 1497 N TYR A 93 5.327 -0.491 -7.246 1.00 0.00 N ATOM 1498 CA TYR A 93 4.951 -1.021 -8.531 1.00 0.00 C ATOM 1499 C TYR A 93 6.056 -1.939 -9.013 1.00 0.00 C ATOM 1500 O TYR A 93 7.222 -1.755 -8.662 1.00 0.00 O ATOM 1501 CB TYR A 93 4.736 0.094 -9.579 1.00 0.00 C ATOM 1502 CG TYR A 93 3.612 1.087 -9.324 1.00 0.00 C ATOM 1503 CD1 TYR A 93 3.684 2.014 -8.295 1.00 0.00 C ATOM 1504 CD2 TYR A 93 2.499 1.125 -10.152 1.00 0.00 C ATOM 1505 CE1 TYR A 93 2.679 2.937 -8.098 1.00 0.00 C ATOM 1506 CE2 TYR A 93 1.488 2.051 -9.953 1.00 0.00 C ATOM 1507 CZ TYR A 93 1.586 2.954 -8.919 1.00 0.00 C ATOM 1508 OH TYR A 93 0.577 3.889 -8.702 1.00 0.00 O ATOM 0 H TYR A 93 6.153 0.107 -7.266 1.00 0.00 H new ATOM 0 HA TYR A 93 4.009 -1.557 -8.416 1.00 0.00 H new ATOM 0 HB2 TYR A 93 5.666 0.654 -9.670 1.00 0.00 H new ATOM 0 HB3 TYR A 93 4.554 -0.381 -10.543 1.00 0.00 H new ATOM 0 HD1 TYR A 93 4.541 2.013 -7.638 1.00 0.00 H new ATOM 0 HD2 TYR A 93 2.420 0.420 -10.966 1.00 0.00 H new ATOM 0 HE1 TYR A 93 2.756 3.650 -7.291 1.00 0.00 H new ATOM 0 HE2 TYR A 93 0.628 2.064 -10.606 1.00 0.00 H new ATOM 0 HH TYR A 93 0.897 4.780 -8.956 1.00 0.00 H new ATOM 1518 N ALA A 94 5.691 -2.912 -9.779 1.00 0.00 N ATOM 1519 CA ALA A 94 6.614 -3.823 -10.373 1.00 0.00 C ATOM 1520 C ALA A 94 6.452 -3.729 -11.872 1.00 0.00 C ATOM 1521 O ALA A 94 5.499 -4.275 -12.438 1.00 0.00 O ATOM 1522 CB ALA A 94 6.341 -5.237 -9.891 1.00 0.00 C ATOM 0 H ALA A 94 4.717 -3.101 -10.016 1.00 0.00 H new ATOM 0 HA ALA A 94 7.636 -3.571 -10.090 1.00 0.00 H new ATOM 0 HB1 ALA A 94 7.052 -5.922 -10.352 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.447 -5.279 -8.807 1.00 0.00 H new ATOM 0 HB3 ALA A 94 5.327 -5.526 -10.168 1.00 0.00 H new ATOM 1528 N ASP A 95 7.354 -2.988 -12.486 1.00 0.00 N ATOM 1529 CA ASP A 95 7.372 -2.702 -13.923 1.00 0.00 C ATOM 1530 C ASP A 95 6.002 -2.344 -14.493 1.00 0.00 C ATOM 1531 O ASP A 95 5.444 -3.029 -15.355 1.00 0.00 O ATOM 1532 CB ASP A 95 8.177 -3.721 -14.792 1.00 0.00 C ATOM 1533 CG ASP A 95 7.624 -5.142 -14.878 1.00 0.00 C ATOM 1534 OD1 ASP A 95 7.985 -6.001 -14.040 1.00 0.00 O ATOM 1535 OD2 ASP A 95 6.909 -5.452 -15.859 1.00 0.00 O ATOM 0 H ASP A 95 8.127 -2.548 -11.986 1.00 0.00 H new ATOM 0 HA ASP A 95 7.961 -1.788 -13.999 1.00 0.00 H new ATOM 0 HB2 ASP A 95 8.248 -3.322 -15.804 1.00 0.00 H new ATOM 0 HB3 ASP A 95 9.192 -3.775 -14.399 1.00 0.00 H new ATOM 1540 N GLY A 96 5.424 -1.313 -13.931 1.00 0.00 N ATOM 1541 CA GLY A 96 4.148 -0.846 -14.383 1.00 0.00 C ATOM 1542 C GLY A 96 2.970 -1.447 -13.644 1.00 0.00 C ATOM 1543 O GLY A 96 1.887 -0.853 -13.620 1.00 0.00 O ATOM 0 H GLY A 96 5.823 -0.782 -13.157 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.113 0.238 -14.279 1.00 0.00 H new ATOM 0 HA3 GLY A 96 4.048 -1.068 -15.445 1.00 0.00 H new ATOM 1547 N LYS A 97 3.155 -2.604 -13.052 1.00 0.00 N ATOM 1548 CA LYS A 97 2.070 -3.294 -12.367 1.00 0.00 C ATOM 1549 C LYS A 97 2.091 -2.912 -10.911 1.00 0.00 C ATOM 1550 O LYS A 97 3.100 -3.079 -10.253 1.00 0.00 O ATOM 1551 CB LYS A 97 2.248 -4.810 -12.479 1.00 0.00 C ATOM 1552 CG LYS A 97 2.507 -5.311 -13.886 1.00 0.00 C ATOM 1553 CD LYS A 97 2.680 -6.817 -13.903 1.00 0.00 C ATOM 1554 CE LYS A 97 3.148 -7.302 -15.259 1.00 0.00 C ATOM 1555 NZ LYS A 97 4.498 -6.787 -15.587 1.00 0.00 N ATOM 0 H LYS A 97 4.049 -3.095 -13.027 1.00 0.00 H new ATOM 0 HA LYS A 97 1.123 -3.009 -12.826 1.00 0.00 H new ATOM 0 HB2 LYS A 97 3.078 -5.114 -11.840 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.353 -5.298 -12.092 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.678 -5.029 -14.535 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.401 -4.834 -14.287 1.00 0.00 H new ATOM 0 HD2 LYS A 97 3.401 -7.111 -13.141 1.00 0.00 H new ATOM 0 HD3 LYS A 97 1.735 -7.297 -13.649 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.161 -8.392 -15.272 1.00 0.00 H new ATOM 0 HE3 LYS A 97 2.440 -6.983 -16.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.926 -7.380 -16.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 4.422 -5.808 -15.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.095 -6.811 -14.736 1.00 0.00 H new ATOM 1569 N MET A 98 1.015 -2.403 -10.404 1.00 0.00 N ATOM 1570 CA MET A 98 0.983 -2.013 -9.016 1.00 0.00 C ATOM 1571 C MET A 98 0.786 -3.236 -8.100 1.00 0.00 C ATOM 1572 O MET A 98 -0.237 -3.935 -8.149 1.00 0.00 O ATOM 1573 CB MET A 98 -0.021 -0.882 -8.762 1.00 0.00 C ATOM 1574 CG MET A 98 -1.441 -1.247 -9.008 1.00 0.00 C ATOM 1575 SD MET A 98 -2.601 0.116 -8.751 1.00 0.00 S ATOM 1576 CE MET A 98 -2.152 1.201 -10.110 1.00 0.00 C ATOM 0 H MET A 98 0.149 -2.245 -10.918 1.00 0.00 H new ATOM 0 HA MET A 98 1.956 -1.595 -8.757 1.00 0.00 H new ATOM 0 HB2 MET A 98 0.081 -0.549 -7.729 1.00 0.00 H new ATOM 0 HB3 MET A 98 0.238 -0.035 -9.397 1.00 0.00 H new ATOM 0 HG2 MET A 98 -1.541 -1.609 -10.031 1.00 0.00 H new ATOM 0 HG3 MET A 98 -1.713 -2.072 -8.350 1.00 0.00 H new ATOM 0 HE1 MET A 98 -3.042 1.713 -10.476 1.00 0.00 H new ATOM 0 HE2 MET A 98 -1.426 1.937 -9.764 1.00 0.00 H new ATOM 0 HE3 MET A 98 -1.715 0.612 -10.916 1.00 0.00 H new ATOM 1586 N VAL A 99 1.795 -3.492 -7.276 1.00 0.00 N ATOM 1587 CA VAL A 99 1.834 -4.671 -6.398 1.00 0.00 C ATOM 1588 C VAL A 99 0.723 -4.600 -5.354 1.00 0.00 C ATOM 1589 O VAL A 99 0.154 -5.623 -4.955 1.00 0.00 O ATOM 1590 CB VAL A 99 3.221 -4.798 -5.688 1.00 0.00 C ATOM 1591 CG1 VAL A 99 3.297 -6.044 -4.808 1.00 0.00 C ATOM 1592 CG2 VAL A 99 4.350 -4.808 -6.711 1.00 0.00 C ATOM 0 H VAL A 99 2.615 -2.891 -7.192 1.00 0.00 H new ATOM 0 HA VAL A 99 1.681 -5.553 -7.020 1.00 0.00 H new ATOM 0 HB VAL A 99 3.334 -3.927 -5.042 1.00 0.00 H new ATOM 0 HG11 VAL A 99 4.277 -6.095 -4.333 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.524 -5.996 -4.041 1.00 0.00 H new ATOM 0 HG13 VAL A 99 3.145 -6.932 -5.421 1.00 0.00 H new ATOM 0 HG21 VAL A 99 5.307 -4.897 -6.196 1.00 0.00 H new ATOM 0 HG22 VAL A 99 4.221 -5.654 -7.387 1.00 0.00 H new ATOM 0 HG23 VAL A 99 4.331 -3.880 -7.283 1.00 0.00 H new ATOM 1602 N ASN A 100 0.385 -3.389 -4.968 1.00 0.00 N ATOM 1603 CA ASN A 100 -0.646 -3.156 -3.970 1.00 0.00 C ATOM 1604 C ASN A 100 -2.028 -3.607 -4.460 1.00 0.00 C ATOM 1605 O ASN A 100 -2.838 -4.079 -3.678 1.00 0.00 O ATOM 1606 CB ASN A 100 -0.622 -1.693 -3.443 1.00 0.00 C ATOM 1607 CG ASN A 100 -0.818 -0.606 -4.481 1.00 0.00 C ATOM 1608 OD1 ASN A 100 -0.517 -0.778 -5.657 1.00 0.00 O ATOM 1609 ND2 ASN A 100 -1.240 0.552 -4.031 1.00 0.00 N ATOM 0 H ASN A 100 0.813 -2.538 -5.333 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.418 -3.784 -3.109 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -1.399 -1.588 -2.686 1.00 0.00 H new ATOM 0 HB3 ASN A 100 0.333 -1.524 -2.945 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -1.326 1.345 -4.666 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -1.482 0.659 -3.046 1.00 0.00 H new ATOM 1616 N GLU A 101 -2.249 -3.516 -5.766 1.00 0.00 N ATOM 1617 CA GLU A 101 -3.470 -4.026 -6.411 1.00 0.00 C ATOM 1618 C GLU A 101 -3.526 -5.543 -6.239 1.00 0.00 C ATOM 1619 O GLU A 101 -4.510 -6.101 -5.748 1.00 0.00 O ATOM 1620 CB GLU A 101 -3.413 -3.690 -7.906 1.00 0.00 C ATOM 1621 CG GLU A 101 -4.463 -4.341 -8.789 1.00 0.00 C ATOM 1622 CD GLU A 101 -5.835 -3.735 -8.705 1.00 0.00 C ATOM 1623 OE1 GLU A 101 -6.566 -3.995 -7.749 1.00 0.00 O ATOM 1624 OE2 GLU A 101 -6.230 -3.019 -9.662 1.00 0.00 O ATOM 0 H GLU A 101 -1.590 -3.087 -6.416 1.00 0.00 H new ATOM 0 HA GLU A 101 -4.352 -3.572 -5.960 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.498 -2.609 -8.016 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.429 -3.972 -8.281 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -4.125 -4.293 -9.824 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -4.533 -5.396 -8.525 1.00 0.00 H new ATOM 1631 N ALA A 102 -2.424 -6.188 -6.608 1.00 0.00 N ATOM 1632 CA ALA A 102 -2.301 -7.644 -6.570 1.00 0.00 C ATOM 1633 C ALA A 102 -2.553 -8.200 -5.172 1.00 0.00 C ATOM 1634 O ALA A 102 -3.303 -9.166 -5.004 1.00 0.00 O ATOM 1635 CB ALA A 102 -0.929 -8.068 -7.078 1.00 0.00 C ATOM 0 H ALA A 102 -1.586 -5.714 -6.944 1.00 0.00 H new ATOM 0 HA ALA A 102 -3.067 -8.059 -7.225 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.849 -9.155 -7.045 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.799 -7.725 -8.105 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.156 -7.628 -6.448 1.00 0.00 H new ATOM 1641 N LEU A 103 -1.956 -7.569 -4.180 1.00 0.00 N ATOM 1642 CA LEU A 103 -2.110 -7.988 -2.790 1.00 0.00 C ATOM 1643 C LEU A 103 -3.561 -7.900 -2.331 1.00 0.00 C ATOM 1644 O LEU A 103 -4.062 -8.803 -1.653 1.00 0.00 O ATOM 1645 CB LEU A 103 -1.207 -7.176 -1.861 1.00 0.00 C ATOM 1646 CG LEU A 103 0.303 -7.334 -2.070 1.00 0.00 C ATOM 1647 CD1 LEU A 103 1.064 -6.438 -1.110 1.00 0.00 C ATOM 1648 CD2 LEU A 103 0.723 -8.782 -1.876 1.00 0.00 C ATOM 0 H LEU A 103 -1.353 -6.756 -4.307 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.805 -9.033 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.459 -6.122 -1.975 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.440 -7.450 -0.832 1.00 0.00 H new ATOM 0 HG LEU A 103 0.540 -7.039 -3.092 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.135 -6.561 -1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 103 0.787 -5.398 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.817 -6.711 -0.084 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.798 -8.873 -2.029 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.472 -9.101 -0.864 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.200 -9.412 -2.595 1.00 0.00 H new ATOM 1660 N VAL A 104 -4.239 -6.841 -2.724 1.00 0.00 N ATOM 1661 CA VAL A 104 -5.632 -6.655 -2.351 1.00 0.00 C ATOM 1662 C VAL A 104 -6.530 -7.657 -3.087 1.00 0.00 C ATOM 1663 O VAL A 104 -7.397 -8.287 -2.477 1.00 0.00 O ATOM 1664 CB VAL A 104 -6.118 -5.191 -2.594 1.00 0.00 C ATOM 1665 CG1 VAL A 104 -7.602 -5.048 -2.286 1.00 0.00 C ATOM 1666 CG2 VAL A 104 -5.323 -4.221 -1.728 1.00 0.00 C ATOM 0 H VAL A 104 -3.851 -6.095 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.706 -6.843 -1.280 1.00 0.00 H new ATOM 0 HB VAL A 104 -5.957 -4.956 -3.646 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.913 -4.019 -2.464 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -8.173 -5.716 -2.930 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.784 -5.307 -1.243 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.672 -3.204 -1.907 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.463 -4.473 -0.677 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.265 -4.291 -1.980 1.00 0.00 H new ATOM 1676 N ARG A 105 -6.277 -7.849 -4.374 1.00 0.00 N ATOM 1677 CA ARG A 105 -7.088 -8.756 -5.197 1.00 0.00 C ATOM 1678 C ARG A 105 -6.933 -10.219 -4.797 1.00 0.00 C ATOM 1679 O ARG A 105 -7.824 -11.023 -5.036 1.00 0.00 O ATOM 1680 CB ARG A 105 -6.813 -8.594 -6.697 1.00 0.00 C ATOM 1681 CG ARG A 105 -7.161 -7.228 -7.248 1.00 0.00 C ATOM 1682 CD ARG A 105 -7.142 -7.207 -8.770 1.00 0.00 C ATOM 1683 NE ARG A 105 -5.848 -7.611 -9.354 1.00 0.00 N ATOM 1684 CZ ARG A 105 -5.343 -7.125 -10.505 1.00 0.00 C ATOM 1685 NH1 ARG A 105 -5.982 -6.164 -11.174 1.00 0.00 N ATOM 1686 NH2 ARG A 105 -4.196 -7.586 -10.963 1.00 0.00 N ATOM 0 H ARG A 105 -5.517 -7.391 -4.878 1.00 0.00 H new ATOM 0 HA ARG A 105 -8.120 -8.463 -5.004 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -5.757 -8.791 -6.885 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -7.380 -9.349 -7.242 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -8.149 -6.935 -6.893 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -6.454 -6.492 -6.866 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -7.922 -7.871 -9.143 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -7.387 -6.202 -9.114 1.00 0.00 H new ATOM 0 HE ARG A 105 -5.297 -8.307 -8.851 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -6.861 -5.791 -10.815 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -5.592 -5.803 -12.044 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -3.694 -8.308 -10.447 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -3.811 -7.221 -11.834 1.00 0.00 H new ATOM 1700 N GLN A 106 -5.803 -10.569 -4.225 1.00 0.00 N ATOM 1701 CA GLN A 106 -5.583 -11.938 -3.777 1.00 0.00 C ATOM 1702 C GLN A 106 -5.957 -12.104 -2.313 1.00 0.00 C ATOM 1703 O GLN A 106 -5.934 -13.216 -1.776 1.00 0.00 O ATOM 1704 CB GLN A 106 -4.135 -12.373 -4.021 1.00 0.00 C ATOM 1705 CG GLN A 106 -3.767 -12.469 -5.492 1.00 0.00 C ATOM 1706 CD GLN A 106 -4.603 -13.501 -6.230 1.00 0.00 C ATOM 1707 OE1 GLN A 106 -5.021 -14.510 -5.665 1.00 0.00 O ATOM 1708 NE2 GLN A 106 -4.853 -13.262 -7.481 1.00 0.00 N ATOM 0 H GLN A 106 -5.023 -9.934 -4.057 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.233 -12.586 -4.365 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -3.465 -11.665 -3.533 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -3.972 -13.343 -3.550 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -3.900 -11.494 -5.962 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -2.712 -12.726 -5.584 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.492 -12.416 -7.921 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -5.411 -13.921 -8.024 1.00 0.00 H new ATOM 1717 N GLY A 107 -6.322 -11.001 -1.683 1.00 0.00 N ATOM 1718 CA GLY A 107 -6.681 -11.022 -0.287 1.00 0.00 C ATOM 1719 C GLY A 107 -5.505 -11.359 0.585 1.00 0.00 C ATOM 1720 O GLY A 107 -5.603 -12.161 1.492 1.00 0.00 O ATOM 0 H GLY A 107 -6.376 -10.082 -2.122 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.080 -10.049 0.001 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.474 -11.752 -0.126 1.00 0.00 H new ATOM 1724 N LEU A 108 -4.393 -10.758 0.293 1.00 0.00 N ATOM 1725 CA LEU A 108 -3.177 -11.002 1.039 1.00 0.00 C ATOM 1726 C LEU A 108 -2.783 -9.755 1.797 1.00 0.00 C ATOM 1727 O LEU A 108 -1.724 -9.679 2.388 1.00 0.00 O ATOM 1728 CB LEU A 108 -2.066 -11.425 0.085 1.00 0.00 C ATOM 1729 CG LEU A 108 -2.305 -12.727 -0.678 1.00 0.00 C ATOM 1730 CD1 LEU A 108 -1.233 -12.922 -1.717 1.00 0.00 C ATOM 1731 CD2 LEU A 108 -2.323 -13.913 0.273 1.00 0.00 C ATOM 0 H LEU A 108 -4.293 -10.084 -0.466 1.00 0.00 H new ATOM 0 HA LEU A 108 -3.345 -11.805 1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.910 -10.625 -0.639 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.142 -11.524 0.654 1.00 0.00 H new ATOM 0 HG LEU A 108 -3.275 -12.662 -1.170 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.413 -13.853 -2.255 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.250 -12.088 -2.419 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.259 -12.967 -1.231 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.495 -14.829 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -1.366 -13.979 0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -3.122 -13.782 1.003 1.00 0.00 H new ATOM 1743 N ALA A 109 -3.654 -8.790 1.775 1.00 0.00 N ATOM 1744 CA ALA A 109 -3.438 -7.541 2.431 1.00 0.00 C ATOM 1745 C ALA A 109 -4.766 -6.900 2.636 1.00 0.00 C ATOM 1746 O ALA A 109 -5.775 -7.391 2.115 1.00 0.00 O ATOM 1747 CB ALA A 109 -2.561 -6.636 1.584 1.00 0.00 C ATOM 0 H ALA A 109 -4.550 -8.853 1.291 1.00 0.00 H new ATOM 0 HA ALA A 109 -2.934 -7.705 3.383 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -2.408 -5.689 2.102 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.597 -7.117 1.416 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -3.047 -6.451 0.626 1.00 0.00 H new ATOM 1753 N LYS A 110 -4.782 -5.833 3.383 1.00 0.00 N ATOM 1754 CA LYS A 110 -5.965 -5.076 3.620 1.00 0.00 C ATOM 1755 C LYS A 110 -5.651 -3.706 3.120 1.00 0.00 C ATOM 1756 O LYS A 110 -4.473 -3.414 2.919 1.00 0.00 O ATOM 1757 CB LYS A 110 -6.280 -5.086 5.125 1.00 0.00 C ATOM 1758 CG LYS A 110 -6.460 -6.504 5.650 1.00 0.00 C ATOM 1759 CD LYS A 110 -6.735 -6.585 7.131 1.00 0.00 C ATOM 1760 CE LYS A 110 -6.998 -8.030 7.515 1.00 0.00 C ATOM 1761 NZ LYS A 110 -7.139 -8.219 8.959 1.00 0.00 N ATOM 0 H LYS A 110 -3.954 -5.463 3.850 1.00 0.00 H new ATOM 0 HA LYS A 110 -6.845 -5.477 3.118 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.473 -4.595 5.670 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -7.187 -4.510 5.312 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.282 -6.977 5.113 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -5.561 -7.079 5.427 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.885 -6.197 7.692 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -7.595 -5.966 7.387 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -7.906 -8.373 7.018 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.181 -8.652 7.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.147 -9.236 9.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -6.340 -7.766 9.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.030 -7.789 9.280 1.00 0.00 H new ATOM 1775 N VAL A 111 -6.624 -2.888 2.863 1.00 0.00 N ATOM 1776 CA VAL A 111 -6.311 -1.574 2.378 1.00 0.00 C ATOM 1777 C VAL A 111 -5.825 -0.715 3.539 1.00 0.00 C ATOM 1778 O VAL A 111 -6.212 -0.936 4.703 1.00 0.00 O ATOM 1779 CB VAL A 111 -7.513 -0.878 1.649 1.00 0.00 C ATOM 1780 CG1 VAL A 111 -8.583 -0.405 2.622 1.00 0.00 C ATOM 1781 CG2 VAL A 111 -7.041 0.262 0.748 1.00 0.00 C ATOM 0 H VAL A 111 -7.616 -3.095 2.976 1.00 0.00 H new ATOM 0 HA VAL A 111 -5.526 -1.682 1.629 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.972 -1.635 1.014 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.393 0.070 2.069 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -8.973 -1.258 3.177 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -8.150 0.313 3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.901 0.720 0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.524 1.010 1.349 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.361 -0.130 -0.008 1.00 0.00 H new ATOM 1791 N ALA A 112 -4.986 0.229 3.248 1.00 0.00 N ATOM 1792 CA ALA A 112 -4.552 1.144 4.253 1.00 0.00 C ATOM 1793 C ALA A 112 -5.562 2.246 4.277 1.00 0.00 C ATOM 1794 O ALA A 112 -5.888 2.825 3.246 1.00 0.00 O ATOM 1795 CB ALA A 112 -3.161 1.685 3.961 1.00 0.00 C ATOM 0 H ALA A 112 -4.588 0.385 2.322 1.00 0.00 H new ATOM 0 HA ALA A 112 -4.480 0.648 5.221 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -2.867 2.378 4.749 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -2.451 0.859 3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -3.167 2.206 3.004 1.00 0.00 H new ATOM 2139 N HIS B 134 -5.843 6.743 -5.521 1.00 0.00 N ATOM 2140 CA HIS B 134 -6.491 5.612 -6.151 1.00 0.00 C ATOM 2141 C HIS B 134 -6.902 4.545 -5.140 1.00 0.00 C ATOM 2142 O HIS B 134 -7.158 3.390 -5.509 1.00 0.00 O ATOM 2143 CB HIS B 134 -5.708 5.041 -7.379 1.00 0.00 C ATOM 2144 CG HIS B 134 -4.269 4.616 -7.183 1.00 0.00 C ATOM 2145 ND1 HIS B 134 -3.855 3.306 -7.278 1.00 0.00 N ATOM 2146 CD2 HIS B 134 -3.139 5.344 -7.018 1.00 0.00 C ATOM 2147 CE1 HIS B 134 -2.546 3.251 -7.179 1.00 0.00 C ATOM 2148 NE2 HIS B 134 -2.079 4.468 -7.026 1.00 0.00 N ATOM 0 HA HIS B 134 -7.417 5.998 -6.577 1.00 0.00 H new ATOM 0 HB2 HIS B 134 -6.260 4.179 -7.753 1.00 0.00 H new ATOM 0 HB3 HIS B 134 -5.727 5.796 -8.165 1.00 0.00 H new ATOM 0 HD2 HIS B 134 -3.081 6.416 -6.901 1.00 0.00 H new ATOM 0 HE1 HIS B 134 -1.951 2.351 -7.217 1.00 0.00 H new ATOM 0 HE2 HIS B 134 -1.096 4.721 -6.929 1.00 0.00 H new ATOM 2157 N GLU B 135 -7.030 4.969 -3.862 1.00 0.00 N ATOM 2158 CA GLU B 135 -7.514 4.103 -2.766 1.00 0.00 C ATOM 2159 C GLU B 135 -8.839 3.490 -3.144 1.00 0.00 C ATOM 2160 O GLU B 135 -9.004 2.290 -3.085 1.00 0.00 O ATOM 2161 CB GLU B 135 -7.738 4.907 -1.472 1.00 0.00 C ATOM 2162 CG GLU B 135 -8.307 4.054 -0.326 1.00 0.00 C ATOM 2163 CD GLU B 135 -8.863 4.867 0.817 1.00 0.00 C ATOM 2164 OE1 GLU B 135 -9.341 5.987 0.582 1.00 0.00 O ATOM 2165 OE2 GLU B 135 -8.902 4.364 1.970 1.00 0.00 O ATOM 0 H GLU B 135 -6.801 5.917 -3.564 1.00 0.00 H new ATOM 0 HA GLU B 135 -6.755 3.339 -2.601 1.00 0.00 H new ATOM 0 HB2 GLU B 135 -6.792 5.347 -1.155 1.00 0.00 H new ATOM 0 HB3 GLU B 135 -8.420 5.732 -1.677 1.00 0.00 H new ATOM 0 HG2 GLU B 135 -9.094 3.411 -0.720 1.00 0.00 H new ATOM 0 HG3 GLU B 135 -7.522 3.400 0.053 1.00 0.00 H new ATOM 2172 N GLN B 136 -9.749 4.353 -3.581 1.00 0.00 N ATOM 2173 CA GLN B 136 -11.123 4.002 -3.938 1.00 0.00 C ATOM 2174 C GLN B 136 -11.208 2.782 -4.872 1.00 0.00 C ATOM 2175 O GLN B 136 -12.077 1.935 -4.707 1.00 0.00 O ATOM 2176 CB GLN B 136 -11.819 5.225 -4.554 1.00 0.00 C ATOM 2177 CG GLN B 136 -11.951 6.403 -3.583 1.00 0.00 C ATOM 2178 CD GLN B 136 -12.545 7.649 -4.220 1.00 0.00 C ATOM 2179 OE1 GLN B 136 -13.759 7.832 -4.246 1.00 0.00 O ATOM 2180 NE2 GLN B 136 -11.704 8.538 -4.685 1.00 0.00 N ATOM 0 H GLN B 136 -9.548 5.346 -3.701 1.00 0.00 H new ATOM 0 HA GLN B 136 -11.639 3.711 -3.023 1.00 0.00 H new ATOM 0 HB2 GLN B 136 -11.260 5.548 -5.432 1.00 0.00 H new ATOM 0 HB3 GLN B 136 -12.812 4.934 -4.898 1.00 0.00 H new ATOM 0 HG2 GLN B 136 -12.575 6.102 -2.741 1.00 0.00 H new ATOM 0 HG3 GLN B 136 -10.967 6.644 -3.180 1.00 0.00 H new ATOM 0 HE21 GLN B 136 -10.701 8.358 -4.650 1.00 0.00 H new ATOM 0 HE22 GLN B 136 -12.052 9.411 -5.082 1.00 0.00 H new ATOM 2189 N LEU B 137 -10.280 2.675 -5.803 1.00 0.00 N ATOM 2190 CA LEU B 137 -10.269 1.564 -6.744 1.00 0.00 C ATOM 2191 C LEU B 137 -9.890 0.265 -6.037 1.00 0.00 C ATOM 2192 O LEU B 137 -10.601 -0.742 -6.132 1.00 0.00 O ATOM 2193 CB LEU B 137 -9.301 1.851 -7.895 1.00 0.00 C ATOM 2194 CG LEU B 137 -9.623 3.086 -8.746 1.00 0.00 C ATOM 2195 CD1 LEU B 137 -8.559 3.302 -9.804 1.00 0.00 C ATOM 2196 CD2 LEU B 137 -10.992 2.949 -9.398 1.00 0.00 C ATOM 0 H LEU B 137 -9.521 3.344 -5.931 1.00 0.00 H new ATOM 0 HA LEU B 137 -11.272 1.449 -7.155 1.00 0.00 H new ATOM 0 HB2 LEU B 137 -8.299 1.969 -7.481 1.00 0.00 H new ATOM 0 HB3 LEU B 137 -9.275 0.979 -8.549 1.00 0.00 H new ATOM 0 HG LEU B 137 -9.638 3.954 -8.087 1.00 0.00 H new ATOM 0 HD11 LEU B 137 -8.808 4.183 -10.396 1.00 0.00 H new ATOM 0 HD12 LEU B 137 -7.592 3.449 -9.323 1.00 0.00 H new ATOM 0 HD13 LEU B 137 -8.511 2.429 -10.455 1.00 0.00 H new ATOM 0 HD21 LEU B 137 -11.200 3.836 -9.997 1.00 0.00 H new ATOM 0 HD22 LEU B 137 -11.003 2.067 -10.039 1.00 0.00 H new ATOM 0 HD23 LEU B 137 -11.754 2.846 -8.626 1.00 0.00 H new ATOM 2208 N LEU B 138 -8.803 0.311 -5.289 1.00 0.00 N ATOM 2209 CA LEU B 138 -8.305 -0.854 -4.596 1.00 0.00 C ATOM 2210 C LEU B 138 -9.228 -1.257 -3.455 1.00 0.00 C ATOM 2211 O LEU B 138 -9.529 -2.427 -3.257 1.00 0.00 O ATOM 2212 CB LEU B 138 -6.921 -0.583 -4.047 1.00 0.00 C ATOM 2213 CG LEU B 138 -5.853 -0.164 -5.057 1.00 0.00 C ATOM 2214 CD1 LEU B 138 -4.515 -0.260 -4.420 1.00 0.00 C ATOM 2215 CD2 LEU B 138 -5.895 -1.009 -6.313 1.00 0.00 C ATOM 0 H LEU B 138 -8.246 1.154 -5.148 1.00 0.00 H new ATOM 0 HA LEU B 138 -8.263 -1.673 -5.314 1.00 0.00 H new ATOM 0 HB2 LEU B 138 -7.001 0.199 -3.292 1.00 0.00 H new ATOM 0 HB3 LEU B 138 -6.574 -1.483 -3.538 1.00 0.00 H new ATOM 0 HG LEU B 138 -6.053 0.865 -5.356 1.00 0.00 H new ATOM 0 HD11 LEU B 138 -3.749 0.038 -5.136 1.00 0.00 H new ATOM 0 HD12 LEU B 138 -4.477 0.399 -3.553 1.00 0.00 H new ATOM 0 HD13 LEU B 138 -4.336 -1.287 -4.103 1.00 0.00 H new ATOM 0 HD21 LEU B 138 -5.119 -0.676 -7.002 1.00 0.00 H new ATOM 0 HD22 LEU B 138 -5.726 -2.054 -6.054 1.00 0.00 H new ATOM 0 HD23 LEU B 138 -6.871 -0.906 -6.788 1.00 0.00 H new ATOM 2227 N ARG B 139 -9.710 -0.268 -2.744 1.00 0.00 N ATOM 2228 CA ARG B 139 -10.533 -0.466 -1.572 1.00 0.00 C ATOM 2229 C ARG B 139 -11.894 -1.068 -1.911 1.00 0.00 C ATOM 2230 O ARG B 139 -12.451 -1.840 -1.132 1.00 0.00 O ATOM 2231 CB ARG B 139 -10.651 0.840 -0.795 1.00 0.00 C ATOM 2232 CG ARG B 139 -11.411 0.741 0.502 1.00 0.00 C ATOM 2233 CD ARG B 139 -11.208 1.986 1.332 1.00 0.00 C ATOM 2234 NE ARG B 139 -11.993 1.951 2.554 1.00 0.00 N ATOM 2235 CZ ARG B 139 -11.799 2.717 3.619 1.00 0.00 C ATOM 2236 NH1 ARG B 139 -10.731 3.533 3.697 1.00 0.00 N ATOM 2237 NH2 ARG B 139 -12.678 2.664 4.622 1.00 0.00 N ATOM 0 H ARG B 139 -9.540 0.713 -2.965 1.00 0.00 H new ATOM 0 HA ARG B 139 -10.043 -1.200 -0.932 1.00 0.00 H new ATOM 0 HB2 ARG B 139 -9.648 1.212 -0.584 1.00 0.00 H new ATOM 0 HB3 ARG B 139 -11.139 1.580 -1.429 1.00 0.00 H new ATOM 0 HG2 ARG B 139 -12.473 0.602 0.298 1.00 0.00 H new ATOM 0 HG3 ARG B 139 -11.077 -0.133 1.060 1.00 0.00 H new ATOM 0 HD2 ARG B 139 -10.152 2.089 1.581 1.00 0.00 H new ATOM 0 HD3 ARG B 139 -11.485 2.863 0.747 1.00 0.00 H new ATOM 0 HE ARG B 139 -12.759 1.279 2.596 1.00 0.00 H new ATOM 0 HH11 ARG B 139 -10.059 3.568 2.931 1.00 0.00 H new ATOM 0 HH12 ARG B 139 -10.594 4.117 4.522 1.00 0.00 H new ATOM 0 HH21 ARG B 139 -13.484 2.041 4.562 1.00 0.00 H new ATOM 0 HH22 ARG B 139 -12.544 3.246 5.449 1.00 0.00 H new ATOM 2251 N LYS B 140 -12.422 -0.758 -3.067 1.00 0.00 N ATOM 2252 CA LYS B 140 -13.662 -1.356 -3.463 1.00 0.00 C ATOM 2253 C LYS B 140 -13.448 -2.776 -3.976 1.00 0.00 C ATOM 2254 O LYS B 140 -14.344 -3.620 -3.905 1.00 0.00 O ATOM 2255 CB LYS B 140 -14.437 -0.465 -4.414 1.00 0.00 C ATOM 2256 CG LYS B 140 -14.926 0.797 -3.719 1.00 0.00 C ATOM 2257 CD LYS B 140 -15.793 1.663 -4.601 1.00 0.00 C ATOM 2258 CE LYS B 140 -16.268 2.883 -3.828 1.00 0.00 C ATOM 2259 NZ LYS B 140 -17.196 3.715 -4.608 1.00 0.00 N ATOM 0 H LYS B 140 -12.018 -0.105 -3.738 1.00 0.00 H new ATOM 0 HA LYS B 140 -14.297 -1.451 -2.582 1.00 0.00 H new ATOM 0 HB2 LYS B 140 -13.804 -0.195 -5.259 1.00 0.00 H new ATOM 0 HB3 LYS B 140 -15.289 -1.014 -4.816 1.00 0.00 H new ATOM 0 HG2 LYS B 140 -15.489 0.519 -2.828 1.00 0.00 H new ATOM 0 HG3 LYS B 140 -14.066 1.377 -3.384 1.00 0.00 H new ATOM 0 HD2 LYS B 140 -15.232 1.976 -5.481 1.00 0.00 H new ATOM 0 HD3 LYS B 140 -16.650 1.091 -4.956 1.00 0.00 H new ATOM 0 HE2 LYS B 140 -16.758 2.560 -2.910 1.00 0.00 H new ATOM 0 HE3 LYS B 140 -15.406 3.482 -3.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 140 -17.491 4.534 -4.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 140 -16.722 4.047 -5.472 1.00 0.00 H new ATOM 0 HZ3 LYS B 140 -18.032 3.153 -4.866 1.00 0.00 H new ATOM 2273 N SER B 141 -12.243 -3.052 -4.448 1.00 0.00 N ATOM 2274 CA SER B 141 -11.862 -4.394 -4.781 1.00 0.00 C ATOM 2275 C SER B 141 -11.751 -5.202 -3.477 1.00 0.00 C ATOM 2276 O SER B 141 -12.149 -6.373 -3.422 1.00 0.00 O ATOM 2277 CB SER B 141 -10.546 -4.388 -5.558 1.00 0.00 C ATOM 2278 OG SER B 141 -10.674 -3.613 -6.745 1.00 0.00 O ATOM 0 H SER B 141 -11.517 -2.353 -4.606 1.00 0.00 H new ATOM 0 HA SER B 141 -12.611 -4.859 -5.422 1.00 0.00 H new ATOM 0 HB2 SER B 141 -9.750 -3.981 -4.934 1.00 0.00 H new ATOM 0 HB3 SER B 141 -10.261 -5.409 -5.812 1.00 0.00 H new ATOM 0 HG SER B 141 -10.633 -2.660 -6.520 1.00 0.00 H new ATOM 2284 N GLU B 142 -11.253 -4.531 -2.421 1.00 0.00 N ATOM 2285 CA GLU B 142 -11.174 -5.101 -1.080 1.00 0.00 C ATOM 2286 C GLU B 142 -12.543 -5.549 -0.617 1.00 0.00 C ATOM 2287 O GLU B 142 -12.695 -6.658 -0.174 1.00 0.00 O ATOM 2288 CB GLU B 142 -10.611 -4.092 -0.064 1.00 0.00 C ATOM 2289 CG GLU B 142 -10.679 -4.574 1.364 1.00 0.00 C ATOM 2290 CD GLU B 142 -10.406 -3.508 2.387 1.00 0.00 C ATOM 2291 OE1 GLU B 142 -11.332 -2.728 2.673 1.00 0.00 O ATOM 2292 OE2 GLU B 142 -9.323 -3.484 2.981 1.00 0.00 O ATOM 0 H GLU B 142 -10.896 -3.578 -2.483 1.00 0.00 H new ATOM 0 HA GLU B 142 -10.499 -5.955 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU B 142 -9.573 -3.875 -0.317 1.00 0.00 H new ATOM 0 HB3 GLU B 142 -11.163 -3.156 -0.150 1.00 0.00 H new ATOM 0 HG2 GLU B 142 -11.668 -4.993 1.548 1.00 0.00 H new ATOM 0 HG3 GLU B 142 -9.960 -5.383 1.497 1.00 0.00 H new ATOM 2299 N ALA B 143 -13.534 -4.666 -0.755 1.00 0.00 N ATOM 2300 CA ALA B 143 -14.918 -4.937 -0.327 1.00 0.00 C ATOM 2301 C ALA B 143 -15.425 -6.268 -0.880 1.00 0.00 C ATOM 2302 O ALA B 143 -16.005 -7.104 -0.145 1.00 0.00 O ATOM 2303 CB ALA B 143 -15.836 -3.796 -0.748 1.00 0.00 C ATOM 0 H ALA B 143 -13.405 -3.741 -1.166 1.00 0.00 H new ATOM 0 HA ALA B 143 -14.924 -5.009 0.761 1.00 0.00 H new ATOM 0 HB1 ALA B 143 -16.855 -4.011 -0.425 1.00 0.00 H new ATOM 0 HB2 ALA B 143 -15.497 -2.868 -0.288 1.00 0.00 H new ATOM 0 HB3 ALA B 143 -15.814 -3.692 -1.833 1.00 0.00 H new ATOM 2309 N GLN B 144 -15.170 -6.480 -2.150 1.00 0.00 N ATOM 2310 CA GLN B 144 -15.553 -7.704 -2.805 1.00 0.00 C ATOM 2311 C GLN B 144 -14.739 -8.870 -2.232 1.00 0.00 C ATOM 2312 O GLN B 144 -15.299 -9.879 -1.820 1.00 0.00 O ATOM 2313 CB GLN B 144 -15.310 -7.576 -4.304 1.00 0.00 C ATOM 2314 CG GLN B 144 -15.771 -8.765 -5.116 1.00 0.00 C ATOM 2315 CD GLN B 144 -15.491 -8.582 -6.581 1.00 0.00 C ATOM 2316 OE1 GLN B 144 -16.310 -8.036 -7.318 1.00 0.00 O ATOM 2317 NE2 GLN B 144 -14.350 -9.038 -7.027 1.00 0.00 N ATOM 0 H GLN B 144 -14.693 -5.811 -2.754 1.00 0.00 H new ATOM 0 HA GLN B 144 -16.612 -7.896 -2.633 1.00 0.00 H new ATOM 0 HB2 GLN B 144 -15.820 -6.684 -4.667 1.00 0.00 H new ATOM 0 HB3 GLN B 144 -14.244 -7.426 -4.475 1.00 0.00 H new ATOM 0 HG2 GLN B 144 -15.270 -9.665 -4.760 1.00 0.00 H new ATOM 0 HG3 GLN B 144 -16.840 -8.915 -4.966 1.00 0.00 H new ATOM 0 HE21 GLN B 144 -13.694 -9.486 -6.387 1.00 0.00 H new ATOM 0 HE22 GLN B 144 -14.115 -8.946 -8.015 1.00 0.00 H new ATOM 2326 N ALA B 145 -13.428 -8.669 -2.135 1.00 0.00 N ATOM 2327 CA ALA B 145 -12.489 -9.680 -1.647 1.00 0.00 C ATOM 2328 C ALA B 145 -12.803 -10.116 -0.213 1.00 0.00 C ATOM 2329 O ALA B 145 -12.585 -11.282 0.139 1.00 0.00 O ATOM 2330 CB ALA B 145 -11.055 -9.179 -1.765 1.00 0.00 C ATOM 0 H ALA B 145 -12.980 -7.790 -2.395 1.00 0.00 H new ATOM 0 HA ALA B 145 -12.602 -10.562 -2.278 1.00 0.00 H new ATOM 0 HB1 ALA B 145 -10.371 -9.944 -1.397 1.00 0.00 H new ATOM 0 HB2 ALA B 145 -10.830 -8.962 -2.809 1.00 0.00 H new ATOM 0 HB3 ALA B 145 -10.937 -8.272 -1.173 1.00 0.00 H new ATOM 2336 N LYS B 146 -13.300 -9.174 0.609 1.00 0.00 N ATOM 2337 CA LYS B 146 -13.733 -9.464 1.979 1.00 0.00 C ATOM 2338 C LYS B 146 -14.756 -10.574 1.954 1.00 0.00 C ATOM 2339 O LYS B 146 -14.626 -11.579 2.652 1.00 0.00 O ATOM 2340 CB LYS B 146 -14.422 -8.263 2.623 1.00 0.00 C ATOM 2341 CG LYS B 146 -13.670 -6.960 2.635 1.00 0.00 C ATOM 2342 CD LYS B 146 -14.559 -5.892 3.231 1.00 0.00 C ATOM 2343 CE LYS B 146 -13.891 -4.552 3.240 1.00 0.00 C ATOM 2344 NZ LYS B 146 -12.833 -4.442 4.258 1.00 0.00 N ATOM 0 H LYS B 146 -13.411 -8.196 0.340 1.00 0.00 H new ATOM 0 HA LYS B 146 -12.841 -9.731 2.546 1.00 0.00 H new ATOM 0 HB2 LYS B 146 -15.369 -8.101 2.108 1.00 0.00 H new ATOM 0 HB3 LYS B 146 -14.661 -8.524 3.654 1.00 0.00 H new ATOM 0 HG2 LYS B 146 -12.754 -7.058 3.218 1.00 0.00 H new ATOM 0 HG3 LYS B 146 -13.375 -6.685 1.622 1.00 0.00 H new ATOM 0 HD2 LYS B 146 -15.486 -5.832 2.661 1.00 0.00 H new ATOM 0 HD3 LYS B 146 -14.828 -6.170 4.250 1.00 0.00 H new ATOM 0 HE2 LYS B 146 -13.462 -4.360 2.256 1.00 0.00 H new ATOM 0 HE3 LYS B 146 -14.640 -3.780 3.418 1.00 0.00 H new ATOM 0 HZ1 LYS B 146 -12.254 -3.600 4.067 1.00 0.00 H new ATOM 0 HZ2 LYS B 146 -13.265 -4.359 5.200 1.00 0.00 H new ATOM 0 HZ3 LYS B 146 -12.232 -5.290 4.227 1.00 0.00 H new ATOM 2358 N LYS B 147 -15.768 -10.393 1.117 1.00 0.00 N ATOM 2359 CA LYS B 147 -16.851 -11.359 1.009 1.00 0.00 C ATOM 2360 C LYS B 147 -16.415 -12.634 0.321 1.00 0.00 C ATOM 2361 O LYS B 147 -16.972 -13.705 0.564 1.00 0.00 O ATOM 2362 CB LYS B 147 -18.049 -10.756 0.317 1.00 0.00 C ATOM 2363 CG LYS B 147 -18.683 -9.657 1.121 1.00 0.00 C ATOM 2364 CD LYS B 147 -19.901 -9.126 0.439 1.00 0.00 C ATOM 2365 CE LYS B 147 -20.532 -8.031 1.264 1.00 0.00 C ATOM 2366 NZ LYS B 147 -21.732 -7.473 0.622 1.00 0.00 N ATOM 0 H LYS B 147 -15.861 -9.585 0.502 1.00 0.00 H new ATOM 0 HA LYS B 147 -17.140 -11.626 2.025 1.00 0.00 H new ATOM 0 HB2 LYS B 147 -17.745 -10.363 -0.653 1.00 0.00 H new ATOM 0 HB3 LYS B 147 -18.787 -11.536 0.128 1.00 0.00 H new ATOM 0 HG2 LYS B 147 -18.950 -10.032 2.109 1.00 0.00 H new ATOM 0 HG3 LYS B 147 -17.965 -8.850 1.270 1.00 0.00 H new ATOM 0 HD2 LYS B 147 -19.635 -8.741 -0.545 1.00 0.00 H new ATOM 0 HD3 LYS B 147 -20.618 -9.932 0.283 1.00 0.00 H new ATOM 0 HE2 LYS B 147 -20.797 -8.425 2.245 1.00 0.00 H new ATOM 0 HE3 LYS B 147 -19.805 -7.235 1.425 1.00 0.00 H new ATOM 0 HZ1 LYS B 147 -22.132 -6.725 1.224 1.00 0.00 H new ATOM 0 HZ2 LYS B 147 -21.477 -7.073 -0.304 1.00 0.00 H new ATOM 0 HZ3 LYS B 147 -22.438 -8.226 0.491 1.00 0.00 H new ATOM 2380 N GLU B 148 -15.427 -12.520 -0.530 1.00 0.00 N ATOM 2381 CA GLU B 148 -14.857 -13.665 -1.214 1.00 0.00 C ATOM 2382 C GLU B 148 -14.016 -14.490 -0.238 1.00 0.00 C ATOM 2383 O GLU B 148 -13.686 -15.648 -0.515 1.00 0.00 O ATOM 2384 CB GLU B 148 -13.985 -13.190 -2.377 1.00 0.00 C ATOM 2385 CG GLU B 148 -14.729 -12.411 -3.445 1.00 0.00 C ATOM 2386 CD GLU B 148 -15.735 -13.242 -4.180 1.00 0.00 C ATOM 2387 OE1 GLU B 148 -16.881 -13.406 -3.695 1.00 0.00 O ATOM 2388 OE2 GLU B 148 -15.399 -13.756 -5.259 1.00 0.00 O ATOM 0 H GLU B 148 -14.990 -11.631 -0.772 1.00 0.00 H new ATOM 0 HA GLU B 148 -15.664 -14.287 -1.601 1.00 0.00 H new ATOM 0 HB2 GLU B 148 -13.184 -12.566 -1.982 1.00 0.00 H new ATOM 0 HB3 GLU B 148 -13.515 -14.058 -2.840 1.00 0.00 H new ATOM 0 HG2 GLU B 148 -15.234 -11.563 -2.983 1.00 0.00 H new ATOM 0 HG3 GLU B 148 -14.011 -12.005 -4.157 1.00 0.00 H new ATOM 2395 N LYS B 149 -13.686 -13.861 0.899 1.00 0.00 N ATOM 2396 CA LYS B 149 -12.878 -14.428 1.959 1.00 0.00 C ATOM 2397 C LYS B 149 -11.587 -14.977 1.413 1.00 0.00 C ATOM 2398 O LYS B 149 -11.263 -16.157 1.563 1.00 0.00 O ATOM 2399 CB LYS B 149 -13.647 -15.454 2.802 1.00 0.00 C ATOM 2400 CG LYS B 149 -14.917 -14.868 3.426 1.00 0.00 C ATOM 2401 CD LYS B 149 -15.644 -15.846 4.338 1.00 0.00 C ATOM 2402 CE LYS B 149 -14.763 -16.295 5.491 1.00 0.00 C ATOM 2403 NZ LYS B 149 -15.510 -17.100 6.488 1.00 0.00 N ATOM 0 H LYS B 149 -13.992 -12.909 1.102 1.00 0.00 H new ATOM 0 HA LYS B 149 -12.624 -13.620 2.645 1.00 0.00 H new ATOM 0 HB2 LYS B 149 -13.913 -16.306 2.177 1.00 0.00 H new ATOM 0 HB3 LYS B 149 -12.998 -15.829 3.593 1.00 0.00 H new ATOM 0 HG2 LYS B 149 -14.656 -13.976 3.995 1.00 0.00 H new ATOM 0 HG3 LYS B 149 -15.592 -14.552 2.631 1.00 0.00 H new ATOM 0 HD2 LYS B 149 -16.546 -15.377 4.730 1.00 0.00 H new ATOM 0 HD3 LYS B 149 -15.961 -16.715 3.762 1.00 0.00 H new ATOM 0 HE2 LYS B 149 -13.931 -16.882 5.103 1.00 0.00 H new ATOM 0 HE3 LYS B 149 -14.335 -15.420 5.980 1.00 0.00 H new ATOM 0 HZ1 LYS B 149 -14.843 -17.683 7.033 1.00 0.00 H new ATOM 0 HZ2 LYS B 149 -16.022 -16.465 7.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 149 -16.189 -17.717 5.998 1.00 0.00 H new ATOM 2417 N LEU B 150 -10.877 -14.120 0.740 1.00 0.00 N ATOM 2418 CA LEU B 150 -9.635 -14.477 0.128 1.00 0.00 C ATOM 2419 C LEU B 150 -8.530 -14.324 1.129 1.00 0.00 C ATOM 2420 O LEU B 150 -8.298 -13.228 1.621 1.00 0.00 O ATOM 2421 CB LEU B 150 -9.371 -13.612 -1.109 1.00 0.00 C ATOM 2422 CG LEU B 150 -10.396 -13.724 -2.241 1.00 0.00 C ATOM 2423 CD1 LEU B 150 -10.063 -12.759 -3.363 1.00 0.00 C ATOM 2424 CD2 LEU B 150 -10.459 -15.147 -2.776 1.00 0.00 C ATOM 0 H LEU B 150 -11.147 -13.146 0.600 1.00 0.00 H new ATOM 0 HA LEU B 150 -9.681 -15.516 -0.199 1.00 0.00 H new ATOM 0 HB2 LEU B 150 -9.320 -12.570 -0.794 1.00 0.00 H new ATOM 0 HB3 LEU B 150 -8.390 -13.873 -1.507 1.00 0.00 H new ATOM 0 HG LEU B 150 -11.373 -13.463 -1.835 1.00 0.00 H new ATOM 0 HD11 LEU B 150 -10.804 -12.855 -4.157 1.00 0.00 H new ATOM 0 HD12 LEU B 150 -10.072 -11.739 -2.980 1.00 0.00 H new ATOM 0 HD13 LEU B 150 -9.074 -12.989 -3.759 1.00 0.00 H new ATOM 0 HD21 LEU B 150 -11.194 -15.202 -3.579 1.00 0.00 H new ATOM 0 HD22 LEU B 150 -9.480 -15.435 -3.160 1.00 0.00 H new ATOM 0 HD23 LEU B 150 -10.748 -15.825 -1.973 1.00 0.00 H new ATOM 2436 N ASN B 151 -7.940 -15.453 1.480 1.00 0.00 N ATOM 2437 CA ASN B 151 -6.796 -15.591 2.399 1.00 0.00 C ATOM 2438 C ASN B 151 -6.948 -14.825 3.707 1.00 0.00 C ATOM 2439 O ASN B 151 -7.502 -15.352 4.676 1.00 0.00 O ATOM 2440 CB ASN B 151 -5.443 -15.286 1.733 1.00 0.00 C ATOM 2441 CG ASN B 151 -5.133 -16.190 0.558 1.00 0.00 C ATOM 2442 OD1 ASN B 151 -4.593 -17.287 0.719 1.00 0.00 O ATOM 2443 ND2 ASN B 151 -5.401 -15.721 -0.639 1.00 0.00 N ATOM 0 H ASN B 151 -8.254 -16.354 1.119 1.00 0.00 H new ATOM 0 HA ASN B 151 -6.801 -16.649 2.662 1.00 0.00 H new ATOM 0 HB2 ASN B 151 -5.438 -14.250 1.396 1.00 0.00 H new ATOM 0 HB3 ASN B 151 -4.651 -15.383 2.475 1.00 0.00 H new ATOM 0 HD21 ASN B 151 -5.162 -16.268 -1.466 1.00 0.00 H new ATOM 0 HD22 ASN B 151 -5.848 -14.810 -0.741 1.00 0.00 H new ATOM 2450 N ILE B 152 -6.542 -13.561 3.711 1.00 0.00 N ATOM 2451 CA ILE B 152 -6.543 -12.762 4.913 1.00 0.00 C ATOM 2452 C ILE B 152 -7.976 -12.403 5.310 1.00 0.00 C ATOM 2453 O ILE B 152 -8.272 -12.206 6.474 1.00 0.00 O ATOM 2454 CB ILE B 152 -5.651 -11.476 4.763 1.00 0.00 C ATOM 2455 CG1 ILE B 152 -5.201 -10.970 6.140 1.00 0.00 C ATOM 2456 CG2 ILE B 152 -6.398 -10.358 4.011 1.00 0.00 C ATOM 2457 CD1 ILE B 152 -4.210 -9.820 6.080 1.00 0.00 C ATOM 0 H ILE B 152 -6.206 -13.071 2.882 1.00 0.00 H new ATOM 0 HA ILE B 152 -6.102 -13.358 5.712 1.00 0.00 H new ATOM 0 HB ILE B 152 -4.773 -11.751 4.179 1.00 0.00 H new ATOM 0 HG12 ILE B 152 -6.078 -10.652 6.704 1.00 0.00 H new ATOM 0 HG13 ILE B 152 -4.751 -11.796 6.690 1.00 0.00 H new ATOM 0 HG21 ILE B 152 -5.753 -9.484 3.925 1.00 0.00 H new ATOM 0 HG22 ILE B 152 -6.670 -10.708 3.015 1.00 0.00 H new ATOM 0 HG23 ILE B 152 -7.301 -10.090 4.560 1.00 0.00 H new ATOM 0 HD11 ILE B 152 -3.940 -9.519 7.092 1.00 0.00 H new ATOM 0 HD12 ILE B 152 -3.315 -10.138 5.546 1.00 0.00 H new ATOM 0 HD13 ILE B 152 -4.663 -8.976 5.559 1.00 0.00 H new ATOM 2469 N TRP B 153 -8.876 -12.391 4.332 1.00 0.00 N ATOM 2470 CA TRP B 153 -10.276 -12.067 4.588 1.00 0.00 C ATOM 2471 C TRP B 153 -10.999 -13.270 5.134 1.00 0.00 C ATOM 2472 O TRP B 153 -12.131 -13.185 5.610 1.00 0.00 O ATOM 2473 CB TRP B 153 -10.969 -11.587 3.328 1.00 0.00 C ATOM 2474 CG TRP B 153 -10.289 -10.417 2.691 1.00 0.00 C ATOM 2475 CD1 TRP B 153 -9.778 -10.346 1.433 1.00 0.00 C ATOM 2476 CD2 TRP B 153 -10.022 -9.161 3.299 1.00 0.00 C ATOM 2477 NE1 TRP B 153 -9.220 -9.118 1.220 1.00 0.00 N ATOM 2478 CE2 TRP B 153 -9.354 -8.374 2.352 1.00 0.00 C ATOM 2479 CE3 TRP B 153 -10.287 -8.624 4.556 1.00 0.00 C ATOM 2480 CZ2 TRP B 153 -8.952 -7.091 2.619 1.00 0.00 C ATOM 2481 CZ3 TRP B 153 -9.888 -7.342 4.819 1.00 0.00 C ATOM 2482 CH2 TRP B 153 -9.228 -6.590 3.856 1.00 0.00 C ATOM 0 H TRP B 153 -8.662 -12.601 3.357 1.00 0.00 H new ATOM 0 HA TRP B 153 -10.301 -11.263 5.323 1.00 0.00 H new ATOM 0 HB2 TRP B 153 -11.015 -12.407 2.611 1.00 0.00 H new ATOM 0 HB3 TRP B 153 -11.997 -11.315 3.567 1.00 0.00 H new ATOM 0 HD1 TRP B 153 -9.809 -11.145 0.707 1.00 0.00 H new ATOM 0 HE1 TRP B 153 -8.776 -8.809 0.355 1.00 0.00 H new ATOM 0 HE3 TRP B 153 -10.797 -9.208 5.308 1.00 0.00 H new ATOM 0 HZ2 TRP B 153 -8.436 -6.500 1.877 1.00 0.00 H new ATOM 0 HZ3 TRP B 153 -10.089 -6.909 5.788 1.00 0.00 H new ATOM 0 HH2 TRP B 153 -8.925 -5.581 4.094 1.00 0.00 H new ATOM 2493 N SER B 154 -10.340 -14.390 5.077 1.00 0.00 N ATOM 2494 CA SER B 154 -10.892 -15.598 5.577 1.00 0.00 C ATOM 2495 C SER B 154 -10.574 -15.741 7.088 1.00 0.00 C ATOM 2496 O SER B 154 -10.766 -16.811 7.682 1.00 0.00 O ATOM 2497 CB SER B 154 -10.405 -16.794 4.728 1.00 0.00 C ATOM 2498 OG SER B 154 -11.064 -18.002 5.074 1.00 0.00 O ATOM 0 H SER B 154 -9.405 -14.484 4.681 1.00 0.00 H new ATOM 0 HA SER B 154 -11.978 -15.580 5.490 1.00 0.00 H new ATOM 0 HB2 SER B 154 -10.573 -16.580 3.672 1.00 0.00 H new ATOM 0 HB3 SER B 154 -9.330 -16.918 4.861 1.00 0.00 H new ATOM 0 HG SER B 154 -11.210 -18.029 6.043 1.00 0.00 H new ATOM 2504 N GLU B 155 -10.100 -14.636 7.715 1.00 0.00 N ATOM 2505 CA GLU B 155 -9.929 -14.610 9.163 1.00 0.00 C ATOM 2506 C GLU B 155 -11.305 -14.687 9.823 1.00 0.00 C ATOM 2507 O GLU B 155 -11.447 -15.246 10.898 1.00 0.00 O ATOM 2508 CB GLU B 155 -9.142 -13.372 9.653 1.00 0.00 C ATOM 2509 CG GLU B 155 -9.742 -12.017 9.284 1.00 0.00 C ATOM 2510 CD GLU B 155 -8.991 -10.856 9.908 1.00 0.00 C ATOM 2511 OE1 GLU B 155 -7.779 -10.700 9.674 1.00 0.00 O ATOM 2512 OE2 GLU B 155 -9.604 -10.046 10.630 1.00 0.00 O ATOM 0 H GLU B 155 -9.838 -13.773 7.239 1.00 0.00 H new ATOM 0 HA GLU B 155 -9.329 -15.473 9.451 1.00 0.00 H new ATOM 0 HB2 GLU B 155 -9.054 -13.426 10.738 1.00 0.00 H new ATOM 0 HB3 GLU B 155 -8.131 -13.423 9.248 1.00 0.00 H new ATOM 0 HG2 GLU B 155 -9.739 -11.906 8.200 1.00 0.00 H new ATOM 0 HG3 GLU B 155 -10.783 -11.986 9.605 1.00 0.00 H new ATOM 2519 N ASP B 156 -12.298 -14.126 9.127 1.00 0.00 N ATOM 2520 CA ASP B 156 -13.723 -14.196 9.484 1.00 0.00 C ATOM 2521 C ASP B 156 -14.031 -13.598 10.852 1.00 0.00 C ATOM 2522 O ASP B 156 -13.881 -14.284 11.891 1.00 0.00 O ATOM 2523 CB ASP B 156 -14.249 -15.624 9.370 1.00 0.00 C ATOM 2524 CG ASP B 156 -15.751 -15.705 9.501 1.00 0.00 C ATOM 2525 OD1 ASP B 156 -16.457 -15.432 8.491 1.00 0.00 O ATOM 2526 OD2 ASP B 156 -16.253 -16.103 10.557 1.00 0.00 O ATOM 2527 OXT ASP B 156 -14.434 -12.417 10.898 1.00 0.00 O ATOM 0 H ASP B 156 -12.130 -13.594 8.273 1.00 0.00 H new ATOM 0 HA ASP B 156 -14.251 -13.576 8.759 1.00 0.00 H new ATOM 0 HB2 ASP B 156 -13.949 -16.041 8.409 1.00 0.00 H new ATOM 0 HB3 ASP B 156 -13.788 -16.239 10.142 1.00 0.00 H new