USER MOD reduce.3.24.130724 H: found=0, std=0, add=675, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 676 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 19 ASN : amide:sc= -0.277 K(o=0.91,f=-0.16) USER MOD Set 1.2: A 56 SER OG : rot 64:sc= 1.19 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.0253 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -136:sc= 1.28 (180deg=0.288) USER MOD Single : A 20 THR OG1 : rot -11:sc= -3.07! USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 SER OG : rot -94:sc= 1.31 USER MOD Single : A 25 MET CE :methyl -110:sc= -0.0934 (180deg=-2.08) USER MOD Single : A 27 MET CE :methyl 144:sc= -0.249 (180deg=-1.07) USER MOD Single : A 28 THR OG1 : rot -140:sc= 0.695 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -133:sc= 0.168 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 1:sc= 0.707 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc=-0.00247 K(o=-0.0025,f=-0.61) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -1.36 K(o=-1.4,f=-4.3!) USER MOD Single : A 47 ASN : amide:sc= -0.0105 K(o=-0.01,f=-0.96) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 65 TYR OH : rot -82:sc= 0.304 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= 0.0719 X(o=0.072,f=-0.018) USER MOD Single : A 76 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0552) USER MOD Single : A 81 SER OG : rot 45:sc= 0.66 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.278 K(o=-0.28,f=-1.8) USER MOD Single : A 91 HIS : no HD1:sc= -0.442 X(o=-0.44,f=-0.044) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 111 N ASP A 8 -16.429 2.692 -11.372 1.00 0.00 N ATOM 112 CA ASP A 8 -15.623 2.534 -10.181 1.00 0.00 C ATOM 113 C ASP A 8 -14.323 1.816 -10.550 1.00 0.00 C ATOM 114 O ASP A 8 -14.249 0.587 -10.564 1.00 0.00 O ATOM 115 CB ASP A 8 -16.402 1.793 -9.077 1.00 0.00 C ATOM 116 CG ASP A 8 -17.014 0.476 -9.524 1.00 0.00 C ATOM 117 OD1 ASP A 8 -17.882 0.488 -10.426 1.00 0.00 O ATOM 118 OD2 ASP A 8 -16.653 -0.576 -8.958 1.00 0.00 O ATOM 0 HA ASP A 8 -15.374 3.515 -9.775 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.731 1.603 -8.239 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.196 2.443 -8.709 1.00 0.00 H new ATOM 123 N PRO A 9 -13.288 2.594 -10.903 1.00 0.00 N ATOM 124 CA PRO A 9 -12.030 2.071 -11.419 1.00 0.00 C ATOM 125 C PRO A 9 -11.045 1.675 -10.323 1.00 0.00 C ATOM 126 O PRO A 9 -11.209 2.024 -9.155 1.00 0.00 O ATOM 127 CB PRO A 9 -11.463 3.240 -12.239 1.00 0.00 C ATOM 128 CG PRO A 9 -12.334 4.431 -11.953 1.00 0.00 C ATOM 129 CD PRO A 9 -13.258 4.054 -10.827 1.00 0.00 C ATOM 0 HA PRO A 9 -12.190 1.157 -11.991 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.428 3.442 -11.961 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -11.467 3.004 -13.303 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -11.727 5.293 -11.678 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.904 4.711 -12.839 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -12.883 4.401 -9.864 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -14.250 4.486 -10.957 1.00 0.00 H new ATOM 137 N THR A 10 -10.018 0.940 -10.716 1.00 0.00 N ATOM 138 CA THR A 10 -8.990 0.497 -9.791 1.00 0.00 C ATOM 139 C THR A 10 -7.747 1.377 -9.911 1.00 0.00 C ATOM 140 O THR A 10 -7.338 1.741 -11.016 1.00 0.00 O ATOM 141 CB THR A 10 -8.623 -0.972 -10.071 1.00 0.00 C ATOM 142 OG1 THR A 10 -9.823 -1.754 -10.149 1.00 0.00 O ATOM 143 CG2 THR A 10 -7.715 -1.539 -8.989 1.00 0.00 C ATOM 0 H THR A 10 -9.874 0.636 -11.679 1.00 0.00 H new ATOM 0 HA THR A 10 -9.379 0.579 -8.776 1.00 0.00 H new ATOM 0 HB THR A 10 -8.083 -1.013 -11.017 1.00 0.00 H new ATOM 0 HG1 THR A 10 -9.593 -2.689 -10.329 1.00 0.00 H new ATOM 0 HG21 THR A 10 -7.477 -2.577 -9.221 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.794 -0.957 -8.945 1.00 0.00 H new ATOM 0 HG23 THR A 10 -8.222 -1.489 -8.025 1.00 0.00 H new ATOM 151 N LEU A 11 -7.167 1.738 -8.776 1.00 0.00 N ATOM 152 CA LEU A 11 -5.977 2.572 -8.762 1.00 0.00 C ATOM 153 C LEU A 11 -4.755 1.754 -8.375 1.00 0.00 C ATOM 154 O LEU A 11 -4.808 0.922 -7.468 1.00 0.00 O ATOM 155 CB LEU A 11 -6.148 3.743 -7.792 1.00 0.00 C ATOM 156 CG LEU A 11 -7.244 4.745 -8.162 1.00 0.00 C ATOM 157 CD1 LEU A 11 -7.364 5.821 -7.096 1.00 0.00 C ATOM 158 CD2 LEU A 11 -6.959 5.371 -9.519 1.00 0.00 C ATOM 0 H LEU A 11 -7.503 1.465 -7.852 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.832 2.968 -9.767 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.363 3.344 -6.801 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.200 4.276 -7.722 1.00 0.00 H new ATOM 0 HG LEU A 11 -8.192 4.210 -8.221 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.148 6.525 -7.376 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.614 5.360 -6.140 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -6.416 6.351 -7.006 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.749 6.081 -9.765 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -6.001 5.891 -9.486 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.922 4.591 -10.279 1.00 0.00 H new ATOM 170 N THR A 12 -3.659 1.992 -9.071 1.00 0.00 N ATOM 171 CA THR A 12 -2.413 1.301 -8.801 1.00 0.00 C ATOM 172 C THR A 12 -1.424 2.255 -8.142 1.00 0.00 C ATOM 173 O THR A 12 -0.987 3.231 -8.752 1.00 0.00 O ATOM 174 CB THR A 12 -1.806 0.730 -10.096 1.00 0.00 C ATOM 175 OG1 THR A 12 -2.801 -0.032 -10.795 1.00 0.00 O ATOM 176 CG2 THR A 12 -0.604 -0.153 -9.797 1.00 0.00 C ATOM 0 H THR A 12 -3.607 2.666 -9.835 1.00 0.00 H new ATOM 0 HA THR A 12 -2.622 0.471 -8.126 1.00 0.00 H new ATOM 0 HB THR A 12 -1.472 1.563 -10.715 1.00 0.00 H new ATOM 0 HG1 THR A 12 -2.416 -0.394 -11.620 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.197 -0.542 -10.730 1.00 0.00 H new ATOM 0 HG22 THR A 12 0.159 0.433 -9.284 1.00 0.00 H new ATOM 0 HG23 THR A 12 -0.912 -0.984 -9.162 1.00 0.00 H new ATOM 184 N LEU A 13 -1.088 1.976 -6.895 1.00 0.00 N ATOM 185 CA LEU A 13 -0.213 2.845 -6.124 1.00 0.00 C ATOM 186 C LEU A 13 1.035 2.086 -5.697 1.00 0.00 C ATOM 187 O LEU A 13 1.079 0.862 -5.769 1.00 0.00 O ATOM 188 CB LEU A 13 -0.944 3.377 -4.889 1.00 0.00 C ATOM 189 CG LEU A 13 -2.261 4.104 -5.170 1.00 0.00 C ATOM 190 CD1 LEU A 13 -2.910 4.553 -3.872 1.00 0.00 C ATOM 191 CD2 LEU A 13 -2.030 5.293 -6.087 1.00 0.00 C ATOM 0 H LEU A 13 -1.410 1.149 -6.391 1.00 0.00 H new ATOM 0 HA LEU A 13 0.079 3.687 -6.751 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -1.145 2.541 -4.219 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -0.278 4.058 -4.359 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.935 3.409 -5.671 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.845 5.068 -4.092 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.113 3.683 -3.247 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.238 5.230 -3.345 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.978 5.797 -6.275 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.337 5.988 -5.613 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -1.609 4.948 -7.031 1.00 0.00 H new ATOM 203 N SER A 14 2.043 2.810 -5.251 1.00 0.00 N ATOM 204 CA SER A 14 3.269 2.190 -4.778 1.00 0.00 C ATOM 205 C SER A 14 3.280 2.149 -3.253 1.00 0.00 C ATOM 206 O SER A 14 2.787 3.072 -2.602 1.00 0.00 O ATOM 207 CB SER A 14 4.477 2.967 -5.301 1.00 0.00 C ATOM 208 OG SER A 14 4.414 3.104 -6.712 1.00 0.00 O ATOM 0 H SER A 14 2.039 3.829 -5.206 1.00 0.00 H new ATOM 0 HA SER A 14 3.321 1.167 -5.152 1.00 0.00 H new ATOM 0 HB2 SER A 14 4.510 3.952 -4.836 1.00 0.00 H new ATOM 0 HB3 SER A 14 5.396 2.451 -5.022 1.00 0.00 H new ATOM 0 HG SER A 14 5.195 3.605 -7.027 1.00 0.00 H new ATOM 214 N LEU A 15 3.816 1.070 -2.694 1.00 0.00 N ATOM 215 CA LEU A 15 3.892 0.914 -1.248 1.00 0.00 C ATOM 216 C LEU A 15 5.217 1.463 -0.729 1.00 0.00 C ATOM 217 O LEU A 15 6.283 1.113 -1.236 1.00 0.00 O ATOM 218 CB LEU A 15 3.753 -0.563 -0.867 1.00 0.00 C ATOM 219 CG LEU A 15 3.610 -0.845 0.630 1.00 0.00 C ATOM 220 CD1 LEU A 15 2.292 -0.297 1.151 1.00 0.00 C ATOM 221 CD2 LEU A 15 3.709 -2.337 0.901 1.00 0.00 C ATOM 0 H LEU A 15 4.205 0.289 -3.223 1.00 0.00 H new ATOM 0 HA LEU A 15 3.075 1.474 -0.793 1.00 0.00 H new ATOM 0 HB2 LEU A 15 2.884 -0.973 -1.381 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.626 -1.100 -1.239 1.00 0.00 H new ATOM 0 HG LEU A 15 4.423 -0.344 1.155 1.00 0.00 H new ATOM 0 HD11 LEU A 15 2.207 -0.506 2.217 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.256 0.780 0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 15 1.466 -0.771 0.621 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.605 -2.520 1.970 1.00 0.00 H new ATOM 0 HD22 LEU A 15 2.915 -2.858 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.677 -2.705 0.562 1.00 0.00 H new ATOM 233 N ILE A 16 5.146 2.334 0.268 1.00 0.00 N ATOM 234 CA ILE A 16 6.344 2.926 0.847 1.00 0.00 C ATOM 235 C ILE A 16 6.529 2.501 2.303 1.00 0.00 C ATOM 236 O ILE A 16 5.583 2.055 2.960 1.00 0.00 O ATOM 237 CB ILE A 16 6.320 4.469 0.771 1.00 0.00 C ATOM 238 CG1 ILE A 16 5.095 5.028 1.504 1.00 0.00 C ATOM 239 CG2 ILE A 16 6.337 4.928 -0.681 1.00 0.00 C ATOM 240 CD1 ILE A 16 5.074 6.540 1.601 1.00 0.00 C ATOM 0 H ILE A 16 4.273 2.646 0.692 1.00 0.00 H new ATOM 0 HA ILE A 16 7.182 2.559 0.255 1.00 0.00 H new ATOM 0 HB ILE A 16 7.213 4.854 1.264 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.193 4.694 0.991 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.063 4.609 2.510 1.00 0.00 H new ATOM 0 HG21 ILE A 16 6.320 6.017 -0.718 1.00 0.00 H new ATOM 0 HG22 ILE A 16 7.241 4.562 -1.168 1.00 0.00 H new ATOM 0 HG23 ILE A 16 5.462 4.533 -1.198 1.00 0.00 H new ATOM 0 HD11 ILE A 16 4.177 6.858 2.133 1.00 0.00 H new ATOM 0 HD12 ILE A 16 5.957 6.882 2.141 1.00 0.00 H new ATOM 0 HD13 ILE A 16 5.073 6.969 0.599 1.00 0.00 H new ATOM 252 N ALA A 17 7.753 2.646 2.792 1.00 0.00 N ATOM 253 CA ALA A 17 8.093 2.295 4.164 1.00 0.00 C ATOM 254 C ALA A 17 7.955 3.511 5.075 1.00 0.00 C ATOM 255 O ALA A 17 8.836 4.372 5.117 1.00 0.00 O ATOM 256 CB ALA A 17 9.508 1.737 4.215 1.00 0.00 C ATOM 0 H ALA A 17 8.537 3.010 2.250 1.00 0.00 H new ATOM 0 HA ALA A 17 7.403 1.530 4.519 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.759 1.475 5.243 1.00 0.00 H new ATOM 0 HB2 ALA A 17 9.571 0.847 3.588 1.00 0.00 H new ATOM 0 HB3 ALA A 17 10.209 2.488 3.850 1.00 0.00 H new ATOM 262 N LYS A 18 6.844 3.586 5.795 1.00 0.00 N ATOM 263 CA LYS A 18 6.570 4.736 6.646 1.00 0.00 C ATOM 264 C LYS A 18 6.863 4.421 8.106 1.00 0.00 C ATOM 265 O LYS A 18 6.508 3.349 8.603 1.00 0.00 O ATOM 266 CB LYS A 18 5.115 5.186 6.495 1.00 0.00 C ATOM 267 CG LYS A 18 4.760 6.378 7.371 1.00 0.00 C ATOM 268 CD LYS A 18 3.306 6.777 7.201 1.00 0.00 C ATOM 269 CE LYS A 18 2.915 7.914 8.129 1.00 0.00 C ATOM 270 NZ LYS A 18 3.088 7.556 9.563 1.00 0.00 N ATOM 0 H LYS A 18 6.120 2.867 5.807 1.00 0.00 H new ATOM 0 HA LYS A 18 7.227 5.545 6.328 1.00 0.00 H new ATOM 0 HB2 LYS A 18 4.927 5.442 5.452 1.00 0.00 H new ATOM 0 HB3 LYS A 18 4.457 4.353 6.742 1.00 0.00 H new ATOM 0 HG2 LYS A 18 4.952 6.134 8.416 1.00 0.00 H new ATOM 0 HG3 LYS A 18 5.402 7.222 7.118 1.00 0.00 H new ATOM 0 HD2 LYS A 18 3.131 7.076 6.168 1.00 0.00 H new ATOM 0 HD3 LYS A 18 2.668 5.915 7.396 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.520 8.791 7.900 1.00 0.00 H new ATOM 0 HE3 LYS A 18 1.876 8.187 7.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 2.260 7.877 10.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 3.182 6.524 9.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.944 8.016 9.935 1.00 0.00 H new ATOM 284 N ASN A 19 7.532 5.362 8.771 1.00 0.00 N ATOM 285 CA ASN A 19 7.860 5.253 10.195 1.00 0.00 C ATOM 286 C ASN A 19 8.772 4.051 10.445 1.00 0.00 C ATOM 287 O ASN A 19 8.952 3.606 11.576 1.00 0.00 O ATOM 288 CB ASN A 19 6.578 5.150 11.039 1.00 0.00 C ATOM 289 CG ASN A 19 6.836 5.329 12.525 1.00 0.00 C ATOM 290 OD1 ASN A 19 7.761 6.039 12.928 1.00 0.00 O ATOM 291 ND2 ASN A 19 6.018 4.694 13.349 1.00 0.00 N ATOM 0 H ASN A 19 7.863 6.224 8.338 1.00 0.00 H new ATOM 0 HA ASN A 19 8.394 6.155 10.496 1.00 0.00 H new ATOM 0 HB2 ASN A 19 5.867 5.905 10.705 1.00 0.00 H new ATOM 0 HB3 ASN A 19 6.114 4.178 10.870 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.141 4.782 14.358 1.00 0.00 H new ATOM 0 HD22 ASN A 19 5.265 4.116 12.975 1.00 0.00 H new ATOM 298 N THR A 20 9.368 3.552 9.371 1.00 0.00 N ATOM 299 CA THR A 20 10.244 2.402 9.436 1.00 0.00 C ATOM 300 C THR A 20 11.442 2.684 10.340 1.00 0.00 C ATOM 301 O THR A 20 12.215 3.614 10.089 1.00 0.00 O ATOM 302 CB THR A 20 10.702 2.006 8.020 1.00 0.00 C ATOM 303 OG1 THR A 20 9.549 1.698 7.235 1.00 0.00 O ATOM 304 CG2 THR A 20 11.642 0.809 8.048 1.00 0.00 C ATOM 0 H THR A 20 9.255 3.936 8.433 1.00 0.00 H new ATOM 0 HA THR A 20 9.693 1.566 9.867 1.00 0.00 H new ATOM 0 HB THR A 20 11.249 2.842 7.584 1.00 0.00 H new ATOM 0 HG1 THR A 20 8.763 1.637 7.818 1.00 0.00 H new ATOM 0 HG21 THR A 20 11.944 0.559 7.031 1.00 0.00 H new ATOM 0 HG22 THR A 20 12.525 1.053 8.639 1.00 0.00 H new ATOM 0 HG23 THR A 20 11.131 -0.044 8.495 1.00 0.00 H new ATOM 312 N PRO A 21 11.584 1.883 11.413 1.00 0.00 N ATOM 313 CA PRO A 21 12.595 2.089 12.462 1.00 0.00 C ATOM 314 C PRO A 21 14.020 2.172 11.924 1.00 0.00 C ATOM 315 O PRO A 21 14.305 1.755 10.800 1.00 0.00 O ATOM 316 CB PRO A 21 12.444 0.854 13.353 1.00 0.00 C ATOM 317 CG PRO A 21 11.053 0.385 13.120 1.00 0.00 C ATOM 318 CD PRO A 21 10.752 0.696 11.685 1.00 0.00 C ATOM 0 HA PRO A 21 12.437 3.037 12.976 1.00 0.00 H new ATOM 0 HB2 PRO A 21 13.170 0.085 13.089 1.00 0.00 H new ATOM 0 HB3 PRO A 21 12.608 1.101 14.402 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.963 -0.683 13.316 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.353 0.891 13.785 1.00 0.00 H new ATOM 0 HD2 PRO A 21 11.012 -0.136 11.030 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.693 0.904 11.532 1.00 0.00 H new ATOM 326 N ALA A 22 14.913 2.705 12.742 1.00 0.00 N ATOM 327 CA ALA A 22 16.305 2.841 12.361 1.00 0.00 C ATOM 328 C ALA A 22 17.021 1.508 12.508 1.00 0.00 C ATOM 329 O ALA A 22 16.659 0.698 13.363 1.00 0.00 O ATOM 330 CB ALA A 22 16.983 3.909 13.207 1.00 0.00 C ATOM 0 H ALA A 22 14.695 3.051 13.677 1.00 0.00 H new ATOM 0 HA ALA A 22 16.355 3.148 11.316 1.00 0.00 H new ATOM 0 HB1 ALA A 22 18.028 4.000 12.910 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.479 4.864 13.059 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.928 3.629 14.259 1.00 0.00 H new ATOM 336 N ASN A 23 18.022 1.287 11.662 1.00 0.00 N ATOM 337 CA ASN A 23 18.823 0.064 11.693 1.00 0.00 C ATOM 338 C ASN A 23 17.984 -1.155 11.341 1.00 0.00 C ATOM 339 O ASN A 23 18.190 -2.239 11.890 1.00 0.00 O ATOM 340 CB ASN A 23 19.477 -0.139 13.066 1.00 0.00 C ATOM 341 CG ASN A 23 20.490 0.933 13.409 1.00 0.00 C ATOM 342 OD1 ASN A 23 21.667 0.826 13.063 1.00 0.00 O ATOM 343 ND2 ASN A 23 20.052 1.960 14.114 1.00 0.00 N ATOM 0 H ASN A 23 18.302 1.947 10.937 1.00 0.00 H new ATOM 0 HA ASN A 23 19.607 0.177 10.945 1.00 0.00 H new ATOM 0 HB2 ASN A 23 18.701 -0.155 13.832 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.967 -1.113 13.088 1.00 0.00 H new ATOM 0 HD21 ASN A 23 20.697 2.700 14.391 1.00 0.00 H new ATOM 0 HD22 ASN A 23 19.069 2.013 14.382 1.00 0.00 H new ATOM 350 N SER A 24 17.063 -0.991 10.404 1.00 0.00 N ATOM 351 CA SER A 24 16.220 -2.091 9.972 1.00 0.00 C ATOM 352 C SER A 24 16.348 -2.305 8.467 1.00 0.00 C ATOM 353 O SER A 24 16.791 -1.413 7.737 1.00 0.00 O ATOM 354 CB SER A 24 14.760 -1.820 10.344 1.00 0.00 C ATOM 355 OG SER A 24 14.277 -0.656 9.700 1.00 0.00 O ATOM 0 H SER A 24 16.882 -0.107 9.929 1.00 0.00 H new ATOM 0 HA SER A 24 16.550 -2.997 10.481 1.00 0.00 H new ATOM 0 HB2 SER A 24 14.145 -2.676 10.064 1.00 0.00 H new ATOM 0 HB3 SER A 24 14.672 -1.704 11.424 1.00 0.00 H new ATOM 0 HG SER A 24 14.387 0.116 10.294 1.00 0.00 H new ATOM 361 N MET A 25 15.975 -3.491 8.012 1.00 0.00 N ATOM 362 CA MET A 25 15.991 -3.816 6.595 1.00 0.00 C ATOM 363 C MET A 25 14.824 -4.734 6.266 1.00 0.00 C ATOM 364 O MET A 25 14.622 -5.745 6.936 1.00 0.00 O ATOM 365 CB MET A 25 17.303 -4.502 6.210 1.00 0.00 C ATOM 366 CG MET A 25 17.422 -4.786 4.721 1.00 0.00 C ATOM 367 SD MET A 25 18.829 -5.839 4.319 1.00 0.00 S ATOM 368 CE MET A 25 18.307 -7.386 5.055 1.00 0.00 C ATOM 0 H MET A 25 15.654 -4.252 8.611 1.00 0.00 H new ATOM 0 HA MET A 25 15.902 -2.889 6.028 1.00 0.00 H new ATOM 0 HB2 MET A 25 18.138 -3.873 6.520 1.00 0.00 H new ATOM 0 HB3 MET A 25 17.389 -5.440 6.759 1.00 0.00 H new ATOM 0 HG2 MET A 25 16.506 -5.263 4.373 1.00 0.00 H new ATOM 0 HG3 MET A 25 17.515 -3.843 4.182 1.00 0.00 H new ATOM 0 HE1 MET A 25 18.924 -7.601 5.927 1.00 0.00 H new ATOM 0 HE2 MET A 25 17.263 -7.310 5.359 1.00 0.00 H new ATOM 0 HE3 MET A 25 18.415 -8.190 4.327 1.00 0.00 H new ATOM 378 N ILE A 26 14.056 -4.378 5.250 1.00 0.00 N ATOM 379 CA ILE A 26 12.926 -5.191 4.833 1.00 0.00 C ATOM 380 C ILE A 26 13.341 -6.114 3.691 1.00 0.00 C ATOM 381 O ILE A 26 13.601 -5.655 2.577 1.00 0.00 O ATOM 382 CB ILE A 26 11.733 -4.324 4.372 1.00 0.00 C ATOM 383 CG1 ILE A 26 11.479 -3.180 5.359 1.00 0.00 C ATOM 384 CG2 ILE A 26 10.484 -5.187 4.234 1.00 0.00 C ATOM 385 CD1 ILE A 26 10.378 -2.235 4.927 1.00 0.00 C ATOM 0 H ILE A 26 14.194 -3.531 4.699 1.00 0.00 H new ATOM 0 HA ILE A 26 12.611 -5.777 5.696 1.00 0.00 H new ATOM 0 HB ILE A 26 11.976 -3.891 3.402 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.223 -3.601 6.331 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.401 -2.614 5.490 1.00 0.00 H new ATOM 0 HG21 ILE A 26 9.648 -4.568 3.909 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.663 -5.971 3.498 1.00 0.00 H new ATOM 0 HG23 ILE A 26 10.247 -5.640 5.196 1.00 0.00 H new ATOM 0 HD11 ILE A 26 10.256 -1.452 5.675 1.00 0.00 H new ATOM 0 HD12 ILE A 26 10.640 -1.784 3.970 1.00 0.00 H new ATOM 0 HD13 ILE A 26 9.444 -2.787 4.824 1.00 0.00 H new ATOM 397 N MET A 27 13.419 -7.410 3.976 1.00 0.00 N ATOM 398 CA MET A 27 13.790 -8.396 2.962 1.00 0.00 C ATOM 399 C MET A 27 12.661 -8.579 1.957 1.00 0.00 C ATOM 400 O MET A 27 12.892 -8.944 0.800 1.00 0.00 O ATOM 401 CB MET A 27 14.123 -9.746 3.601 1.00 0.00 C ATOM 402 CG MET A 27 15.382 -9.742 4.452 1.00 0.00 C ATOM 403 SD MET A 27 15.792 -11.387 5.069 1.00 0.00 S ATOM 404 CE MET A 27 16.015 -12.278 3.531 1.00 0.00 C ATOM 0 H MET A 27 13.231 -7.803 4.898 1.00 0.00 H new ATOM 0 HA MET A 27 14.676 -8.022 2.448 1.00 0.00 H new ATOM 0 HB2 MET A 27 13.282 -10.059 4.219 1.00 0.00 H new ATOM 0 HB3 MET A 27 14.234 -10.490 2.813 1.00 0.00 H new ATOM 0 HG2 MET A 27 16.215 -9.358 3.863 1.00 0.00 H new ATOM 0 HG3 MET A 27 15.247 -9.063 5.294 1.00 0.00 H new ATOM 0 HE1 MET A 27 16.819 -13.005 3.645 1.00 0.00 H new ATOM 0 HE2 MET A 27 15.091 -12.796 3.273 1.00 0.00 H new ATOM 0 HE3 MET A 27 16.271 -11.576 2.738 1.00 0.00 H new ATOM 414 N THR A 28 11.443 -8.344 2.415 1.00 0.00 N ATOM 415 CA THR A 28 10.270 -8.428 1.565 1.00 0.00 C ATOM 416 C THR A 28 10.167 -7.171 0.703 1.00 0.00 C ATOM 417 O THR A 28 10.158 -6.054 1.223 1.00 0.00 O ATOM 418 CB THR A 28 9.002 -8.578 2.425 1.00 0.00 C ATOM 419 OG1 THR A 28 9.274 -9.452 3.533 1.00 0.00 O ATOM 420 CG2 THR A 28 7.849 -9.137 1.606 1.00 0.00 C ATOM 0 H THR A 28 11.241 -8.091 3.382 1.00 0.00 H new ATOM 0 HA THR A 28 10.362 -9.301 0.919 1.00 0.00 H new ATOM 0 HB THR A 28 8.716 -7.592 2.791 1.00 0.00 H new ATOM 0 HG1 THR A 28 8.503 -10.037 3.685 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.966 -9.233 2.238 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.631 -8.463 0.778 1.00 0.00 H new ATOM 0 HG23 THR A 28 8.122 -10.117 1.214 1.00 0.00 H new ATOM 428 N LYS A 29 10.111 -7.348 -0.610 1.00 0.00 N ATOM 429 CA LYS A 29 10.077 -6.214 -1.520 1.00 0.00 C ATOM 430 C LYS A 29 8.726 -5.513 -1.450 1.00 0.00 C ATOM 431 O LYS A 29 7.679 -6.161 -1.521 1.00 0.00 O ATOM 432 CB LYS A 29 10.357 -6.660 -2.957 1.00 0.00 C ATOM 433 CG LYS A 29 10.476 -5.501 -3.934 1.00 0.00 C ATOM 434 CD LYS A 29 10.647 -5.983 -5.364 1.00 0.00 C ATOM 435 CE LYS A 29 9.403 -6.697 -5.869 1.00 0.00 C ATOM 436 NZ LYS A 29 9.551 -7.128 -7.282 1.00 0.00 N ATOM 0 H LYS A 29 10.088 -8.260 -1.066 1.00 0.00 H new ATOM 0 HA LYS A 29 10.855 -5.515 -1.214 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.280 -7.239 -2.977 1.00 0.00 H new ATOM 0 HB3 LYS A 29 9.557 -7.323 -3.287 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.586 -4.875 -3.865 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.326 -4.878 -3.657 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.867 -5.133 -6.011 1.00 0.00 H new ATOM 0 HD3 LYS A 29 11.502 -6.657 -5.421 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.203 -7.566 -5.243 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.542 -6.035 -5.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.683 -7.611 -7.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.717 -6.296 -7.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.357 -7.780 -7.363 1.00 0.00 H new ATOM 450 N LEU A 30 8.759 -4.196 -1.296 1.00 0.00 N ATOM 451 CA LEU A 30 7.543 -3.396 -1.265 1.00 0.00 C ATOM 452 C LEU A 30 6.892 -3.378 -2.645 1.00 0.00 C ATOM 453 O LEU A 30 7.456 -2.840 -3.602 1.00 0.00 O ATOM 454 CB LEU A 30 7.856 -1.968 -0.807 1.00 0.00 C ATOM 455 CG LEU A 30 8.473 -1.853 0.588 1.00 0.00 C ATOM 456 CD1 LEU A 30 8.807 -0.404 0.903 1.00 0.00 C ATOM 457 CD2 LEU A 30 7.530 -2.422 1.638 1.00 0.00 C ATOM 0 H LEU A 30 9.619 -3.658 -1.190 1.00 0.00 H new ATOM 0 HA LEU A 30 6.848 -3.843 -0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.537 -1.514 -1.527 1.00 0.00 H new ATOM 0 HB3 LEU A 30 6.935 -1.386 -0.829 1.00 0.00 H new ATOM 0 HG LEU A 30 9.396 -2.432 0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.245 -0.340 1.899 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.519 -0.027 0.169 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.897 0.195 0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.986 -2.331 2.624 1.00 0.00 H new ATOM 0 HD22 LEU A 30 6.590 -1.870 1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.337 -3.473 1.423 1.00 0.00 H new ATOM 469 N PRO A 31 5.705 -3.982 -2.769 1.00 0.00 N ATOM 470 CA PRO A 31 5.009 -4.103 -4.044 1.00 0.00 C ATOM 471 C PRO A 31 4.170 -2.874 -4.378 1.00 0.00 C ATOM 472 O PRO A 31 4.188 -1.871 -3.661 1.00 0.00 O ATOM 473 CB PRO A 31 4.113 -5.316 -3.813 1.00 0.00 C ATOM 474 CG PRO A 31 3.776 -5.265 -2.360 1.00 0.00 C ATOM 475 CD PRO A 31 4.944 -4.605 -1.668 1.00 0.00 C ATOM 0 HA PRO A 31 5.696 -4.201 -4.884 1.00 0.00 H new ATOM 0 HB2 PRO A 31 3.216 -5.269 -4.430 1.00 0.00 H new ATOM 0 HB3 PRO A 31 4.627 -6.243 -4.068 1.00 0.00 H new ATOM 0 HG2 PRO A 31 2.859 -4.700 -2.195 1.00 0.00 H new ATOM 0 HG3 PRO A 31 3.608 -6.267 -1.966 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.611 -3.863 -0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.549 -5.331 -1.125 1.00 0.00 H new ATOM 483 N SER A 32 3.450 -2.955 -5.478 1.00 0.00 N ATOM 484 CA SER A 32 2.525 -1.913 -5.863 1.00 0.00 C ATOM 485 C SER A 32 1.100 -2.385 -5.611 1.00 0.00 C ATOM 486 O SER A 32 0.699 -3.455 -6.072 1.00 0.00 O ATOM 487 CB SER A 32 2.733 -1.550 -7.332 1.00 0.00 C ATOM 488 OG SER A 32 4.082 -1.167 -7.563 1.00 0.00 O ATOM 0 H SER A 32 3.490 -3.741 -6.126 1.00 0.00 H new ATOM 0 HA SER A 32 2.705 -1.019 -5.266 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.477 -2.401 -7.963 1.00 0.00 H new ATOM 0 HB3 SER A 32 2.065 -0.735 -7.610 1.00 0.00 H new ATOM 0 HG SER A 32 4.200 -0.939 -8.509 1.00 0.00 H new ATOM 494 N VAL A 33 0.346 -1.591 -4.868 1.00 0.00 N ATOM 495 CA VAL A 33 -0.995 -1.971 -4.464 1.00 0.00 C ATOM 496 C VAL A 33 -2.003 -1.596 -5.543 1.00 0.00 C ATOM 497 O VAL A 33 -1.818 -0.615 -6.266 1.00 0.00 O ATOM 498 CB VAL A 33 -1.400 -1.299 -3.130 1.00 0.00 C ATOM 499 CG1 VAL A 33 -0.359 -1.567 -2.053 1.00 0.00 C ATOM 500 CG2 VAL A 33 -1.609 0.199 -3.304 1.00 0.00 C ATOM 0 H VAL A 33 0.643 -0.675 -4.532 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.996 -3.052 -4.321 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.347 -1.737 -2.815 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -0.664 -1.085 -1.124 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.270 -2.641 -1.892 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.604 -1.167 -2.370 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -1.893 0.640 -2.348 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -0.684 0.657 -3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -2.400 0.374 -4.033 1.00 0.00 H new ATOM 510 N ARG A 34 -3.055 -2.382 -5.659 1.00 0.00 N ATOM 511 CA ARG A 34 -4.119 -2.089 -6.601 1.00 0.00 C ATOM 512 C ARG A 34 -5.453 -2.101 -5.880 1.00 0.00 C ATOM 513 O ARG A 34 -6.037 -3.157 -5.644 1.00 0.00 O ATOM 514 CB ARG A 34 -4.132 -3.087 -7.762 1.00 0.00 C ATOM 515 CG ARG A 34 -2.902 -3.010 -8.651 1.00 0.00 C ATOM 516 CD ARG A 34 -3.061 -3.878 -9.888 1.00 0.00 C ATOM 517 NE ARG A 34 -4.191 -3.448 -10.713 1.00 0.00 N ATOM 518 CZ ARG A 34 -4.958 -4.281 -11.415 1.00 0.00 C ATOM 519 NH1 ARG A 34 -4.709 -5.585 -11.410 1.00 0.00 N ATOM 520 NH2 ARG A 34 -5.975 -3.809 -12.125 1.00 0.00 N ATOM 0 H ARG A 34 -3.197 -3.231 -5.111 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.941 -1.099 -7.022 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -4.216 -4.097 -7.360 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -5.020 -2.911 -8.370 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -2.730 -1.976 -8.949 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -2.024 -3.330 -8.090 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -2.145 -3.841 -10.478 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -3.205 -4.916 -9.588 1.00 0.00 H new ATOM 0 HE ARG A 34 -4.404 -2.451 -10.753 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -3.928 -5.953 -10.867 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -5.299 -6.219 -11.949 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -6.170 -2.808 -12.134 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -6.562 -4.447 -12.662 1.00 0.00 H new ATOM 534 N VAL A 35 -5.917 -0.922 -5.511 1.00 0.00 N ATOM 535 CA VAL A 35 -7.147 -0.790 -4.755 1.00 0.00 C ATOM 536 C VAL A 35 -8.267 -0.280 -5.650 1.00 0.00 C ATOM 537 O VAL A 35 -8.077 0.667 -6.417 1.00 0.00 O ATOM 538 CB VAL A 35 -6.968 0.156 -3.543 1.00 0.00 C ATOM 539 CG1 VAL A 35 -5.998 -0.446 -2.536 1.00 0.00 C ATOM 540 CG2 VAL A 35 -6.488 1.534 -3.982 1.00 0.00 C ATOM 0 H VAL A 35 -5.457 -0.037 -5.724 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.410 -1.778 -4.378 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.941 0.275 -3.067 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -5.884 0.232 -1.690 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.385 -1.402 -2.184 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.029 -0.600 -3.011 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.372 2.175 -3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.530 1.440 -4.492 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.219 1.975 -4.660 1.00 0.00 H new ATOM 550 N LYS A 36 -9.422 -0.918 -5.584 1.00 0.00 N ATOM 551 CA LYS A 36 -10.540 -0.487 -6.390 1.00 0.00 C ATOM 552 C LYS A 36 -11.221 0.681 -5.705 1.00 0.00 C ATOM 553 O LYS A 36 -11.418 0.671 -4.488 1.00 0.00 O ATOM 554 CB LYS A 36 -11.535 -1.624 -6.627 1.00 0.00 C ATOM 555 CG LYS A 36 -12.448 -1.369 -7.818 1.00 0.00 C ATOM 556 CD LYS A 36 -13.472 -2.474 -8.004 1.00 0.00 C ATOM 557 CE LYS A 36 -14.232 -2.299 -9.312 1.00 0.00 C ATOM 558 NZ LYS A 36 -15.386 -3.225 -9.422 1.00 0.00 N ATOM 0 H LYS A 36 -9.605 -1.725 -4.988 1.00 0.00 H new ATOM 0 HA LYS A 36 -10.168 -0.177 -7.367 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -10.987 -2.553 -6.787 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -12.142 -1.762 -5.732 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -12.963 -0.418 -7.681 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -11.846 -1.278 -8.722 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.972 -3.443 -7.996 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -14.172 -2.470 -7.169 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.586 -1.271 -9.389 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -13.554 -2.466 -10.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -15.381 -3.676 -10.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -15.316 -3.956 -8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -16.271 -2.693 -9.299 1.00 0.00 H new ATOM 572 N THR A 37 -11.557 1.689 -6.479 1.00 0.00 N ATOM 573 CA THR A 37 -12.160 2.892 -5.948 1.00 0.00 C ATOM 574 C THR A 37 -13.463 3.192 -6.670 1.00 0.00 C ATOM 575 O THR A 37 -13.719 2.651 -7.736 1.00 0.00 O ATOM 576 CB THR A 37 -11.199 4.088 -6.077 1.00 0.00 C ATOM 577 OG1 THR A 37 -10.679 4.160 -7.413 1.00 0.00 O ATOM 578 CG2 THR A 37 -10.050 3.971 -5.084 1.00 0.00 C ATOM 0 H THR A 37 -11.421 1.699 -7.490 1.00 0.00 H new ATOM 0 HA THR A 37 -12.370 2.729 -4.891 1.00 0.00 H new ATOM 0 HB THR A 37 -11.757 4.998 -5.856 1.00 0.00 H new ATOM 0 HG1 THR A 37 -11.065 3.439 -7.953 1.00 0.00 H new ATOM 0 HG21 THR A 37 -9.385 4.827 -5.195 1.00 0.00 H new ATOM 0 HG22 THR A 37 -10.447 3.949 -4.069 1.00 0.00 H new ATOM 0 HG23 THR A 37 -9.495 3.053 -5.277 1.00 0.00 H new ATOM 586 N GLU A 38 -14.287 4.033 -6.075 1.00 0.00 N ATOM 587 CA GLU A 38 -15.561 4.397 -6.665 1.00 0.00 C ATOM 588 C GLU A 38 -15.626 5.906 -6.850 1.00 0.00 C ATOM 589 O GLU A 38 -15.627 6.668 -5.877 1.00 0.00 O ATOM 590 CB GLU A 38 -16.710 3.887 -5.783 1.00 0.00 C ATOM 591 CG GLU A 38 -18.093 4.013 -6.411 1.00 0.00 C ATOM 592 CD GLU A 38 -18.811 5.286 -6.015 1.00 0.00 C ATOM 593 OE1 GLU A 38 -19.506 5.278 -4.980 1.00 0.00 O ATOM 594 OE2 GLU A 38 -18.679 6.299 -6.726 1.00 0.00 O ATOM 0 H GLU A 38 -14.095 4.479 -5.178 1.00 0.00 H new ATOM 0 HA GLU A 38 -15.661 3.931 -7.645 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.529 2.840 -5.542 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.701 4.437 -4.842 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -17.997 3.979 -7.496 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -18.698 3.155 -6.118 1.00 0.00 H new ATOM 601 N GLY A 39 -15.642 6.331 -8.103 1.00 0.00 N ATOM 602 CA GLY A 39 -15.684 7.740 -8.411 1.00 0.00 C ATOM 603 C GLY A 39 -14.970 8.048 -9.707 1.00 0.00 C ATOM 604 O GLY A 39 -14.417 7.152 -10.343 1.00 0.00 O ATOM 0 H GLY A 39 -15.626 5.717 -8.918 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -16.721 8.067 -8.480 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -15.225 8.304 -7.599 1.00 0.00 H new ATOM 608 N TYR A 40 -14.970 9.311 -10.092 1.00 0.00 N ATOM 609 CA TYR A 40 -14.331 9.724 -11.330 1.00 0.00 C ATOM 610 C TYR A 40 -13.210 10.702 -11.032 1.00 0.00 C ATOM 611 O TYR A 40 -13.316 11.517 -10.115 1.00 0.00 O ATOM 612 CB TYR A 40 -15.348 10.362 -12.275 1.00 0.00 C ATOM 613 CG TYR A 40 -16.506 9.457 -12.627 1.00 0.00 C ATOM 614 CD1 TYR A 40 -16.408 8.545 -13.670 1.00 0.00 C ATOM 615 CD2 TYR A 40 -17.696 9.518 -11.918 1.00 0.00 C ATOM 616 CE1 TYR A 40 -17.466 7.720 -13.995 1.00 0.00 C ATOM 617 CE2 TYR A 40 -18.758 8.696 -12.237 1.00 0.00 C ATOM 618 CZ TYR A 40 -18.638 7.799 -13.277 1.00 0.00 C ATOM 619 OH TYR A 40 -19.697 6.984 -13.603 1.00 0.00 O ATOM 0 H TYR A 40 -15.405 10.069 -9.566 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.915 8.842 -11.817 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.736 11.271 -11.816 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.840 10.660 -13.192 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -15.490 8.480 -14.235 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -17.794 10.220 -11.103 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -17.375 7.016 -14.809 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -19.678 8.755 -11.675 1.00 0.00 H new ATOM 0 HH TYR A 40 -20.447 7.165 -12.999 1.00 0.00 H new ATOM 629 N ASN A 41 -12.138 10.620 -11.800 1.00 0.00 N ATOM 630 CA ASN A 41 -10.969 11.448 -11.558 1.00 0.00 C ATOM 631 C ASN A 41 -10.518 12.175 -12.824 1.00 0.00 C ATOM 632 O ASN A 41 -9.760 11.638 -13.637 1.00 0.00 O ATOM 633 CB ASN A 41 -9.822 10.607 -10.968 1.00 0.00 C ATOM 634 CG ASN A 41 -9.679 9.231 -11.608 1.00 0.00 C ATOM 635 OD1 ASN A 41 -9.998 9.026 -12.782 1.00 0.00 O ATOM 636 ND2 ASN A 41 -9.198 8.272 -10.832 1.00 0.00 N ATOM 0 H ASN A 41 -12.052 9.989 -12.597 1.00 0.00 H new ATOM 0 HA ASN A 41 -11.249 12.210 -10.830 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -8.886 11.152 -11.086 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -9.986 10.485 -9.897 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -9.081 7.328 -11.201 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.944 8.477 -9.866 1.00 0.00 H new ATOM 643 N PRO A 42 -11.011 13.408 -13.022 1.00 0.00 N ATOM 644 CA PRO A 42 -10.580 14.267 -14.129 1.00 0.00 C ATOM 645 C PRO A 42 -9.094 14.592 -14.025 1.00 0.00 C ATOM 646 O PRO A 42 -8.355 14.518 -15.010 1.00 0.00 O ATOM 647 CB PRO A 42 -11.421 15.538 -13.960 1.00 0.00 C ATOM 648 CG PRO A 42 -12.566 15.136 -13.094 1.00 0.00 C ATOM 649 CD PRO A 42 -12.040 14.056 -12.194 1.00 0.00 C ATOM 0 HA PRO A 42 -10.718 13.792 -15.101 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -10.840 16.336 -13.499 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -11.768 15.912 -14.923 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -12.934 15.983 -12.515 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -13.401 14.773 -13.693 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -11.620 14.465 -11.275 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -12.823 13.356 -11.903 1.00 0.00 H new ATOM 657 N SER A 43 -8.669 14.947 -12.820 1.00 0.00 N ATOM 658 CA SER A 43 -7.268 15.182 -12.540 1.00 0.00 C ATOM 659 C SER A 43 -6.779 14.177 -11.493 1.00 0.00 C ATOM 660 O SER A 43 -6.804 12.974 -11.748 1.00 0.00 O ATOM 661 CB SER A 43 -7.065 16.626 -12.075 1.00 0.00 C ATOM 662 OG SER A 43 -7.595 17.540 -13.020 1.00 0.00 O ATOM 0 H SER A 43 -9.285 15.078 -12.017 1.00 0.00 H new ATOM 0 HA SER A 43 -6.679 15.039 -13.446 1.00 0.00 H new ATOM 0 HB2 SER A 43 -7.549 16.773 -11.110 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.002 16.820 -11.931 1.00 0.00 H new ATOM 0 HG SER A 43 -7.456 18.457 -12.702 1.00 0.00 H new ATOM 668 N ILE A 44 -6.385 14.668 -10.311 1.00 0.00 N ATOM 669 CA ILE A 44 -5.891 13.819 -9.222 1.00 0.00 C ATOM 670 C ILE A 44 -4.697 12.965 -9.663 1.00 0.00 C ATOM 671 O ILE A 44 -4.856 11.931 -10.315 1.00 0.00 O ATOM 672 CB ILE A 44 -7.013 12.916 -8.664 1.00 0.00 C ATOM 673 CG1 ILE A 44 -8.174 13.777 -8.148 1.00 0.00 C ATOM 674 CG2 ILE A 44 -6.481 12.016 -7.555 1.00 0.00 C ATOM 675 CD1 ILE A 44 -9.360 12.974 -7.659 1.00 0.00 C ATOM 0 H ILE A 44 -6.400 15.662 -10.084 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.554 14.486 -8.429 1.00 0.00 H new ATOM 0 HB ILE A 44 -7.379 12.279 -9.470 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.813 14.407 -7.335 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.502 14.443 -8.946 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -7.288 11.389 -7.177 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -5.685 11.384 -7.949 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.089 12.630 -6.745 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.139 13.652 -7.310 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -9.748 12.364 -8.475 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.048 12.327 -6.839 1.00 0.00 H new ATOM 687 N ASN A 45 -3.498 13.407 -9.312 1.00 0.00 N ATOM 688 CA ASN A 45 -2.284 12.715 -9.725 1.00 0.00 C ATOM 689 C ASN A 45 -2.099 11.413 -8.953 1.00 0.00 C ATOM 690 O ASN A 45 -1.651 11.399 -7.801 1.00 0.00 O ATOM 691 CB ASN A 45 -1.059 13.618 -9.561 1.00 0.00 C ATOM 692 CG ASN A 45 0.217 12.958 -10.050 1.00 0.00 C ATOM 693 OD1 ASN A 45 0.184 12.050 -10.883 1.00 0.00 O ATOM 694 ND2 ASN A 45 1.349 13.425 -9.556 1.00 0.00 N ATOM 0 H ASN A 45 -3.339 14.239 -8.744 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.388 12.466 -10.781 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -1.219 14.545 -10.111 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -0.947 13.886 -8.510 1.00 0.00 H new ATOM 0 HD21 ASN A 45 2.239 13.033 -9.862 1.00 0.00 H new ATOM 0 HD22 ASN A 45 1.333 14.178 -8.868 1.00 0.00 H new ATOM 701 N VAL A 46 -2.449 10.316 -9.613 1.00 0.00 N ATOM 702 CA VAL A 46 -2.361 8.987 -9.022 1.00 0.00 C ATOM 703 C VAL A 46 -0.906 8.624 -8.718 1.00 0.00 C ATOM 704 O VAL A 46 -0.629 7.792 -7.858 1.00 0.00 O ATOM 705 CB VAL A 46 -2.979 7.924 -9.961 1.00 0.00 C ATOM 706 CG1 VAL A 46 -3.048 6.565 -9.281 1.00 0.00 C ATOM 707 CG2 VAL A 46 -4.360 8.362 -10.428 1.00 0.00 C ATOM 0 H VAL A 46 -2.801 10.322 -10.570 1.00 0.00 H new ATOM 0 HA VAL A 46 -2.924 9.001 -8.089 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.333 7.829 -10.834 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -3.487 5.838 -9.965 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -2.043 6.244 -9.006 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -3.664 6.638 -8.385 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -4.779 7.602 -11.087 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.012 8.492 -9.564 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -4.279 9.306 -10.967 1.00 0.00 H new ATOM 717 N ASN A 47 0.020 9.277 -9.409 1.00 0.00 N ATOM 718 CA ASN A 47 1.442 9.014 -9.213 1.00 0.00 C ATOM 719 C ASN A 47 1.964 9.741 -7.977 1.00 0.00 C ATOM 720 O ASN A 47 3.077 9.481 -7.517 1.00 0.00 O ATOM 721 CB ASN A 47 2.249 9.414 -10.454 1.00 0.00 C ATOM 722 CG ASN A 47 1.906 8.557 -11.661 1.00 0.00 C ATOM 723 OD1 ASN A 47 1.503 7.403 -11.522 1.00 0.00 O ATOM 724 ND2 ASN A 47 2.067 9.108 -12.853 1.00 0.00 N ATOM 0 H ASN A 47 -0.186 9.991 -10.108 1.00 0.00 H new ATOM 0 HA ASN A 47 1.566 7.942 -9.057 1.00 0.00 H new ATOM 0 HB2 ASN A 47 2.058 10.461 -10.688 1.00 0.00 H new ATOM 0 HB3 ASN A 47 3.314 9.325 -10.238 1.00 0.00 H new ATOM 0 HD21 ASN A 47 1.855 8.573 -13.695 1.00 0.00 H new ATOM 0 HD22 ASN A 47 2.403 10.068 -12.930 1.00 0.00 H new ATOM 731 N GLU A 48 1.158 10.650 -7.439 1.00 0.00 N ATOM 732 CA GLU A 48 1.505 11.332 -6.199 1.00 0.00 C ATOM 733 C GLU A 48 0.799 10.655 -5.032 1.00 0.00 C ATOM 734 O GLU A 48 1.205 10.786 -3.878 1.00 0.00 O ATOM 735 CB GLU A 48 1.122 12.812 -6.261 1.00 0.00 C ATOM 736 CG GLU A 48 1.687 13.626 -5.106 1.00 0.00 C ATOM 737 CD GLU A 48 1.200 15.058 -5.099 1.00 0.00 C ATOM 738 OE1 GLU A 48 1.589 15.830 -5.997 1.00 0.00 O ATOM 739 OE2 GLU A 48 0.420 15.420 -4.194 1.00 0.00 O ATOM 0 H GLU A 48 0.263 10.930 -7.841 1.00 0.00 H new ATOM 0 HA GLU A 48 2.584 11.270 -6.057 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.477 13.233 -7.202 1.00 0.00 H new ATOM 0 HB3 GLU A 48 0.036 12.900 -6.262 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.412 13.150 -4.165 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.776 13.618 -5.162 1.00 0.00 H new ATOM 746 N LEU A 49 -0.276 9.942 -5.340 1.00 0.00 N ATOM 747 CA LEU A 49 -0.972 9.144 -4.338 1.00 0.00 C ATOM 748 C LEU A 49 -0.111 7.947 -3.937 1.00 0.00 C ATOM 749 O LEU A 49 0.430 7.245 -4.794 1.00 0.00 O ATOM 750 CB LEU A 49 -2.321 8.663 -4.878 1.00 0.00 C ATOM 751 CG LEU A 49 -3.295 9.771 -5.285 1.00 0.00 C ATOM 752 CD1 LEU A 49 -4.560 9.170 -5.877 1.00 0.00 C ATOM 753 CD2 LEU A 49 -3.633 10.655 -4.092 1.00 0.00 C ATOM 0 H LEU A 49 -0.685 9.899 -6.273 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.152 9.765 -3.460 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.141 8.025 -5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.798 8.044 -4.118 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.815 10.390 -6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -5.244 9.970 -6.162 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.305 8.580 -6.757 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -5.039 8.529 -5.137 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -4.327 11.436 -4.403 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -4.094 10.051 -3.310 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.721 11.112 -3.708 1.00 0.00 H new ATOM 765 N PHE A 50 0.023 7.721 -2.636 1.00 0.00 N ATOM 766 CA PHE A 50 0.868 6.642 -2.143 1.00 0.00 C ATOM 767 C PHE A 50 0.144 5.778 -1.118 1.00 0.00 C ATOM 768 O PHE A 50 -0.771 6.235 -0.426 1.00 0.00 O ATOM 769 CB PHE A 50 2.152 7.193 -1.511 1.00 0.00 C ATOM 770 CG PHE A 50 3.072 7.885 -2.476 1.00 0.00 C ATOM 771 CD1 PHE A 50 3.629 7.193 -3.541 1.00 0.00 C ATOM 772 CD2 PHE A 50 3.383 9.225 -2.316 1.00 0.00 C ATOM 773 CE1 PHE A 50 4.479 7.826 -4.427 1.00 0.00 C ATOM 774 CE2 PHE A 50 4.233 9.863 -3.198 1.00 0.00 C ATOM 775 CZ PHE A 50 4.781 9.163 -4.256 1.00 0.00 C ATOM 0 H PHE A 50 -0.439 8.266 -1.908 1.00 0.00 H new ATOM 0 HA PHE A 50 1.120 6.026 -3.006 1.00 0.00 H new ATOM 0 HB2 PHE A 50 1.882 7.893 -0.720 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.691 6.372 -1.039 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.396 6.148 -3.679 1.00 0.00 H new ATOM 0 HD2 PHE A 50 2.956 9.777 -1.492 1.00 0.00 H new ATOM 0 HE1 PHE A 50 4.907 7.276 -5.252 1.00 0.00 H new ATOM 0 HE2 PHE A 50 4.469 10.908 -3.061 1.00 0.00 H new ATOM 0 HZ PHE A 50 5.444 9.660 -4.948 1.00 0.00 H new ATOM 785 N ALA A 51 0.567 4.528 -1.038 1.00 0.00 N ATOM 786 CA ALA A 51 0.131 3.620 0.005 1.00 0.00 C ATOM 787 C ALA A 51 1.336 3.261 0.853 1.00 0.00 C ATOM 788 O ALA A 51 2.435 3.101 0.330 1.00 0.00 O ATOM 789 CB ALA A 51 -0.498 2.372 -0.595 1.00 0.00 C ATOM 0 H ALA A 51 1.225 4.114 -1.698 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.628 4.100 0.623 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -0.818 1.705 0.206 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -1.361 2.654 -1.199 1.00 0.00 H new ATOM 0 HB3 ALA A 51 0.233 1.862 -1.222 1.00 0.00 H new ATOM 795 N TYR A 52 1.159 3.155 2.153 1.00 0.00 N ATOM 796 CA TYR A 52 2.292 2.911 3.025 1.00 0.00 C ATOM 797 C TYR A 52 2.011 1.814 4.026 1.00 0.00 C ATOM 798 O TYR A 52 0.861 1.463 4.286 1.00 0.00 O ATOM 799 CB TYR A 52 2.686 4.192 3.772 1.00 0.00 C ATOM 800 CG TYR A 52 1.587 4.784 4.626 1.00 0.00 C ATOM 801 CD1 TYR A 52 1.377 4.339 5.927 1.00 0.00 C ATOM 802 CD2 TYR A 52 0.765 5.790 4.137 1.00 0.00 C ATOM 803 CE1 TYR A 52 0.378 4.880 6.712 1.00 0.00 C ATOM 804 CE2 TYR A 52 -0.235 6.334 4.918 1.00 0.00 C ATOM 805 CZ TYR A 52 -0.423 5.876 6.204 1.00 0.00 C ATOM 806 OH TYR A 52 -1.421 6.416 6.983 1.00 0.00 O ATOM 0 H TYR A 52 0.258 3.232 2.625 1.00 0.00 H new ATOM 0 HA TYR A 52 3.117 2.589 2.389 1.00 0.00 H new ATOM 0 HB2 TYR A 52 3.546 3.977 4.406 1.00 0.00 H new ATOM 0 HB3 TYR A 52 3.005 4.938 3.044 1.00 0.00 H new ATOM 0 HD1 TYR A 52 2.005 3.558 6.330 1.00 0.00 H new ATOM 0 HD2 TYR A 52 0.910 6.153 3.130 1.00 0.00 H new ATOM 0 HE1 TYR A 52 0.226 4.523 7.720 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -0.867 7.115 4.523 1.00 0.00 H new ATOM 0 HH TYR A 52 -1.894 7.108 6.475 1.00 0.00 H new ATOM 816 N VAL A 53 3.076 1.276 4.579 1.00 0.00 N ATOM 817 CA VAL A 53 2.985 0.414 5.732 1.00 0.00 C ATOM 818 C VAL A 53 3.619 1.130 6.910 1.00 0.00 C ATOM 819 O VAL A 53 4.802 1.483 6.876 1.00 0.00 O ATOM 820 CB VAL A 53 3.660 -0.959 5.508 1.00 0.00 C ATOM 821 CG1 VAL A 53 2.813 -1.829 4.592 1.00 0.00 C ATOM 822 CG2 VAL A 53 5.061 -0.798 4.932 1.00 0.00 C ATOM 0 H VAL A 53 4.027 1.425 4.241 1.00 0.00 H new ATOM 0 HA VAL A 53 1.933 0.206 5.925 1.00 0.00 H new ATOM 0 HB VAL A 53 3.746 -1.449 6.478 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.305 -2.791 4.447 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.834 -1.987 5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.693 -1.334 3.629 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.509 -1.781 4.786 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.004 -0.279 3.975 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.674 -0.219 5.622 1.00 0.00 H new ATOM 832 N ASP A 54 2.826 1.392 7.931 1.00 0.00 N ATOM 833 CA ASP A 54 3.307 2.149 9.069 1.00 0.00 C ATOM 834 C ASP A 54 3.968 1.215 10.059 1.00 0.00 C ATOM 835 O ASP A 54 3.297 0.486 10.794 1.00 0.00 O ATOM 836 CB ASP A 54 2.169 2.917 9.733 1.00 0.00 C ATOM 837 CG ASP A 54 2.666 3.865 10.803 1.00 0.00 C ATOM 838 OD1 ASP A 54 2.993 5.025 10.467 1.00 0.00 O ATOM 839 OD2 ASP A 54 2.721 3.461 11.983 1.00 0.00 O ATOM 0 H ASP A 54 1.853 1.094 7.996 1.00 0.00 H new ATOM 0 HA ASP A 54 4.040 2.876 8.721 1.00 0.00 H new ATOM 0 HB2 ASP A 54 1.623 3.480 8.976 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.465 2.211 10.174 1.00 0.00 H new ATOM 844 N LEU A 55 5.288 1.218 10.055 1.00 0.00 N ATOM 845 CA LEU A 55 6.042 0.296 10.879 1.00 0.00 C ATOM 846 C LEU A 55 6.296 0.877 12.261 1.00 0.00 C ATOM 847 O LEU A 55 7.392 1.345 12.558 1.00 0.00 O ATOM 848 CB LEU A 55 7.366 -0.081 10.208 1.00 0.00 C ATOM 849 CG LEU A 55 7.240 -0.691 8.807 1.00 0.00 C ATOM 850 CD1 LEU A 55 8.590 -1.189 8.319 1.00 0.00 C ATOM 851 CD2 LEU A 55 6.225 -1.821 8.798 1.00 0.00 C ATOM 0 H LEU A 55 5.858 1.848 9.491 1.00 0.00 H new ATOM 0 HA LEU A 55 5.444 -0.608 10.994 1.00 0.00 H new ATOM 0 HB2 LEU A 55 7.989 0.811 10.143 1.00 0.00 H new ATOM 0 HB3 LEU A 55 7.890 -0.790 10.849 1.00 0.00 H new ATOM 0 HG LEU A 55 6.890 0.088 8.129 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.481 -1.619 7.323 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.293 -0.357 8.280 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.966 -1.950 9.003 1.00 0.00 H new ATOM 0 HD21 LEU A 55 6.153 -2.238 7.793 1.00 0.00 H new ATOM 0 HD22 LEU A 55 6.541 -2.600 9.492 1.00 0.00 H new ATOM 0 HD23 LEU A 55 5.251 -1.438 9.102 1.00 0.00 H new ATOM 863 N SER A 56 5.265 0.860 13.092 1.00 0.00 N ATOM 864 CA SER A 56 5.405 1.252 14.487 1.00 0.00 C ATOM 865 C SER A 56 5.903 0.064 15.310 1.00 0.00 C ATOM 866 O SER A 56 5.929 0.098 16.539 1.00 0.00 O ATOM 867 CB SER A 56 4.075 1.772 15.035 1.00 0.00 C ATOM 868 OG SER A 56 3.695 2.988 14.400 1.00 0.00 O ATOM 0 H SER A 56 4.322 0.579 12.825 1.00 0.00 H new ATOM 0 HA SER A 56 6.135 2.058 14.557 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.299 1.022 14.884 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.159 1.931 16.110 1.00 0.00 H new ATOM 0 HG SER A 56 3.542 2.825 13.446 1.00 0.00 H new ATOM 874 N GLY A 57 6.296 -0.989 14.605 1.00 0.00 N ATOM 875 CA GLY A 57 6.876 -2.146 15.242 1.00 0.00 C ATOM 876 C GLY A 57 8.330 -2.308 14.860 1.00 0.00 C ATOM 877 O GLY A 57 8.644 -2.677 13.728 1.00 0.00 O ATOM 0 H GLY A 57 6.220 -1.058 13.590 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.790 -2.050 16.324 1.00 0.00 H new ATOM 0 HA3 GLY A 57 6.320 -3.039 14.956 1.00 0.00 H new ATOM 881 N SER A 58 9.221 -2.016 15.796 1.00 0.00 N ATOM 882 CA SER A 58 10.654 -2.101 15.546 1.00 0.00 C ATOM 883 C SER A 58 11.159 -3.521 15.782 1.00 0.00 C ATOM 884 O SER A 58 12.364 -3.777 15.791 1.00 0.00 O ATOM 885 CB SER A 58 11.401 -1.122 16.450 1.00 0.00 C ATOM 886 OG SER A 58 10.862 0.189 16.344 1.00 0.00 O ATOM 0 H SER A 58 8.976 -1.717 16.740 1.00 0.00 H new ATOM 0 HA SER A 58 10.839 -1.838 14.505 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.341 -1.460 17.485 1.00 0.00 H new ATOM 0 HB3 SER A 58 12.457 -1.107 16.180 1.00 0.00 H new ATOM 0 HG SER A 58 11.357 0.795 16.934 1.00 0.00 H new ATOM 892 N GLU A 59 10.225 -4.436 15.966 1.00 0.00 N ATOM 893 CA GLU A 59 10.551 -5.828 16.214 1.00 0.00 C ATOM 894 C GLU A 59 10.915 -6.534 14.909 1.00 0.00 C ATOM 895 O GLU A 59 10.126 -6.566 13.962 1.00 0.00 O ATOM 896 CB GLU A 59 9.377 -6.519 16.916 1.00 0.00 C ATOM 897 CG GLU A 59 8.046 -6.370 16.194 1.00 0.00 C ATOM 898 CD GLU A 59 6.870 -6.686 17.088 1.00 0.00 C ATOM 899 OE1 GLU A 59 6.586 -7.880 17.310 1.00 0.00 O ATOM 900 OE2 GLU A 59 6.238 -5.736 17.601 1.00 0.00 O ATOM 0 H GLU A 59 9.225 -4.237 15.948 1.00 0.00 H new ATOM 0 HA GLU A 59 11.420 -5.882 16.869 1.00 0.00 H new ATOM 0 HB2 GLU A 59 9.604 -7.580 17.021 1.00 0.00 H new ATOM 0 HB3 GLU A 59 9.279 -6.113 17.923 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.951 -5.351 15.819 1.00 0.00 H new ATOM 0 HG3 GLU A 59 8.029 -7.031 15.328 1.00 0.00 H new ATOM 907 N PRO A 60 12.133 -7.086 14.837 1.00 0.00 N ATOM 908 CA PRO A 60 12.619 -7.769 13.642 1.00 0.00 C ATOM 909 C PRO A 60 12.003 -9.153 13.476 1.00 0.00 C ATOM 910 O PRO A 60 11.256 -9.624 14.335 1.00 0.00 O ATOM 911 CB PRO A 60 14.123 -7.873 13.886 1.00 0.00 C ATOM 912 CG PRO A 60 14.259 -7.915 15.368 1.00 0.00 C ATOM 913 CD PRO A 60 13.132 -7.086 15.920 1.00 0.00 C ATOM 0 HA PRO A 60 12.359 -7.235 12.728 1.00 0.00 H new ATOM 0 HB2 PRO A 60 14.539 -8.768 13.424 1.00 0.00 H new ATOM 0 HB3 PRO A 60 14.654 -7.020 13.463 1.00 0.00 H new ATOM 0 HG2 PRO A 60 14.203 -8.940 15.734 1.00 0.00 H new ATOM 0 HG3 PRO A 60 15.224 -7.517 15.681 1.00 0.00 H new ATOM 0 HD2 PRO A 60 12.729 -7.518 16.836 1.00 0.00 H new ATOM 0 HD3 PRO A 60 13.460 -6.075 16.162 1.00 0.00 H new ATOM 921 N GLY A 61 12.325 -9.804 12.374 1.00 0.00 N ATOM 922 CA GLY A 61 11.747 -11.093 12.084 1.00 0.00 C ATOM 923 C GLY A 61 10.627 -10.967 11.081 1.00 0.00 C ATOM 924 O GLY A 61 10.551 -9.973 10.361 1.00 0.00 O ATOM 0 H GLY A 61 12.980 -9.460 11.672 1.00 0.00 H new ATOM 0 HA2 GLY A 61 12.515 -11.761 11.695 1.00 0.00 H new ATOM 0 HA3 GLY A 61 11.369 -11.542 13.003 1.00 0.00 H new ATOM 928 N GLU A 62 9.748 -11.944 11.037 1.00 0.00 N ATOM 929 CA GLU A 62 8.653 -11.913 10.089 1.00 0.00 C ATOM 930 C GLU A 62 7.383 -11.446 10.788 1.00 0.00 C ATOM 931 O GLU A 62 6.816 -12.166 11.608 1.00 0.00 O ATOM 932 CB GLU A 62 8.459 -13.294 9.460 1.00 0.00 C ATOM 933 CG GLU A 62 7.516 -13.296 8.272 1.00 0.00 C ATOM 934 CD GLU A 62 7.443 -14.639 7.578 1.00 0.00 C ATOM 935 OE1 GLU A 62 6.722 -15.530 8.070 1.00 0.00 O ATOM 936 OE2 GLU A 62 8.099 -14.807 6.530 1.00 0.00 O ATOM 0 H GLU A 62 9.768 -12.765 11.642 1.00 0.00 H new ATOM 0 HA GLU A 62 8.886 -11.210 9.289 1.00 0.00 H new ATOM 0 HB2 GLU A 62 9.429 -13.679 9.144 1.00 0.00 H new ATOM 0 HB3 GLU A 62 8.076 -13.978 10.218 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.518 -13.011 8.606 1.00 0.00 H new ATOM 0 HG3 GLU A 62 7.840 -12.540 7.556 1.00 0.00 H new ATOM 943 N HIS A 63 6.961 -10.227 10.492 1.00 0.00 N ATOM 944 CA HIS A 63 5.758 -9.668 11.095 1.00 0.00 C ATOM 945 C HIS A 63 4.882 -9.039 10.027 1.00 0.00 C ATOM 946 O HIS A 63 5.382 -8.462 9.063 1.00 0.00 O ATOM 947 CB HIS A 63 6.101 -8.624 12.165 1.00 0.00 C ATOM 948 CG HIS A 63 6.770 -9.195 13.381 1.00 0.00 C ATOM 949 ND1 HIS A 63 6.078 -9.794 14.414 1.00 0.00 N ATOM 950 CD2 HIS A 63 8.078 -9.260 13.724 1.00 0.00 C ATOM 951 CE1 HIS A 63 6.931 -10.200 15.334 1.00 0.00 C ATOM 952 NE2 HIS A 63 8.151 -9.889 14.942 1.00 0.00 N ATOM 0 H HIS A 63 7.433 -9.604 9.837 1.00 0.00 H new ATOM 0 HA HIS A 63 5.217 -10.483 11.576 1.00 0.00 H new ATOM 0 HB2 HIS A 63 6.752 -7.868 11.725 1.00 0.00 H new ATOM 0 HB3 HIS A 63 5.186 -8.117 12.470 1.00 0.00 H new ATOM 0 HD2 HIS A 63 8.910 -8.886 13.146 1.00 0.00 H new ATOM 0 HE1 HIS A 63 6.674 -10.703 16.254 1.00 0.00 H new ATOM 0 HE2 HIS A 63 9.008 -10.084 15.459 1.00 0.00 H new ATOM 961 N ASP A 64 3.580 -9.152 10.201 1.00 0.00 N ATOM 962 CA ASP A 64 2.637 -8.630 9.228 1.00 0.00 C ATOM 963 C ASP A 64 2.192 -7.227 9.607 1.00 0.00 C ATOM 964 O ASP A 64 2.011 -6.911 10.784 1.00 0.00 O ATOM 965 CB ASP A 64 1.425 -9.559 9.079 1.00 0.00 C ATOM 966 CG ASP A 64 0.626 -9.713 10.358 1.00 0.00 C ATOM 967 OD1 ASP A 64 -0.291 -8.903 10.595 1.00 0.00 O ATOM 968 OD2 ASP A 64 0.903 -10.662 11.124 1.00 0.00 O ATOM 0 H ASP A 64 3.149 -9.602 11.009 1.00 0.00 H new ATOM 0 HA ASP A 64 3.145 -8.581 8.265 1.00 0.00 H new ATOM 0 HB2 ASP A 64 0.773 -9.171 8.296 1.00 0.00 H new ATOM 0 HB3 ASP A 64 1.767 -10.541 8.752 1.00 0.00 H new ATOM 973 N TYR A 65 2.047 -6.383 8.600 1.00 0.00 N ATOM 974 CA TYR A 65 1.619 -5.011 8.799 1.00 0.00 C ATOM 975 C TYR A 65 0.535 -4.652 7.795 1.00 0.00 C ATOM 976 O TYR A 65 0.342 -5.351 6.799 1.00 0.00 O ATOM 977 CB TYR A 65 2.806 -4.052 8.689 1.00 0.00 C ATOM 978 CG TYR A 65 3.800 -4.207 9.820 1.00 0.00 C ATOM 979 CD1 TYR A 65 3.599 -3.567 11.036 1.00 0.00 C ATOM 980 CD2 TYR A 65 4.931 -5.002 9.676 1.00 0.00 C ATOM 981 CE1 TYR A 65 4.496 -3.712 12.076 1.00 0.00 C ATOM 982 CE2 TYR A 65 5.831 -5.156 10.714 1.00 0.00 C ATOM 983 CZ TYR A 65 5.609 -4.507 11.911 1.00 0.00 C ATOM 984 OH TYR A 65 6.499 -4.659 12.950 1.00 0.00 O ATOM 0 H TYR A 65 2.222 -6.629 7.626 1.00 0.00 H new ATOM 0 HA TYR A 65 1.206 -4.916 9.803 1.00 0.00 H new ATOM 0 HB2 TYR A 65 3.315 -4.220 7.740 1.00 0.00 H new ATOM 0 HB3 TYR A 65 2.437 -3.026 8.675 1.00 0.00 H new ATOM 0 HD1 TYR A 65 2.726 -2.945 11.171 1.00 0.00 H new ATOM 0 HD2 TYR A 65 5.110 -5.507 8.738 1.00 0.00 H new ATOM 0 HE1 TYR A 65 4.326 -3.205 13.014 1.00 0.00 H new ATOM 0 HE2 TYR A 65 6.703 -5.781 10.589 1.00 0.00 H new ATOM 0 HH TYR A 65 7.111 -3.894 12.971 1.00 0.00 H new ATOM 994 N GLU A 66 -0.167 -3.565 8.059 1.00 0.00 N ATOM 995 CA GLU A 66 -1.337 -3.203 7.277 1.00 0.00 C ATOM 996 C GLU A 66 -0.972 -2.257 6.146 1.00 0.00 C ATOM 997 O GLU A 66 -0.147 -1.359 6.318 1.00 0.00 O ATOM 998 CB GLU A 66 -2.373 -2.539 8.179 1.00 0.00 C ATOM 999 CG GLU A 66 -2.808 -3.407 9.344 1.00 0.00 C ATOM 1000 CD GLU A 66 -3.576 -2.623 10.382 1.00 0.00 C ATOM 1001 OE1 GLU A 66 -4.808 -2.478 10.236 1.00 0.00 O ATOM 1002 OE2 GLU A 66 -2.949 -2.144 11.351 1.00 0.00 O ATOM 0 H GLU A 66 0.054 -2.914 8.813 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.750 -4.114 6.844 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -1.962 -1.606 8.565 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -3.248 -2.279 7.583 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -3.428 -4.224 8.975 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.930 -3.858 9.807 1.00 0.00 H new ATOM 1009 N VAL A 67 -1.586 -2.466 4.991 1.00 0.00 N ATOM 1010 CA VAL A 67 -1.450 -1.535 3.886 1.00 0.00 C ATOM 1011 C VAL A 67 -2.377 -0.348 4.113 1.00 0.00 C ATOM 1012 O VAL A 67 -3.601 -0.474 4.042 1.00 0.00 O ATOM 1013 CB VAL A 67 -1.771 -2.198 2.530 1.00 0.00 C ATOM 1014 CG1 VAL A 67 -1.655 -1.190 1.395 1.00 0.00 C ATOM 1015 CG2 VAL A 67 -0.851 -3.385 2.287 1.00 0.00 C ATOM 0 H VAL A 67 -2.182 -3.271 4.797 1.00 0.00 H new ATOM 0 HA VAL A 67 -0.413 -1.202 3.850 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.799 -2.558 2.561 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -1.886 -1.679 0.449 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -2.357 -0.373 1.561 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.640 -0.795 1.361 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.091 -3.841 1.326 1.00 0.00 H new ATOM 0 HG22 VAL A 67 0.185 -3.047 2.279 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.987 -4.119 3.081 1.00 0.00 H new ATOM 1025 N LYS A 68 -1.787 0.791 4.424 1.00 0.00 N ATOM 1026 CA LYS A 68 -2.552 1.982 4.736 1.00 0.00 C ATOM 1027 C LYS A 68 -2.419 2.988 3.604 1.00 0.00 C ATOM 1028 O LYS A 68 -1.330 3.498 3.339 1.00 0.00 O ATOM 1029 CB LYS A 68 -2.059 2.595 6.049 1.00 0.00 C ATOM 1030 CG LYS A 68 -1.834 1.571 7.152 1.00 0.00 C ATOM 1031 CD LYS A 68 -1.261 2.206 8.410 1.00 0.00 C ATOM 1032 CE LYS A 68 -2.309 3.011 9.162 1.00 0.00 C ATOM 1033 NZ LYS A 68 -1.778 3.556 10.442 1.00 0.00 N ATOM 0 H LYS A 68 -0.776 0.916 4.467 1.00 0.00 H new ATOM 0 HA LYS A 68 -3.602 1.713 4.850 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -1.127 3.128 5.864 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.785 3.332 6.392 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -2.778 1.082 7.391 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -1.155 0.797 6.795 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.863 1.428 9.062 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -0.427 2.855 8.143 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.656 3.832 8.534 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -3.173 2.380 9.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -2.523 4.098 10.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.471 2.772 11.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.969 4.179 10.245 1.00 0.00 H new ATOM 1047 N VAL A 69 -3.517 3.254 2.923 1.00 0.00 N ATOM 1048 CA VAL A 69 -3.515 4.190 1.812 1.00 0.00 C ATOM 1049 C VAL A 69 -3.877 5.589 2.300 1.00 0.00 C ATOM 1050 O VAL A 69 -4.736 5.746 3.171 1.00 0.00 O ATOM 1051 CB VAL A 69 -4.509 3.756 0.713 1.00 0.00 C ATOM 1052 CG1 VAL A 69 -4.408 4.665 -0.505 1.00 0.00 C ATOM 1053 CG2 VAL A 69 -4.275 2.303 0.320 1.00 0.00 C ATOM 0 H VAL A 69 -4.426 2.834 3.120 1.00 0.00 H new ATOM 0 HA VAL A 69 -2.511 4.199 1.388 1.00 0.00 H new ATOM 0 HB VAL A 69 -5.518 3.845 1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.119 4.337 -1.264 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -4.636 5.690 -0.214 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.397 4.619 -0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.986 2.017 -0.455 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -3.259 2.187 -0.058 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -4.413 1.664 1.192 1.00 0.00 H new ATOM 1063 N GLU A 70 -3.199 6.599 1.768 1.00 0.00 N ATOM 1064 CA GLU A 70 -3.532 7.981 2.084 1.00 0.00 C ATOM 1065 C GLU A 70 -4.912 8.323 1.533 1.00 0.00 C ATOM 1066 O GLU A 70 -5.213 8.015 0.381 1.00 0.00 O ATOM 1067 CB GLU A 70 -2.473 8.930 1.517 1.00 0.00 C ATOM 1068 CG GLU A 70 -1.142 8.860 2.252 1.00 0.00 C ATOM 1069 CD GLU A 70 -1.212 9.453 3.647 1.00 0.00 C ATOM 1070 OE1 GLU A 70 -1.982 8.941 4.486 1.00 0.00 O ATOM 1071 OE2 GLU A 70 -0.499 10.445 3.908 1.00 0.00 O ATOM 0 H GLU A 70 -2.420 6.487 1.119 1.00 0.00 H new ATOM 0 HA GLU A 70 -3.550 8.101 3.167 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -2.311 8.695 0.465 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.851 9.952 1.561 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -0.823 7.820 2.319 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -0.384 9.389 1.674 1.00 0.00 H new ATOM 1078 N PRO A 71 -5.768 8.947 2.358 1.00 0.00 N ATOM 1079 CA PRO A 71 -7.152 9.257 1.986 1.00 0.00 C ATOM 1080 C PRO A 71 -7.243 10.095 0.714 1.00 0.00 C ATOM 1081 O PRO A 71 -6.806 11.248 0.680 1.00 0.00 O ATOM 1082 CB PRO A 71 -7.693 10.044 3.189 1.00 0.00 C ATOM 1083 CG PRO A 71 -6.490 10.460 3.967 1.00 0.00 C ATOM 1084 CD PRO A 71 -5.450 9.408 3.717 1.00 0.00 C ATOM 0 HA PRO A 71 -7.719 8.351 1.769 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -8.269 10.910 2.864 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -8.358 9.428 3.794 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -6.138 11.440 3.646 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -6.720 10.536 5.030 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -4.441 9.815 3.780 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -5.513 8.598 4.443 1.00 0.00 H new ATOM 1092 N ILE A 72 -7.799 9.498 -0.331 1.00 0.00 N ATOM 1093 CA ILE A 72 -7.950 10.174 -1.609 1.00 0.00 C ATOM 1094 C ILE A 72 -9.209 11.034 -1.599 1.00 0.00 C ATOM 1095 O ILE A 72 -10.306 10.533 -1.350 1.00 0.00 O ATOM 1096 CB ILE A 72 -8.036 9.181 -2.798 1.00 0.00 C ATOM 1097 CG1 ILE A 72 -6.876 8.177 -2.778 1.00 0.00 C ATOM 1098 CG2 ILE A 72 -8.043 9.936 -4.120 1.00 0.00 C ATOM 1099 CD1 ILE A 72 -7.147 6.945 -1.937 1.00 0.00 C ATOM 0 H ILE A 72 -8.154 8.542 -0.317 1.00 0.00 H new ATOM 0 HA ILE A 72 -7.062 10.792 -1.745 1.00 0.00 H new ATOM 0 HB ILE A 72 -8.968 8.625 -2.695 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -6.659 7.867 -3.800 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -5.983 8.675 -2.399 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -8.104 9.226 -4.944 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -8.903 10.604 -4.153 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -7.127 10.520 -4.211 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -6.282 6.283 -1.972 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -7.334 7.243 -0.905 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -8.020 6.422 -2.328 1.00 0.00 H new ATOM 1111 N PRO A 73 -9.069 12.341 -1.842 1.00 0.00 N ATOM 1112 CA PRO A 73 -10.213 13.248 -1.929 1.00 0.00 C ATOM 1113 C PRO A 73 -11.031 13.006 -3.196 1.00 0.00 C ATOM 1114 O PRO A 73 -10.474 12.658 -4.239 1.00 0.00 O ATOM 1115 CB PRO A 73 -9.567 14.636 -1.961 1.00 0.00 C ATOM 1116 CG PRO A 73 -8.203 14.408 -2.512 1.00 0.00 C ATOM 1117 CD PRO A 73 -7.787 13.042 -2.046 1.00 0.00 C ATOM 0 HA PRO A 73 -10.911 13.114 -1.103 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -10.137 15.323 -2.587 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -9.523 15.075 -0.964 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.208 14.463 -3.601 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.508 15.169 -2.158 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -7.167 12.537 -2.787 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -7.206 13.092 -1.125 1.00 0.00 H new ATOM 1125 N ASN A 74 -12.355 13.146 -3.077 1.00 0.00 N ATOM 1126 CA ASN A 74 -13.283 13.014 -4.213 1.00 0.00 C ATOM 1127 C ASN A 74 -13.461 11.553 -4.650 1.00 0.00 C ATOM 1128 O ASN A 74 -14.473 11.195 -5.250 1.00 0.00 O ATOM 1129 CB ASN A 74 -12.819 13.885 -5.396 1.00 0.00 C ATOM 1130 CG ASN A 74 -13.713 13.768 -6.618 1.00 0.00 C ATOM 1131 OD1 ASN A 74 -14.720 14.467 -6.735 1.00 0.00 O ATOM 1132 ND2 ASN A 74 -13.338 12.901 -7.547 1.00 0.00 N ATOM 0 H ASN A 74 -12.817 13.354 -2.192 1.00 0.00 H new ATOM 0 HA ASN A 74 -14.257 13.368 -3.877 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -12.784 14.927 -5.079 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -11.803 13.601 -5.670 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -13.891 12.794 -8.398 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -12.497 12.340 -7.412 1.00 0.00 H new ATOM 1139 N ILE A 75 -12.485 10.714 -4.341 1.00 0.00 N ATOM 1140 CA ILE A 75 -12.537 9.311 -4.719 1.00 0.00 C ATOM 1141 C ILE A 75 -12.777 8.428 -3.499 1.00 0.00 C ATOM 1142 O ILE A 75 -12.046 8.506 -2.512 1.00 0.00 O ATOM 1143 CB ILE A 75 -11.233 8.876 -5.424 1.00 0.00 C ATOM 1144 CG1 ILE A 75 -11.013 9.698 -6.697 1.00 0.00 C ATOM 1145 CG2 ILE A 75 -11.266 7.392 -5.750 1.00 0.00 C ATOM 1146 CD1 ILE A 75 -12.100 9.521 -7.734 1.00 0.00 C ATOM 0 H ILE A 75 -11.645 10.981 -3.828 1.00 0.00 H new ATOM 0 HA ILE A 75 -13.368 9.191 -5.414 1.00 0.00 H new ATOM 0 HB ILE A 75 -10.401 9.058 -4.744 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -10.947 10.753 -6.430 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -10.055 9.420 -7.137 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -10.338 7.108 -6.246 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -11.375 6.819 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.108 7.183 -6.409 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.874 10.134 -8.606 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -12.153 8.474 -8.031 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -13.058 9.827 -7.313 1.00 0.00 H new ATOM 1158 N LYS A 76 -13.807 7.598 -3.569 1.00 0.00 N ATOM 1159 CA LYS A 76 -14.136 6.687 -2.479 1.00 0.00 C ATOM 1160 C LYS A 76 -13.374 5.376 -2.643 1.00 0.00 C ATOM 1161 O LYS A 76 -13.440 4.746 -3.693 1.00 0.00 O ATOM 1162 CB LYS A 76 -15.645 6.420 -2.460 1.00 0.00 C ATOM 1163 CG LYS A 76 -16.085 5.403 -1.418 1.00 0.00 C ATOM 1164 CD LYS A 76 -17.576 5.128 -1.516 1.00 0.00 C ATOM 1165 CE LYS A 76 -18.022 4.049 -0.540 1.00 0.00 C ATOM 1166 NZ LYS A 76 -17.798 4.438 0.876 1.00 0.00 N ATOM 0 H LYS A 76 -14.433 7.535 -4.372 1.00 0.00 H new ATOM 0 HA LYS A 76 -13.845 7.146 -1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -16.167 7.360 -2.277 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -15.953 6.071 -3.445 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -15.531 4.474 -1.556 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -15.845 5.773 -0.421 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -18.128 6.047 -1.318 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -17.822 4.821 -2.533 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -19.081 3.840 -0.693 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -17.481 3.127 -0.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -18.224 3.726 1.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -16.777 4.497 1.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -18.237 5.364 1.055 1.00 0.00 H new ATOM 1180 N ILE A 77 -12.646 4.972 -1.615 1.00 0.00 N ATOM 1181 CA ILE A 77 -11.911 3.715 -1.661 1.00 0.00 C ATOM 1182 C ILE A 77 -12.856 2.546 -1.377 1.00 0.00 C ATOM 1183 O ILE A 77 -13.703 2.621 -0.487 1.00 0.00 O ATOM 1184 CB ILE A 77 -10.723 3.709 -0.663 1.00 0.00 C ATOM 1185 CG1 ILE A 77 -9.884 2.437 -0.830 1.00 0.00 C ATOM 1186 CG2 ILE A 77 -11.219 3.837 0.772 1.00 0.00 C ATOM 1187 CD1 ILE A 77 -8.636 2.414 0.030 1.00 0.00 C ATOM 0 H ILE A 77 -12.547 5.491 -0.743 1.00 0.00 H new ATOM 0 HA ILE A 77 -11.496 3.605 -2.663 1.00 0.00 H new ATOM 0 HB ILE A 77 -10.092 4.570 -0.883 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.500 1.571 -0.585 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -9.596 2.337 -1.876 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -10.368 3.830 1.453 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -11.767 4.772 0.885 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -11.877 3.000 1.006 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -8.093 1.484 -0.141 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -7.999 3.259 -0.230 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -8.917 2.482 1.081 1.00 0.00 H new ATOM 1199 N VAL A 78 -12.737 1.484 -2.158 1.00 0.00 N ATOM 1200 CA VAL A 78 -13.613 0.329 -2.007 1.00 0.00 C ATOM 1201 C VAL A 78 -12.884 -0.820 -1.327 1.00 0.00 C ATOM 1202 O VAL A 78 -13.213 -1.212 -0.206 1.00 0.00 O ATOM 1203 CB VAL A 78 -14.137 -0.164 -3.371 1.00 0.00 C ATOM 1204 CG1 VAL A 78 -15.131 -1.302 -3.194 1.00 0.00 C ATOM 1205 CG2 VAL A 78 -14.754 0.978 -4.158 1.00 0.00 C ATOM 0 H VAL A 78 -12.045 1.396 -2.902 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.454 0.650 -1.392 1.00 0.00 H new ATOM 0 HB VAL A 78 -13.289 -0.546 -3.939 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -15.485 -1.631 -4.171 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -14.645 -2.134 -2.685 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.977 -0.957 -2.599 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -15.116 0.606 -5.116 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -15.586 1.400 -3.595 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.003 1.749 -4.329 1.00 0.00 H new ATOM 1215 N GLU A 79 -11.876 -1.334 -2.005 1.00 0.00 N ATOM 1216 CA GLU A 79 -11.188 -2.530 -1.557 1.00 0.00 C ATOM 1217 C GLU A 79 -9.707 -2.252 -1.373 1.00 0.00 C ATOM 1218 O GLU A 79 -9.092 -1.571 -2.189 1.00 0.00 O ATOM 1219 CB GLU A 79 -11.390 -3.655 -2.575 1.00 0.00 C ATOM 1220 CG GLU A 79 -10.694 -4.954 -2.205 1.00 0.00 C ATOM 1221 CD GLU A 79 -10.843 -6.017 -3.272 1.00 0.00 C ATOM 1222 OE1 GLU A 79 -11.860 -6.736 -3.257 1.00 0.00 O ATOM 1223 OE2 GLU A 79 -9.946 -6.132 -4.131 1.00 0.00 O ATOM 0 H GLU A 79 -11.514 -0.940 -2.873 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.604 -2.837 -0.597 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -12.458 -3.845 -2.684 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -11.024 -3.322 -3.546 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.635 -4.759 -2.036 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -11.103 -5.327 -1.266 1.00 0.00 H new ATOM 1230 N ILE A 80 -9.148 -2.771 -0.292 1.00 0.00 N ATOM 1231 CA ILE A 80 -7.729 -2.640 -0.029 1.00 0.00 C ATOM 1232 C ILE A 80 -7.024 -3.950 -0.355 1.00 0.00 C ATOM 1233 O ILE A 80 -7.212 -4.953 0.331 1.00 0.00 O ATOM 1234 CB ILE A 80 -7.459 -2.259 1.444 1.00 0.00 C ATOM 1235 CG1 ILE A 80 -8.229 -0.987 1.812 1.00 0.00 C ATOM 1236 CG2 ILE A 80 -5.965 -2.066 1.679 1.00 0.00 C ATOM 1237 CD1 ILE A 80 -8.097 -0.593 3.268 1.00 0.00 C ATOM 0 H ILE A 80 -9.662 -3.290 0.420 1.00 0.00 H new ATOM 0 HA ILE A 80 -7.342 -1.841 -0.662 1.00 0.00 H new ATOM 0 HB ILE A 80 -7.805 -3.071 2.083 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -7.874 -0.166 1.189 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -9.284 -1.132 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -5.792 -1.798 2.721 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -5.438 -2.992 1.450 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -5.595 -1.269 1.034 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -8.669 0.316 3.452 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -8.479 -1.396 3.898 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -7.048 -0.415 3.503 1.00 0.00 H new ATOM 1249 N SER A 81 -6.246 -3.948 -1.422 1.00 0.00 N ATOM 1250 CA SER A 81 -5.505 -5.131 -1.819 1.00 0.00 C ATOM 1251 C SER A 81 -4.126 -4.745 -2.344 1.00 0.00 C ATOM 1252 O SER A 81 -4.012 -3.934 -3.267 1.00 0.00 O ATOM 1253 CB SER A 81 -6.289 -5.918 -2.871 1.00 0.00 C ATOM 1254 OG SER A 81 -6.729 -5.078 -3.925 1.00 0.00 O ATOM 0 H SER A 81 -6.111 -3.140 -2.029 1.00 0.00 H new ATOM 0 HA SER A 81 -5.368 -5.769 -0.946 1.00 0.00 H new ATOM 0 HB2 SER A 81 -5.662 -6.713 -3.275 1.00 0.00 H new ATOM 0 HB3 SER A 81 -7.149 -6.397 -2.403 1.00 0.00 H new ATOM 0 HG SER A 81 -5.999 -4.484 -4.196 1.00 0.00 H new ATOM 1260 N PRO A 82 -3.056 -5.312 -1.761 1.00 0.00 N ATOM 1261 CA PRO A 82 -3.154 -6.292 -0.666 1.00 0.00 C ATOM 1262 C PRO A 82 -3.687 -5.690 0.636 1.00 0.00 C ATOM 1263 O PRO A 82 -3.658 -4.477 0.831 1.00 0.00 O ATOM 1264 CB PRO A 82 -1.711 -6.768 -0.482 1.00 0.00 C ATOM 1265 CG PRO A 82 -0.873 -5.654 -1.008 1.00 0.00 C ATOM 1266 CD PRO A 82 -1.657 -5.047 -2.136 1.00 0.00 C ATOM 0 HA PRO A 82 -3.858 -7.088 -0.908 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.491 -6.967 0.567 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.527 -7.693 -1.028 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -0.671 -4.916 -0.231 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.092 -6.022 -1.357 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -1.462 -3.979 -2.232 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.404 -5.504 -3.093 1.00 0.00 H new ATOM 1274 N ARG A 83 -4.177 -6.556 1.515 1.00 0.00 N ATOM 1275 CA ARG A 83 -4.731 -6.133 2.796 1.00 0.00 C ATOM 1276 C ARG A 83 -3.631 -6.014 3.840 1.00 0.00 C ATOM 1277 O ARG A 83 -3.270 -4.917 4.270 1.00 0.00 O ATOM 1278 CB ARG A 83 -5.780 -7.143 3.270 1.00 0.00 C ATOM 1279 CG ARG A 83 -7.102 -7.063 2.529 1.00 0.00 C ATOM 1280 CD ARG A 83 -7.883 -8.360 2.648 1.00 0.00 C ATOM 1281 NE ARG A 83 -7.393 -9.374 1.711 1.00 0.00 N ATOM 1282 CZ ARG A 83 -6.944 -10.579 2.067 1.00 0.00 C ATOM 1283 NH1 ARG A 83 -6.884 -10.922 3.347 1.00 0.00 N ATOM 1284 NH2 ARG A 83 -6.546 -11.438 1.134 1.00 0.00 N ATOM 0 H ARG A 83 -4.202 -7.564 1.362 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.199 -5.157 2.665 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -5.375 -8.149 3.160 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -5.963 -6.988 4.333 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -7.696 -6.241 2.929 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -6.919 -6.842 1.477 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -7.807 -8.739 3.667 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -8.939 -8.168 2.457 1.00 0.00 H new ATOM 0 HE ARG A 83 -7.395 -9.143 0.718 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -7.182 -10.263 4.066 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -6.540 -11.845 3.612 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -6.584 -11.175 0.149 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -6.202 -12.360 1.403 1.00 0.00 H new ATOM 1298 N VAL A 84 -3.103 -7.158 4.242 1.00 0.00 N ATOM 1299 CA VAL A 84 -2.038 -7.214 5.224 1.00 0.00 C ATOM 1300 C VAL A 84 -0.830 -7.913 4.619 1.00 0.00 C ATOM 1301 O VAL A 84 -0.958 -8.996 4.049 1.00 0.00 O ATOM 1302 CB VAL A 84 -2.490 -7.963 6.498 1.00 0.00 C ATOM 1303 CG1 VAL A 84 -1.371 -8.020 7.526 1.00 0.00 C ATOM 1304 CG2 VAL A 84 -3.726 -7.308 7.098 1.00 0.00 C ATOM 0 H VAL A 84 -3.401 -8.070 3.897 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.776 -6.194 5.506 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.742 -8.984 6.212 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -1.717 -8.553 8.412 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.513 -8.541 7.101 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.079 -7.007 7.803 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -4.027 -7.851 7.994 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.499 -6.274 7.359 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.538 -7.329 6.371 1.00 0.00 H new ATOM 1314 N VAL A 85 0.331 -7.292 4.728 1.00 0.00 N ATOM 1315 CA VAL A 85 1.544 -7.854 4.155 1.00 0.00 C ATOM 1316 C VAL A 85 2.492 -8.326 5.248 1.00 0.00 C ATOM 1317 O VAL A 85 2.705 -7.634 6.245 1.00 0.00 O ATOM 1318 CB VAL A 85 2.268 -6.846 3.233 1.00 0.00 C ATOM 1319 CG1 VAL A 85 1.447 -6.583 1.980 1.00 0.00 C ATOM 1320 CG2 VAL A 85 2.553 -5.540 3.963 1.00 0.00 C ATOM 0 H VAL A 85 0.461 -6.401 5.206 1.00 0.00 H new ATOM 0 HA VAL A 85 1.242 -8.709 3.550 1.00 0.00 H new ATOM 0 HB VAL A 85 3.222 -7.286 2.941 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.973 -5.871 1.343 1.00 0.00 H new ATOM 0 HG12 VAL A 85 1.302 -7.517 1.437 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.477 -6.172 2.260 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.063 -4.851 3.290 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.614 -5.096 4.294 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.186 -5.737 4.828 1.00 0.00 H new ATOM 1330 N THR A 86 3.043 -9.512 5.066 1.00 0.00 N ATOM 1331 CA THR A 86 3.977 -10.069 6.028 1.00 0.00 C ATOM 1332 C THR A 86 5.408 -9.717 5.633 1.00 0.00 C ATOM 1333 O THR A 86 5.921 -10.199 4.623 1.00 0.00 O ATOM 1334 CB THR A 86 3.817 -11.596 6.143 1.00 0.00 C ATOM 1335 OG1 THR A 86 2.439 -11.930 6.358 1.00 0.00 O ATOM 1336 CG2 THR A 86 4.640 -12.141 7.295 1.00 0.00 C ATOM 0 H THR A 86 2.860 -10.109 4.260 1.00 0.00 H new ATOM 0 HA THR A 86 3.757 -9.634 7.003 1.00 0.00 H new ATOM 0 HB THR A 86 4.168 -12.042 5.212 1.00 0.00 H new ATOM 0 HG1 THR A 86 2.345 -12.903 6.428 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.510 -13.222 7.356 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.693 -11.911 7.131 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.309 -11.683 8.227 1.00 0.00 H new ATOM 1344 N LEU A 87 6.044 -8.865 6.429 1.00 0.00 N ATOM 1345 CA LEU A 87 7.361 -8.343 6.099 1.00 0.00 C ATOM 1346 C LEU A 87 8.444 -8.980 6.964 1.00 0.00 C ATOM 1347 O LEU A 87 8.259 -9.192 8.164 1.00 0.00 O ATOM 1348 CB LEU A 87 7.387 -6.821 6.280 1.00 0.00 C ATOM 1349 CG LEU A 87 6.362 -6.041 5.450 1.00 0.00 C ATOM 1350 CD1 LEU A 87 6.441 -4.557 5.772 1.00 0.00 C ATOM 1351 CD2 LEU A 87 6.586 -6.273 3.964 1.00 0.00 C ATOM 0 H LEU A 87 5.665 -8.521 7.311 1.00 0.00 H new ATOM 0 HA LEU A 87 7.565 -8.590 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 87 7.223 -6.595 7.334 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.384 -6.459 6.028 1.00 0.00 H new ATOM 0 HG LEU A 87 5.366 -6.402 5.707 1.00 0.00 H new ATOM 0 HD11 LEU A 87 5.707 -4.016 5.175 1.00 0.00 H new ATOM 0 HD12 LEU A 87 6.232 -4.403 6.831 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.440 -4.187 5.542 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.848 -5.710 3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.587 -5.940 3.691 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.484 -7.335 3.742 1.00 0.00 H new ATOM 1363 N GLN A 88 9.567 -9.294 6.335 1.00 0.00 N ATOM 1364 CA GLN A 88 10.736 -9.800 7.038 1.00 0.00 C ATOM 1365 C GLN A 88 11.688 -8.653 7.364 1.00 0.00 C ATOM 1366 O GLN A 88 12.308 -8.076 6.468 1.00 0.00 O ATOM 1367 CB GLN A 88 11.451 -10.850 6.181 1.00 0.00 C ATOM 1368 CG GLN A 88 12.736 -11.392 6.796 1.00 0.00 C ATOM 1369 CD GLN A 88 12.504 -12.241 8.030 1.00 0.00 C ATOM 1370 OE1 GLN A 88 11.473 -12.900 8.170 1.00 0.00 O ATOM 1371 NE2 GLN A 88 13.472 -12.238 8.931 1.00 0.00 N ATOM 0 H GLN A 88 9.693 -9.206 5.327 1.00 0.00 H new ATOM 0 HA GLN A 88 10.413 -10.266 7.969 1.00 0.00 H new ATOM 0 HB2 GLN A 88 10.769 -11.681 6.002 1.00 0.00 H new ATOM 0 HB3 GLN A 88 11.683 -10.413 5.210 1.00 0.00 H new ATOM 0 HG2 GLN A 88 13.264 -11.986 6.050 1.00 0.00 H new ATOM 0 HG3 GLN A 88 13.386 -10.556 7.056 1.00 0.00 H new ATOM 0 HE21 GLN A 88 14.310 -11.678 8.777 1.00 0.00 H new ATOM 0 HE22 GLN A 88 13.380 -12.796 9.780 1.00 0.00 H new ATOM 1380 N LEU A 89 11.785 -8.319 8.642 1.00 0.00 N ATOM 1381 CA LEU A 89 12.656 -7.242 9.089 1.00 0.00 C ATOM 1382 C LEU A 89 13.952 -7.786 9.667 1.00 0.00 C ATOM 1383 O LEU A 89 13.943 -8.677 10.515 1.00 0.00 O ATOM 1384 CB LEU A 89 11.968 -6.381 10.150 1.00 0.00 C ATOM 1385 CG LEU A 89 10.803 -5.529 9.657 1.00 0.00 C ATOM 1386 CD1 LEU A 89 10.181 -4.765 10.817 1.00 0.00 C ATOM 1387 CD2 LEU A 89 11.265 -4.565 8.576 1.00 0.00 C ATOM 0 H LEU A 89 11.269 -8.781 9.391 1.00 0.00 H new ATOM 0 HA LEU A 89 12.879 -6.631 8.214 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.606 -7.035 10.943 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.713 -5.722 10.596 1.00 0.00 H new ATOM 0 HG LEU A 89 10.049 -6.190 9.229 1.00 0.00 H new ATOM 0 HD11 LEU A 89 9.351 -4.161 10.451 1.00 0.00 H new ATOM 0 HD12 LEU A 89 9.815 -5.471 11.563 1.00 0.00 H new ATOM 0 HD13 LEU A 89 10.931 -4.116 11.269 1.00 0.00 H new ATOM 0 HD21 LEU A 89 10.420 -3.966 8.237 1.00 0.00 H new ATOM 0 HD22 LEU A 89 12.036 -3.909 8.979 1.00 0.00 H new ATOM 0 HD23 LEU A 89 11.671 -5.128 7.736 1.00 0.00 H new ATOM 1399 N GLU A 90 15.058 -7.247 9.200 1.00 0.00 N ATOM 1400 CA GLU A 90 16.356 -7.532 9.788 1.00 0.00 C ATOM 1401 C GLU A 90 16.970 -6.241 10.308 1.00 0.00 C ATOM 1402 O GLU A 90 16.375 -5.170 10.186 1.00 0.00 O ATOM 1403 CB GLU A 90 17.301 -8.187 8.778 1.00 0.00 C ATOM 1404 CG GLU A 90 16.852 -9.561 8.309 1.00 0.00 C ATOM 1405 CD GLU A 90 18.007 -10.394 7.793 1.00 0.00 C ATOM 1406 OE1 GLU A 90 18.490 -10.136 6.671 1.00 0.00 O ATOM 1407 OE2 GLU A 90 18.463 -11.292 8.527 1.00 0.00 O ATOM 0 H GLU A 90 15.087 -6.604 8.409 1.00 0.00 H new ATOM 0 HA GLU A 90 16.211 -8.233 10.610 1.00 0.00 H new ATOM 0 HB2 GLU A 90 17.399 -7.533 7.911 1.00 0.00 H new ATOM 0 HB3 GLU A 90 18.291 -8.273 9.226 1.00 0.00 H new ATOM 0 HG2 GLU A 90 16.368 -10.085 9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 90 16.107 -9.449 7.522 1.00 0.00 H new ATOM 1414 N HIS A 91 18.146 -6.344 10.902 1.00 0.00 N ATOM 1415 CA HIS A 91 18.860 -5.171 11.379 1.00 0.00 C ATOM 1416 C HIS A 91 19.908 -4.740 10.369 1.00 0.00 C ATOM 1417 O HIS A 91 20.429 -5.559 9.621 1.00 0.00 O ATOM 1418 CB HIS A 91 19.521 -5.445 12.729 1.00 0.00 C ATOM 1419 CG HIS A 91 18.554 -5.498 13.868 1.00 0.00 C ATOM 1420 ND1 HIS A 91 18.539 -6.512 14.800 1.00 0.00 N ATOM 1421 CD2 HIS A 91 17.571 -4.642 14.228 1.00 0.00 C ATOM 1422 CE1 HIS A 91 17.587 -6.279 15.685 1.00 0.00 C ATOM 1423 NE2 HIS A 91 16.986 -5.149 15.361 1.00 0.00 N ATOM 0 H HIS A 91 18.628 -7.228 11.066 1.00 0.00 H new ATOM 0 HA HIS A 91 18.136 -4.366 11.505 1.00 0.00 H new ATOM 0 HB2 HIS A 91 20.059 -6.391 12.675 1.00 0.00 H new ATOM 0 HB3 HIS A 91 20.260 -4.669 12.927 1.00 0.00 H new ATOM 0 HD2 HIS A 91 17.297 -3.730 13.719 1.00 0.00 H new ATOM 0 HE1 HIS A 91 17.342 -6.906 16.530 1.00 0.00 H new ATOM 0 HE2 HIS A 91 16.212 -4.722 15.870 1.00 0.00 H new ATOM 1432 N HIS A 92 20.215 -3.453 10.356 1.00 0.00 N ATOM 1433 CA HIS A 92 21.187 -2.903 9.421 1.00 0.00 C ATOM 1434 C HIS A 92 22.585 -3.436 9.740 1.00 0.00 C ATOM 1435 O HIS A 92 23.415 -3.610 8.849 1.00 0.00 O ATOM 1436 CB HIS A 92 21.164 -1.371 9.486 1.00 0.00 C ATOM 1437 CG HIS A 92 21.925 -0.688 8.389 1.00 0.00 C ATOM 1438 ND1 HIS A 92 21.318 -0.128 7.285 1.00 0.00 N ATOM 1439 CD2 HIS A 92 23.248 -0.443 8.250 1.00 0.00 C ATOM 1440 CE1 HIS A 92 22.234 0.427 6.517 1.00 0.00 C ATOM 1441 NE2 HIS A 92 23.416 0.254 7.078 1.00 0.00 N ATOM 0 H HIS A 92 19.803 -2.765 10.986 1.00 0.00 H new ATOM 0 HA HIS A 92 20.925 -3.212 8.409 1.00 0.00 H new ATOM 0 HB2 HIS A 92 20.128 -1.035 9.455 1.00 0.00 H new ATOM 0 HB3 HIS A 92 21.573 -1.055 10.446 1.00 0.00 H new ATOM 0 HD2 HIS A 92 24.029 -0.741 8.934 1.00 0.00 H new ATOM 0 HE1 HIS A 92 22.048 0.938 5.584 1.00 0.00 H new ATOM 0 HE2 HIS A 92 24.306 0.583 6.704 1.00 0.00 H new