USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 983 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 130 ASN : amide:sc= -4.08! C(o=-3.6!,f=-6.1!) USER MOD Set 1.2: A 133 THR OG1 : rot 180:sc= 0.515 USER MOD Set 2.1: A 56 ASN :FLIP amide:sc= -2.19! F(o=-2.9,f=-2.2!) USER MOD Set 2.2: A 122 THR OG1 : rot -170:sc= 0 USER MOD Set 3.1: A 83 MET CE :methyl -149:sc= -3.09! (180deg=-2.49!) USER MOD Set 3.2: A 85 TYR OH : rot -13:sc= -2.1! USER MOD Set 4.1: A 82 SER OG : rot -111:sc= 1.02 USER MOD Set 4.2: A 97 MET CE :methyl -102:sc=-0.00592 (180deg=-1.46!) USER MOD Set 5.1: A 63 THR OG1 : rot -62:sc= 0.734 USER MOD Set 5.2: A 76 LYS NZ :NH3+ -171:sc= 0.0416 (180deg=-1.62) USER MOD Set 6.1: A 70 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 71 GLN : amide:sc= -2.89 K(o=-2.9,f=-7!) USER MOD Set 7.1: A 40 ASN : amide:sc= -0.55 K(o=-0.56,f=-2) USER MOD Set 7.2: A 62 HIS : no HD1:sc= -0.0112 X(o=-0.56,f=-1) USER MOD Set 8.1: A 38 GLN : amide:sc= -1.8! X(o=-0.079!,f=-0.3) USER MOD Set 8.2: A 44 SER OG : rot 35:sc= 1.72 USER MOD Single : A 9 LYS NZ :NH3+ 164:sc= -0.0064 (180deg=-0.25) USER MOD Single : A 11 LYS NZ :NH3+ -156:sc= -0.146 (180deg=-0.887) USER MOD Single : A 12 SER OG : rot -65:sc= 1.09 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc=-0.00787 USER MOD Single : A 26 LYS NZ :NH3+ 158:sc= -0.0749 (180deg=-0.635) USER MOD Single : A 30 TYR OH : rot 30:sc= -3.03! USER MOD Single : A 35 THR OG1 : rot 179:sc= -0.485 USER MOD Single : A 49 ASN : amide:sc= -0.637 X(o=-0.64,f=-0.28) USER MOD Single : A 51 SER OG : rot 180:sc= -0.224 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 160:sc= -0.234 USER MOD Single : A 69 ASN : amide:sc= -1.19 X(o=-1.2,f=-1.6) USER MOD Single : A 73 THR OG1 : rot 180:sc= -1.36 USER MOD Single : A 74 ASN : amide:sc= -2.34 K(o=-2.3,f=-9.8!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -151:sc= -2.28! (180deg=-3.35!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.295 K(o=-0.29,f=-1.9!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 146:sc= -0.276 (180deg=-1.47!) USER MOD Single : A 95 TYR OH : rot 180:sc= -0.0169 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -79:sc= -0.0113 USER MOD Single : A 99 SER OG : rot 180:sc= -0.809 USER MOD Single : A 119 LYS NZ :NH3+ 174:sc= 0.341 (180deg=0.322) USER MOD Single : A 120 GLN : amide:sc= -0.76 X(o=-0.76,f=-0.81) USER MOD Single : A 125 THR OG1 : rot 95:sc= 0.153 USER MOD Single : A 126 CYS SG : rot -85:sc= -1.04 USER MOD Single : A 129 TYR OH : rot 159:sc= -2.97! USER MOD Single : A 132 LYS NZ :NH3+ 155:sc= -0.104 (180deg=-0.546) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 32:sc= 0.00433 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.434 11.046 1.712 1.00 0.00 N ATOM 101 CA ILE A 7 10.959 11.247 1.797 1.00 0.00 C ATOM 102 C ILE A 7 10.680 12.765 1.748 1.00 0.00 C ATOM 103 O ILE A 7 11.057 13.479 2.656 1.00 0.00 O ATOM 104 CB ILE A 7 10.442 10.673 3.126 1.00 0.00 C ATOM 105 CG1 ILE A 7 11.112 9.323 3.404 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.923 10.470 3.043 1.00 0.00 C ATOM 107 CD1 ILE A 7 10.605 8.769 4.738 1.00 0.00 C ATOM 0 HA ILE A 7 10.457 10.742 0.972 1.00 0.00 H new ATOM 0 HB ILE A 7 10.678 11.370 3.930 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.891 8.622 2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.195 9.442 3.435 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.558 10.063 3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.438 11.427 2.849 1.00 0.00 H new ATOM 0 HG23 ILE A 7 8.692 9.776 2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.080 7.809 4.937 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.849 9.468 5.538 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.524 8.636 4.689 1.00 0.00 H new ATOM 119 N PRO A 8 10.048 13.280 0.711 1.00 0.00 N ATOM 120 CA PRO A 8 9.773 14.745 0.609 1.00 0.00 C ATOM 121 C PRO A 8 8.606 15.183 1.505 1.00 0.00 C ATOM 122 O PRO A 8 7.503 14.690 1.393 1.00 0.00 O ATOM 123 CB PRO A 8 9.444 14.947 -0.876 1.00 0.00 C ATOM 124 CG PRO A 8 8.867 13.640 -1.325 1.00 0.00 C ATOM 125 CD PRO A 8 9.528 12.551 -0.465 1.00 0.00 C ATOM 0 HA PRO A 8 10.617 15.347 0.946 1.00 0.00 H new ATOM 0 HB2 PRO A 8 8.733 15.761 -1.016 1.00 0.00 H new ATOM 0 HB3 PRO A 8 10.337 15.202 -1.447 1.00 0.00 H new ATOM 0 HG2 PRO A 8 7.784 13.630 -1.198 1.00 0.00 H new ATOM 0 HG3 PRO A 8 9.066 13.472 -2.383 1.00 0.00 H new ATOM 0 HD2 PRO A 8 8.810 11.785 -0.173 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.329 12.048 -1.007 1.00 0.00 H new ATOM 133 N LYS A 9 8.845 16.108 2.392 1.00 0.00 N ATOM 134 CA LYS A 9 7.755 16.576 3.294 1.00 0.00 C ATOM 135 C LYS A 9 6.606 17.143 2.457 1.00 0.00 C ATOM 136 O LYS A 9 5.550 17.457 2.969 1.00 0.00 O ATOM 137 CB LYS A 9 8.296 17.663 4.224 1.00 0.00 C ATOM 138 CG LYS A 9 9.596 17.179 4.871 1.00 0.00 C ATOM 139 CD LYS A 9 10.115 18.245 5.838 1.00 0.00 C ATOM 140 CE LYS A 9 11.399 17.748 6.504 1.00 0.00 C ATOM 141 NZ LYS A 9 12.495 17.700 5.495 1.00 0.00 N ATOM 0 H LYS A 9 9.748 16.561 2.532 1.00 0.00 H new ATOM 0 HA LYS A 9 7.390 15.738 3.888 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.476 18.580 3.663 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.560 17.898 4.993 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.423 16.244 5.403 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.342 16.975 4.103 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.307 19.175 5.302 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.361 18.463 6.595 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.675 18.409 7.325 1.00 0.00 H new ATOM 0 HE3 LYS A 9 11.240 16.758 6.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 13.412 17.629 5.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.365 16.872 4.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.475 18.566 4.919 1.00 0.00 H new ATOM 155 N ASP A 10 6.801 17.273 1.174 1.00 0.00 N ATOM 156 CA ASP A 10 5.717 17.814 0.308 1.00 0.00 C ATOM 157 C ASP A 10 4.675 16.722 0.062 1.00 0.00 C ATOM 158 O ASP A 10 4.814 15.908 -0.829 1.00 0.00 O ATOM 159 CB ASP A 10 6.309 18.268 -1.027 1.00 0.00 C ATOM 160 CG ASP A 10 7.095 19.564 -0.825 1.00 0.00 C ATOM 161 OD1 ASP A 10 8.203 19.488 -0.320 1.00 0.00 O ATOM 162 OD2 ASP A 10 6.577 20.609 -1.181 1.00 0.00 O ATOM 0 H ASP A 10 7.664 17.028 0.688 1.00 0.00 H new ATOM 0 HA ASP A 10 5.245 18.664 0.801 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.962 17.493 -1.429 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.513 18.423 -1.755 1.00 0.00 H new ATOM 167 N LYS A 11 3.633 16.696 0.846 1.00 0.00 N ATOM 168 CA LYS A 11 2.586 15.657 0.660 1.00 0.00 C ATOM 169 C LYS A 11 2.032 15.729 -0.764 1.00 0.00 C ATOM 170 O LYS A 11 1.236 14.905 -1.169 1.00 0.00 O ATOM 171 CB LYS A 11 1.457 15.899 1.665 1.00 0.00 C ATOM 172 CG LYS A 11 2.009 15.828 3.113 1.00 0.00 C ATOM 173 CD LYS A 11 1.015 15.104 4.029 1.00 0.00 C ATOM 174 CE LYS A 11 -0.272 15.925 4.140 1.00 0.00 C ATOM 175 NZ LYS A 11 0.048 17.278 4.676 1.00 0.00 N ATOM 0 H LYS A 11 3.463 17.352 1.609 1.00 0.00 H new ATOM 0 HA LYS A 11 3.018 14.670 0.823 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.004 16.874 1.487 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.673 15.154 1.529 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.966 15.306 3.119 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.193 16.835 3.489 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.793 14.114 3.631 1.00 0.00 H new ATOM 0 HD3 LYS A 11 1.453 14.960 5.017 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.746 16.012 3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.982 15.421 4.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.797 17.681 5.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.812 17.202 5.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.353 17.897 3.898 1.00 0.00 H new ATOM 189 N SER A 12 2.449 16.712 -1.525 1.00 0.00 N ATOM 190 CA SER A 12 1.957 16.857 -2.932 1.00 0.00 C ATOM 191 C SER A 12 3.097 16.549 -3.905 1.00 0.00 C ATOM 192 O SER A 12 3.259 17.210 -4.911 1.00 0.00 O ATOM 193 CB SER A 12 1.482 18.293 -3.151 1.00 0.00 C ATOM 194 OG SER A 12 1.245 18.503 -4.536 1.00 0.00 O ATOM 0 H SER A 12 3.115 17.426 -1.229 1.00 0.00 H new ATOM 0 HA SER A 12 1.133 16.164 -3.105 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.571 18.477 -2.582 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.232 18.996 -2.788 1.00 0.00 H new ATOM 0 HG SER A 12 2.089 18.424 -5.028 1.00 0.00 H new ATOM 200 N LYS A 13 3.888 15.547 -3.614 1.00 0.00 N ATOM 201 CA LYS A 13 5.025 15.190 -4.522 1.00 0.00 C ATOM 202 C LYS A 13 5.170 13.664 -4.572 1.00 0.00 C ATOM 203 O LYS A 13 5.109 12.987 -3.565 1.00 0.00 O ATOM 204 CB LYS A 13 6.326 15.821 -3.980 1.00 0.00 C ATOM 205 CG LYS A 13 6.500 17.274 -4.507 1.00 0.00 C ATOM 206 CD LYS A 13 7.494 17.309 -5.678 1.00 0.00 C ATOM 207 CE LYS A 13 6.939 16.510 -6.858 1.00 0.00 C ATOM 208 NZ LYS A 13 7.830 16.688 -8.039 1.00 0.00 N ATOM 0 H LYS A 13 3.797 14.959 -2.786 1.00 0.00 H new ATOM 0 HA LYS A 13 4.832 15.568 -5.526 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.306 15.825 -2.890 1.00 0.00 H new ATOM 0 HB3 LYS A 13 7.181 15.216 -4.281 1.00 0.00 H new ATOM 0 HG2 LYS A 13 5.536 17.668 -4.829 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.855 17.918 -3.703 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.677 18.340 -5.980 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.452 16.894 -5.365 1.00 0.00 H new ATOM 0 HE2 LYS A 13 6.870 15.454 -6.596 1.00 0.00 H new ATOM 0 HE3 LYS A 13 5.930 16.846 -7.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 7.454 16.145 -8.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 7.874 17.696 -8.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 8.785 16.347 -7.808 1.00 0.00 H new ATOM 222 N VAL A 14 5.356 13.124 -5.745 1.00 0.00 N ATOM 223 CA VAL A 14 5.501 11.648 -5.882 1.00 0.00 C ATOM 224 C VAL A 14 6.715 11.157 -5.092 1.00 0.00 C ATOM 225 O VAL A 14 7.837 11.543 -5.354 1.00 0.00 O ATOM 226 CB VAL A 14 5.695 11.294 -7.357 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.819 9.777 -7.501 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.496 11.788 -8.169 1.00 0.00 C ATOM 0 H VAL A 14 5.414 13.646 -6.620 1.00 0.00 H new ATOM 0 HA VAL A 14 4.602 11.169 -5.493 1.00 0.00 H new ATOM 0 HB VAL A 14 6.601 11.772 -7.728 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.957 9.521 -8.552 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.676 9.426 -6.926 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.912 9.301 -7.128 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.638 11.534 -9.219 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.587 11.313 -7.801 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.408 12.870 -8.066 1.00 0.00 H new ATOM 238 N ALA A 15 6.503 10.286 -4.139 1.00 0.00 N ATOM 239 CA ALA A 15 7.647 9.742 -3.345 1.00 0.00 C ATOM 240 C ALA A 15 8.069 8.405 -3.960 1.00 0.00 C ATOM 241 O ALA A 15 9.168 7.932 -3.755 1.00 0.00 O ATOM 242 CB ALA A 15 7.208 9.530 -1.891 1.00 0.00 C ATOM 0 H ALA A 15 5.585 9.927 -3.876 1.00 0.00 H new ATOM 0 HA ALA A 15 8.484 10.440 -3.362 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.043 9.133 -1.313 1.00 0.00 H new ATOM 0 HB2 ALA A 15 6.891 10.482 -1.464 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.378 8.824 -1.861 1.00 0.00 H new ATOM 248 N GLY A 16 7.196 7.797 -4.719 1.00 0.00 N ATOM 249 CA GLY A 16 7.534 6.493 -5.355 1.00 0.00 C ATOM 250 C GLY A 16 6.436 6.113 -6.351 1.00 0.00 C ATOM 251 O GLY A 16 5.591 6.917 -6.694 1.00 0.00 O ATOM 0 H GLY A 16 6.261 8.149 -4.926 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.495 6.563 -5.865 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.633 5.719 -4.594 1.00 0.00 H new ATOM 255 N TYR A 17 6.444 4.895 -6.825 1.00 0.00 N ATOM 256 CA TYR A 17 5.402 4.466 -7.809 1.00 0.00 C ATOM 257 C TYR A 17 5.164 2.956 -7.676 1.00 0.00 C ATOM 258 O TYR A 17 6.081 2.163 -7.768 1.00 0.00 O ATOM 259 CB TYR A 17 5.896 4.801 -9.243 1.00 0.00 C ATOM 260 CG TYR A 17 4.940 5.740 -9.954 1.00 0.00 C ATOM 261 CD1 TYR A 17 3.766 5.240 -10.526 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.241 7.104 -10.050 1.00 0.00 C ATOM 263 CE1 TYR A 17 2.890 6.105 -11.192 1.00 0.00 C ATOM 264 CE2 TYR A 17 4.367 7.968 -10.717 1.00 0.00 C ATOM 265 CZ TYR A 17 3.190 7.469 -11.289 1.00 0.00 C ATOM 266 OH TYR A 17 2.327 8.320 -11.947 1.00 0.00 O ATOM 0 H TYR A 17 7.125 4.178 -6.575 1.00 0.00 H new ATOM 0 HA TYR A 17 4.466 4.990 -7.614 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.885 5.257 -9.191 1.00 0.00 H new ATOM 0 HB3 TYR A 17 5.999 3.881 -9.818 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.535 4.187 -10.454 1.00 0.00 H new ATOM 0 HD2 TYR A 17 6.148 7.489 -9.609 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.982 5.720 -11.631 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.600 9.020 -10.791 1.00 0.00 H new ATOM 0 HH TYR A 17 2.684 9.232 -11.921 1.00 0.00 H new ATOM 276 N ILE A 18 3.934 2.553 -7.497 1.00 0.00 N ATOM 277 CA ILE A 18 3.634 1.096 -7.402 1.00 0.00 C ATOM 278 C ILE A 18 3.277 0.615 -8.804 1.00 0.00 C ATOM 279 O ILE A 18 2.710 1.351 -9.586 1.00 0.00 O ATOM 280 CB ILE A 18 2.453 0.858 -6.455 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.160 -0.643 -6.376 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.216 1.589 -6.976 1.00 0.00 C ATOM 283 CD1 ILE A 18 1.250 -0.926 -5.180 1.00 0.00 C ATOM 0 H ILE A 18 3.126 3.169 -7.413 1.00 0.00 H new ATOM 0 HA ILE A 18 4.495 0.553 -7.011 1.00 0.00 H new ATOM 0 HB ILE A 18 2.704 1.236 -5.464 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.683 -0.980 -7.296 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.091 -1.201 -6.277 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.379 1.416 -6.299 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.422 2.658 -7.033 1.00 0.00 H new ATOM 0 HG23 ILE A 18 0.963 1.215 -7.968 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.043 -1.995 -5.125 1.00 0.00 H new ATOM 0 HD12 ILE A 18 1.744 -0.605 -4.263 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.314 -0.380 -5.298 1.00 0.00 H new ATOM 295 N GLU A 19 3.618 -0.597 -9.147 1.00 0.00 N ATOM 296 CA GLU A 19 3.312 -1.095 -10.523 1.00 0.00 C ATOM 297 C GLU A 19 2.998 -2.587 -10.472 1.00 0.00 C ATOM 298 O GLU A 19 3.753 -3.376 -9.941 1.00 0.00 O ATOM 299 CB GLU A 19 4.535 -0.854 -11.414 1.00 0.00 C ATOM 300 CG GLU A 19 4.366 -1.558 -12.768 1.00 0.00 C ATOM 301 CD GLU A 19 3.007 -1.204 -13.375 1.00 0.00 C ATOM 302 OE1 GLU A 19 2.894 -0.129 -13.940 1.00 0.00 O ATOM 303 OE2 GLU A 19 2.101 -2.014 -13.262 1.00 0.00 O ATOM 0 H GLU A 19 4.093 -1.263 -8.539 1.00 0.00 H new ATOM 0 HA GLU A 19 2.448 -0.567 -10.926 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.673 0.216 -11.569 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.432 -1.222 -10.916 1.00 0.00 H new ATOM 0 HG2 GLU A 19 5.165 -1.258 -13.446 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.446 -2.637 -12.639 1.00 0.00 H new ATOM 310 N ILE A 20 1.878 -2.980 -11.025 1.00 0.00 N ATOM 311 CA ILE A 20 1.493 -4.420 -11.020 1.00 0.00 C ATOM 312 C ILE A 20 0.774 -4.742 -12.344 1.00 0.00 C ATOM 313 O ILE A 20 -0.170 -4.067 -12.703 1.00 0.00 O ATOM 314 CB ILE A 20 0.543 -4.673 -9.841 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.316 -4.446 -8.538 1.00 0.00 C ATOM 316 CG2 ILE A 20 0.014 -6.119 -9.897 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.438 -4.775 -7.332 1.00 0.00 C ATOM 0 H ILE A 20 1.211 -2.359 -11.482 1.00 0.00 H new ATOM 0 HA ILE A 20 2.375 -5.052 -10.919 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.306 -3.992 -9.891 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.210 -5.069 -8.525 1.00 0.00 H new ATOM 0 HG13 ILE A 20 1.649 -3.410 -8.481 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.660 -6.293 -9.058 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.524 -6.274 -10.832 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.851 -6.815 -9.841 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.003 -4.608 -6.415 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -0.443 -4.133 -7.338 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.127 -5.819 -7.382 1.00 0.00 H new ATOM 329 N PRO A 21 1.194 -5.759 -13.072 1.00 0.00 N ATOM 330 CA PRO A 21 0.535 -6.128 -14.358 1.00 0.00 C ATOM 331 C PRO A 21 -0.785 -6.871 -14.124 1.00 0.00 C ATOM 332 O PRO A 21 -1.794 -6.577 -14.734 1.00 0.00 O ATOM 333 CB PRO A 21 1.566 -7.034 -15.038 1.00 0.00 C ATOM 334 CG PRO A 21 2.296 -7.689 -13.911 1.00 0.00 C ATOM 335 CD PRO A 21 2.322 -6.665 -12.767 1.00 0.00 C ATOM 0 HA PRO A 21 0.269 -5.258 -14.958 1.00 0.00 H new ATOM 0 HB2 PRO A 21 1.083 -7.772 -15.679 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.244 -6.459 -15.668 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.794 -8.606 -13.602 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.307 -7.965 -14.210 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.196 -7.147 -11.797 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.269 -6.126 -12.735 1.00 0.00 H new ATOM 343 N ASP A 22 -0.784 -7.832 -13.240 1.00 0.00 N ATOM 344 CA ASP A 22 -2.033 -8.592 -12.960 1.00 0.00 C ATOM 345 C ASP A 22 -3.178 -7.614 -12.700 1.00 0.00 C ATOM 346 O ASP A 22 -4.335 -7.936 -12.893 1.00 0.00 O ATOM 347 CB ASP A 22 -1.828 -9.474 -11.728 1.00 0.00 C ATOM 348 CG ASP A 22 -0.864 -10.610 -12.069 1.00 0.00 C ATOM 349 OD1 ASP A 22 0.328 -10.357 -12.120 1.00 0.00 O ATOM 350 OD2 ASP A 22 -1.335 -11.717 -12.276 1.00 0.00 O ATOM 0 H ASP A 22 0.030 -8.123 -12.699 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.277 -9.217 -13.819 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -1.431 -8.880 -10.905 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -2.783 -9.881 -11.396 1.00 0.00 H new ATOM 355 N ALA A 23 -2.864 -6.420 -12.258 1.00 0.00 N ATOM 356 CA ALA A 23 -3.922 -5.400 -11.972 1.00 0.00 C ATOM 357 C ALA A 23 -3.680 -4.161 -12.836 1.00 0.00 C ATOM 358 O ALA A 23 -4.316 -3.142 -12.662 1.00 0.00 O ATOM 359 CB ALA A 23 -3.851 -5.012 -10.494 1.00 0.00 C ATOM 0 H ALA A 23 -1.910 -6.106 -12.081 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.905 -5.812 -12.199 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.618 -4.269 -10.276 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.016 -5.896 -9.878 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -2.868 -4.594 -10.274 1.00 0.00 H new ATOM 365 N ASP A 24 -2.764 -4.250 -13.768 1.00 0.00 N ATOM 366 CA ASP A 24 -2.464 -3.088 -14.661 1.00 0.00 C ATOM 367 C ASP A 24 -2.430 -1.794 -13.843 1.00 0.00 C ATOM 368 O ASP A 24 -2.888 -0.757 -14.279 1.00 0.00 O ATOM 369 CB ASP A 24 -3.539 -2.990 -15.751 1.00 0.00 C ATOM 370 CG ASP A 24 -4.875 -2.568 -15.134 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.628 -3.445 -14.745 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.121 -1.376 -15.062 1.00 0.00 O ATOM 0 H ASP A 24 -2.207 -5.085 -13.950 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.490 -3.234 -15.127 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.235 -2.268 -16.509 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.648 -3.952 -16.253 1.00 0.00 H new ATOM 377 N ILE A 25 -1.891 -1.853 -12.654 1.00 0.00 N ATOM 378 CA ILE A 25 -1.825 -0.635 -11.788 1.00 0.00 C ATOM 379 C ILE A 25 -0.482 0.081 -12.009 1.00 0.00 C ATOM 380 O ILE A 25 0.537 -0.530 -12.257 1.00 0.00 O ATOM 381 CB ILE A 25 -2.000 -1.073 -10.311 1.00 0.00 C ATOM 382 CG1 ILE A 25 -3.496 -1.072 -9.956 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.249 -0.135 -9.351 1.00 0.00 C ATOM 384 CD1 ILE A 25 -3.721 -1.862 -8.669 1.00 0.00 C ATOM 0 H ILE A 25 -1.491 -2.696 -12.242 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.620 0.066 -12.043 1.00 0.00 H new ATOM 0 HB ILE A 25 -1.583 -2.074 -10.202 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.849 -0.048 -9.832 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.073 -1.512 -10.770 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.394 -0.473 -8.325 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.185 -0.146 -9.590 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -1.634 0.879 -9.457 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.782 -1.859 -8.421 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.384 -2.889 -8.809 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -3.157 -1.403 -7.857 1.00 0.00 H new ATOM 396 N LYS A 26 -0.500 1.383 -11.917 1.00 0.00 N ATOM 397 CA LYS A 26 0.734 2.197 -12.106 1.00 0.00 C ATOM 398 C LYS A 26 0.435 3.589 -11.557 1.00 0.00 C ATOM 399 O LYS A 26 0.074 4.486 -12.293 1.00 0.00 O ATOM 400 CB LYS A 26 1.068 2.295 -13.596 1.00 0.00 C ATOM 401 CG LYS A 26 2.471 2.883 -13.765 1.00 0.00 C ATOM 402 CD LYS A 26 2.738 3.150 -15.247 1.00 0.00 C ATOM 403 CE LYS A 26 4.136 3.748 -15.414 1.00 0.00 C ATOM 404 NZ LYS A 26 5.152 2.784 -14.906 1.00 0.00 N ATOM 0 H LYS A 26 -1.338 1.928 -11.714 1.00 0.00 H new ATOM 0 HA LYS A 26 1.582 1.744 -11.593 1.00 0.00 H new ATOM 0 HB2 LYS A 26 1.017 1.309 -14.057 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.335 2.922 -14.104 1.00 0.00 H new ATOM 0 HG2 LYS A 26 2.560 3.809 -13.196 1.00 0.00 H new ATOM 0 HG3 LYS A 26 3.216 2.193 -13.369 1.00 0.00 H new ATOM 0 HD2 LYS A 26 2.657 2.223 -15.815 1.00 0.00 H new ATOM 0 HD3 LYS A 26 1.988 3.834 -15.645 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.324 3.972 -16.464 1.00 0.00 H new ATOM 0 HE3 LYS A 26 4.208 4.689 -14.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 6.075 2.994 -15.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 5.225 2.869 -13.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 4.866 1.815 -15.154 1.00 0.00 H new ATOM 418 N GLU A 27 0.514 3.760 -10.260 1.00 0.00 N ATOM 419 CA GLU A 27 0.159 5.071 -9.642 1.00 0.00 C ATOM 420 C GLU A 27 1.241 5.530 -8.642 1.00 0.00 C ATOM 421 O GLU A 27 1.966 4.723 -8.097 1.00 0.00 O ATOM 422 CB GLU A 27 -1.156 4.852 -8.889 1.00 0.00 C ATOM 423 CG GLU A 27 -2.346 4.816 -9.866 1.00 0.00 C ATOM 424 CD GLU A 27 -2.491 3.423 -10.484 1.00 0.00 C ATOM 425 OE1 GLU A 27 -2.959 2.537 -9.791 1.00 0.00 O ATOM 426 OE2 GLU A 27 -2.145 3.270 -11.643 1.00 0.00 O ATOM 0 H GLU A 27 0.812 3.041 -9.600 1.00 0.00 H new ATOM 0 HA GLU A 27 0.074 5.839 -10.411 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.109 3.917 -8.331 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.301 5.651 -8.161 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -3.263 5.085 -9.341 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.200 5.556 -10.653 1.00 0.00 H new ATOM 433 N PRO A 28 1.333 6.827 -8.386 1.00 0.00 N ATOM 434 CA PRO A 28 2.322 7.398 -7.417 1.00 0.00 C ATOM 435 C PRO A 28 1.834 7.307 -5.963 1.00 0.00 C ATOM 436 O PRO A 28 0.668 7.085 -5.706 1.00 0.00 O ATOM 437 CB PRO A 28 2.410 8.862 -7.848 1.00 0.00 C ATOM 438 CG PRO A 28 1.031 9.181 -8.318 1.00 0.00 C ATOM 439 CD PRO A 28 0.515 7.904 -8.994 1.00 0.00 C ATOM 0 HA PRO A 28 3.272 6.864 -7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.709 9.505 -7.020 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.145 9.002 -8.641 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.390 9.469 -7.484 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.040 10.017 -9.017 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.548 7.753 -8.806 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.645 7.943 -10.075 1.00 0.00 H new ATOM 447 N VAL A 29 2.721 7.491 -5.012 1.00 0.00 N ATOM 448 CA VAL A 29 2.325 7.435 -3.566 1.00 0.00 C ATOM 449 C VAL A 29 2.908 8.657 -2.838 1.00 0.00 C ATOM 450 O VAL A 29 4.090 8.924 -2.910 1.00 0.00 O ATOM 451 CB VAL A 29 2.880 6.147 -2.936 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.968 4.967 -3.284 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.286 5.874 -3.480 1.00 0.00 C ATOM 0 H VAL A 29 3.710 7.679 -5.177 1.00 0.00 H new ATOM 0 HA VAL A 29 1.239 7.441 -3.479 1.00 0.00 H new ATOM 0 HB VAL A 29 2.922 6.268 -1.854 1.00 0.00 H new ATOM 0 HG11 VAL A 29 2.365 4.056 -2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.966 5.155 -2.898 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.923 4.849 -4.367 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.678 4.961 -3.033 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.241 5.757 -4.563 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.941 6.710 -3.232 1.00 0.00 H new ATOM 463 N TYR A 30 2.087 9.409 -2.139 1.00 0.00 N ATOM 464 CA TYR A 30 2.610 10.614 -1.417 1.00 0.00 C ATOM 465 C TYR A 30 3.050 10.214 0.005 1.00 0.00 C ATOM 466 O TYR A 30 2.484 9.313 0.594 1.00 0.00 O ATOM 467 CB TYR A 30 1.507 11.684 -1.303 1.00 0.00 C ATOM 468 CG TYR A 30 0.637 11.687 -2.539 1.00 0.00 C ATOM 469 CD1 TYR A 30 1.161 12.123 -3.761 1.00 0.00 C ATOM 470 CD2 TYR A 30 -0.701 11.275 -2.458 1.00 0.00 C ATOM 471 CE1 TYR A 30 0.351 12.143 -4.902 1.00 0.00 C ATOM 472 CE2 TYR A 30 -1.512 11.297 -3.596 1.00 0.00 C ATOM 473 CZ TYR A 30 -0.987 11.731 -4.820 1.00 0.00 C ATOM 474 OH TYR A 30 -1.786 11.755 -5.945 1.00 0.00 O ATOM 0 H TYR A 30 1.086 9.242 -2.038 1.00 0.00 H new ATOM 0 HA TYR A 30 3.456 11.015 -1.976 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.895 11.491 -0.422 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.959 12.667 -1.168 1.00 0.00 H new ATOM 0 HD1 TYR A 30 2.190 12.444 -3.824 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -1.106 10.940 -1.514 1.00 0.00 H new ATOM 0 HE1 TYR A 30 0.756 12.476 -5.846 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.542 10.980 -3.532 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.234 11.608 -6.741 1.00 0.00 H new ATOM 484 N PRO A 31 4.026 10.891 0.575 1.00 0.00 N ATOM 485 CA PRO A 31 4.488 10.600 1.959 1.00 0.00 C ATOM 486 C PRO A 31 3.589 11.265 3.005 1.00 0.00 C ATOM 487 O PRO A 31 3.649 12.462 3.210 1.00 0.00 O ATOM 488 CB PRO A 31 5.887 11.207 1.993 1.00 0.00 C ATOM 489 CG PRO A 31 5.790 12.391 1.089 1.00 0.00 C ATOM 490 CD PRO A 31 4.807 11.995 -0.021 1.00 0.00 C ATOM 0 HA PRO A 31 4.468 9.535 2.192 1.00 0.00 H new ATOM 0 HB2 PRO A 31 6.171 11.499 3.004 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.638 10.499 1.643 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.435 13.268 1.631 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.765 12.646 0.674 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.167 12.830 -0.304 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.330 11.674 -0.922 1.00 0.00 H new ATOM 498 N GLY A 32 2.755 10.513 3.665 1.00 0.00 N ATOM 499 CA GLY A 32 1.867 11.133 4.685 1.00 0.00 C ATOM 500 C GLY A 32 0.913 10.091 5.260 1.00 0.00 C ATOM 501 O GLY A 32 0.977 8.923 4.928 1.00 0.00 O ATOM 0 H GLY A 32 2.650 9.506 3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.468 11.567 5.485 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.299 11.947 4.236 1.00 0.00 H new ATOM 505 N PRO A 33 0.026 10.519 6.118 1.00 0.00 N ATOM 506 CA PRO A 33 -0.971 9.625 6.756 1.00 0.00 C ATOM 507 C PRO A 33 -2.133 9.334 5.810 1.00 0.00 C ATOM 508 O PRO A 33 -2.835 10.228 5.393 1.00 0.00 O ATOM 509 CB PRO A 33 -1.432 10.422 7.981 1.00 0.00 C ATOM 510 CG PRO A 33 -1.285 11.858 7.579 1.00 0.00 C ATOM 511 CD PRO A 33 -0.124 11.915 6.572 1.00 0.00 C ATOM 0 HA PRO A 33 -0.563 8.649 7.018 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.464 10.187 8.240 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -0.823 10.191 8.855 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.206 12.231 7.130 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.077 12.484 8.447 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.350 12.583 5.741 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.790 12.283 7.038 1.00 0.00 H new ATOM 519 N ALA A 34 -2.318 8.091 5.458 1.00 0.00 N ATOM 520 CA ALA A 34 -3.424 7.728 4.517 1.00 0.00 C ATOM 521 C ALA A 34 -4.712 8.481 4.886 1.00 0.00 C ATOM 522 O ALA A 34 -5.539 7.993 5.628 1.00 0.00 O ATOM 523 CB ALA A 34 -3.664 6.208 4.578 1.00 0.00 C ATOM 0 H ALA A 34 -1.751 7.307 5.781 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.140 8.012 3.504 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.469 5.939 3.894 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.753 5.684 4.290 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.940 5.924 5.593 1.00 0.00 H new ATOM 529 N THR A 35 -4.881 9.668 4.355 1.00 0.00 N ATOM 530 CA THR A 35 -6.111 10.476 4.642 1.00 0.00 C ATOM 531 C THR A 35 -7.018 10.444 3.402 1.00 0.00 C ATOM 532 O THR A 35 -6.546 10.278 2.297 1.00 0.00 O ATOM 533 CB THR A 35 -5.699 11.928 4.938 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.617 12.289 4.090 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.263 12.059 6.400 1.00 0.00 C ATOM 0 H THR A 35 -4.213 10.117 3.728 1.00 0.00 H new ATOM 0 HA THR A 35 -6.642 10.066 5.501 1.00 0.00 H new ATOM 0 HB THR A 35 -6.548 12.587 4.757 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.362 13.219 4.263 1.00 0.00 H new ATOM 0 HG21 THR A 35 -4.973 13.090 6.602 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.090 11.780 7.053 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.415 11.400 6.587 1.00 0.00 H new ATOM 543 N PRO A 36 -8.308 10.604 3.573 1.00 0.00 N ATOM 544 CA PRO A 36 -9.270 10.591 2.429 1.00 0.00 C ATOM 545 C PRO A 36 -9.127 11.834 1.543 1.00 0.00 C ATOM 546 O PRO A 36 -9.143 11.750 0.332 1.00 0.00 O ATOM 547 CB PRO A 36 -10.646 10.553 3.113 1.00 0.00 C ATOM 548 CG PRO A 36 -10.425 11.185 4.450 1.00 0.00 C ATOM 549 CD PRO A 36 -8.997 10.815 4.860 1.00 0.00 C ATOM 0 HA PRO A 36 -9.102 9.748 1.758 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.390 11.100 2.535 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.010 9.530 3.214 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.548 12.267 4.395 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.148 10.819 5.179 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.528 11.610 5.440 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -8.977 9.917 5.477 1.00 0.00 H new ATOM 557 N GLU A 37 -8.987 12.985 2.140 1.00 0.00 N ATOM 558 CA GLU A 37 -8.844 14.227 1.330 1.00 0.00 C ATOM 559 C GLU A 37 -7.542 14.171 0.529 1.00 0.00 C ATOM 560 O GLU A 37 -7.382 14.857 -0.461 1.00 0.00 O ATOM 561 CB GLU A 37 -8.821 15.444 2.257 1.00 0.00 C ATOM 562 CG GLU A 37 -7.816 15.208 3.387 1.00 0.00 C ATOM 563 CD GLU A 37 -7.564 16.521 4.129 1.00 0.00 C ATOM 564 OE1 GLU A 37 -7.027 17.431 3.518 1.00 0.00 O ATOM 565 OE2 GLU A 37 -7.913 16.596 5.295 1.00 0.00 O ATOM 0 H GLU A 37 -8.965 13.119 3.151 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.687 14.309 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.549 16.337 1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.814 15.618 2.670 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -8.199 14.456 4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -6.881 14.822 2.981 1.00 0.00 H new ATOM 572 N GLN A 38 -6.603 13.365 0.953 1.00 0.00 N ATOM 573 CA GLN A 38 -5.305 13.273 0.219 1.00 0.00 C ATOM 574 C GLN A 38 -5.361 12.129 -0.799 1.00 0.00 C ATOM 575 O GLN A 38 -5.247 12.345 -1.988 1.00 0.00 O ATOM 576 CB GLN A 38 -4.171 13.015 1.222 1.00 0.00 C ATOM 577 CG GLN A 38 -2.817 13.439 0.611 1.00 0.00 C ATOM 578 CD GLN A 38 -1.692 12.574 1.182 1.00 0.00 C ATOM 579 OE1 GLN A 38 -0.878 13.041 1.953 1.00 0.00 O ATOM 580 NE2 GLN A 38 -1.616 11.321 0.830 1.00 0.00 N ATOM 0 H GLN A 38 -6.679 12.767 1.776 1.00 0.00 H new ATOM 0 HA GLN A 38 -5.122 14.209 -0.308 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.354 13.571 2.141 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.144 11.958 1.489 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.850 13.337 -0.474 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -2.624 14.490 0.827 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -2.301 10.931 0.182 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -0.872 10.731 1.202 1.00 0.00 H new ATOM 589 N LEU A 39 -5.531 10.911 -0.344 1.00 0.00 N ATOM 590 CA LEU A 39 -5.590 9.761 -1.294 1.00 0.00 C ATOM 591 C LEU A 39 -6.514 10.111 -2.456 1.00 0.00 C ATOM 592 O LEU A 39 -6.458 9.511 -3.511 1.00 0.00 O ATOM 593 CB LEU A 39 -6.133 8.523 -0.581 1.00 0.00 C ATOM 594 CG LEU A 39 -5.244 8.168 0.622 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.039 7.313 1.614 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.014 7.378 0.155 1.00 0.00 C ATOM 0 H LEU A 39 -5.631 10.666 0.641 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.586 9.554 -1.665 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.154 8.706 -0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.171 7.683 -1.274 1.00 0.00 H new ATOM 0 HG LEU A 39 -4.920 9.091 1.103 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.407 7.062 2.466 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.909 7.871 1.959 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.367 6.397 1.123 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.391 7.132 1.015 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.336 6.459 -0.335 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.439 7.981 -0.548 1.00 0.00 H new ATOM 608 N ASN A 40 -7.350 11.091 -2.279 1.00 0.00 N ATOM 609 CA ASN A 40 -8.256 11.486 -3.385 1.00 0.00 C ATOM 610 C ASN A 40 -7.380 11.978 -4.533 1.00 0.00 C ATOM 611 O ASN A 40 -7.749 11.927 -5.689 1.00 0.00 O ATOM 612 CB ASN A 40 -9.175 12.617 -2.907 1.00 0.00 C ATOM 613 CG ASN A 40 -10.441 12.032 -2.273 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.437 10.908 -1.810 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.529 12.750 -2.233 1.00 0.00 N ATOM 0 H ASN A 40 -7.445 11.633 -1.420 1.00 0.00 H new ATOM 0 HA ASN A 40 -8.874 10.648 -3.707 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.651 13.241 -2.183 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.442 13.259 -3.747 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.377 12.368 -1.813 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.532 13.693 -2.622 1.00 0.00 H new ATOM 622 N ARG A 41 -6.208 12.438 -4.206 1.00 0.00 N ATOM 623 CA ARG A 41 -5.271 12.920 -5.253 1.00 0.00 C ATOM 624 C ARG A 41 -4.533 11.712 -5.824 1.00 0.00 C ATOM 625 O ARG A 41 -3.958 11.767 -6.892 1.00 0.00 O ATOM 626 CB ARG A 41 -4.259 13.887 -4.636 1.00 0.00 C ATOM 627 CG ARG A 41 -4.995 15.051 -3.970 1.00 0.00 C ATOM 628 CD ARG A 41 -4.023 15.817 -3.069 1.00 0.00 C ATOM 629 NE ARG A 41 -4.638 17.108 -2.651 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.133 17.779 -1.652 1.00 0.00 C ATOM 631 NH1 ARG A 41 -3.091 17.316 -1.015 1.00 0.00 N ATOM 632 NH2 ARG A 41 -4.669 18.911 -1.288 1.00 0.00 N ATOM 0 H ARG A 41 -5.857 12.501 -3.251 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.821 13.438 -6.039 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.645 13.366 -3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.585 14.263 -5.406 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.407 15.717 -4.728 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.834 14.677 -3.384 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.777 15.219 -2.191 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.089 16.003 -3.600 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.454 17.468 -3.146 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.672 16.430 -1.298 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.696 17.840 -0.234 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.484 19.272 -1.784 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.274 19.435 -0.507 1.00 0.00 H new ATOM 646 N GLY A 42 -4.549 10.616 -5.113 1.00 0.00 N ATOM 647 CA GLY A 42 -3.850 9.397 -5.611 1.00 0.00 C ATOM 648 C GLY A 42 -3.682 8.380 -4.477 1.00 0.00 C ATOM 649 O GLY A 42 -4.618 8.055 -3.774 1.00 0.00 O ATOM 0 H GLY A 42 -5.015 10.513 -4.211 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.419 8.951 -6.427 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.874 9.668 -6.013 1.00 0.00 H new ATOM 653 N VAL A 43 -2.488 7.867 -4.310 1.00 0.00 N ATOM 654 CA VAL A 43 -2.218 6.852 -3.241 1.00 0.00 C ATOM 655 C VAL A 43 -1.236 7.444 -2.218 1.00 0.00 C ATOM 656 O VAL A 43 -0.605 8.453 -2.464 1.00 0.00 O ATOM 657 CB VAL A 43 -1.600 5.617 -3.912 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.619 4.413 -2.968 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.398 5.281 -5.173 1.00 0.00 C ATOM 0 H VAL A 43 -1.676 8.111 -4.877 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.137 6.577 -2.724 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.564 5.841 -4.166 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.176 3.552 -3.468 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.047 4.646 -2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.648 4.183 -2.693 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.965 4.405 -5.655 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.433 5.072 -4.904 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.365 6.126 -5.860 1.00 0.00 H new ATOM 669 N SER A 44 -1.108 6.829 -1.072 1.00 0.00 N ATOM 670 CA SER A 44 -0.170 7.352 -0.033 1.00 0.00 C ATOM 671 C SER A 44 0.120 6.243 0.983 1.00 0.00 C ATOM 672 O SER A 44 -0.634 5.298 1.105 1.00 0.00 O ATOM 673 CB SER A 44 -0.812 8.553 0.667 1.00 0.00 C ATOM 674 OG SER A 44 0.205 9.362 1.242 1.00 0.00 O ATOM 0 H SER A 44 -1.614 5.984 -0.809 1.00 0.00 H new ATOM 0 HA SER A 44 0.765 7.668 -0.496 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.395 9.135 -0.047 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.501 8.212 1.439 1.00 0.00 H new ATOM 0 HG SER A 44 0.999 9.346 0.668 1.00 0.00 H new ATOM 680 N PHE A 45 1.202 6.337 1.714 1.00 0.00 N ATOM 681 CA PHE A 45 1.500 5.262 2.702 1.00 0.00 C ATOM 682 C PHE A 45 0.346 5.154 3.698 1.00 0.00 C ATOM 683 O PHE A 45 -0.487 6.033 3.797 1.00 0.00 O ATOM 684 CB PHE A 45 2.801 5.552 3.460 1.00 0.00 C ATOM 685 CG PHE A 45 4.000 5.450 2.529 1.00 0.00 C ATOM 686 CD1 PHE A 45 4.259 4.266 1.816 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.859 6.545 2.384 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.368 4.192 0.963 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.967 6.467 1.534 1.00 0.00 C ATOM 690 CZ PHE A 45 6.220 5.292 0.822 1.00 0.00 C ATOM 0 H PHE A 45 1.880 7.098 1.670 1.00 0.00 H new ATOM 0 HA PHE A 45 1.619 4.323 2.162 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.758 6.549 3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.913 4.847 4.284 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.604 3.415 1.926 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.665 7.456 2.932 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.565 3.284 0.413 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.627 7.315 1.428 1.00 0.00 H new ATOM 0 HZ PHE A 45 7.073 5.233 0.163 1.00 0.00 H new ATOM 700 N ALA A 46 0.290 4.082 4.440 1.00 0.00 N ATOM 701 CA ALA A 46 -0.809 3.917 5.431 1.00 0.00 C ATOM 702 C ALA A 46 -0.523 4.787 6.655 1.00 0.00 C ATOM 703 O ALA A 46 -1.414 5.133 7.406 1.00 0.00 O ATOM 704 CB ALA A 46 -0.906 2.449 5.851 1.00 0.00 C ATOM 0 H ALA A 46 0.959 3.313 4.402 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.754 4.223 4.982 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.711 2.331 6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.113 1.833 4.976 1.00 0.00 H new ATOM 0 HB3 ALA A 46 0.036 2.136 6.301 1.00 0.00 H new ATOM 710 N GLU A 47 0.721 5.145 6.863 1.00 0.00 N ATOM 711 CA GLU A 47 1.080 5.999 8.043 1.00 0.00 C ATOM 712 C GLU A 47 2.099 7.070 7.630 1.00 0.00 C ATOM 713 O GLU A 47 2.922 6.863 6.761 1.00 0.00 O ATOM 714 CB GLU A 47 1.693 5.126 9.137 1.00 0.00 C ATOM 715 CG GLU A 47 0.615 4.248 9.783 1.00 0.00 C ATOM 716 CD GLU A 47 0.261 3.093 8.843 1.00 0.00 C ATOM 717 OE1 GLU A 47 1.172 2.399 8.423 1.00 0.00 O ATOM 718 OE2 GLU A 47 -0.914 2.922 8.564 1.00 0.00 O ATOM 0 H GLU A 47 1.506 4.883 6.266 1.00 0.00 H new ATOM 0 HA GLU A 47 0.177 6.483 8.414 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.478 4.499 8.714 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.161 5.755 9.894 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.973 3.858 10.736 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -0.273 4.843 9.995 1.00 0.00 H new ATOM 725 N GLU A 48 2.033 8.219 8.250 1.00 0.00 N ATOM 726 CA GLU A 48 2.974 9.331 7.915 1.00 0.00 C ATOM 727 C GLU A 48 4.427 8.946 8.239 1.00 0.00 C ATOM 728 O GLU A 48 5.357 9.502 7.689 1.00 0.00 O ATOM 729 CB GLU A 48 2.578 10.578 8.718 1.00 0.00 C ATOM 730 CG GLU A 48 2.966 10.408 10.198 1.00 0.00 C ATOM 731 CD GLU A 48 4.427 10.821 10.409 1.00 0.00 C ATOM 732 OE1 GLU A 48 4.733 11.980 10.182 1.00 0.00 O ATOM 733 OE2 GLU A 48 5.213 9.971 10.794 1.00 0.00 O ATOM 0 H GLU A 48 1.359 8.438 8.984 1.00 0.00 H new ATOM 0 HA GLU A 48 2.910 9.534 6.846 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.072 11.457 8.304 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.504 10.747 8.634 1.00 0.00 H new ATOM 0 HG2 GLU A 48 2.314 11.016 10.825 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.825 9.371 10.502 1.00 0.00 H new ATOM 740 N ASN A 49 4.636 8.024 9.143 1.00 0.00 N ATOM 741 CA ASN A 49 6.037 7.644 9.510 1.00 0.00 C ATOM 742 C ASN A 49 6.564 6.569 8.559 1.00 0.00 C ATOM 743 O ASN A 49 7.665 6.079 8.710 1.00 0.00 O ATOM 744 CB ASN A 49 6.055 7.100 10.940 1.00 0.00 C ATOM 745 CG ASN A 49 7.499 7.030 11.441 1.00 0.00 C ATOM 746 OD1 ASN A 49 7.935 6.009 11.934 1.00 0.00 O ATOM 747 ND2 ASN A 49 8.264 8.081 11.331 1.00 0.00 N ATOM 0 H ASN A 49 3.903 7.519 9.642 1.00 0.00 H new ATOM 0 HA ASN A 49 6.672 8.527 9.436 1.00 0.00 H new ATOM 0 HB2 ASN A 49 5.463 7.742 11.592 1.00 0.00 H new ATOM 0 HB3 ASN A 49 5.600 6.110 10.970 1.00 0.00 H new ATOM 0 HD21 ASN A 49 9.229 8.046 11.659 1.00 0.00 H new ATOM 0 HD22 ASN A 49 7.897 8.938 10.917 1.00 0.00 H new ATOM 754 N GLU A 50 5.796 6.203 7.575 1.00 0.00 N ATOM 755 CA GLU A 50 6.263 5.166 6.616 1.00 0.00 C ATOM 756 C GLU A 50 7.454 5.707 5.828 1.00 0.00 C ATOM 757 O GLU A 50 7.691 6.896 5.769 1.00 0.00 O ATOM 758 CB GLU A 50 5.116 4.812 5.664 1.00 0.00 C ATOM 759 CG GLU A 50 5.356 3.433 5.042 1.00 0.00 C ATOM 760 CD GLU A 50 5.145 2.356 6.108 1.00 0.00 C ATOM 761 OE1 GLU A 50 4.001 2.110 6.455 1.00 0.00 O ATOM 762 OE2 GLU A 50 6.130 1.795 6.559 1.00 0.00 O ATOM 0 H GLU A 50 4.865 6.577 7.392 1.00 0.00 H new ATOM 0 HA GLU A 50 6.572 4.270 7.154 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.170 4.816 6.205 1.00 0.00 H new ATOM 0 HB3 GLU A 50 5.038 5.565 4.880 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.674 3.274 4.207 1.00 0.00 H new ATOM 0 HG3 GLU A 50 6.368 3.372 4.642 1.00 0.00 H new ATOM 769 N SER A 51 8.203 4.833 5.221 1.00 0.00 N ATOM 770 CA SER A 51 9.384 5.262 4.427 1.00 0.00 C ATOM 771 C SER A 51 9.554 4.300 3.256 1.00 0.00 C ATOM 772 O SER A 51 8.876 3.297 3.160 1.00 0.00 O ATOM 773 CB SER A 51 10.631 5.222 5.311 1.00 0.00 C ATOM 774 OG SER A 51 10.426 6.045 6.451 1.00 0.00 O ATOM 0 H SER A 51 8.045 3.826 5.242 1.00 0.00 H new ATOM 0 HA SER A 51 9.242 6.277 4.057 1.00 0.00 H new ATOM 0 HB2 SER A 51 10.839 4.198 5.620 1.00 0.00 H new ATOM 0 HB3 SER A 51 11.499 5.568 4.750 1.00 0.00 H new ATOM 0 HG SER A 51 11.223 6.020 7.020 1.00 0.00 H new ATOM 780 N LEU A 52 10.455 4.591 2.365 1.00 0.00 N ATOM 781 CA LEU A 52 10.674 3.694 1.207 1.00 0.00 C ATOM 782 C LEU A 52 11.627 2.585 1.634 1.00 0.00 C ATOM 783 O LEU A 52 12.216 1.908 0.815 1.00 0.00 O ATOM 784 CB LEU A 52 11.298 4.493 0.064 1.00 0.00 C ATOM 785 CG LEU A 52 10.351 5.633 -0.357 1.00 0.00 C ATOM 786 CD1 LEU A 52 10.340 6.761 0.701 1.00 0.00 C ATOM 787 CD2 LEU A 52 10.808 6.192 -1.712 1.00 0.00 C ATOM 0 H LEU A 52 11.052 5.418 2.391 1.00 0.00 H new ATOM 0 HA LEU A 52 9.729 3.267 0.872 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.258 4.903 0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 52 11.493 3.838 -0.785 1.00 0.00 H new ATOM 0 HG LEU A 52 9.339 5.238 -0.441 1.00 0.00 H new ATOM 0 HD11 LEU A 52 9.664 7.554 0.381 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.002 6.360 1.657 1.00 0.00 H new ATOM 0 HD13 LEU A 52 11.346 7.165 0.812 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.142 6.999 -2.016 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.825 6.574 -1.624 1.00 0.00 H new ATOM 0 HD23 LEU A 52 10.782 5.399 -2.460 1.00 0.00 H new ATOM 799 N ASP A 53 11.790 2.398 2.919 1.00 0.00 N ATOM 800 CA ASP A 53 12.715 1.337 3.411 1.00 0.00 C ATOM 801 C ASP A 53 12.177 0.719 4.702 1.00 0.00 C ATOM 802 O ASP A 53 12.807 -0.138 5.290 1.00 0.00 O ATOM 803 CB ASP A 53 14.088 1.950 3.688 1.00 0.00 C ATOM 804 CG ASP A 53 14.793 2.251 2.364 1.00 0.00 C ATOM 805 OD1 ASP A 53 14.580 3.330 1.836 1.00 0.00 O ATOM 806 OD2 ASP A 53 15.532 1.398 1.902 1.00 0.00 O ATOM 0 H ASP A 53 11.321 2.936 3.648 1.00 0.00 H new ATOM 0 HA ASP A 53 12.796 0.561 2.649 1.00 0.00 H new ATOM 0 HB2 ASP A 53 13.978 2.866 4.269 1.00 0.00 H new ATOM 0 HB3 ASP A 53 14.690 1.264 4.284 1.00 0.00 H new ATOM 811 N ASP A 54 11.026 1.133 5.162 1.00 0.00 N ATOM 812 CA ASP A 54 10.496 0.541 6.421 1.00 0.00 C ATOM 813 C ASP A 54 10.381 -0.977 6.257 1.00 0.00 C ATOM 814 O ASP A 54 9.777 -1.463 5.322 1.00 0.00 O ATOM 815 CB ASP A 54 9.114 1.126 6.721 1.00 0.00 C ATOM 816 CG ASP A 54 8.703 0.761 8.150 1.00 0.00 C ATOM 817 OD1 ASP A 54 9.460 0.064 8.803 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.636 1.185 8.564 1.00 0.00 O ATOM 0 H ASP A 54 10.439 1.845 4.727 1.00 0.00 H new ATOM 0 HA ASP A 54 11.173 0.771 7.244 1.00 0.00 H new ATOM 0 HB2 ASP A 54 9.133 2.209 6.602 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.382 0.740 6.011 1.00 0.00 H new ATOM 823 N GLN A 55 10.967 -1.728 7.160 1.00 0.00 N ATOM 824 CA GLN A 55 10.902 -3.224 7.072 1.00 0.00 C ATOM 825 C GLN A 55 9.490 -3.658 6.683 1.00 0.00 C ATOM 826 O GLN A 55 9.276 -4.747 6.194 1.00 0.00 O ATOM 827 CB GLN A 55 11.267 -3.832 8.428 1.00 0.00 C ATOM 828 CG GLN A 55 10.535 -3.077 9.536 1.00 0.00 C ATOM 829 CD GLN A 55 10.739 -3.802 10.868 1.00 0.00 C ATOM 830 OE1 GLN A 55 11.617 -3.455 11.633 1.00 0.00 O ATOM 831 NE2 GLN A 55 9.958 -4.800 11.180 1.00 0.00 N ATOM 0 H GLN A 55 11.490 -1.368 7.958 1.00 0.00 H new ATOM 0 HA GLN A 55 11.606 -3.570 6.316 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.995 -4.887 8.451 1.00 0.00 H new ATOM 0 HB3 GLN A 55 12.344 -3.777 8.586 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.910 -2.056 9.604 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.472 -3.011 9.305 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.221 -5.091 10.538 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.085 -5.289 12.066 1.00 0.00 H new ATOM 840 N ASN A 56 8.525 -2.803 6.882 1.00 0.00 N ATOM 841 CA ASN A 56 7.124 -3.146 6.509 1.00 0.00 C ATOM 842 C ASN A 56 6.439 -1.897 5.969 1.00 0.00 C ATOM 843 O ASN A 56 6.069 -1.006 6.708 1.00 0.00 O ATOM 844 CB ASN A 56 6.369 -3.657 7.738 1.00 0.00 C ATOM 845 CG ASN A 56 4.907 -3.911 7.363 1.00 0.00 C ATOM 846 OD1 ASN A 56 4.423 -5.119 7.458 1.00 0.00 O flip ATOM 847 ND2 ASN A 56 4.199 -3.000 6.983 1.00 0.00 N flip ATOM 0 H ASN A 56 8.648 -1.876 7.289 1.00 0.00 H new ATOM 0 HA ASN A 56 7.127 -3.926 5.748 1.00 0.00 H new ATOM 0 HB2 ASN A 56 6.827 -4.575 8.105 1.00 0.00 H new ATOM 0 HB3 ASN A 56 6.428 -2.927 8.545 1.00 0.00 H new ATOM 0 HD21 ASN A 56 4.578 -2.056 6.909 1.00 0.00 H new ATOM 0 HD22 ASN A 56 3.225 -3.179 6.738 1.00 0.00 H new ATOM 854 N ILE A 57 6.274 -1.820 4.676 1.00 0.00 N ATOM 855 CA ILE A 57 5.622 -0.626 4.069 1.00 0.00 C ATOM 856 C ILE A 57 4.133 -0.913 3.876 1.00 0.00 C ATOM 857 O ILE A 57 3.751 -1.830 3.176 1.00 0.00 O ATOM 858 CB ILE A 57 6.274 -0.332 2.714 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.701 0.172 2.942 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.472 0.739 1.969 1.00 0.00 C ATOM 861 CD1 ILE A 57 8.460 0.180 1.613 1.00 0.00 C ATOM 0 H ILE A 57 6.565 -2.537 4.011 1.00 0.00 H new ATOM 0 HA ILE A 57 5.742 0.238 4.723 1.00 0.00 H new ATOM 0 HB ILE A 57 6.292 -1.244 2.118 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.680 1.176 3.366 1.00 0.00 H new ATOM 0 HG13 ILE A 57 8.213 -0.467 3.661 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.942 0.942 1.007 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.454 0.385 1.808 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.448 1.654 2.561 1.00 0.00 H new ATOM 0 HD11 ILE A 57 9.476 0.539 1.776 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.493 -0.831 1.207 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.952 0.838 0.908 1.00 0.00 H new ATOM 873 N SER A 58 3.292 -0.127 4.499 1.00 0.00 N ATOM 874 CA SER A 58 1.816 -0.327 4.373 1.00 0.00 C ATOM 875 C SER A 58 1.243 0.800 3.515 1.00 0.00 C ATOM 876 O SER A 58 1.420 1.965 3.814 1.00 0.00 O ATOM 877 CB SER A 58 1.187 -0.296 5.767 1.00 0.00 C ATOM 878 OG SER A 58 1.806 0.726 6.537 1.00 0.00 O ATOM 0 H SER A 58 3.568 0.653 5.096 1.00 0.00 H new ATOM 0 HA SER A 58 1.599 -1.287 3.905 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.115 -0.112 5.691 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.311 -1.262 6.256 1.00 0.00 H new ATOM 0 HG SER A 58 1.220 0.975 7.282 1.00 0.00 H new ATOM 884 N ILE A 59 0.578 0.462 2.434 1.00 0.00 N ATOM 885 CA ILE A 59 0.011 1.510 1.526 1.00 0.00 C ATOM 886 C ILE A 59 -1.514 1.495 1.561 1.00 0.00 C ATOM 887 O ILE A 59 -2.138 0.531 1.955 1.00 0.00 O ATOM 888 CB ILE A 59 0.470 1.238 0.091 1.00 0.00 C ATOM 889 CG1 ILE A 59 1.999 1.193 0.044 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.040 2.350 -0.831 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.452 0.657 -1.316 1.00 0.00 C ATOM 0 H ILE A 59 0.403 -0.499 2.141 1.00 0.00 H new ATOM 0 HA ILE A 59 0.364 2.484 1.865 1.00 0.00 H new ATOM 0 HB ILE A 59 0.069 0.281 -0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.408 2.190 0.209 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.379 0.556 0.843 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.288 2.155 -1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.129 2.379 -0.799 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.358 3.309 -0.499 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.541 0.625 -1.350 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.055 -0.347 -1.462 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.084 1.311 -2.106 1.00 0.00 H new ATOM 903 N ALA A 60 -2.108 2.574 1.123 1.00 0.00 N ATOM 904 CA ALA A 60 -3.595 2.679 1.084 1.00 0.00 C ATOM 905 C ALA A 60 -3.983 3.289 -0.264 1.00 0.00 C ATOM 906 O ALA A 60 -3.493 4.338 -0.633 1.00 0.00 O ATOM 907 CB ALA A 60 -4.072 3.581 2.225 1.00 0.00 C ATOM 0 H ALA A 60 -1.616 3.401 0.785 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.056 1.698 1.201 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.159 3.659 2.197 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.763 3.155 3.179 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.635 4.573 2.112 1.00 0.00 H new ATOM 913 N GLY A 61 -4.840 2.636 -1.013 1.00 0.00 N ATOM 914 CA GLY A 61 -5.234 3.180 -2.358 1.00 0.00 C ATOM 915 C GLY A 61 -6.748 3.092 -2.552 1.00 0.00 C ATOM 916 O GLY A 61 -7.418 2.257 -1.978 1.00 0.00 O ATOM 0 H GLY A 61 -5.283 1.754 -0.755 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -4.910 4.217 -2.446 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.728 2.621 -3.145 1.00 0.00 H new ATOM 920 N HIS A 62 -7.284 3.963 -3.365 1.00 0.00 N ATOM 921 CA HIS A 62 -8.758 3.958 -3.616 1.00 0.00 C ATOM 922 C HIS A 62 -9.130 2.784 -4.537 1.00 0.00 C ATOM 923 O HIS A 62 -8.282 2.165 -5.140 1.00 0.00 O ATOM 924 CB HIS A 62 -9.167 5.294 -4.272 1.00 0.00 C ATOM 925 CG HIS A 62 -9.530 6.308 -3.214 1.00 0.00 C ATOM 926 ND1 HIS A 62 -10.783 6.334 -2.619 1.00 0.00 N ATOM 927 CD2 HIS A 62 -8.822 7.337 -2.640 1.00 0.00 C ATOM 928 CE1 HIS A 62 -10.790 7.346 -1.733 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.621 7.989 -1.706 1.00 0.00 N ATOM 0 H HIS A 62 -6.764 4.681 -3.869 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.287 3.841 -2.670 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.347 5.673 -4.883 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.014 5.135 -4.939 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -7.802 7.599 -2.878 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.639 7.607 -1.118 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.367 8.788 -1.125 1.00 0.00 H new ATOM 937 N THR A 63 -10.402 2.489 -4.659 1.00 0.00 N ATOM 938 CA THR A 63 -10.840 1.373 -5.547 1.00 0.00 C ATOM 939 C THR A 63 -12.266 1.654 -6.031 1.00 0.00 C ATOM 940 O THR A 63 -13.228 1.222 -5.430 1.00 0.00 O ATOM 941 CB THR A 63 -10.824 0.044 -4.783 1.00 0.00 C ATOM 942 OG1 THR A 63 -11.753 -0.850 -5.379 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.212 0.277 -3.323 1.00 0.00 C ATOM 0 H THR A 63 -11.157 2.977 -4.178 1.00 0.00 H new ATOM 0 HA THR A 63 -10.157 1.303 -6.394 1.00 0.00 H new ATOM 0 HB THR A 63 -9.821 -0.382 -4.824 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.657 -0.478 -5.307 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.198 -0.672 -2.787 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.502 0.964 -2.863 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.213 0.705 -3.277 1.00 0.00 H new ATOM 951 N PHE A 64 -12.410 2.374 -7.111 1.00 0.00 N ATOM 952 CA PHE A 64 -13.778 2.681 -7.627 1.00 0.00 C ATOM 953 C PHE A 64 -14.232 1.550 -8.552 1.00 0.00 C ATOM 954 O PHE A 64 -13.636 1.296 -9.579 1.00 0.00 O ATOM 955 CB PHE A 64 -13.748 3.999 -8.409 1.00 0.00 C ATOM 956 CG PHE A 64 -13.694 5.165 -7.444 1.00 0.00 C ATOM 957 CD1 PHE A 64 -14.781 5.419 -6.597 1.00 0.00 C ATOM 958 CD2 PHE A 64 -12.563 5.991 -7.398 1.00 0.00 C ATOM 959 CE1 PHE A 64 -14.736 6.497 -5.704 1.00 0.00 C ATOM 960 CE2 PHE A 64 -12.520 7.069 -6.505 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.606 7.321 -5.659 1.00 0.00 C ATOM 0 H PHE A 64 -11.642 2.763 -7.658 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.472 2.773 -6.791 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.881 4.021 -9.070 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.633 4.078 -9.041 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -15.653 4.783 -6.633 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -11.725 5.796 -8.051 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -15.573 6.692 -5.050 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -11.649 7.706 -6.469 1.00 0.00 H new ATOM 0 HZ PHE A 64 -13.572 8.152 -4.971 1.00 0.00 H new ATOM 971 N ILE A 65 -15.281 0.866 -8.190 1.00 0.00 N ATOM 972 CA ILE A 65 -15.776 -0.254 -9.040 1.00 0.00 C ATOM 973 C ILE A 65 -16.145 0.272 -10.424 1.00 0.00 C ATOM 974 O ILE A 65 -16.091 -0.440 -11.406 1.00 0.00 O ATOM 975 CB ILE A 65 -17.031 -0.866 -8.417 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.819 -1.098 -6.924 1.00 0.00 C ATOM 977 CG2 ILE A 65 -17.335 -2.200 -9.098 1.00 0.00 C ATOM 978 CD1 ILE A 65 -18.093 -1.699 -6.340 1.00 0.00 C ATOM 0 H ILE A 65 -15.819 1.034 -7.340 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.989 -1.004 -9.116 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.867 -0.180 -8.555 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.975 -1.769 -6.761 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.581 -0.159 -6.425 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -18.229 -2.639 -8.656 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.500 -2.036 -10.163 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.493 -2.878 -8.962 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.958 -1.871 -5.272 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.924 -1.011 -6.494 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -18.309 -2.645 -6.836 1.00 0.00 H new ATOM 990 N ASP A 66 -16.546 1.509 -10.502 1.00 0.00 N ATOM 991 CA ASP A 66 -16.950 2.077 -11.811 1.00 0.00 C ATOM 992 C ASP A 66 -15.717 2.591 -12.543 1.00 0.00 C ATOM 993 O ASP A 66 -15.808 3.392 -13.452 1.00 0.00 O ATOM 994 CB ASP A 66 -17.931 3.228 -11.580 1.00 0.00 C ATOM 995 CG ASP A 66 -18.647 3.566 -12.890 1.00 0.00 C ATOM 996 OD1 ASP A 66 -19.003 2.641 -13.602 1.00 0.00 O ATOM 997 OD2 ASP A 66 -18.824 4.742 -13.159 1.00 0.00 O ATOM 0 H ASP A 66 -16.611 2.151 -9.712 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.430 1.306 -12.414 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.659 2.951 -10.817 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.398 4.104 -11.209 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.562 2.132 -12.154 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.310 2.587 -12.827 1.00 0.00 C ATOM 1004 C ARG A 67 -12.257 1.471 -12.773 1.00 0.00 C ATOM 1005 O ARG A 67 -11.270 1.580 -12.073 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.776 3.843 -12.117 1.00 0.00 C ATOM 1007 CG ARG A 67 -11.847 4.635 -13.060 1.00 0.00 C ATOM 1008 CD ARG A 67 -12.667 5.613 -13.911 1.00 0.00 C ATOM 1009 NE ARG A 67 -11.808 6.178 -14.988 1.00 0.00 N ATOM 1010 CZ ARG A 67 -12.353 6.792 -16.002 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -13.652 6.905 -16.076 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -11.601 7.292 -16.944 1.00 0.00 N ATOM 0 H ARG A 67 -14.428 1.460 -11.398 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.523 2.824 -13.869 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -13.608 4.473 -11.802 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -12.233 3.557 -11.216 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -11.105 5.182 -12.477 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.301 3.948 -13.707 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -13.525 5.101 -14.347 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.059 6.415 -13.286 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.794 6.085 -14.933 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.241 6.513 -15.341 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.078 7.385 -16.869 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.586 7.203 -16.888 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -12.028 7.772 -17.736 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.469 0.408 -13.507 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.528 -0.763 -13.552 1.00 0.00 C ATOM 1028 C PRO A 68 -10.080 -0.376 -13.906 1.00 0.00 C ATOM 1029 O PRO A 68 -9.289 -1.211 -14.297 1.00 0.00 O ATOM 1030 CB PRO A 68 -12.130 -1.665 -14.643 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.579 -1.303 -14.675 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.635 0.194 -14.379 1.00 0.00 C ATOM 0 HA PRO A 68 -11.445 -1.240 -12.575 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.656 -1.489 -15.609 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.990 -2.720 -14.407 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -14.018 -1.527 -15.647 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -14.141 -1.870 -13.933 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.570 0.788 -15.291 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.565 0.472 -13.883 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.724 0.872 -13.764 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.332 1.303 -14.082 1.00 0.00 C ATOM 1042 C ASN A 69 -7.960 2.471 -13.169 1.00 0.00 C ATOM 1043 O ASN A 69 -7.710 3.570 -13.626 1.00 0.00 O ATOM 1044 CB ASN A 69 -8.254 1.752 -15.543 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.950 0.723 -16.434 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -8.409 -0.333 -16.701 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -10.136 0.985 -16.909 1.00 0.00 N ATOM 0 H ASN A 69 -10.341 1.616 -13.439 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.642 0.473 -13.926 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -8.726 2.728 -15.660 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -7.212 1.864 -15.844 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.609 0.305 -17.504 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.591 1.870 -16.686 1.00 0.00 H new ATOM 1054 N TYR A 70 -7.936 2.245 -11.876 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.597 3.340 -10.909 1.00 0.00 C ATOM 1056 C TYR A 70 -6.517 2.862 -9.930 1.00 0.00 C ATOM 1057 O TYR A 70 -5.716 2.001 -10.234 1.00 0.00 O ATOM 1058 CB TYR A 70 -8.866 3.740 -10.132 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.749 5.172 -9.646 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -8.685 6.218 -10.574 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -8.705 5.453 -8.273 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -8.577 7.542 -10.133 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -8.597 6.777 -7.832 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.533 7.821 -8.761 1.00 0.00 C ATOM 1065 OH TYR A 70 -8.426 9.126 -8.326 1.00 0.00 O ATOM 0 H TYR A 70 -8.138 1.342 -11.446 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.216 4.202 -11.457 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.742 3.635 -10.772 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.009 3.070 -9.284 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -8.719 6.003 -11.632 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -8.754 4.647 -7.555 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -8.528 8.348 -10.850 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -8.563 6.993 -6.774 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.410 9.144 -7.346 1.00 0.00 H new ATOM 1075 N GLN A 71 -6.485 3.443 -8.761 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.457 3.070 -7.746 1.00 0.00 C ATOM 1077 C GLN A 71 -5.589 1.601 -7.318 1.00 0.00 C ATOM 1078 O GLN A 71 -4.961 0.719 -7.869 1.00 0.00 O ATOM 1079 CB GLN A 71 -5.629 3.965 -6.518 1.00 0.00 C ATOM 1080 CG GLN A 71 -5.376 5.423 -6.908 1.00 0.00 C ATOM 1081 CD GLN A 71 -5.812 6.338 -5.762 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -5.689 5.985 -4.606 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -6.323 7.507 -6.036 1.00 0.00 N ATOM 0 H GLN A 71 -7.136 4.169 -8.462 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.471 3.205 -8.192 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -6.635 3.855 -6.113 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -4.935 3.662 -5.734 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -4.319 5.574 -7.127 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -5.928 5.669 -7.815 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -6.426 7.804 -7.006 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -6.619 8.124 -5.280 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.374 1.350 -6.304 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.539 -0.040 -5.773 1.00 0.00 C ATOM 1094 C PHE A 72 -7.774 -0.715 -6.392 1.00 0.00 C ATOM 1095 O PHE A 72 -8.235 -1.728 -5.915 1.00 0.00 O ATOM 1096 CB PHE A 72 -6.714 0.062 -4.240 1.00 0.00 C ATOM 1097 CG PHE A 72 -6.187 -1.176 -3.554 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -7.017 -2.289 -3.365 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -4.862 -1.209 -3.112 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -6.518 -3.432 -2.739 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -4.365 -2.351 -2.481 1.00 0.00 C ATOM 1102 CZ PHE A 72 -5.193 -3.465 -2.296 1.00 0.00 C ATOM 0 H PHE A 72 -6.917 2.059 -5.812 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.666 -0.641 -6.027 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.188 0.941 -3.868 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -7.768 0.196 -3.998 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.042 -2.262 -3.704 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.222 -0.351 -3.258 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.156 -4.292 -2.597 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.342 -2.375 -2.136 1.00 0.00 H new ATOM 0 HZ PHE A 72 -4.808 -4.350 -1.811 1.00 0.00 H new ATOM 1112 N THR A 73 -8.323 -0.171 -7.439 1.00 0.00 N ATOM 1113 CA THR A 73 -9.531 -0.807 -8.039 1.00 0.00 C ATOM 1114 C THR A 73 -9.192 -2.190 -8.612 1.00 0.00 C ATOM 1115 O THR A 73 -9.890 -3.156 -8.379 1.00 0.00 O ATOM 1116 CB THR A 73 -10.079 0.059 -9.178 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.442 1.338 -8.682 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.308 -0.628 -9.775 1.00 0.00 C ATOM 0 H THR A 73 -7.995 0.676 -7.903 1.00 0.00 H new ATOM 0 HA THR A 73 -10.275 -0.907 -7.249 1.00 0.00 H new ATOM 0 HB THR A 73 -9.314 0.182 -9.944 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.790 1.887 -9.416 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.706 -0.020 -10.587 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.026 -1.608 -10.160 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.069 -0.747 -9.004 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.153 -2.285 -9.396 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.802 -3.594 -10.024 1.00 0.00 C ATOM 1128 C ASN A 74 -6.993 -4.474 -9.068 1.00 0.00 C ATOM 1129 O ASN A 74 -6.906 -5.673 -9.248 1.00 0.00 O ATOM 1130 CB ASN A 74 -6.990 -3.327 -11.291 1.00 0.00 C ATOM 1131 CG ASN A 74 -7.877 -2.620 -12.314 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -8.413 -1.564 -12.043 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -8.058 -3.158 -13.486 1.00 0.00 N ATOM 0 H ASN A 74 -7.530 -1.512 -9.630 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.723 -4.125 -10.265 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.121 -2.712 -11.058 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.616 -4.265 -11.702 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.649 -2.693 -14.175 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.609 -4.045 -13.715 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.398 -3.906 -8.061 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.600 -4.740 -7.118 1.00 0.00 C ATOM 1142 C LEU A 75 -6.476 -5.886 -6.599 1.00 0.00 C ATOM 1143 O LEU A 75 -5.993 -6.949 -6.272 1.00 0.00 O ATOM 1144 CB LEU A 75 -5.121 -3.860 -5.949 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.938 -4.495 -5.175 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -4.379 -5.758 -4.403 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.769 -4.830 -6.124 1.00 0.00 C ATOM 0 H LEU A 75 -6.427 -2.909 -7.848 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.731 -5.159 -7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.819 -2.885 -6.332 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.951 -3.690 -5.263 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.595 -3.757 -4.450 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.524 -6.177 -3.872 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.157 -5.494 -3.687 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.767 -6.496 -5.105 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.953 -5.274 -5.554 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.107 -5.535 -6.883 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.419 -3.917 -6.607 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.764 -5.691 -6.544 1.00 0.00 N ATOM 1160 CA LYS A 76 -8.650 -6.785 -6.065 1.00 0.00 C ATOM 1161 C LYS A 76 -8.590 -7.910 -7.087 1.00 0.00 C ATOM 1162 O LYS A 76 -8.767 -9.074 -6.782 1.00 0.00 O ATOM 1163 CB LYS A 76 -10.087 -6.267 -5.943 1.00 0.00 C ATOM 1164 CG LYS A 76 -10.065 -4.842 -5.380 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.468 -4.429 -4.917 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.321 -4.018 -6.121 1.00 0.00 C ATOM 1167 NZ LYS A 76 -11.689 -2.856 -6.805 1.00 0.00 N ATOM 0 H LYS A 76 -8.238 -4.827 -6.808 1.00 0.00 H new ATOM 0 HA LYS A 76 -8.327 -7.142 -5.087 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -10.574 -6.278 -6.918 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -10.667 -6.919 -5.290 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.368 -4.785 -4.544 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.707 -4.149 -6.141 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.944 -5.256 -4.390 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.397 -3.601 -4.212 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -12.417 -4.854 -6.814 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -13.328 -3.758 -5.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.339 -2.481 -7.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.480 -2.114 -6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.805 -3.160 -7.261 1.00 0.00 H new ATOM 1181 N ALA A 77 -8.328 -7.545 -8.302 1.00 0.00 N ATOM 1182 CA ALA A 77 -8.231 -8.543 -9.395 1.00 0.00 C ATOM 1183 C ALA A 77 -6.949 -9.359 -9.215 1.00 0.00 C ATOM 1184 O ALA A 77 -6.848 -10.490 -9.646 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.192 -7.790 -10.726 1.00 0.00 C ATOM 0 H ALA A 77 -8.174 -6.579 -8.591 1.00 0.00 H new ATOM 0 HA ALA A 77 -9.085 -9.220 -9.378 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.121 -8.504 -11.546 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.102 -7.200 -10.837 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.326 -7.129 -10.745 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.970 -8.783 -8.574 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.686 -9.503 -8.351 1.00 0.00 C ATOM 1193 C ALA A 78 -4.954 -10.826 -7.623 1.00 0.00 C ATOM 1194 O ALA A 78 -6.047 -11.078 -7.158 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.768 -8.622 -7.500 1.00 0.00 C ATOM 0 H ALA A 78 -6.005 -7.838 -8.193 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.211 -9.717 -9.308 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.824 -9.139 -7.330 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.579 -7.683 -8.021 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.247 -8.416 -6.543 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.961 -11.673 -7.522 1.00 0.00 N ATOM 1202 CA LYS A 79 -4.150 -12.983 -6.823 1.00 0.00 C ATOM 1203 C LYS A 79 -2.821 -13.412 -6.197 1.00 0.00 C ATOM 1204 O LYS A 79 -1.785 -12.842 -6.475 1.00 0.00 O ATOM 1205 CB LYS A 79 -4.607 -14.042 -7.831 1.00 0.00 C ATOM 1206 CG LYS A 79 -5.932 -13.611 -8.463 1.00 0.00 C ATOM 1207 CD LYS A 79 -6.534 -14.783 -9.240 1.00 0.00 C ATOM 1208 CE LYS A 79 -7.879 -14.362 -9.833 1.00 0.00 C ATOM 1209 NZ LYS A 79 -8.348 -15.403 -10.791 1.00 0.00 N ATOM 0 H LYS A 79 -3.025 -11.514 -7.894 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.906 -12.878 -6.045 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.850 -14.174 -8.604 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.726 -15.005 -7.334 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -6.625 -13.280 -7.690 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.770 -12.764 -9.130 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.855 -15.094 -10.034 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.667 -15.641 -8.581 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -8.613 -14.227 -9.038 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -7.780 -13.403 -10.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -9.263 -15.117 -11.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -7.651 -15.511 -11.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -8.458 -16.309 -10.293 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.837 -14.404 -5.346 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.565 -14.844 -4.705 1.00 0.00 C ATOM 1225 C LYS A 80 -0.503 -15.086 -5.785 1.00 0.00 C ATOM 1226 O LYS A 80 -0.813 -15.426 -6.909 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.798 -16.133 -3.893 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.761 -16.218 -2.759 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.789 -17.604 -2.100 1.00 0.00 C ATOM 1230 CE LYS A 80 -2.230 -18.014 -1.781 1.00 0.00 C ATOM 1231 NZ LYS A 80 -2.956 -16.859 -1.181 1.00 0.00 N ATOM 0 H LYS A 80 -3.669 -14.925 -5.069 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.217 -14.064 -4.028 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.806 -16.138 -3.479 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.715 -17.005 -4.542 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.235 -16.018 -3.155 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.967 -15.451 -2.013 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.334 -18.339 -2.764 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.197 -17.591 -1.185 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.735 -18.342 -2.689 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.235 -18.858 -1.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.697 -17.209 -0.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.287 -16.268 -0.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.391 -16.292 -1.937 1.00 0.00 H new ATOM 1245 N GLY A 81 0.748 -14.906 -5.453 1.00 0.00 N ATOM 1246 CA GLY A 81 1.829 -15.119 -6.460 1.00 0.00 C ATOM 1247 C GLY A 81 1.974 -13.862 -7.318 1.00 0.00 C ATOM 1248 O GLY A 81 2.955 -13.679 -8.012 1.00 0.00 O ATOM 0 H GLY A 81 1.068 -14.621 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.771 -15.342 -5.958 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.592 -15.977 -7.089 1.00 0.00 H new ATOM 1252 N SER A 82 1.006 -12.990 -7.268 1.00 0.00 N ATOM 1253 CA SER A 82 1.078 -11.739 -8.065 1.00 0.00 C ATOM 1254 C SER A 82 2.259 -10.914 -7.572 1.00 0.00 C ATOM 1255 O SER A 82 2.230 -10.361 -6.490 1.00 0.00 O ATOM 1256 CB SER A 82 -0.215 -10.943 -7.883 1.00 0.00 C ATOM 1257 OG SER A 82 -0.482 -10.792 -6.495 1.00 0.00 O ATOM 0 H SER A 82 0.162 -13.093 -6.704 1.00 0.00 H new ATOM 0 HA SER A 82 1.206 -11.976 -9.121 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.123 -9.965 -8.356 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.044 -11.457 -8.371 1.00 0.00 H new ATOM 0 HG SER A 82 -1.267 -11.326 -6.253 1.00 0.00 H new ATOM 1263 N MET A 83 3.307 -10.831 -8.341 1.00 0.00 N ATOM 1264 CA MET A 83 4.484 -10.045 -7.886 1.00 0.00 C ATOM 1265 C MET A 83 4.234 -8.559 -8.143 1.00 0.00 C ATOM 1266 O MET A 83 3.314 -8.190 -8.846 1.00 0.00 O ATOM 1267 CB MET A 83 5.737 -10.505 -8.635 1.00 0.00 C ATOM 1268 CG MET A 83 5.612 -10.145 -10.116 1.00 0.00 C ATOM 1269 SD MET A 83 6.904 -10.998 -11.057 1.00 0.00 S ATOM 1270 CE MET A 83 8.326 -10.330 -10.158 1.00 0.00 C ATOM 0 H MET A 83 3.399 -11.270 -9.257 1.00 0.00 H new ATOM 0 HA MET A 83 4.635 -10.203 -6.818 1.00 0.00 H new ATOM 0 HB2 MET A 83 6.622 -10.032 -8.209 1.00 0.00 H new ATOM 0 HB3 MET A 83 5.866 -11.581 -8.522 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.628 -10.430 -10.489 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.703 -9.067 -10.248 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.178 -10.249 -10.833 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.078 -9.343 -9.767 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.579 -10.995 -9.332 1.00 0.00 H new ATOM 1280 N VAL A 84 5.036 -7.700 -7.565 1.00 0.00 N ATOM 1281 CA VAL A 84 4.833 -6.229 -7.755 1.00 0.00 C ATOM 1282 C VAL A 84 6.187 -5.520 -7.863 1.00 0.00 C ATOM 1283 O VAL A 84 7.231 -6.125 -7.715 1.00 0.00 O ATOM 1284 CB VAL A 84 4.048 -5.685 -6.551 1.00 0.00 C ATOM 1285 CG1 VAL A 84 2.891 -6.636 -6.228 1.00 0.00 C ATOM 1286 CG2 VAL A 84 4.964 -5.592 -5.329 1.00 0.00 C ATOM 0 H VAL A 84 5.824 -7.953 -6.969 1.00 0.00 H new ATOM 0 HA VAL A 84 4.276 -6.047 -8.674 1.00 0.00 H new ATOM 0 HB VAL A 84 3.664 -4.695 -6.796 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.332 -6.253 -5.374 1.00 0.00 H new ATOM 0 HG12 VAL A 84 2.229 -6.710 -7.091 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.287 -7.623 -5.989 1.00 0.00 H new ATOM 0 HG21 VAL A 84 4.400 -5.206 -4.480 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.350 -6.582 -5.088 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.795 -4.922 -5.548 1.00 0.00 H new ATOM 1296 N TYR A 85 6.176 -4.234 -8.117 1.00 0.00 N ATOM 1297 CA TYR A 85 7.456 -3.474 -8.234 1.00 0.00 C ATOM 1298 C TYR A 85 7.280 -2.086 -7.618 1.00 0.00 C ATOM 1299 O TYR A 85 6.569 -1.249 -8.137 1.00 0.00 O ATOM 1300 CB TYR A 85 7.832 -3.328 -9.709 1.00 0.00 C ATOM 1301 CG TYR A 85 8.003 -4.696 -10.322 1.00 0.00 C ATOM 1302 CD1 TYR A 85 6.881 -5.415 -10.746 1.00 0.00 C ATOM 1303 CD2 TYR A 85 9.283 -5.243 -10.469 1.00 0.00 C ATOM 1304 CE1 TYR A 85 7.038 -6.683 -11.318 1.00 0.00 C ATOM 1305 CE2 TYR A 85 9.440 -6.511 -11.038 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.318 -7.231 -11.463 1.00 0.00 C ATOM 1307 OH TYR A 85 8.473 -8.480 -12.030 1.00 0.00 O ATOM 0 H TYR A 85 5.331 -3.678 -8.249 1.00 0.00 H new ATOM 0 HA TYR A 85 8.246 -4.011 -7.709 1.00 0.00 H new ATOM 0 HB2 TYR A 85 7.058 -2.774 -10.240 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.755 -2.757 -9.805 1.00 0.00 H new ATOM 0 HD1 TYR A 85 5.894 -4.992 -10.632 1.00 0.00 H new ATOM 0 HD2 TYR A 85 10.149 -4.686 -10.143 1.00 0.00 H new ATOM 0 HE1 TYR A 85 6.172 -7.238 -11.647 1.00 0.00 H new ATOM 0 HE2 TYR A 85 10.427 -6.934 -11.149 1.00 0.00 H new ATOM 0 HH TYR A 85 7.602 -8.926 -12.081 1.00 0.00 H new ATOM 1317 N PHE A 86 7.930 -1.836 -6.513 1.00 0.00 N ATOM 1318 CA PHE A 86 7.817 -0.501 -5.852 1.00 0.00 C ATOM 1319 C PHE A 86 8.973 0.377 -6.328 1.00 0.00 C ATOM 1320 O PHE A 86 10.127 0.084 -6.092 1.00 0.00 O ATOM 1321 CB PHE A 86 7.890 -0.685 -4.331 1.00 0.00 C ATOM 1322 CG PHE A 86 7.573 0.623 -3.633 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.297 1.187 -3.753 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.552 1.266 -2.860 1.00 0.00 C ATOM 1325 CE1 PHE A 86 5.999 2.391 -3.104 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.251 2.472 -2.210 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.976 3.033 -2.333 1.00 0.00 C ATOM 0 H PHE A 86 8.538 -2.502 -6.036 1.00 0.00 H new ATOM 0 HA PHE A 86 6.869 -0.028 -6.108 1.00 0.00 H new ATOM 0 HB2 PHE A 86 7.186 -1.455 -4.016 1.00 0.00 H new ATOM 0 HB3 PHE A 86 8.885 -1.027 -4.045 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.542 0.693 -4.347 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.537 0.833 -2.766 1.00 0.00 H new ATOM 0 HE1 PHE A 86 5.015 2.825 -3.198 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.004 2.967 -1.615 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.745 3.962 -1.833 1.00 0.00 H new ATOM 1337 N LYS A 87 8.672 1.445 -7.016 1.00 0.00 N ATOM 1338 CA LYS A 87 9.755 2.331 -7.528 1.00 0.00 C ATOM 1339 C LYS A 87 10.150 3.344 -6.455 1.00 0.00 C ATOM 1340 O LYS A 87 9.320 3.859 -5.731 1.00 0.00 O ATOM 1341 CB LYS A 87 9.258 3.072 -8.769 1.00 0.00 C ATOM 1342 CG LYS A 87 10.409 3.867 -9.390 1.00 0.00 C ATOM 1343 CD LYS A 87 10.017 4.316 -10.799 1.00 0.00 C ATOM 1344 CE LYS A 87 11.086 5.262 -11.349 1.00 0.00 C ATOM 1345 NZ LYS A 87 10.894 5.428 -12.817 1.00 0.00 N ATOM 0 H LYS A 87 7.723 1.742 -7.245 1.00 0.00 H new ATOM 0 HA LYS A 87 10.624 1.725 -7.784 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.861 2.362 -9.494 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.442 3.743 -8.501 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.641 4.734 -8.772 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.309 3.254 -9.430 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.912 3.450 -11.452 1.00 0.00 H new ATOM 0 HD3 LYS A 87 9.049 4.817 -10.776 1.00 0.00 H new ATOM 0 HE2 LYS A 87 11.022 6.230 -10.851 1.00 0.00 H new ATOM 0 HE3 LYS A 87 12.080 4.864 -11.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.620 6.071 -13.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.976 4.503 -13.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 9.951 5.826 -13.001 1.00 0.00 H new ATOM 1359 N VAL A 88 11.421 3.626 -6.346 1.00 0.00 N ATOM 1360 CA VAL A 88 11.898 4.600 -5.321 1.00 0.00 C ATOM 1361 C VAL A 88 13.110 5.358 -5.873 1.00 0.00 C ATOM 1362 O VAL A 88 14.067 4.766 -6.332 1.00 0.00 O ATOM 1363 CB VAL A 88 12.296 3.839 -4.048 1.00 0.00 C ATOM 1364 CG1 VAL A 88 11.153 2.907 -3.635 1.00 0.00 C ATOM 1365 CG2 VAL A 88 13.559 3.008 -4.310 1.00 0.00 C ATOM 0 H VAL A 88 12.154 3.220 -6.927 1.00 0.00 H new ATOM 0 HA VAL A 88 11.105 5.309 -5.084 1.00 0.00 H new ATOM 0 HB VAL A 88 12.495 4.554 -3.250 1.00 0.00 H new ATOM 0 HG11 VAL A 88 11.433 2.366 -2.731 1.00 0.00 H new ATOM 0 HG12 VAL A 88 10.256 3.495 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL A 88 10.955 2.196 -4.437 1.00 0.00 H new ATOM 0 HG21 VAL A 88 13.836 2.471 -3.403 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.365 2.293 -5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 88 14.375 3.669 -4.604 1.00 0.00 H new ATOM 1375 N GLY A 89 13.076 6.661 -5.835 1.00 0.00 N ATOM 1376 CA GLY A 89 14.227 7.455 -6.358 1.00 0.00 C ATOM 1377 C GLY A 89 14.657 6.908 -7.723 1.00 0.00 C ATOM 1378 O GLY A 89 13.911 6.956 -8.682 1.00 0.00 O ATOM 0 H GLY A 89 12.302 7.212 -5.465 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.946 8.504 -6.449 1.00 0.00 H new ATOM 0 HA3 GLY A 89 15.061 7.408 -5.658 1.00 0.00 H new ATOM 1382 N ASN A 90 15.859 6.389 -7.812 1.00 0.00 N ATOM 1383 CA ASN A 90 16.366 5.832 -9.107 1.00 0.00 C ATOM 1384 C ASN A 90 16.610 4.328 -8.953 1.00 0.00 C ATOM 1385 O ASN A 90 17.684 3.831 -9.231 1.00 0.00 O ATOM 1386 CB ASN A 90 17.680 6.524 -9.474 1.00 0.00 C ATOM 1387 CG ASN A 90 17.426 8.016 -9.700 1.00 0.00 C ATOM 1388 OD1 ASN A 90 16.971 8.709 -8.812 1.00 0.00 O ATOM 1389 ND2 ASN A 90 17.702 8.545 -10.862 1.00 0.00 N ATOM 0 H ASN A 90 16.517 6.327 -7.035 1.00 0.00 H new ATOM 0 HA ASN A 90 15.630 6.003 -9.892 1.00 0.00 H new ATOM 0 HB2 ASN A 90 18.411 6.385 -8.677 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.100 6.075 -10.374 1.00 0.00 H new ATOM 0 HD21 ASN A 90 17.535 9.538 -11.023 1.00 0.00 H new ATOM 0 HD22 ASN A 90 18.084 7.965 -11.609 1.00 0.00 H new ATOM 1396 N GLU A 91 15.619 3.599 -8.514 1.00 0.00 N ATOM 1397 CA GLU A 91 15.787 2.127 -8.345 1.00 0.00 C ATOM 1398 C GLU A 91 14.411 1.487 -8.143 1.00 0.00 C ATOM 1399 O GLU A 91 13.487 2.126 -7.679 1.00 0.00 O ATOM 1400 CB GLU A 91 16.670 1.847 -7.127 1.00 0.00 C ATOM 1401 CG GLU A 91 16.771 0.334 -6.905 1.00 0.00 C ATOM 1402 CD GLU A 91 17.938 0.032 -5.961 1.00 0.00 C ATOM 1403 OE1 GLU A 91 18.141 0.801 -5.036 1.00 0.00 O ATOM 1404 OE2 GLU A 91 18.607 -0.965 -6.179 1.00 0.00 O ATOM 0 H GLU A 91 14.698 3.961 -8.265 1.00 0.00 H new ATOM 0 HA GLU A 91 16.260 1.706 -9.232 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.663 2.270 -7.280 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.251 2.328 -6.243 1.00 0.00 H new ATOM 0 HG2 GLU A 91 15.840 -0.045 -6.482 1.00 0.00 H new ATOM 0 HG3 GLU A 91 16.919 -0.175 -7.858 1.00 0.00 H new ATOM 1411 N THR A 92 14.265 0.233 -8.500 1.00 0.00 N ATOM 1412 CA THR A 92 12.943 -0.455 -8.348 1.00 0.00 C ATOM 1413 C THR A 92 13.122 -1.807 -7.653 1.00 0.00 C ATOM 1414 O THR A 92 13.875 -2.652 -8.097 1.00 0.00 O ATOM 1415 CB THR A 92 12.334 -0.662 -9.740 1.00 0.00 C ATOM 1416 OG1 THR A 92 10.969 -1.031 -9.608 1.00 0.00 O ATOM 1417 CG2 THR A 92 13.092 -1.761 -10.495 1.00 0.00 C ATOM 0 H THR A 92 15.008 -0.346 -8.892 1.00 0.00 H new ATOM 0 HA THR A 92 12.281 0.159 -7.738 1.00 0.00 H new ATOM 0 HB THR A 92 12.411 0.269 -10.302 1.00 0.00 H new ATOM 0 HG1 THR A 92 10.578 -1.162 -10.497 1.00 0.00 H new ATOM 0 HG21 THR A 92 12.649 -1.897 -11.481 1.00 0.00 H new ATOM 0 HG22 THR A 92 14.138 -1.473 -10.604 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.029 -2.695 -9.937 1.00 0.00 H new ATOM 1425 N ARG A 93 12.414 -2.023 -6.572 1.00 0.00 N ATOM 1426 CA ARG A 93 12.513 -3.334 -5.845 1.00 0.00 C ATOM 1427 C ARG A 93 11.347 -4.224 -6.293 1.00 0.00 C ATOM 1428 O ARG A 93 10.486 -3.799 -7.036 1.00 0.00 O ATOM 1429 CB ARG A 93 12.472 -3.116 -4.307 1.00 0.00 C ATOM 1430 CG ARG A 93 11.889 -1.734 -3.970 1.00 0.00 C ATOM 1431 CD ARG A 93 12.981 -0.656 -4.075 1.00 0.00 C ATOM 1432 NE ARG A 93 13.729 -0.584 -2.787 1.00 0.00 N ATOM 1433 CZ ARG A 93 14.877 0.033 -2.732 1.00 0.00 C ATOM 1434 NH1 ARG A 93 15.376 0.580 -3.807 1.00 0.00 N ATOM 1435 NH2 ARG A 93 15.529 0.100 -1.604 1.00 0.00 N ATOM 0 H ARG A 93 11.770 -1.349 -6.158 1.00 0.00 H new ATOM 0 HA ARG A 93 13.462 -3.815 -6.083 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.869 -3.895 -3.840 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.478 -3.202 -3.895 1.00 0.00 H new ATOM 0 HG2 ARG A 93 11.071 -1.501 -4.651 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.472 -1.743 -2.963 1.00 0.00 H new ATOM 0 HD2 ARG A 93 13.663 -0.891 -4.892 1.00 0.00 H new ATOM 0 HD3 ARG A 93 12.533 0.311 -4.303 1.00 0.00 H new ATOM 0 HE ARG A 93 13.343 -1.018 -1.948 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.868 0.525 -4.690 1.00 0.00 H new ATOM 0 HH12 ARG A 93 16.274 1.062 -3.764 1.00 0.00 H new ATOM 0 HH21 ARG A 93 15.141 -0.330 -0.764 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.427 0.583 -1.562 1.00 0.00 H new ATOM 1449 N LYS A 94 11.316 -5.459 -5.856 1.00 0.00 N ATOM 1450 CA LYS A 94 10.208 -6.378 -6.270 1.00 0.00 C ATOM 1451 C LYS A 94 9.816 -7.288 -5.101 1.00 0.00 C ATOM 1452 O LYS A 94 10.606 -7.560 -4.220 1.00 0.00 O ATOM 1453 CB LYS A 94 10.685 -7.244 -7.439 1.00 0.00 C ATOM 1454 CG LYS A 94 11.902 -8.071 -7.000 1.00 0.00 C ATOM 1455 CD LYS A 94 12.638 -8.634 -8.232 1.00 0.00 C ATOM 1456 CE LYS A 94 13.648 -7.609 -8.765 1.00 0.00 C ATOM 1457 NZ LYS A 94 14.617 -7.260 -7.688 1.00 0.00 N ATOM 0 H LYS A 94 12.009 -5.871 -5.231 1.00 0.00 H new ATOM 0 HA LYS A 94 9.344 -5.785 -6.569 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.882 -7.904 -7.767 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.947 -6.614 -8.289 1.00 0.00 H new ATOM 0 HG2 LYS A 94 12.580 -7.450 -6.415 1.00 0.00 H new ATOM 0 HG3 LYS A 94 11.581 -8.889 -6.354 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.153 -9.557 -7.966 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.918 -8.884 -9.011 1.00 0.00 H new ATOM 0 HE2 LYS A 94 14.177 -8.017 -9.626 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.128 -6.713 -9.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.551 -7.078 -8.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.290 -6.408 -7.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.687 -8.050 -7.015 1.00 0.00 H new ATOM 1471 N TYR A 95 8.596 -7.768 -5.100 1.00 0.00 N ATOM 1472 CA TYR A 95 8.130 -8.675 -4.003 1.00 0.00 C ATOM 1473 C TYR A 95 7.306 -9.811 -4.615 1.00 0.00 C ATOM 1474 O TYR A 95 7.081 -9.853 -5.810 1.00 0.00 O ATOM 1475 CB TYR A 95 7.251 -7.901 -3.013 1.00 0.00 C ATOM 1476 CG TYR A 95 7.912 -6.589 -2.642 1.00 0.00 C ATOM 1477 CD1 TYR A 95 7.993 -5.550 -3.582 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.438 -6.410 -1.354 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.600 -4.337 -3.232 1.00 0.00 C ATOM 1480 CE2 TYR A 95 9.043 -5.197 -1.007 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.126 -4.162 -1.945 1.00 0.00 C ATOM 1482 OH TYR A 95 9.724 -2.966 -1.602 1.00 0.00 O ATOM 0 H TYR A 95 7.898 -7.569 -5.817 1.00 0.00 H new ATOM 0 HA TYR A 95 8.997 -9.074 -3.476 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.273 -7.712 -3.455 1.00 0.00 H new ATOM 0 HB3 TYR A 95 7.086 -8.500 -2.117 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.588 -5.685 -4.574 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.376 -7.209 -0.630 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.663 -3.536 -3.954 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.446 -5.059 -0.015 1.00 0.00 H new ATOM 0 HH TYR A 95 10.034 -3.010 -0.673 1.00 0.00 H new ATOM 1492 N LYS A 96 6.849 -10.734 -3.805 1.00 0.00 N ATOM 1493 CA LYS A 96 6.033 -11.874 -4.331 1.00 0.00 C ATOM 1494 C LYS A 96 4.895 -12.175 -3.355 1.00 0.00 C ATOM 1495 O LYS A 96 5.116 -12.652 -2.258 1.00 0.00 O ATOM 1496 CB LYS A 96 6.918 -13.114 -4.475 1.00 0.00 C ATOM 1497 CG LYS A 96 6.070 -14.290 -4.974 1.00 0.00 C ATOM 1498 CD LYS A 96 6.979 -15.455 -5.411 1.00 0.00 C ATOM 1499 CE LYS A 96 7.444 -15.259 -6.861 1.00 0.00 C ATOM 1500 NZ LYS A 96 8.183 -16.472 -7.312 1.00 0.00 N ATOM 0 H LYS A 96 7.006 -10.747 -2.797 1.00 0.00 H new ATOM 0 HA LYS A 96 5.621 -11.607 -5.304 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.731 -12.915 -5.174 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.375 -13.362 -3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.396 -14.622 -4.185 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.449 -13.970 -5.811 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.844 -15.517 -4.751 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.440 -16.398 -5.320 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.586 -15.081 -7.509 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.086 -14.381 -6.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.499 -16.341 -8.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.010 -16.622 -6.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.557 -17.300 -7.257 1.00 0.00 H new ATOM 1514 N MET A 97 3.677 -11.892 -3.738 1.00 0.00 N ATOM 1515 CA MET A 97 2.526 -12.159 -2.828 1.00 0.00 C ATOM 1516 C MET A 97 2.634 -13.593 -2.291 1.00 0.00 C ATOM 1517 O MET A 97 2.899 -14.522 -3.027 1.00 0.00 O ATOM 1518 CB MET A 97 1.202 -11.981 -3.607 1.00 0.00 C ATOM 1519 CG MET A 97 0.588 -10.600 -3.329 1.00 0.00 C ATOM 1520 SD MET A 97 1.643 -9.308 -4.028 1.00 0.00 S ATOM 1521 CE MET A 97 0.375 -8.020 -4.160 1.00 0.00 C ATOM 0 H MET A 97 3.431 -11.488 -4.641 1.00 0.00 H new ATOM 0 HA MET A 97 2.541 -11.459 -1.992 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.385 -12.094 -4.675 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.498 -12.762 -3.320 1.00 0.00 H new ATOM 0 HG2 MET A 97 -0.410 -10.542 -3.763 1.00 0.00 H new ATOM 0 HG3 MET A 97 0.478 -10.451 -2.255 1.00 0.00 H new ATOM 0 HE1 MET A 97 0.040 -7.944 -5.194 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.471 -8.276 -3.522 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.793 -7.064 -3.843 1.00 0.00 H new ATOM 1531 N THR A 98 2.423 -13.777 -1.014 1.00 0.00 N ATOM 1532 CA THR A 98 2.509 -15.149 -0.432 1.00 0.00 C ATOM 1533 C THR A 98 1.622 -15.246 0.815 1.00 0.00 C ATOM 1534 O THR A 98 1.790 -16.135 1.626 1.00 0.00 O ATOM 1535 CB THR A 98 3.965 -15.455 -0.042 1.00 0.00 C ATOM 1536 OG1 THR A 98 4.538 -14.306 0.567 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.780 -15.831 -1.284 1.00 0.00 C ATOM 0 H THR A 98 2.195 -13.037 -0.350 1.00 0.00 H new ATOM 0 HA THR A 98 2.168 -15.870 -1.175 1.00 0.00 H new ATOM 0 HB THR A 98 3.978 -16.292 0.656 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.792 -13.661 -0.126 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.808 -16.045 -0.993 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.344 -16.714 -1.752 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.768 -15.002 -1.992 1.00 0.00 H new ATOM 1545 N SER A 99 0.677 -14.356 0.987 1.00 0.00 N ATOM 1546 CA SER A 99 -0.190 -14.447 2.191 1.00 0.00 C ATOM 1547 C SER A 99 -1.352 -13.470 2.049 1.00 0.00 C ATOM 1548 O SER A 99 -1.296 -12.342 2.488 1.00 0.00 O ATOM 1549 CB SER A 99 0.635 -14.110 3.436 1.00 0.00 C ATOM 1550 OG SER A 99 -0.180 -13.421 4.376 1.00 0.00 O ATOM 0 H SER A 99 0.473 -13.583 0.354 1.00 0.00 H new ATOM 0 HA SER A 99 -0.585 -15.458 2.290 1.00 0.00 H new ATOM 0 HB2 SER A 99 1.029 -15.023 3.882 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.491 -13.494 3.161 1.00 0.00 H new ATOM 0 HG SER A 99 0.349 -13.207 5.173 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.406 -13.905 1.434 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.585 -13.023 1.249 1.00 0.00 C ATOM 1558 C ILE A 100 -4.420 -13.019 2.535 1.00 0.00 C ATOM 1559 O ILE A 100 -4.644 -14.051 3.137 1.00 0.00 O ATOM 1560 CB ILE A 100 -4.415 -13.582 0.098 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -3.582 -13.611 -1.197 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -5.670 -12.732 -0.105 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -3.023 -12.222 -1.532 1.00 0.00 C ATOM 0 H ILE A 100 -2.505 -14.843 1.047 1.00 0.00 H new ATOM 0 HA ILE A 100 -3.272 -12.003 1.027 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.713 -14.601 0.345 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -2.761 -14.319 -1.088 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.200 -13.965 -2.022 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.256 -13.139 -0.929 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.268 -12.743 0.806 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.381 -11.707 -0.337 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.440 -12.276 -2.451 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.847 -11.521 -1.666 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -2.385 -11.881 -0.717 1.00 0.00 H new ATOM 1842 N ASP A 118 11.008 -10.980 7.318 1.00 0.00 N ATOM 1843 CA ASP A 118 11.850 -10.226 6.339 1.00 0.00 C ATOM 1844 C ASP A 118 11.031 -9.071 5.775 1.00 0.00 C ATOM 1845 O ASP A 118 9.837 -9.000 5.991 1.00 0.00 O ATOM 1846 CB ASP A 118 12.258 -11.161 5.197 1.00 0.00 C ATOM 1847 CG ASP A 118 13.089 -12.316 5.757 1.00 0.00 C ATOM 1848 OD1 ASP A 118 12.794 -12.755 6.856 1.00 0.00 O ATOM 1849 OD2 ASP A 118 14.007 -12.743 5.076 1.00 0.00 O ATOM 0 HA ASP A 118 12.743 -9.844 6.833 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.371 -11.547 4.694 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.834 -10.612 4.452 1.00 0.00 H new ATOM 1854 N LYS A 119 11.659 -8.170 5.054 1.00 0.00 N ATOM 1855 CA LYS A 119 10.915 -7.013 4.458 1.00 0.00 C ATOM 1856 C LYS A 119 9.547 -7.497 3.972 1.00 0.00 C ATOM 1857 O LYS A 119 9.371 -8.654 3.643 1.00 0.00 O ATOM 1858 CB LYS A 119 11.711 -6.432 3.282 1.00 0.00 C ATOM 1859 CG LYS A 119 12.870 -5.575 3.810 1.00 0.00 C ATOM 1860 CD LYS A 119 13.493 -4.778 2.658 1.00 0.00 C ATOM 1861 CE LYS A 119 13.861 -5.721 1.507 1.00 0.00 C ATOM 1862 NZ LYS A 119 14.868 -5.060 0.630 1.00 0.00 N ATOM 0 H LYS A 119 12.659 -8.187 4.852 1.00 0.00 H new ATOM 0 HA LYS A 119 10.782 -6.236 5.210 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.098 -7.239 2.659 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.058 -5.828 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 119 12.509 -4.895 4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 119 13.624 -6.212 4.273 1.00 0.00 H new ATOM 0 HD2 LYS A 119 12.792 -4.020 2.308 1.00 0.00 H new ATOM 0 HD3 LYS A 119 14.382 -4.253 3.007 1.00 0.00 H new ATOM 0 HE2 LYS A 119 14.262 -6.655 1.901 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.971 -5.975 0.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 15.195 -5.733 -0.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 14.436 -4.236 0.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 15.677 -4.748 1.204 1.00 0.00 H new ATOM 1876 N GLN A 120 8.570 -6.643 3.974 1.00 0.00 N ATOM 1877 CA GLN A 120 7.208 -7.080 3.570 1.00 0.00 C ATOM 1878 C GLN A 120 6.408 -5.887 3.049 1.00 0.00 C ATOM 1879 O GLN A 120 6.698 -4.747 3.353 1.00 0.00 O ATOM 1880 CB GLN A 120 6.502 -7.705 4.790 1.00 0.00 C ATOM 1881 CG GLN A 120 6.803 -6.885 6.060 1.00 0.00 C ATOM 1882 CD GLN A 120 6.506 -7.706 7.310 1.00 0.00 C ATOM 1883 OE1 GLN A 120 5.439 -8.266 7.448 1.00 0.00 O ATOM 1884 NE2 GLN A 120 7.427 -7.798 8.233 1.00 0.00 N ATOM 0 H GLN A 120 8.653 -5.661 4.237 1.00 0.00 H new ATOM 0 HA GLN A 120 7.280 -7.819 2.772 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.426 -7.740 4.618 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.837 -8.734 4.925 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.848 -6.576 6.061 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.202 -5.976 6.064 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.322 -7.324 8.110 1.00 0.00 H new ATOM 0 HE22 GLN A 120 7.251 -8.344 9.077 1.00 0.00 H new ATOM 1893 N LEU A 121 5.403 -6.154 2.254 1.00 0.00 N ATOM 1894 CA LEU A 121 4.556 -5.065 1.679 1.00 0.00 C ATOM 1895 C LEU A 121 3.100 -5.288 2.092 1.00 0.00 C ATOM 1896 O LEU A 121 2.438 -6.168 1.586 1.00 0.00 O ATOM 1897 CB LEU A 121 4.655 -5.130 0.151 1.00 0.00 C ATOM 1898 CG LEU A 121 4.043 -3.867 -0.480 1.00 0.00 C ATOM 1899 CD1 LEU A 121 4.942 -2.640 -0.230 1.00 0.00 C ATOM 1900 CD2 LEU A 121 3.888 -4.091 -1.989 1.00 0.00 C ATOM 0 H LEU A 121 5.129 -7.096 1.975 1.00 0.00 H new ATOM 0 HA LEU A 121 4.895 -4.095 2.041 1.00 0.00 H new ATOM 0 HB2 LEU A 121 5.699 -5.225 -0.149 1.00 0.00 H new ATOM 0 HB3 LEU A 121 4.136 -6.016 -0.216 1.00 0.00 H new ATOM 0 HG LEU A 121 3.071 -3.678 -0.025 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.490 -1.759 -0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 121 5.049 -2.480 0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 121 5.924 -2.812 -0.671 1.00 0.00 H new ATOM 0 HD21 LEU A 121 3.455 -3.201 -2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.865 -4.286 -2.430 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.233 -4.945 -2.165 1.00 0.00 H new ATOM 1912 N THR A 122 2.587 -4.498 3.000 1.00 0.00 N ATOM 1913 CA THR A 122 1.163 -4.678 3.427 1.00 0.00 C ATOM 1914 C THR A 122 0.271 -3.800 2.549 1.00 0.00 C ATOM 1915 O THR A 122 0.515 -2.624 2.377 1.00 0.00 O ATOM 1916 CB THR A 122 1.011 -4.274 4.898 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.705 -5.208 5.714 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.472 -4.266 5.280 1.00 0.00 C ATOM 0 H THR A 122 3.088 -3.740 3.463 1.00 0.00 H new ATOM 0 HA THR A 122 0.870 -5.722 3.318 1.00 0.00 H new ATOM 0 HB THR A 122 1.426 -3.277 5.046 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.483 -5.049 6.655 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.577 -3.978 6.326 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.006 -3.552 4.652 1.00 0.00 H new ATOM 0 HG23 THR A 122 -0.891 -5.262 5.134 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.747 -4.373 1.964 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.653 -3.593 1.062 1.00 0.00 C ATOM 1928 C LEU A 123 -2.970 -3.268 1.786 1.00 0.00 C ATOM 1929 O LEU A 123 -3.465 -4.046 2.578 1.00 0.00 O ATOM 1930 CB LEU A 123 -1.945 -4.444 -0.180 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.766 -4.381 -1.164 1.00 0.00 C ATOM 1932 CD1 LEU A 123 0.434 -5.150 -0.602 1.00 0.00 C ATOM 1933 CD2 LEU A 123 -1.188 -5.008 -2.495 1.00 0.00 C ATOM 0 H LEU A 123 -0.994 -5.357 2.072 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.174 -2.656 0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.126 -5.478 0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.853 -4.088 -0.667 1.00 0.00 H new ATOM 0 HG LEU A 123 -0.482 -3.339 -1.314 1.00 0.00 H new ATOM 0 HD11 LEU A 123 1.263 -5.098 -1.308 1.00 0.00 H new ATOM 0 HD12 LEU A 123 0.738 -4.708 0.347 1.00 0.00 H new ATOM 0 HD13 LEU A 123 0.157 -6.192 -0.444 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -0.355 -4.966 -3.197 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -1.474 -6.047 -2.333 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -2.035 -4.458 -2.904 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.539 -2.114 1.513 1.00 0.00 N ATOM 1946 CA ILE A 124 -4.828 -1.715 2.172 1.00 0.00 C ATOM 1947 C ILE A 124 -5.711 -0.963 1.166 1.00 0.00 C ATOM 1948 O ILE A 124 -5.233 -0.150 0.401 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.538 -0.771 3.347 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.417 -1.338 4.218 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -5.804 -0.597 4.195 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.093 -0.339 5.328 1.00 0.00 C ATOM 0 H ILE A 124 -3.163 -1.428 0.858 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.334 -2.614 2.524 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.227 0.196 2.951 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.721 -2.292 4.648 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.531 -1.529 3.613 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.594 0.074 5.028 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.599 -0.175 3.580 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.120 -1.566 4.580 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.294 -0.737 5.954 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.772 0.604 4.886 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.981 -0.171 5.937 1.00 0.00 H new ATOM 1964 N THR A 125 -6.997 -1.210 1.171 1.00 0.00 N ATOM 1965 CA THR A 125 -7.907 -0.483 0.226 1.00 0.00 C ATOM 1966 C THR A 125 -8.522 0.716 0.957 1.00 0.00 C ATOM 1967 O THR A 125 -8.460 0.809 2.167 1.00 0.00 O ATOM 1968 CB THR A 125 -9.035 -1.419 -0.240 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.152 -1.278 0.628 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.563 -2.878 -0.201 1.00 0.00 C ATOM 0 H THR A 125 -7.457 -1.881 1.786 1.00 0.00 H new ATOM 0 HA THR A 125 -7.338 -0.147 -0.641 1.00 0.00 H new ATOM 0 HB THR A 125 -9.313 -1.155 -1.260 1.00 0.00 H new ATOM 0 HG1 THR A 125 -10.784 -0.634 0.246 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.370 -3.531 -0.533 1.00 0.00 H new ATOM 0 HG22 THR A 125 -7.703 -3.000 -0.860 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.279 -3.142 0.818 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.122 1.631 0.240 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.745 2.816 0.908 1.00 0.00 C ATOM 1980 C CYS A 126 -10.946 3.301 0.088 1.00 0.00 C ATOM 1981 O CYS A 126 -10.796 3.963 -0.917 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.703 3.937 1.029 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.762 3.715 2.558 1.00 0.00 S ATOM 0 H CYS A 126 -9.208 1.610 -0.776 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.089 2.535 1.904 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.032 3.920 0.170 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.196 4.909 1.030 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.401 4.270 3.545 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.138 2.988 0.517 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.345 3.441 -0.234 1.00 0.00 C ATOM 1991 C ASP A 127 -14.542 3.489 0.715 1.00 0.00 C ATOM 1992 O ASP A 127 -14.638 2.718 1.649 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.634 2.469 -1.381 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.453 1.031 -0.891 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -12.371 0.718 -0.422 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -14.400 0.269 -0.992 1.00 0.00 O ATOM 0 H ASP A 127 -12.329 2.438 1.355 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.166 4.435 -0.645 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.650 2.614 -1.747 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -12.963 2.667 -2.217 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.451 4.396 0.487 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.638 4.502 1.380 1.00 0.00 C ATOM 2003 C ASP A 128 -16.161 4.804 2.799 1.00 0.00 C ATOM 2004 O ASP A 128 -16.445 4.078 3.722 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.415 3.178 1.368 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.423 2.606 -0.050 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -17.292 3.381 -0.982 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -17.562 1.400 -0.181 1.00 0.00 O ATOM 0 H ASP A 128 -15.423 5.068 -0.279 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.293 5.301 1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -16.956 2.468 2.056 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.436 3.340 1.712 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.428 5.864 2.979 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.931 6.187 4.342 1.00 0.00 C ATOM 2015 C TYR A 129 -16.122 6.437 5.274 1.00 0.00 C ATOM 2016 O TYR A 129 -16.915 7.329 5.050 1.00 0.00 O ATOM 2017 CB TYR A 129 -14.032 7.428 4.273 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.520 7.783 5.651 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.349 8.447 6.562 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -12.206 7.455 6.010 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.866 8.783 7.832 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.723 7.789 7.279 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.552 8.454 8.191 1.00 0.00 C ATOM 2024 OH TYR A 129 -12.075 8.788 9.441 1.00 0.00 O ATOM 0 H TYR A 129 -15.153 6.518 2.246 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.350 5.352 4.734 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.193 7.241 3.603 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.590 8.267 3.858 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.362 8.700 6.285 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.566 6.944 5.306 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -14.506 9.296 8.535 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.711 7.534 7.556 1.00 0.00 H new ATOM 0 HH TYR A 129 -11.305 8.223 9.659 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.266 5.648 6.317 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.422 5.851 7.243 1.00 0.00 C ATOM 2036 C ASN A 130 -17.078 6.940 8.269 1.00 0.00 C ATOM 2037 O ASN A 130 -16.036 6.917 8.893 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.753 4.516 7.950 1.00 0.00 C ATOM 2039 CG ASN A 130 -16.906 4.327 9.217 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -15.724 4.605 9.221 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -17.468 3.863 10.298 1.00 0.00 N ATOM 0 H ASN A 130 -15.639 4.882 6.562 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.296 6.174 6.678 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -18.811 4.494 8.211 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -17.576 3.686 7.265 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -16.915 3.734 11.145 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -18.461 3.629 10.296 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.953 7.894 8.442 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.694 8.990 9.421 1.00 0.00 C ATOM 2050 C GLU A 131 -18.219 8.569 10.791 1.00 0.00 C ATOM 2051 O GLU A 131 -18.210 9.333 11.734 1.00 0.00 O ATOM 2052 CB GLU A 131 -18.415 10.262 8.967 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.866 9.929 8.620 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.650 11.225 8.403 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -20.108 12.125 7.783 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.780 11.294 8.860 1.00 0.00 O ATOM 0 H GLU A 131 -18.841 7.962 7.945 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.623 9.184 9.481 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -18.382 11.013 9.756 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.911 10.689 8.100 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.904 9.314 7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -20.319 9.348 9.423 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.673 7.354 10.905 1.00 0.00 N ATOM 2064 CA LYS A 132 -19.196 6.877 12.215 1.00 0.00 C ATOM 2065 C LYS A 132 -18.025 6.688 13.177 1.00 0.00 C ATOM 2066 O LYS A 132 -17.940 7.329 14.206 1.00 0.00 O ATOM 2067 CB LYS A 132 -19.924 5.541 12.026 1.00 0.00 C ATOM 2068 CG LYS A 132 -20.805 5.601 10.774 1.00 0.00 C ATOM 2069 CD LYS A 132 -21.826 6.732 10.919 1.00 0.00 C ATOM 2070 CE LYS A 132 -22.925 6.566 9.865 1.00 0.00 C ATOM 2071 NZ LYS A 132 -23.757 5.375 10.199 1.00 0.00 N ATOM 0 H LYS A 132 -18.705 6.670 10.149 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.894 7.610 12.620 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.200 4.732 11.933 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.535 5.323 12.902 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -20.188 5.765 9.890 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -21.318 4.650 10.632 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -22.261 6.718 11.918 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -21.335 7.698 10.799 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -23.548 7.460 9.830 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -22.481 6.447 8.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -24.704 5.485 9.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -23.308 4.519 9.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -23.840 5.288 11.232 1.00 0.00 H new ATOM 2085 N THR A 133 -17.115 5.811 12.842 1.00 0.00 N ATOM 2086 CA THR A 133 -15.931 5.565 13.720 1.00 0.00 C ATOM 2087 C THR A 133 -14.720 6.313 13.159 1.00 0.00 C ATOM 2088 O THR A 133 -13.642 6.277 13.718 1.00 0.00 O ATOM 2089 CB THR A 133 -15.628 4.065 13.752 1.00 0.00 C ATOM 2090 OG1 THR A 133 -15.405 3.602 12.428 1.00 0.00 O ATOM 2091 CG2 THR A 133 -16.814 3.316 14.362 1.00 0.00 C ATOM 0 H THR A 133 -17.141 5.250 11.991 1.00 0.00 H new ATOM 0 HA THR A 133 -16.144 5.918 14.729 1.00 0.00 H new ATOM 0 HB THR A 133 -14.739 3.886 14.356 1.00 0.00 H new ATOM 0 HG1 THR A 133 -15.209 2.642 12.446 1.00 0.00 H new ATOM 0 HG21 THR A 133 -16.597 2.248 14.384 1.00 0.00 H new ATOM 0 HG22 THR A 133 -16.986 3.673 15.378 1.00 0.00 H new ATOM 0 HG23 THR A 133 -17.705 3.493 13.759 1.00 0.00 H new ATOM 2099 N GLY A 134 -14.888 6.985 12.052 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.743 7.726 11.452 1.00 0.00 C ATOM 2101 C GLY A 134 -12.729 6.724 10.903 1.00 0.00 C ATOM 2102 O GLY A 134 -11.549 6.805 11.179 1.00 0.00 O ATOM 0 H GLY A 134 -15.767 7.052 11.539 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -14.095 8.379 10.654 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -13.274 8.363 12.202 1.00 0.00 H new ATOM 2106 N VAL A 135 -13.184 5.772 10.131 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.256 4.748 9.563 1.00 0.00 C ATOM 2108 C VAL A 135 -12.754 4.321 8.183 1.00 0.00 C ATOM 2109 O VAL A 135 -13.866 4.613 7.795 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.241 3.521 10.483 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -11.049 2.620 10.139 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -12.127 3.977 11.939 1.00 0.00 C ATOM 0 H VAL A 135 -14.163 5.659 9.868 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.254 5.169 9.481 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.165 2.961 10.343 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -11.047 1.752 10.798 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.130 2.290 9.103 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -10.122 3.177 10.271 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.116 3.105 12.593 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.204 4.542 12.072 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -12.979 4.609 12.190 1.00 0.00 H new ATOM 2122 N TRP A 136 -11.949 3.614 7.442 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.397 3.155 6.109 1.00 0.00 C ATOM 2124 C TRP A 136 -13.399 2.020 6.306 1.00 0.00 C ATOM 2125 O TRP A 136 -13.060 0.968 6.807 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.186 2.677 5.304 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.413 3.873 4.849 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.268 4.325 5.406 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.727 4.787 3.764 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.862 5.459 4.726 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.728 5.781 3.704 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.775 4.843 2.835 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.763 6.800 2.753 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.819 5.865 1.873 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -10.813 6.843 1.833 1.00 0.00 C ATOM 0 H TRP A 136 -11.003 3.337 7.705 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.874 3.967 5.560 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.557 2.030 5.915 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.511 2.088 4.446 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.755 3.875 6.243 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -8.023 5.992 4.954 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.554 4.095 2.859 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -8.985 7.549 2.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.630 5.899 1.161 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -10.851 7.628 1.092 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.642 2.241 5.945 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.689 1.188 6.137 1.00 0.00 C ATOM 2148 C GLU A 137 -15.113 -0.192 5.790 1.00 0.00 C ATOM 2149 O GLU A 137 -14.764 -0.964 6.662 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.900 1.483 5.244 1.00 0.00 C ATOM 2151 CG GLU A 137 -18.126 0.708 5.744 1.00 0.00 C ATOM 2152 CD GLU A 137 -17.913 -0.794 5.547 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -17.332 -1.412 6.424 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -18.344 -1.303 4.526 1.00 0.00 O ATOM 0 H GLU A 137 -14.976 3.108 5.525 1.00 0.00 H new ATOM 0 HA GLU A 137 -16.006 1.192 7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.111 2.552 5.246 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.679 1.203 4.214 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -18.297 0.924 6.799 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -19.016 1.031 5.204 1.00 0.00 H new ATOM 2161 N LYS A 138 -14.994 -0.503 4.527 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.420 -1.825 4.137 1.00 0.00 C ATOM 2163 C LYS A 138 -12.896 -1.711 4.129 1.00 0.00 C ATOM 2164 O LYS A 138 -12.350 -0.652 3.888 1.00 0.00 O ATOM 2165 CB LYS A 138 -14.908 -2.205 2.736 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.437 -2.290 2.729 1.00 0.00 C ATOM 2167 CD LYS A 138 -16.903 -3.058 1.489 1.00 0.00 C ATOM 2168 CE LYS A 138 -18.431 -3.135 1.483 1.00 0.00 C ATOM 2169 NZ LYS A 138 -18.883 -3.941 0.313 1.00 0.00 N ATOM 0 H LYS A 138 -15.268 0.098 3.750 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.736 -2.591 4.846 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -14.572 -1.465 2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.479 -3.162 2.438 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -16.788 -2.790 3.632 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -16.867 -1.288 2.732 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -16.549 -2.561 0.586 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -16.477 -4.061 1.488 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -18.787 -3.587 2.409 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -18.856 -2.133 1.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.922 -3.994 0.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -18.555 -3.492 -0.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -18.488 -4.901 0.379 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.195 -2.781 4.397 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.703 -2.704 4.408 1.00 0.00 C ATOM 2185 C ARG A 139 -10.093 -4.053 4.028 1.00 0.00 C ATOM 2186 O ARG A 139 -9.636 -4.793 4.876 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.221 -2.331 5.810 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.675 -0.912 6.154 1.00 0.00 C ATOM 2189 CD ARG A 139 -9.904 -0.420 7.379 1.00 0.00 C ATOM 2190 NE ARG A 139 -10.065 -1.399 8.490 1.00 0.00 N ATOM 2191 CZ ARG A 139 -9.271 -1.350 9.524 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -8.334 -0.444 9.584 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -9.413 -2.208 10.498 1.00 0.00 N ATOM 0 H ARG A 139 -12.587 -3.699 4.607 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.392 -1.950 3.685 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -10.617 -3.036 6.540 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -9.134 -2.397 5.860 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -10.501 -0.247 5.308 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -11.746 -0.899 6.354 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.848 -0.301 7.135 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.273 0.559 7.686 1.00 0.00 H new ATOM 0 HE ARG A 139 -10.797 -2.108 8.442 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -8.223 0.226 8.823 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -7.713 -0.405 10.392 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -10.145 -2.917 10.451 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.792 -2.169 11.306 1.00 0.00 H new ATOM 2207 N LYS A 140 -10.048 -4.373 2.763 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.428 -5.664 2.362 1.00 0.00 C ATOM 2209 C LYS A 140 -7.911 -5.504 2.478 1.00 0.00 C ATOM 2210 O LYS A 140 -7.385 -4.419 2.307 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.821 -6.011 0.919 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.272 -5.584 0.671 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.775 -6.160 -0.668 1.00 0.00 C ATOM 2214 CE LYS A 140 -12.346 -7.571 -0.460 1.00 0.00 C ATOM 2215 NZ LYS A 140 -12.345 -8.301 -1.760 1.00 0.00 N ATOM 0 H LYS A 140 -10.410 -3.802 1.999 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.773 -6.473 3.006 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.157 -5.506 0.218 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.711 -7.082 0.748 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.906 -5.933 1.486 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.341 -4.496 0.656 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -12.542 -5.508 -1.087 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -10.957 -6.194 -1.388 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -11.749 -8.112 0.274 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -13.360 -7.511 -0.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -12.731 -9.257 -1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.932 -7.787 -2.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -11.371 -8.370 -2.119 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.202 -6.560 2.791 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.719 -6.454 2.944 1.00 0.00 C ATOM 2231 C ILE A 141 -5.016 -7.622 2.258 1.00 0.00 C ATOM 2232 O ILE A 141 -5.527 -8.721 2.168 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.367 -6.448 4.432 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.149 -7.553 5.146 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -5.738 -5.095 5.038 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -5.675 -7.657 6.596 1.00 0.00 C ATOM 0 H ILE A 141 -7.587 -7.492 2.947 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.384 -5.529 2.476 1.00 0.00 H new ATOM 0 HB ILE A 141 -4.298 -6.621 4.552 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -7.217 -7.335 5.116 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -6.003 -8.505 4.635 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -5.487 -5.090 6.099 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -5.184 -4.305 4.531 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -6.808 -4.923 4.917 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -6.232 -8.444 7.105 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -4.611 -7.894 6.615 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.844 -6.707 7.103 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.830 -7.367 1.784 1.00 0.00 N ATOM 2249 CA PHE A 142 -3.020 -8.409 1.097 1.00 0.00 C ATOM 2250 C PHE A 142 -1.558 -8.155 1.477 1.00 0.00 C ATOM 2251 O PHE A 142 -1.155 -7.018 1.624 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.200 -8.288 -0.432 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.616 -7.848 -0.771 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.057 -6.558 -0.436 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -5.489 -8.730 -1.426 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.360 -6.158 -0.752 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.791 -8.326 -1.742 1.00 0.00 C ATOM 2258 CZ PHE A 142 -7.227 -7.040 -1.405 1.00 0.00 C ATOM 0 H PHE A 142 -3.377 -6.455 1.846 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.331 -9.410 1.394 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.485 -7.570 -0.832 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.988 -9.247 -0.906 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.390 -5.873 0.066 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -5.155 -9.723 -1.687 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -6.697 -5.166 -0.491 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -7.460 -9.008 -2.246 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.232 -6.729 -1.649 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.759 -9.182 1.655 1.00 0.00 N ATOM 2269 CA VAL A 143 0.673 -8.950 2.045 1.00 0.00 C ATOM 2270 C VAL A 143 1.611 -9.864 1.252 1.00 0.00 C ATOM 2271 O VAL A 143 1.267 -10.975 0.871 1.00 0.00 O ATOM 2272 CB VAL A 143 0.846 -9.202 3.549 1.00 0.00 C ATOM 2273 CG1 VAL A 143 0.319 -10.588 3.913 1.00 0.00 C ATOM 2274 CG2 VAL A 143 2.330 -9.106 3.917 1.00 0.00 C ATOM 0 H VAL A 143 -1.030 -10.160 1.549 1.00 0.00 H new ATOM 0 HA VAL A 143 0.930 -7.916 1.816 1.00 0.00 H new ATOM 0 HB VAL A 143 0.282 -8.451 4.102 1.00 0.00 H new ATOM 0 HG11 VAL A 143 0.447 -10.757 4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -0.739 -10.653 3.659 1.00 0.00 H new ATOM 0 HG13 VAL A 143 0.873 -11.345 3.358 1.00 0.00 H new ATOM 0 HG21 VAL A 143 2.452 -9.285 4.985 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.893 -9.853 3.357 1.00 0.00 H new ATOM 0 HG23 VAL A 143 2.702 -8.112 3.671 1.00 0.00 H new ATOM 2284 N ALA A 144 2.806 -9.381 1.009 1.00 0.00 N ATOM 2285 CA ALA A 144 3.820 -10.163 0.244 1.00 0.00 C ATOM 2286 C ALA A 144 5.140 -10.146 1.017 1.00 0.00 C ATOM 2287 O ALA A 144 5.231 -9.587 2.091 1.00 0.00 O ATOM 2288 CB ALA A 144 4.026 -9.497 -1.120 1.00 0.00 C ATOM 0 H ALA A 144 3.124 -8.461 1.315 1.00 0.00 H new ATOM 0 HA ALA A 144 3.484 -11.191 0.109 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.766 -10.058 -1.691 1.00 0.00 H new ATOM 0 HB2 ALA A 144 3.082 -9.483 -1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.378 -8.475 -0.977 1.00 0.00 H new ATOM 2294 N THR A 145 6.169 -10.750 0.483 1.00 0.00 N ATOM 2295 CA THR A 145 7.483 -10.757 1.195 1.00 0.00 C ATOM 2296 C THR A 145 8.621 -10.762 0.174 1.00 0.00 C ATOM 2297 O THR A 145 8.495 -11.299 -0.908 1.00 0.00 O ATOM 2298 CB THR A 145 7.579 -11.994 2.098 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.695 -11.856 2.966 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.751 -13.256 1.249 1.00 0.00 C ATOM 0 H THR A 145 6.158 -11.238 -0.413 1.00 0.00 H new ATOM 0 HA THR A 145 7.563 -9.863 1.813 1.00 0.00 H new ATOM 0 HB THR A 145 6.663 -12.080 2.682 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.831 -10.908 3.176 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.818 -14.127 1.901 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.895 -13.366 0.583 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.663 -13.175 0.657 1.00 0.00 H new ATOM 2308 N GLU A 146 9.731 -10.163 0.509 1.00 0.00 N ATOM 2309 CA GLU A 146 10.872 -10.131 -0.447 1.00 0.00 C ATOM 2310 C GLU A 146 11.156 -11.551 -0.940 1.00 0.00 C ATOM 2311 O GLU A 146 11.026 -12.511 -0.206 1.00 0.00 O ATOM 2312 CB GLU A 146 12.112 -9.578 0.260 1.00 0.00 C ATOM 2313 CG GLU A 146 13.299 -9.576 -0.706 1.00 0.00 C ATOM 2314 CD GLU A 146 14.480 -8.848 -0.061 1.00 0.00 C ATOM 2315 OE1 GLU A 146 15.088 -9.419 0.829 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.756 -7.732 -0.469 1.00 0.00 O ATOM 0 H GLU A 146 9.896 -9.696 1.401 1.00 0.00 H new ATOM 0 HA GLU A 146 10.623 -9.493 -1.295 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.919 -8.566 0.616 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.344 -10.185 1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.581 -10.599 -0.955 1.00 0.00 H new ATOM 0 HG3 GLU A 146 13.021 -9.086 -1.639 1.00 0.00 H new ATOM 2323 N VAL A 147 11.534 -11.692 -2.184 1.00 0.00 N ATOM 2324 CA VAL A 147 11.818 -13.051 -2.738 1.00 0.00 C ATOM 2325 C VAL A 147 13.309 -13.365 -2.562 1.00 0.00 C ATOM 2326 O VAL A 147 13.959 -12.857 -1.670 1.00 0.00 O ATOM 2327 CB VAL A 147 11.441 -13.082 -4.236 1.00 0.00 C ATOM 2328 CG1 VAL A 147 10.998 -14.495 -4.645 1.00 0.00 C ATOM 2329 CG2 VAL A 147 10.291 -12.100 -4.489 1.00 0.00 C ATOM 0 H VAL A 147 11.659 -10.923 -2.842 1.00 0.00 H new ATOM 0 HA VAL A 147 11.229 -13.800 -2.208 1.00 0.00 H new ATOM 0 HB VAL A 147 12.312 -12.798 -4.826 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.735 -14.502 -5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 147 11.813 -15.197 -4.469 1.00 0.00 H new ATOM 0 HG13 VAL A 147 10.131 -14.790 -4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 147 10.022 -12.119 -5.545 1.00 0.00 H new ATOM 0 HG22 VAL A 147 9.428 -12.389 -3.889 1.00 0.00 H new ATOM 0 HG23 VAL A 147 10.605 -11.093 -4.213 1.00 0.00 H new