USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 960 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 115 THR OG1 : rot 180:sc= 0.559 USER MOD Set 1.2: A 119 LYS NZ :NH3+ -179:sc= 0.63 (180deg=0) USER MOD Set 2.1: A 94 ASN : amide:sc= 0.321 K(o=2.2,f=0.24) USER MOD Set 2.2: A 106 TYR OH : rot -146:sc= 1.83 USER MOD Set 3.1: A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 71 THR OG1 : rot 82:sc= 1.25 USER MOD Set 4.1: A 44 ASN : amide:sc= 0.976 K(o=2.1,f=-1.7) USER MOD Set 4.2: A 47 GLN : amide:sc= 1.16 K(o=2.1,f=-0.11) USER MOD Set 5.1: A 31 ASN : amide:sc= 0 X(o=-0.019,f=-0.45) USER MOD Set 5.2: A 32 ASN : amide:sc= -0.0189 K(o=-0.019,f=-0.58) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -169:sc= -0.747 (180deg=-1.3) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0522) USER MOD Single : A 51 TYR OH : rot 120:sc= 0 USER MOD Single : A 56 SER OG : rot -120:sc=-0.00112 USER MOD Single : A 59 ASN : amide:sc= -0.0101 X(o=-0.01,f=0) USER MOD Single : A 60 MET CE :methyl -125:sc= -0.596 (180deg=-1.78!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 180:sc= 0.0859 USER MOD Single : A 85 MET CE :methyl 165:sc= -0.024 (180deg=-0.621) USER MOD Single : A 87 THR OG1 : rot 112:sc= 1.1 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 SER OG : rot -70:sc= -0.688 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= 0.474 K(o=0.47,f=-0.075) USER MOD Single : A 122 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.254) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl -162:sc= -0.0217 (180deg=-0.155) USER MOD ----------------------------------------------------------------- ATOM 79 N LEU A 6 10.792 -10.407 0.522 1.00 0.00 N ATOM 80 CA LEU A 6 9.401 -10.115 0.198 1.00 0.00 C ATOM 81 C LEU A 6 9.293 -8.635 -0.146 1.00 0.00 C ATOM 82 O LEU A 6 9.488 -7.785 0.725 1.00 0.00 O ATOM 83 CB LEU A 6 8.480 -10.486 1.368 1.00 0.00 C ATOM 84 CG LEU A 6 7.012 -10.101 1.069 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.103 -11.329 1.092 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.499 -9.038 2.043 1.00 0.00 C ATOM 0 HA LEU A 6 9.082 -10.711 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.546 -11.557 1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.815 -9.978 2.273 1.00 0.00 H new ATOM 0 HG LEU A 6 6.990 -9.676 0.066 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.078 -11.027 0.878 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.436 -12.042 0.338 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.146 -11.795 2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.465 -8.793 1.802 1.00 0.00 H new ATOM 0 HD22 LEU A 6 6.553 -9.422 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.113 -8.141 1.960 1.00 0.00 H new ATOM 98 N LYS A 7 9.064 -8.336 -1.422 1.00 0.00 N ATOM 99 CA LYS A 7 9.194 -6.975 -1.905 1.00 0.00 C ATOM 100 C LYS A 7 7.996 -6.165 -1.434 1.00 0.00 C ATOM 101 O LYS A 7 6.855 -6.637 -1.524 1.00 0.00 O ATOM 102 CB LYS A 7 9.350 -6.965 -3.436 1.00 0.00 C ATOM 103 CG LYS A 7 10.099 -5.708 -3.892 1.00 0.00 C ATOM 104 CD LYS A 7 11.605 -5.784 -3.605 1.00 0.00 C ATOM 105 CE LYS A 7 12.373 -6.091 -4.892 1.00 0.00 C ATOM 106 NZ LYS A 7 13.824 -6.261 -4.660 1.00 0.00 N ATOM 0 H LYS A 7 8.790 -9.016 -2.131 1.00 0.00 H new ATOM 0 HA LYS A 7 10.093 -6.512 -1.497 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.891 -7.855 -3.758 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.368 -7.001 -3.908 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.943 -5.564 -4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.680 -4.837 -3.389 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.950 -4.840 -3.183 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.803 -6.557 -2.862 1.00 0.00 H new ATOM 0 HE2 LYS A 7 11.972 -6.999 -5.343 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.215 -5.283 -5.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.298 -6.467 -5.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 14.216 -5.387 -4.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 13.980 -7.049 -3.999 1.00 0.00 H new ATOM 120 N PHE A 8 8.250 -4.960 -0.938 1.00 0.00 N ATOM 121 CA PHE A 8 7.227 -3.959 -0.717 1.00 0.00 C ATOM 122 C PHE A 8 7.168 -3.095 -1.970 1.00 0.00 C ATOM 123 O PHE A 8 8.195 -2.861 -2.613 1.00 0.00 O ATOM 124 CB PHE A 8 7.607 -3.119 0.509 1.00 0.00 C ATOM 125 CG PHE A 8 7.173 -3.702 1.835 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.636 -4.965 2.259 1.00 0.00 C ATOM 127 CD2 PHE A 8 6.257 -2.991 2.631 1.00 0.00 C ATOM 128 CE1 PHE A 8 7.136 -5.532 3.442 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.764 -3.557 3.817 1.00 0.00 C ATOM 130 CZ PHE A 8 6.190 -4.834 4.210 1.00 0.00 C ATOM 0 H PHE A 8 9.186 -4.652 -0.676 1.00 0.00 H new ATOM 0 HA PHE A 8 6.253 -4.410 -0.530 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.689 -2.989 0.522 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.168 -2.127 0.403 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.374 -5.495 1.675 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.932 -2.006 2.329 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.479 -6.505 3.761 1.00 0.00 H new ATOM 0 HE2 PHE A 8 5.058 -3.011 4.425 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.789 -5.282 5.107 1.00 0.00 H new ATOM 140 N LEU A 9 5.995 -2.563 -2.283 1.00 0.00 N ATOM 141 CA LEU A 9 5.817 -1.506 -3.260 1.00 0.00 C ATOM 142 C LEU A 9 5.156 -0.340 -2.549 1.00 0.00 C ATOM 143 O LEU A 9 4.228 -0.562 -1.767 1.00 0.00 O ATOM 144 CB LEU A 9 4.943 -1.993 -4.422 1.00 0.00 C ATOM 145 CG LEU A 9 4.877 -0.978 -5.571 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.225 -0.789 -6.272 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.855 -1.461 -6.593 1.00 0.00 C ATOM 0 H LEU A 9 5.121 -2.864 -1.852 1.00 0.00 H new ATOM 0 HA LEU A 9 6.777 -1.204 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.336 -2.938 -4.798 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.935 -2.190 -4.057 1.00 0.00 H new ATOM 0 HG LEU A 9 4.593 -0.016 -5.144 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.118 -0.060 -7.076 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.962 -0.431 -5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.556 -1.741 -6.687 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.798 -0.748 -7.416 1.00 0.00 H new ATOM 0 HD22 LEU A 9 4.157 -2.435 -6.977 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.878 -1.546 -6.118 1.00 0.00 H new ATOM 159 N VAL A 10 5.613 0.875 -2.839 1.00 0.00 N ATOM 160 CA VAL A 10 5.066 2.102 -2.273 1.00 0.00 C ATOM 161 C VAL A 10 4.771 3.064 -3.430 1.00 0.00 C ATOM 162 O VAL A 10 5.696 3.561 -4.066 1.00 0.00 O ATOM 163 CB VAL A 10 5.998 2.684 -1.184 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.275 3.792 -0.406 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.460 1.625 -0.164 1.00 0.00 C ATOM 0 H VAL A 10 6.386 1.036 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 10 4.130 1.909 -1.750 1.00 0.00 H new ATOM 0 HB VAL A 10 6.872 3.070 -1.709 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.941 4.194 0.358 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.986 4.589 -1.091 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.384 3.381 0.069 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.111 2.092 0.575 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.591 1.198 0.336 1.00 0.00 H new ATOM 0 HG23 VAL A 10 7.005 0.835 -0.681 1.00 0.00 H new ATOM 175 N VAL A 11 3.495 3.289 -3.755 1.00 0.00 N ATOM 176 CA VAL A 11 3.070 4.215 -4.808 1.00 0.00 C ATOM 177 C VAL A 11 2.102 5.212 -4.181 1.00 0.00 C ATOM 178 O VAL A 11 0.947 5.327 -4.581 1.00 0.00 O ATOM 179 CB VAL A 11 2.510 3.491 -6.062 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.582 4.417 -7.283 1.00 0.00 C ATOM 181 CG2 VAL A 11 3.261 2.183 -6.329 1.00 0.00 C ATOM 0 H VAL A 11 2.716 2.826 -3.287 1.00 0.00 H new ATOM 0 HA VAL A 11 3.930 4.757 -5.201 1.00 0.00 H new ATOM 0 HB VAL A 11 1.466 3.240 -5.873 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.187 3.899 -8.157 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.991 5.314 -7.095 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.619 4.698 -7.466 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.846 1.699 -7.213 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.317 2.397 -6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.155 1.521 -5.470 1.00 0.00 H new ATOM 191 N ASP A 12 2.560 5.909 -3.144 1.00 0.00 N ATOM 192 CA ASP A 12 1.958 7.172 -2.730 1.00 0.00 C ATOM 193 C ASP A 12 2.060 8.173 -3.890 1.00 0.00 C ATOM 194 O ASP A 12 2.857 7.983 -4.813 1.00 0.00 O ATOM 195 CB ASP A 12 2.687 7.730 -1.506 1.00 0.00 C ATOM 196 CG ASP A 12 4.154 8.000 -1.811 1.00 0.00 C ATOM 197 OD1 ASP A 12 4.897 7.002 -1.910 1.00 0.00 O ATOM 198 OD2 ASP A 12 4.545 9.177 -1.982 1.00 0.00 O ATOM 0 H ASP A 12 3.352 5.617 -2.572 1.00 0.00 H new ATOM 0 HA ASP A 12 0.913 7.007 -2.468 1.00 0.00 H new ATOM 0 HB2 ASP A 12 2.205 8.652 -1.182 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.609 7.023 -0.680 1.00 0.00 H new ATOM 203 N ASP A 13 1.279 9.249 -3.860 1.00 0.00 N ATOM 204 CA ASP A 13 1.400 10.320 -4.846 1.00 0.00 C ATOM 205 C ASP A 13 2.554 11.248 -4.476 1.00 0.00 C ATOM 206 O ASP A 13 3.364 11.629 -5.325 1.00 0.00 O ATOM 207 CB ASP A 13 0.090 11.125 -4.918 1.00 0.00 C ATOM 208 CG ASP A 13 0.338 12.575 -5.349 1.00 0.00 C ATOM 209 OD1 ASP A 13 0.791 12.824 -6.490 1.00 0.00 O ATOM 210 OD2 ASP A 13 0.210 13.486 -4.497 1.00 0.00 O ATOM 0 H ASP A 13 0.553 9.403 -3.161 1.00 0.00 H new ATOM 0 HA ASP A 13 1.599 9.875 -5.821 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.592 10.648 -5.622 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.398 11.114 -3.943 1.00 0.00 H new ATOM 215 N PHE A 14 2.590 11.655 -3.208 1.00 0.00 N ATOM 216 CA PHE A 14 3.309 12.846 -2.779 1.00 0.00 C ATOM 217 C PHE A 14 4.827 12.764 -2.977 1.00 0.00 C ATOM 218 O PHE A 14 5.485 13.804 -3.003 1.00 0.00 O ATOM 219 CB PHE A 14 2.924 13.147 -1.323 1.00 0.00 C ATOM 220 CG PHE A 14 3.391 14.477 -0.752 1.00 0.00 C ATOM 221 CD1 PHE A 14 3.357 15.657 -1.523 1.00 0.00 C ATOM 222 CD2 PHE A 14 3.834 14.543 0.584 1.00 0.00 C ATOM 223 CE1 PHE A 14 3.795 16.873 -0.973 1.00 0.00 C ATOM 224 CE2 PHE A 14 4.255 15.763 1.137 1.00 0.00 C ATOM 225 CZ PHE A 14 4.247 16.929 0.355 1.00 0.00 C ATOM 0 H PHE A 14 2.118 11.163 -2.449 1.00 0.00 H new ATOM 0 HA PHE A 14 3.008 13.674 -3.421 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.838 13.106 -1.243 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.320 12.349 -0.695 1.00 0.00 H new ATOM 0 HD1 PHE A 14 2.993 15.626 -2.539 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.850 13.648 1.188 1.00 0.00 H new ATOM 0 HE1 PHE A 14 3.784 17.770 -1.575 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.585 15.804 2.164 1.00 0.00 H new ATOM 0 HZ PHE A 14 4.587 17.865 0.773 1.00 0.00 H new ATOM 235 N SER A 15 5.406 11.569 -3.114 1.00 0.00 N ATOM 236 CA SER A 15 6.822 11.275 -3.292 1.00 0.00 C ATOM 237 C SER A 15 7.619 11.544 -2.009 1.00 0.00 C ATOM 238 O SER A 15 8.336 10.659 -1.540 1.00 0.00 O ATOM 239 CB SER A 15 7.380 11.941 -4.559 1.00 0.00 C ATOM 240 OG SER A 15 8.575 11.295 -4.955 1.00 0.00 O ATOM 0 H SER A 15 4.847 10.716 -3.102 1.00 0.00 H new ATOM 0 HA SER A 15 6.939 10.206 -3.468 1.00 0.00 H new ATOM 0 HB2 SER A 15 6.645 11.889 -5.362 1.00 0.00 H new ATOM 0 HB3 SER A 15 7.572 12.997 -4.371 1.00 0.00 H new ATOM 0 HG SER A 15 8.925 11.723 -5.764 1.00 0.00 H new ATOM 246 N THR A 16 7.435 12.689 -1.346 1.00 0.00 N ATOM 247 CA THR A 16 7.807 12.858 0.057 1.00 0.00 C ATOM 248 C THR A 16 7.172 11.728 0.892 1.00 0.00 C ATOM 249 O THR A 16 7.806 11.185 1.800 1.00 0.00 O ATOM 250 CB THR A 16 7.369 14.259 0.525 1.00 0.00 C ATOM 251 OG1 THR A 16 8.111 15.282 -0.121 1.00 0.00 O ATOM 252 CG2 THR A 16 7.493 14.445 2.040 1.00 0.00 C ATOM 0 H THR A 16 7.025 13.522 -1.768 1.00 0.00 H new ATOM 0 HA THR A 16 8.887 12.789 0.187 1.00 0.00 H new ATOM 0 HB THR A 16 6.317 14.339 0.252 1.00 0.00 H new ATOM 0 HG1 THR A 16 7.807 16.158 0.197 1.00 0.00 H new ATOM 0 HG21 THR A 16 7.171 15.450 2.311 1.00 0.00 H new ATOM 0 HG22 THR A 16 6.866 13.713 2.549 1.00 0.00 H new ATOM 0 HG23 THR A 16 8.531 14.304 2.340 1.00 0.00 H new ATOM 260 N MET A 17 5.947 11.309 0.558 1.00 0.00 N ATOM 261 CA MET A 17 5.284 10.247 1.294 1.00 0.00 C ATOM 262 C MET A 17 5.973 8.883 1.096 1.00 0.00 C ATOM 263 O MET A 17 5.841 8.040 1.985 1.00 0.00 O ATOM 264 CB MET A 17 3.772 10.287 1.017 1.00 0.00 C ATOM 265 CG MET A 17 2.945 9.332 1.876 1.00 0.00 C ATOM 266 SD MET A 17 1.237 9.888 2.162 1.00 0.00 S ATOM 267 CE MET A 17 0.506 9.799 0.508 1.00 0.00 C ATOM 0 H MET A 17 5.403 11.692 -0.215 1.00 0.00 H new ATOM 0 HA MET A 17 5.389 10.415 2.366 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.413 11.304 1.178 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.602 10.051 -0.033 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.922 8.354 1.395 1.00 0.00 H new ATOM 0 HG3 MET A 17 3.441 9.203 2.838 1.00 0.00 H new ATOM 0 HE1 MET A 17 -0.465 10.294 0.512 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.163 10.295 -0.207 1.00 0.00 H new ATOM 0 HE3 MET A 17 0.380 8.755 0.222 1.00 0.00 H new ATOM 277 N ARG A 18 6.821 8.684 0.067 1.00 0.00 N ATOM 278 CA ARG A 18 7.694 7.509 -0.032 1.00 0.00 C ATOM 279 C ARG A 18 8.646 7.522 1.147 1.00 0.00 C ATOM 280 O ARG A 18 8.822 6.509 1.821 1.00 0.00 O ATOM 281 CB ARG A 18 8.528 7.513 -1.330 1.00 0.00 C ATOM 282 CG ARG A 18 7.695 7.519 -2.610 1.00 0.00 C ATOM 283 CD ARG A 18 8.504 7.825 -3.876 1.00 0.00 C ATOM 284 NE ARG A 18 7.713 8.021 -5.114 1.00 0.00 N ATOM 285 CZ ARG A 18 6.405 7.873 -5.401 1.00 0.00 C ATOM 286 NH1 ARG A 18 5.503 7.390 -4.565 1.00 0.00 N ATOM 287 NH2 ARG A 18 5.989 8.251 -6.599 1.00 0.00 N ATOM 0 H ARG A 18 6.916 9.334 -0.713 1.00 0.00 H new ATOM 0 HA ARG A 18 7.065 6.619 -0.037 1.00 0.00 H new ATOM 0 HB2 ARG A 18 9.177 8.388 -1.328 1.00 0.00 H new ATOM 0 HB3 ARG A 18 9.175 6.636 -1.335 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.214 6.547 -2.724 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.900 8.258 -2.511 1.00 0.00 H new ATOM 0 HD2 ARG A 18 9.095 8.724 -3.699 1.00 0.00 H new ATOM 0 HD3 ARG A 18 9.207 7.009 -4.042 1.00 0.00 H new ATOM 0 HE ARG A 18 8.272 8.330 -5.909 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.781 7.099 -3.628 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.529 7.309 -4.857 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.652 8.640 -7.270 1.00 0.00 H new ATOM 0 HH22 ARG A 18 5.006 8.154 -6.852 1.00 0.00 H new ATOM 301 N ARG A 19 9.265 8.684 1.390 1.00 0.00 N ATOM 302 CA ARG A 19 10.200 8.899 2.485 1.00 0.00 C ATOM 303 C ARG A 19 9.489 8.557 3.778 1.00 0.00 C ATOM 304 O ARG A 19 10.011 7.726 4.512 1.00 0.00 O ATOM 305 CB ARG A 19 10.765 10.338 2.511 1.00 0.00 C ATOM 306 CG ARG A 19 11.227 10.884 1.157 1.00 0.00 C ATOM 307 CD ARG A 19 12.423 10.115 0.595 1.00 0.00 C ATOM 308 NE ARG A 19 13.705 10.781 0.866 1.00 0.00 N ATOM 309 CZ ARG A 19 14.544 10.577 1.885 1.00 0.00 C ATOM 310 NH1 ARG A 19 14.216 9.787 2.901 1.00 0.00 N ATOM 311 NH2 ARG A 19 15.719 11.188 1.877 1.00 0.00 N ATOM 0 H ARG A 19 9.122 9.514 0.815 1.00 0.00 H new ATOM 0 HA ARG A 19 11.066 8.252 2.348 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.000 11.004 2.911 1.00 0.00 H new ATOM 0 HB3 ARG A 19 11.607 10.368 3.203 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.401 10.835 0.448 1.00 0.00 H new ATOM 0 HG3 ARG A 19 11.493 11.936 1.264 1.00 0.00 H new ATOM 0 HD2 ARG A 19 12.440 9.114 1.025 1.00 0.00 H new ATOM 0 HD3 ARG A 19 12.300 9.997 -0.482 1.00 0.00 H new ATOM 0 HE ARG A 19 13.990 11.489 0.190 1.00 0.00 H new ATOM 0 HH11 ARG A 19 13.308 9.322 2.913 1.00 0.00 H new ATOM 0 HH12 ARG A 19 14.872 9.645 3.669 1.00 0.00 H new ATOM 0 HH21 ARG A 19 15.969 11.802 1.102 1.00 0.00 H new ATOM 0 HH22 ARG A 19 16.373 11.045 2.646 1.00 0.00 H new ATOM 325 N ILE A 20 8.310 9.143 4.027 1.00 0.00 N ATOM 326 CA ILE A 20 7.535 8.848 5.234 1.00 0.00 C ATOM 327 C ILE A 20 7.339 7.332 5.337 1.00 0.00 C ATOM 328 O ILE A 20 7.899 6.719 6.241 1.00 0.00 O ATOM 329 CB ILE A 20 6.221 9.672 5.306 1.00 0.00 C ATOM 330 CG1 ILE A 20 6.452 11.089 5.882 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.159 9.010 6.207 1.00 0.00 C ATOM 332 CD1 ILE A 20 7.369 11.992 5.056 1.00 0.00 C ATOM 0 H ILE A 20 7.874 9.825 3.406 1.00 0.00 H new ATOM 0 HA ILE A 20 8.088 9.168 6.117 1.00 0.00 H new ATOM 0 HB ILE A 20 5.873 9.722 4.274 1.00 0.00 H new ATOM 0 HG12 ILE A 20 5.485 11.581 5.988 1.00 0.00 H new ATOM 0 HG13 ILE A 20 6.872 10.992 6.883 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.260 9.626 6.223 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.915 8.022 5.816 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.550 8.913 7.220 1.00 0.00 H new ATOM 0 HD11 ILE A 20 7.464 12.961 5.547 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.353 11.531 4.970 1.00 0.00 H new ATOM 0 HD13 ILE A 20 6.945 12.129 4.061 1.00 0.00 H new ATOM 344 N VAL A 21 6.556 6.718 4.445 1.00 0.00 N ATOM 345 CA VAL A 21 6.140 5.321 4.564 1.00 0.00 C ATOM 346 C VAL A 21 7.358 4.403 4.719 1.00 0.00 C ATOM 347 O VAL A 21 7.366 3.560 5.618 1.00 0.00 O ATOM 348 CB VAL A 21 5.239 4.932 3.370 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.915 3.428 3.347 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.900 5.687 3.421 1.00 0.00 C ATOM 0 H VAL A 21 6.191 7.182 3.613 1.00 0.00 H new ATOM 0 HA VAL A 21 5.544 5.195 5.468 1.00 0.00 H new ATOM 0 HB VAL A 21 5.803 5.198 2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.280 3.206 2.490 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.841 2.858 3.270 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.395 3.154 4.265 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.285 5.395 2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.379 5.441 4.346 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.086 6.760 3.383 1.00 0.00 H new ATOM 360 N ARG A 22 8.404 4.565 3.902 1.00 0.00 N ATOM 361 CA ARG A 22 9.592 3.720 3.999 1.00 0.00 C ATOM 362 C ARG A 22 10.297 3.916 5.344 1.00 0.00 C ATOM 363 O ARG A 22 10.809 2.945 5.895 1.00 0.00 O ATOM 364 CB ARG A 22 10.519 3.993 2.804 1.00 0.00 C ATOM 365 CG ARG A 22 11.534 2.862 2.579 1.00 0.00 C ATOM 366 CD ARG A 22 12.494 3.244 1.445 1.00 0.00 C ATOM 367 NE ARG A 22 13.496 2.195 1.187 1.00 0.00 N ATOM 368 CZ ARG A 22 14.582 1.939 1.930 1.00 0.00 C ATOM 369 NH1 ARG A 22 14.844 2.645 3.023 1.00 0.00 N ATOM 370 NH2 ARG A 22 15.402 0.960 1.580 1.00 0.00 N ATOM 0 H ARG A 22 8.449 5.273 3.169 1.00 0.00 H new ATOM 0 HA ARG A 22 9.295 2.672 3.958 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.918 4.122 1.904 1.00 0.00 H new ATOM 0 HB3 ARG A 22 11.053 4.929 2.968 1.00 0.00 H new ATOM 0 HG2 ARG A 22 12.094 2.676 3.495 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.013 1.937 2.331 1.00 0.00 H new ATOM 0 HD2 ARG A 22 11.923 3.430 0.535 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.002 4.174 1.699 1.00 0.00 H new ATOM 0 HE ARG A 22 13.349 1.608 0.366 1.00 0.00 H new ATOM 0 HH11 ARG A 22 14.215 3.395 3.309 1.00 0.00 H new ATOM 0 HH12 ARG A 22 15.675 2.437 3.577 1.00 0.00 H new ATOM 0 HH21 ARG A 22 15.206 0.404 0.748 1.00 0.00 H new ATOM 0 HH22 ARG A 22 16.229 0.762 2.143 1.00 0.00 H new ATOM 384 N ASN A 23 10.317 5.127 5.906 1.00 0.00 N ATOM 385 CA ASN A 23 10.922 5.383 7.212 1.00 0.00 C ATOM 386 C ASN A 23 10.075 4.804 8.355 1.00 0.00 C ATOM 387 O ASN A 23 10.606 4.356 9.374 1.00 0.00 O ATOM 388 CB ASN A 23 11.137 6.890 7.399 1.00 0.00 C ATOM 389 CG ASN A 23 12.304 7.161 8.326 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.452 7.040 7.913 1.00 0.00 O ATOM 391 ND2 ASN A 23 12.075 7.549 9.562 1.00 0.00 N ATOM 0 H ASN A 23 9.914 5.956 5.468 1.00 0.00 H new ATOM 0 HA ASN A 23 11.888 4.879 7.244 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.320 7.358 6.432 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.232 7.342 7.805 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.856 7.752 10.186 1.00 0.00 H new ATOM 0 HD22 ASN A 23 11.116 7.647 9.897 1.00 0.00 H new ATOM 398 N LEU A 24 8.746 4.785 8.206 1.00 0.00 N ATOM 399 CA LEU A 24 7.845 4.122 9.153 1.00 0.00 C ATOM 400 C LEU A 24 8.045 2.606 9.087 1.00 0.00 C ATOM 401 O LEU A 24 7.994 1.927 10.111 1.00 0.00 O ATOM 402 CB LEU A 24 6.370 4.464 8.874 1.00 0.00 C ATOM 403 CG LEU A 24 6.015 5.964 8.899 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.547 6.154 8.512 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.344 6.621 10.238 1.00 0.00 C ATOM 0 H LEU A 24 8.265 5.230 7.424 1.00 0.00 H new ATOM 0 HA LEU A 24 8.089 4.485 10.152 1.00 0.00 H new ATOM 0 HB2 LEU A 24 6.102 4.062 7.897 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.752 3.951 9.610 1.00 0.00 H new ATOM 0 HG LEU A 24 6.638 6.472 8.162 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.300 7.216 8.531 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.381 5.761 7.509 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.912 5.621 9.220 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.074 7.677 10.201 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.781 6.130 11.032 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.411 6.526 10.437 1.00 0.00 H new ATOM 417 N LEU A 25 8.293 2.063 7.893 1.00 0.00 N ATOM 418 CA LEU A 25 8.658 0.662 7.723 1.00 0.00 C ATOM 419 C LEU A 25 10.040 0.391 8.323 1.00 0.00 C ATOM 420 O LEU A 25 10.228 -0.655 8.936 1.00 0.00 O ATOM 421 CB LEU A 25 8.577 0.264 6.238 1.00 0.00 C ATOM 422 CG LEU A 25 7.116 0.149 5.758 1.00 0.00 C ATOM 423 CD1 LEU A 25 7.003 0.286 4.240 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.499 -1.191 6.173 1.00 0.00 C ATOM 0 H LEU A 25 8.245 2.586 7.019 1.00 0.00 H new ATOM 0 HA LEU A 25 7.946 0.038 8.264 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.102 1.004 5.634 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.086 -0.688 6.088 1.00 0.00 H new ATOM 0 HG LEU A 25 6.574 0.967 6.232 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.958 0.199 3.944 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.388 1.259 3.933 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.583 -0.502 3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.469 -1.242 5.820 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.073 -2.007 5.735 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.515 -1.278 7.259 1.00 0.00 H new ATOM 436 N LYS A 26 10.998 1.317 8.231 1.00 0.00 N ATOM 437 CA LYS A 26 12.285 1.143 8.900 1.00 0.00 C ATOM 438 C LYS A 26 12.134 1.123 10.421 1.00 0.00 C ATOM 439 O LYS A 26 12.860 0.356 11.055 1.00 0.00 O ATOM 440 CB LYS A 26 13.301 2.198 8.432 1.00 0.00 C ATOM 441 CG LYS A 26 13.866 1.901 7.027 1.00 0.00 C ATOM 442 CD LYS A 26 15.192 1.119 7.038 1.00 0.00 C ATOM 443 CE LYS A 26 15.077 -0.237 7.744 1.00 0.00 C ATOM 444 NZ LYS A 26 16.344 -0.993 7.742 1.00 0.00 N ATOM 0 H LYS A 26 10.907 2.186 7.705 1.00 0.00 H new ATOM 0 HA LYS A 26 12.678 0.167 8.613 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.824 3.178 8.427 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.123 2.247 9.146 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.126 1.334 6.462 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.016 2.843 6.500 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.524 0.962 6.012 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.957 1.717 7.533 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.755 -0.079 8.773 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.304 -0.831 7.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.208 -1.900 8.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.641 -1.170 6.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.078 -0.442 8.231 1.00 0.00 H new ATOM 458 N GLU A 27 11.203 1.884 11.010 1.00 0.00 N ATOM 459 CA GLU A 27 10.923 1.787 12.448 1.00 0.00 C ATOM 460 C GLU A 27 10.545 0.352 12.837 1.00 0.00 C ATOM 461 O GLU A 27 11.253 -0.277 13.626 1.00 0.00 O ATOM 462 CB GLU A 27 9.806 2.752 12.885 1.00 0.00 C ATOM 463 CG GLU A 27 10.214 4.226 12.925 1.00 0.00 C ATOM 464 CD GLU A 27 10.779 4.689 14.269 1.00 0.00 C ATOM 465 OE1 GLU A 27 11.367 3.890 15.031 1.00 0.00 O ATOM 466 OE2 GLU A 27 10.606 5.880 14.614 1.00 0.00 O ATOM 0 H GLU A 27 10.633 2.571 10.516 1.00 0.00 H new ATOM 0 HA GLU A 27 11.839 2.071 12.966 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.962 2.641 12.204 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.458 2.458 13.875 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.959 4.405 12.150 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.346 4.838 12.680 1.00 0.00 H new ATOM 473 N LEU A 28 9.416 -0.163 12.337 1.00 0.00 N ATOM 474 CA LEU A 28 8.784 -1.379 12.867 1.00 0.00 C ATOM 475 C LEU A 28 8.082 -2.215 11.789 1.00 0.00 C ATOM 476 O LEU A 28 7.116 -2.932 12.063 1.00 0.00 O ATOM 477 CB LEU A 28 7.890 -1.043 14.082 1.00 0.00 C ATOM 478 CG LEU A 28 6.886 0.118 13.943 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.904 -0.043 12.778 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.134 0.266 15.273 1.00 0.00 C ATOM 0 H LEU A 28 8.913 0.251 11.552 1.00 0.00 H new ATOM 0 HA LEU A 28 9.577 -2.033 13.230 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.329 -1.940 14.342 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.543 -0.820 14.926 1.00 0.00 H new ATOM 0 HG LEU A 28 7.453 1.019 13.711 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.231 0.814 12.748 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.458 -0.103 11.841 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.323 -0.955 12.915 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.417 1.084 15.197 1.00 0.00 H new ATOM 0 HD22 LEU A 28 5.605 -0.660 15.497 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.845 0.480 16.071 1.00 0.00 H new ATOM 492 N GLY A 29 8.570 -2.136 10.553 1.00 0.00 N ATOM 493 CA GLY A 29 8.159 -2.959 9.432 1.00 0.00 C ATOM 494 C GLY A 29 9.370 -3.653 8.815 1.00 0.00 C ATOM 495 O GLY A 29 9.994 -4.490 9.472 1.00 0.00 O ATOM 0 H GLY A 29 9.295 -1.464 10.301 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.435 -3.703 9.764 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.663 -2.343 8.682 1.00 0.00 H new ATOM 499 N PHE A 30 9.682 -3.337 7.555 1.00 0.00 N ATOM 500 CA PHE A 30 10.490 -4.172 6.669 1.00 0.00 C ATOM 501 C PHE A 30 11.430 -3.330 5.797 1.00 0.00 C ATOM 502 O PHE A 30 11.375 -2.097 5.816 1.00 0.00 O ATOM 503 CB PHE A 30 9.542 -4.998 5.782 1.00 0.00 C ATOM 504 CG PHE A 30 8.621 -5.945 6.531 1.00 0.00 C ATOM 505 CD1 PHE A 30 7.401 -5.479 7.058 1.00 0.00 C ATOM 506 CD2 PHE A 30 8.967 -7.300 6.686 1.00 0.00 C ATOM 507 CE1 PHE A 30 6.528 -6.359 7.715 1.00 0.00 C ATOM 508 CE2 PHE A 30 8.100 -8.180 7.355 1.00 0.00 C ATOM 509 CZ PHE A 30 6.877 -7.713 7.866 1.00 0.00 C ATOM 0 H PHE A 30 9.371 -2.471 7.114 1.00 0.00 H new ATOM 0 HA PHE A 30 11.115 -4.828 7.274 1.00 0.00 H new ATOM 0 HB2 PHE A 30 8.932 -4.313 5.193 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.140 -5.578 5.079 1.00 0.00 H new ATOM 0 HD1 PHE A 30 7.136 -4.437 6.956 1.00 0.00 H new ATOM 0 HD2 PHE A 30 9.903 -7.665 6.289 1.00 0.00 H new ATOM 0 HE1 PHE A 30 5.588 -5.997 8.105 1.00 0.00 H new ATOM 0 HE2 PHE A 30 8.374 -9.218 7.477 1.00 0.00 H new ATOM 0 HZ PHE A 30 6.207 -8.392 8.373 1.00 0.00 H new ATOM 519 N ASN A 31 12.269 -4.002 5.001 1.00 0.00 N ATOM 520 CA ASN A 31 13.142 -3.418 3.977 1.00 0.00 C ATOM 521 C ASN A 31 12.807 -3.999 2.592 1.00 0.00 C ATOM 522 O ASN A 31 11.899 -4.821 2.482 1.00 0.00 O ATOM 523 CB ASN A 31 14.623 -3.624 4.352 1.00 0.00 C ATOM 524 CG ASN A 31 15.142 -5.021 4.013 1.00 0.00 C ATOM 525 OD1 ASN A 31 15.609 -5.278 2.910 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.088 -5.966 4.926 1.00 0.00 N ATOM 0 H ASN A 31 12.362 -5.016 5.056 1.00 0.00 H new ATOM 0 HA ASN A 31 12.967 -2.343 3.928 1.00 0.00 H new ATOM 0 HB2 ASN A 31 15.229 -2.882 3.832 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.749 -3.446 5.420 1.00 0.00 H new ATOM 0 HD21 ASN A 31 15.433 -6.902 4.712 1.00 0.00 H new ATOM 0 HD22 ASN A 31 14.701 -5.763 5.848 1.00 0.00 H new ATOM 533 N ASN A 32 13.552 -3.601 1.550 1.00 0.00 N ATOM 534 CA ASN A 32 13.345 -3.933 0.134 1.00 0.00 C ATOM 535 C ASN A 32 11.979 -3.434 -0.318 1.00 0.00 C ATOM 536 O ASN A 32 11.042 -4.211 -0.512 1.00 0.00 O ATOM 537 CB ASN A 32 13.602 -5.417 -0.210 1.00 0.00 C ATOM 538 CG ASN A 32 15.060 -5.739 -0.515 1.00 0.00 C ATOM 539 OD1 ASN A 32 15.972 -5.001 -0.150 1.00 0.00 O ATOM 540 ND2 ASN A 32 15.322 -6.834 -1.206 1.00 0.00 N ATOM 0 H ASN A 32 14.366 -3.001 1.683 1.00 0.00 H new ATOM 0 HA ASN A 32 14.107 -3.407 -0.441 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.271 -6.035 0.624 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.992 -5.691 -1.071 1.00 0.00 H new ATOM 0 HD21 ASN A 32 16.286 -7.071 -1.440 1.00 0.00 H new ATOM 0 HD22 ASN A 32 14.560 -7.442 -1.506 1.00 0.00 H new ATOM 547 N VAL A 33 11.889 -2.115 -0.493 1.00 0.00 N ATOM 548 CA VAL A 33 10.701 -1.443 -0.991 1.00 0.00 C ATOM 549 C VAL A 33 11.093 -0.781 -2.312 1.00 0.00 C ATOM 550 O VAL A 33 12.097 -0.062 -2.369 1.00 0.00 O ATOM 551 CB VAL A 33 10.040 -0.518 0.071 1.00 0.00 C ATOM 552 CG1 VAL A 33 10.455 -0.831 1.528 1.00 0.00 C ATOM 553 CG2 VAL A 33 10.220 0.984 -0.176 1.00 0.00 C ATOM 0 H VAL A 33 12.658 -1.477 -0.287 1.00 0.00 H new ATOM 0 HA VAL A 33 9.893 -2.146 -1.192 1.00 0.00 H new ATOM 0 HB VAL A 33 8.984 -0.756 -0.057 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.951 -0.142 2.206 1.00 0.00 H new ATOM 0 HG12 VAL A 33 10.173 -1.855 1.775 1.00 0.00 H new ATOM 0 HG13 VAL A 33 11.534 -0.717 1.631 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.725 1.545 0.617 1.00 0.00 H new ATOM 0 HG22 VAL A 33 11.283 1.227 -0.183 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.781 1.250 -1.138 1.00 0.00 H new ATOM 563 N GLU A 34 10.366 -1.079 -3.379 1.00 0.00 N ATOM 564 CA GLU A 34 10.387 -0.334 -4.632 1.00 0.00 C ATOM 565 C GLU A 34 9.263 0.703 -4.583 1.00 0.00 C ATOM 566 O GLU A 34 8.419 0.685 -3.682 1.00 0.00 O ATOM 567 CB GLU A 34 10.180 -1.318 -5.801 1.00 0.00 C ATOM 568 CG GLU A 34 11.432 -1.519 -6.667 1.00 0.00 C ATOM 569 CD GLU A 34 12.681 -1.922 -5.884 1.00 0.00 C ATOM 570 OE1 GLU A 34 12.811 -3.095 -5.477 1.00 0.00 O ATOM 571 OE2 GLU A 34 13.621 -1.100 -5.762 1.00 0.00 O ATOM 0 H GLU A 34 9.724 -1.871 -3.398 1.00 0.00 H new ATOM 0 HA GLU A 34 11.340 0.175 -4.776 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.867 -2.282 -5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.368 -0.955 -6.431 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.223 -2.285 -7.414 1.00 0.00 H new ATOM 0 HG3 GLU A 34 11.638 -0.595 -7.207 1.00 0.00 H new ATOM 578 N GLU A 35 9.219 1.578 -5.583 1.00 0.00 N ATOM 579 CA GLU A 35 8.143 2.529 -5.804 1.00 0.00 C ATOM 580 C GLU A 35 7.779 2.494 -7.290 1.00 0.00 C ATOM 581 O GLU A 35 8.451 1.821 -8.078 1.00 0.00 O ATOM 582 CB GLU A 35 8.546 3.940 -5.336 1.00 0.00 C ATOM 583 CG GLU A 35 9.004 3.998 -3.864 1.00 0.00 C ATOM 584 CD GLU A 35 10.491 3.708 -3.634 1.00 0.00 C ATOM 585 OE1 GLU A 35 11.280 3.616 -4.604 1.00 0.00 O ATOM 586 OE2 GLU A 35 10.923 3.687 -2.458 1.00 0.00 O ATOM 0 H GLU A 35 9.958 1.644 -6.283 1.00 0.00 H new ATOM 0 HA GLU A 35 7.268 2.256 -5.214 1.00 0.00 H new ATOM 0 HB2 GLU A 35 9.351 4.308 -5.972 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.700 4.613 -5.471 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.777 4.988 -3.468 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.417 3.282 -3.289 1.00 0.00 H new ATOM 593 N ALA A 36 6.725 3.205 -7.690 1.00 0.00 N ATOM 594 CA ALA A 36 6.261 3.273 -9.070 1.00 0.00 C ATOM 595 C ALA A 36 5.893 4.713 -9.416 1.00 0.00 C ATOM 596 O ALA A 36 5.954 5.601 -8.565 1.00 0.00 O ATOM 597 CB ALA A 36 5.061 2.340 -9.265 1.00 0.00 C ATOM 0 H ALA A 36 6.160 3.761 -7.048 1.00 0.00 H new ATOM 0 HA ALA A 36 7.058 2.948 -9.739 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.720 2.397 -10.299 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.355 1.316 -9.036 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.253 2.643 -8.599 1.00 0.00 H new ATOM 603 N GLU A 37 5.505 4.939 -10.669 1.00 0.00 N ATOM 604 CA GLU A 37 5.041 6.241 -11.131 1.00 0.00 C ATOM 605 C GLU A 37 3.604 6.519 -10.674 1.00 0.00 C ATOM 606 O GLU A 37 3.259 7.662 -10.366 1.00 0.00 O ATOM 607 CB GLU A 37 5.079 6.289 -12.666 1.00 0.00 C ATOM 608 CG GLU A 37 6.488 6.139 -13.261 1.00 0.00 C ATOM 609 CD GLU A 37 6.774 7.261 -14.252 1.00 0.00 C ATOM 610 OE1 GLU A 37 6.458 7.137 -15.454 1.00 0.00 O ATOM 611 OE2 GLU A 37 7.256 8.336 -13.817 1.00 0.00 O ATOM 0 H GLU A 37 5.504 4.221 -11.393 1.00 0.00 H new ATOM 0 HA GLU A 37 5.700 6.997 -10.705 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.443 5.496 -13.060 1.00 0.00 H new ATOM 0 HB3 GLU A 37 4.653 7.235 -13.000 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.229 6.154 -12.462 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.577 5.174 -13.760 1.00 0.00 H new ATOM 618 N ASP A 38 2.762 5.484 -10.693 1.00 0.00 N ATOM 619 CA ASP A 38 1.302 5.544 -10.730 1.00 0.00 C ATOM 620 C ASP A 38 0.790 4.101 -10.690 1.00 0.00 C ATOM 621 O ASP A 38 1.562 3.189 -10.975 1.00 0.00 O ATOM 622 CB ASP A 38 0.894 6.211 -12.054 1.00 0.00 C ATOM 623 CG ASP A 38 -0.494 5.817 -12.568 1.00 0.00 C ATOM 624 OD1 ASP A 38 -1.527 6.184 -11.970 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.513 5.072 -13.565 1.00 0.00 O ATOM 0 H ASP A 38 3.104 4.523 -10.682 1.00 0.00 H new ATOM 0 HA ASP A 38 0.890 6.111 -9.895 1.00 0.00 H new ATOM 0 HB2 ASP A 38 0.925 7.293 -11.925 1.00 0.00 H new ATOM 0 HB3 ASP A 38 1.633 5.960 -12.815 1.00 0.00 H new ATOM 630 N GLY A 39 -0.482 3.863 -10.370 1.00 0.00 N ATOM 631 CA GLY A 39 -1.117 2.550 -10.379 1.00 0.00 C ATOM 632 C GLY A 39 -0.866 1.726 -11.649 1.00 0.00 C ATOM 633 O GLY A 39 -0.575 0.537 -11.536 1.00 0.00 O ATOM 0 H GLY A 39 -1.119 4.608 -10.088 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.762 1.983 -9.518 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.192 2.680 -10.253 1.00 0.00 H new ATOM 637 N VAL A 40 -0.918 2.313 -12.850 1.00 0.00 N ATOM 638 CA VAL A 40 -0.696 1.574 -14.097 1.00 0.00 C ATOM 639 C VAL A 40 0.720 0.974 -14.094 1.00 0.00 C ATOM 640 O VAL A 40 0.939 -0.143 -14.576 1.00 0.00 O ATOM 641 CB VAL A 40 -0.905 2.520 -15.302 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.762 1.801 -16.638 1.00 0.00 C ATOM 643 CG2 VAL A 40 -2.283 3.195 -15.324 1.00 0.00 C ATOM 0 H VAL A 40 -1.113 3.305 -12.984 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.411 0.756 -14.179 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.125 3.270 -15.172 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.918 2.510 -17.451 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.238 1.374 -16.716 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.503 1.005 -16.704 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.357 3.843 -16.197 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -3.061 2.433 -15.371 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.412 3.789 -14.419 1.00 0.00 H new ATOM 653 N ASP A 41 1.673 1.718 -13.531 1.00 0.00 N ATOM 654 CA ASP A 41 3.070 1.334 -13.382 1.00 0.00 C ATOM 655 C ASP A 41 3.234 0.377 -12.195 1.00 0.00 C ATOM 656 O ASP A 41 3.995 -0.589 -12.262 1.00 0.00 O ATOM 657 CB ASP A 41 3.906 2.607 -13.192 1.00 0.00 C ATOM 658 CG ASP A 41 5.382 2.342 -13.452 1.00 0.00 C ATOM 659 OD1 ASP A 41 6.076 1.805 -12.569 1.00 0.00 O ATOM 660 OD2 ASP A 41 5.845 2.631 -14.576 1.00 0.00 O ATOM 0 H ASP A 41 1.480 2.645 -13.151 1.00 0.00 H new ATOM 0 HA ASP A 41 3.414 0.809 -14.273 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.549 3.384 -13.868 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.775 2.983 -12.177 1.00 0.00 H new ATOM 665 N ALA A 42 2.461 0.594 -11.123 1.00 0.00 N ATOM 666 CA ALA A 42 2.447 -0.219 -9.923 1.00 0.00 C ATOM 667 C ALA A 42 2.115 -1.651 -10.298 1.00 0.00 C ATOM 668 O ALA A 42 2.820 -2.562 -9.885 1.00 0.00 O ATOM 669 CB ALA A 42 1.418 0.320 -8.920 1.00 0.00 C ATOM 0 H ALA A 42 1.806 1.375 -11.077 1.00 0.00 H new ATOM 0 HA ALA A 42 3.429 -0.183 -9.452 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.421 -0.303 -8.025 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.675 1.344 -8.650 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.426 0.302 -9.371 1.00 0.00 H new ATOM 675 N LEU A 43 1.082 -1.831 -11.124 1.00 0.00 N ATOM 676 CA LEU A 43 0.656 -3.110 -11.667 1.00 0.00 C ATOM 677 C LEU A 43 1.839 -3.829 -12.334 1.00 0.00 C ATOM 678 O LEU A 43 2.118 -5.000 -12.057 1.00 0.00 O ATOM 679 CB LEU A 43 -0.509 -2.861 -12.644 1.00 0.00 C ATOM 680 CG LEU A 43 -1.480 -4.048 -12.680 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.466 -4.004 -11.507 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.263 -4.054 -13.996 1.00 0.00 C ATOM 0 H LEU A 43 0.501 -1.055 -11.442 1.00 0.00 H new ATOM 0 HA LEU A 43 0.305 -3.767 -10.872 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.046 -1.960 -12.348 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.114 -2.683 -13.644 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.886 -4.958 -12.599 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.139 -4.860 -11.565 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.915 -4.038 -10.567 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -3.047 -3.083 -11.554 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.948 -4.902 -14.008 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.830 -3.128 -14.086 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.569 -4.137 -14.832 1.00 0.00 H new ATOM 694 N ASN A 44 2.572 -3.086 -13.172 1.00 0.00 N ATOM 695 CA ASN A 44 3.761 -3.568 -13.866 1.00 0.00 C ATOM 696 C ASN A 44 4.946 -3.816 -12.921 1.00 0.00 C ATOM 697 O ASN A 44 5.864 -4.560 -13.276 1.00 0.00 O ATOM 698 CB ASN A 44 4.141 -2.607 -15.003 1.00 0.00 C ATOM 699 CG ASN A 44 5.164 -3.214 -15.963 1.00 0.00 C ATOM 700 OD1 ASN A 44 5.321 -4.426 -16.057 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.856 -2.390 -16.722 1.00 0.00 N ATOM 0 H ASN A 44 2.347 -2.115 -13.387 1.00 0.00 H new ATOM 0 HA ASN A 44 3.512 -4.539 -14.295 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.244 -2.333 -15.558 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.546 -1.688 -14.578 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.529 -2.759 -17.394 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.719 -1.383 -16.638 1.00 0.00 H new ATOM 708 N LYS A 45 4.972 -3.236 -11.713 1.00 0.00 N ATOM 709 CA LYS A 45 5.857 -3.736 -10.655 1.00 0.00 C ATOM 710 C LYS A 45 5.379 -5.099 -10.174 1.00 0.00 C ATOM 711 O LYS A 45 6.199 -6.005 -10.110 1.00 0.00 O ATOM 712 CB LYS A 45 6.032 -2.775 -9.462 1.00 0.00 C ATOM 713 CG LYS A 45 7.205 -1.812 -9.667 1.00 0.00 C ATOM 714 CD LYS A 45 6.842 -0.669 -10.614 1.00 0.00 C ATOM 715 CE LYS A 45 8.030 0.273 -10.817 1.00 0.00 C ATOM 716 NZ LYS A 45 9.081 -0.354 -11.633 1.00 0.00 N ATOM 0 H LYS A 45 4.400 -2.434 -11.448 1.00 0.00 H new ATOM 0 HA LYS A 45 6.845 -3.820 -11.108 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.115 -2.204 -9.319 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.192 -3.353 -8.552 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.512 -1.403 -8.704 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.059 -2.359 -10.068 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.527 -1.075 -11.575 1.00 0.00 H new ATOM 0 HD3 LYS A 45 5.997 -0.112 -10.210 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.691 1.189 -11.300 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.441 0.557 -9.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.799 0.356 -11.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.526 -1.124 -11.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.662 -0.739 -12.504 1.00 0.00 H new ATOM 730 N LEU A 46 4.094 -5.285 -9.855 1.00 0.00 N ATOM 731 CA LEU A 46 3.596 -6.544 -9.276 1.00 0.00 C ATOM 732 C LEU A 46 3.983 -7.711 -10.180 1.00 0.00 C ATOM 733 O LEU A 46 4.653 -8.649 -9.739 1.00 0.00 O ATOM 734 CB LEU A 46 2.068 -6.561 -9.050 1.00 0.00 C ATOM 735 CG LEU A 46 1.447 -5.227 -8.648 1.00 0.00 C ATOM 736 CD1 LEU A 46 -0.062 -5.356 -8.662 1.00 0.00 C ATOM 737 CD2 LEU A 46 1.918 -4.674 -7.300 1.00 0.00 C ATOM 0 H LEU A 46 3.373 -4.576 -9.988 1.00 0.00 H new ATOM 0 HA LEU A 46 4.061 -6.637 -8.294 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.587 -6.904 -9.966 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.841 -7.295 -8.277 1.00 0.00 H new ATOM 0 HG LEU A 46 1.789 -4.501 -9.385 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.511 -4.405 -8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.395 -5.627 -9.664 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.368 -6.129 -7.957 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.421 -3.724 -7.103 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.672 -5.383 -6.510 1.00 0.00 H new ATOM 0 HD23 LEU A 46 2.997 -4.520 -7.327 1.00 0.00 H new ATOM 749 N GLN A 47 3.610 -7.627 -11.462 1.00 0.00 N ATOM 750 CA GLN A 47 3.926 -8.685 -12.425 1.00 0.00 C ATOM 751 C GLN A 47 5.420 -8.766 -12.785 1.00 0.00 C ATOM 752 O GLN A 47 5.795 -9.624 -13.581 1.00 0.00 O ATOM 753 CB GLN A 47 3.064 -8.559 -13.691 1.00 0.00 C ATOM 754 CG GLN A 47 3.254 -7.211 -14.399 1.00 0.00 C ATOM 755 CD GLN A 47 2.869 -7.245 -15.868 1.00 0.00 C ATOM 756 OE1 GLN A 47 1.949 -7.941 -16.290 1.00 0.00 O ATOM 757 NE2 GLN A 47 3.533 -6.463 -16.693 1.00 0.00 N ATOM 0 H GLN A 47 3.092 -6.841 -11.854 1.00 0.00 H new ATOM 0 HA GLN A 47 3.684 -9.623 -11.925 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.315 -9.366 -14.379 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.014 -8.682 -13.425 1.00 0.00 H new ATOM 0 HG2 GLN A 47 2.656 -6.454 -13.891 1.00 0.00 H new ATOM 0 HG3 GLN A 47 4.297 -6.906 -14.311 1.00 0.00 H new ATOM 0 HE21 GLN A 47 4.297 -5.885 -16.344 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.283 -6.435 -17.682 1.00 0.00 H new ATOM 766 N ALA A 48 6.292 -7.905 -12.247 1.00 0.00 N ATOM 767 CA ALA A 48 7.726 -8.025 -12.480 1.00 0.00 C ATOM 768 C ALA A 48 8.257 -9.337 -11.895 1.00 0.00 C ATOM 769 O ALA A 48 9.233 -9.875 -12.422 1.00 0.00 O ATOM 770 CB ALA A 48 8.491 -6.835 -11.888 1.00 0.00 C ATOM 0 H ALA A 48 6.026 -7.122 -11.650 1.00 0.00 H new ATOM 0 HA ALA A 48 7.887 -8.027 -13.558 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.557 -6.956 -12.079 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.142 -5.912 -12.350 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.318 -6.790 -10.813 1.00 0.00 H new ATOM 776 N GLY A 49 7.636 -9.876 -10.839 1.00 0.00 N ATOM 777 CA GLY A 49 8.031 -11.146 -10.252 1.00 0.00 C ATOM 778 C GLY A 49 7.074 -11.552 -9.142 1.00 0.00 C ATOM 779 O GLY A 49 6.169 -12.359 -9.363 1.00 0.00 O ATOM 0 H GLY A 49 6.843 -9.436 -10.372 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.049 -11.917 -11.022 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.043 -11.068 -9.855 1.00 0.00 H new ATOM 783 N GLY A 50 7.270 -11.022 -7.935 1.00 0.00 N ATOM 784 CA GLY A 50 6.480 -11.398 -6.774 1.00 0.00 C ATOM 785 C GLY A 50 6.627 -10.344 -5.694 1.00 0.00 C ATOM 786 O GLY A 50 7.576 -10.390 -4.907 1.00 0.00 O ATOM 0 H GLY A 50 7.983 -10.319 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 50 5.432 -11.503 -7.054 1.00 0.00 H new ATOM 0 HA3 GLY A 50 6.808 -12.367 -6.397 1.00 0.00 H new ATOM 790 N TYR A 51 5.734 -9.361 -5.689 1.00 0.00 N ATOM 791 CA TYR A 51 5.598 -8.431 -4.582 1.00 0.00 C ATOM 792 C TYR A 51 4.702 -9.052 -3.516 1.00 0.00 C ATOM 793 O TYR A 51 3.868 -9.916 -3.805 1.00 0.00 O ATOM 794 CB TYR A 51 5.043 -7.097 -5.092 1.00 0.00 C ATOM 795 CG TYR A 51 6.117 -6.248 -5.739 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.666 -6.601 -6.987 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.612 -5.126 -5.054 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.706 -5.839 -7.543 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.603 -4.321 -5.638 1.00 0.00 C ATOM 800 CZ TYR A 51 8.160 -4.679 -6.885 1.00 0.00 C ATOM 801 OH TYR A 51 9.131 -3.911 -7.439 1.00 0.00 O ATOM 0 H TYR A 51 5.084 -9.189 -6.456 1.00 0.00 H new ATOM 0 HA TYR A 51 6.570 -8.230 -4.132 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.247 -7.287 -5.812 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.598 -6.548 -4.262 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.286 -7.461 -7.518 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.229 -4.882 -4.074 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.158 -6.142 -8.476 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.939 -3.428 -5.133 1.00 0.00 H new ATOM 0 HH TYR A 51 8.786 -3.006 -7.590 1.00 0.00 H new ATOM 811 N GLY A 52 4.873 -8.592 -2.279 1.00 0.00 N ATOM 812 CA GLY A 52 4.098 -9.025 -1.135 1.00 0.00 C ATOM 813 C GLY A 52 3.235 -7.881 -0.650 1.00 0.00 C ATOM 814 O GLY A 52 2.019 -7.957 -0.747 1.00 0.00 O ATOM 0 H GLY A 52 5.575 -7.889 -2.046 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.474 -9.876 -1.406 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.762 -9.358 -0.337 1.00 0.00 H new ATOM 818 N PHE A 53 3.843 -6.821 -0.123 1.00 0.00 N ATOM 819 CA PHE A 53 3.091 -5.637 0.270 1.00 0.00 C ATOM 820 C PHE A 53 2.962 -4.717 -0.932 1.00 0.00 C ATOM 821 O PHE A 53 3.942 -4.465 -1.634 1.00 0.00 O ATOM 822 CB PHE A 53 3.790 -4.910 1.414 1.00 0.00 C ATOM 823 CG PHE A 53 3.305 -5.320 2.787 1.00 0.00 C ATOM 824 CD1 PHE A 53 3.746 -6.526 3.362 1.00 0.00 C ATOM 825 CD2 PHE A 53 2.469 -4.461 3.521 1.00 0.00 C ATOM 826 CE1 PHE A 53 3.388 -6.858 4.679 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.120 -4.783 4.839 1.00 0.00 C ATOM 828 CZ PHE A 53 2.579 -5.980 5.421 1.00 0.00 C ATOM 0 H PHE A 53 4.848 -6.759 0.040 1.00 0.00 H new ATOM 0 HA PHE A 53 2.102 -5.937 0.616 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.862 -5.095 1.348 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.643 -3.837 1.293 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.363 -7.200 2.787 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.096 -3.554 3.069 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.732 -7.782 5.119 1.00 0.00 H new ATOM 0 HE2 PHE A 53 1.497 -4.111 5.410 1.00 0.00 H new ATOM 0 HZ PHE A 53 2.309 -6.224 6.438 1.00 0.00 H new ATOM 838 N VAL A 54 1.766 -4.176 -1.119 1.00 0.00 N ATOM 839 CA VAL A 54 1.431 -3.207 -2.148 1.00 0.00 C ATOM 840 C VAL A 54 0.730 -2.103 -1.370 1.00 0.00 C ATOM 841 O VAL A 54 -0.270 -2.353 -0.704 1.00 0.00 O ATOM 842 CB VAL A 54 0.585 -3.891 -3.247 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.242 -3.008 -4.459 1.00 0.00 C ATOM 844 CG2 VAL A 54 1.365 -5.089 -3.798 1.00 0.00 C ATOM 0 H VAL A 54 0.968 -4.413 -0.529 1.00 0.00 H new ATOM 0 HA VAL A 54 2.274 -2.791 -2.700 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.352 -4.154 -2.756 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.353 -3.581 -5.170 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.327 -2.140 -4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.162 -2.676 -4.940 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.778 -5.580 -4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.309 -4.745 -4.220 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.564 -5.796 -2.992 1.00 0.00 H new ATOM 854 N ILE A 55 1.354 -0.932 -1.321 1.00 0.00 N ATOM 855 CA ILE A 55 0.949 0.202 -0.509 1.00 0.00 C ATOM 856 C ILE A 55 0.890 1.378 -1.476 1.00 0.00 C ATOM 857 O ILE A 55 1.863 1.601 -2.197 1.00 0.00 O ATOM 858 CB ILE A 55 1.940 0.416 0.669 1.00 0.00 C ATOM 859 CG1 ILE A 55 2.368 -0.917 1.342 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.348 1.414 1.675 1.00 0.00 C ATOM 861 CD1 ILE A 55 3.231 -0.768 2.601 1.00 0.00 C ATOM 0 H ILE A 55 2.192 -0.742 -1.871 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.019 0.060 -0.028 1.00 0.00 H new ATOM 0 HB ILE A 55 2.858 0.841 0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.470 -1.479 1.601 1.00 0.00 H new ATOM 0 HG13 ILE A 55 2.918 -1.513 0.613 1.00 0.00 H new ATOM 0 HG21 ILE A 55 2.048 1.559 2.498 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.168 2.368 1.179 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.407 1.024 2.063 1.00 0.00 H new ATOM 0 HD11 ILE A 55 3.476 -1.755 2.993 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.151 -0.239 2.351 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.681 -0.204 3.354 1.00 0.00 H new ATOM 873 N SER A 56 -0.228 2.097 -1.563 1.00 0.00 N ATOM 874 CA SER A 56 -0.318 3.173 -2.543 1.00 0.00 C ATOM 875 C SER A 56 -1.352 4.231 -2.170 1.00 0.00 C ATOM 876 O SER A 56 -2.139 4.048 -1.241 1.00 0.00 O ATOM 877 CB SER A 56 -0.560 2.567 -3.931 1.00 0.00 C ATOM 878 OG SER A 56 -1.735 1.786 -3.980 1.00 0.00 O ATOM 0 H SER A 56 -1.058 1.960 -0.986 1.00 0.00 H new ATOM 0 HA SER A 56 0.630 3.711 -2.557 1.00 0.00 H new ATOM 0 HB2 SER A 56 -0.628 3.368 -4.667 1.00 0.00 H new ATOM 0 HB3 SER A 56 0.295 1.950 -4.209 1.00 0.00 H new ATOM 0 HG SER A 56 -1.506 0.866 -4.230 1.00 0.00 H new ATOM 884 N ASP A 57 -1.327 5.353 -2.888 1.00 0.00 N ATOM 885 CA ASP A 57 -2.257 6.457 -2.697 1.00 0.00 C ATOM 886 C ASP A 57 -3.623 6.103 -3.266 1.00 0.00 C ATOM 887 O ASP A 57 -3.763 5.153 -4.041 1.00 0.00 O ATOM 888 CB ASP A 57 -1.745 7.723 -3.403 1.00 0.00 C ATOM 889 CG ASP A 57 -2.010 8.952 -2.546 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.206 9.269 -2.349 1.00 0.00 O ATOM 891 OD2 ASP A 57 -1.024 9.549 -2.061 1.00 0.00 O ATOM 0 H ASP A 57 -0.647 5.520 -3.630 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.339 6.643 -1.626 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.677 7.631 -3.598 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.237 7.833 -4.369 1.00 0.00 H new ATOM 896 N TRP A 58 -4.635 6.905 -2.940 1.00 0.00 N ATOM 897 CA TRP A 58 -5.827 6.951 -3.767 1.00 0.00 C ATOM 898 C TRP A 58 -5.496 7.830 -4.978 1.00 0.00 C ATOM 899 O TRP A 58 -5.884 7.514 -6.104 1.00 0.00 O ATOM 900 CB TRP A 58 -7.026 7.508 -2.983 1.00 0.00 C ATOM 901 CG TRP A 58 -8.325 7.418 -3.728 1.00 0.00 C ATOM 902 CD1 TRP A 58 -8.600 8.043 -4.893 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.508 6.612 -3.437 1.00 0.00 C ATOM 904 NE1 TRP A 58 -9.827 7.643 -5.366 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.456 6.796 -4.486 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.863 5.716 -2.414 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.691 6.136 -4.507 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -11.111 5.072 -2.393 1.00 0.00 C ATOM 909 CH2 TRP A 58 -12.018 5.279 -3.449 1.00 0.00 C ATOM 0 H TRP A 58 -4.650 7.518 -2.125 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.112 5.949 -4.088 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -7.118 6.965 -2.042 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -6.832 8.551 -2.732 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -7.950 8.754 -5.382 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -10.221 7.938 -6.259 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -9.156 5.517 -1.622 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.380 6.285 -5.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -11.373 4.422 -1.571 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.972 4.774 -3.443 1.00 0.00 H new ATOM 920 N ASN A 59 -4.809 8.949 -4.733 1.00 0.00 N ATOM 921 CA ASN A 59 -4.719 10.132 -5.577 1.00 0.00 C ATOM 922 C ASN A 59 -3.743 9.942 -6.744 1.00 0.00 C ATOM 923 O ASN A 59 -2.779 10.694 -6.885 1.00 0.00 O ATOM 924 CB ASN A 59 -4.320 11.322 -4.677 1.00 0.00 C ATOM 925 CG ASN A 59 -4.669 12.654 -5.315 1.00 0.00 C ATOM 926 OD1 ASN A 59 -3.816 13.484 -5.616 1.00 0.00 O ATOM 927 ND2 ASN A 59 -5.949 12.927 -5.459 1.00 0.00 N ATOM 0 H ASN A 59 -4.264 9.054 -3.877 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.686 10.325 -6.043 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.826 11.236 -3.715 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.249 11.284 -4.478 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -6.239 13.834 -5.823 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -6.650 12.231 -5.206 1.00 0.00 H new ATOM 934 N MET A 60 -3.940 8.919 -7.576 1.00 0.00 N ATOM 935 CA MET A 60 -3.034 8.638 -8.686 1.00 0.00 C ATOM 936 C MET A 60 -3.275 9.613 -9.846 1.00 0.00 C ATOM 937 O MET A 60 -4.297 10.311 -9.858 1.00 0.00 O ATOM 938 CB MET A 60 -3.196 7.166 -9.099 1.00 0.00 C ATOM 939 CG MET A 60 -2.031 6.273 -8.658 1.00 0.00 C ATOM 940 SD MET A 60 -1.633 6.204 -6.888 1.00 0.00 S ATOM 941 CE MET A 60 -0.313 7.449 -6.757 1.00 0.00 C ATOM 0 H MET A 60 -4.723 8.270 -7.500 1.00 0.00 H new ATOM 0 HA MET A 60 -2.000 8.790 -8.376 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.122 6.778 -8.674 1.00 0.00 H new ATOM 0 HB3 MET A 60 -3.295 7.110 -10.183 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.243 5.258 -8.992 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.138 6.603 -9.189 1.00 0.00 H new ATOM 0 HE1 MET A 60 0.570 6.997 -6.306 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.063 7.820 -7.751 1.00 0.00 H new ATOM 0 HE3 MET A 60 -0.654 8.277 -6.136 1.00 0.00 H new ATOM 951 N PRO A 61 -2.352 9.693 -10.825 1.00 0.00 N ATOM 952 CA PRO A 61 -2.584 10.426 -12.056 1.00 0.00 C ATOM 953 C PRO A 61 -3.513 9.642 -12.991 1.00 0.00 C ATOM 954 O PRO A 61 -4.367 10.276 -13.613 1.00 0.00 O ATOM 955 CB PRO A 61 -1.209 10.663 -12.677 1.00 0.00 C ATOM 956 CG PRO A 61 -0.401 9.470 -12.192 1.00 0.00 C ATOM 957 CD PRO A 61 -0.998 9.150 -10.818 1.00 0.00 C ATOM 0 HA PRO A 61 -3.085 11.376 -11.871 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -1.259 10.700 -13.765 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -0.774 11.606 -12.346 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -0.491 8.624 -12.873 1.00 0.00 H new ATOM 0 HG3 PRO A 61 0.660 9.709 -12.120 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -1.011 8.075 -10.640 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -0.403 9.598 -10.022 1.00 0.00 H new ATOM 965 N ASN A 62 -3.383 8.308 -13.099 1.00 0.00 N ATOM 966 CA ASN A 62 -4.121 7.525 -14.086 1.00 0.00 C ATOM 967 C ASN A 62 -5.013 6.481 -13.442 1.00 0.00 C ATOM 968 O ASN A 62 -6.238 6.536 -13.557 1.00 0.00 O ATOM 969 CB ASN A 62 -3.189 6.853 -15.101 1.00 0.00 C ATOM 970 CG ASN A 62 -4.000 6.510 -16.339 1.00 0.00 C ATOM 971 OD1 ASN A 62 -4.553 5.419 -16.472 1.00 0.00 O ATOM 972 ND2 ASN A 62 -4.142 7.461 -17.238 1.00 0.00 N ATOM 0 H ASN A 62 -2.766 7.753 -12.506 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.754 8.237 -14.615 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -2.365 7.519 -15.359 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.749 5.952 -14.674 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -4.719 7.300 -18.064 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -3.675 8.359 -17.109 1.00 0.00 H new ATOM 979 N MET A 63 -4.390 5.469 -12.848 1.00 0.00 N ATOM 980 CA MET A 63 -5.092 4.380 -12.191 1.00 0.00 C ATOM 981 C MET A 63 -5.275 4.761 -10.728 1.00 0.00 C ATOM 982 O MET A 63 -4.471 4.375 -9.875 1.00 0.00 O ATOM 983 CB MET A 63 -4.366 3.057 -12.441 1.00 0.00 C ATOM 984 CG MET A 63 -5.039 1.837 -11.807 1.00 0.00 C ATOM 985 SD MET A 63 -4.220 0.263 -12.187 1.00 0.00 S ATOM 986 CE MET A 63 -4.848 -0.049 -13.861 1.00 0.00 C ATOM 0 H MET A 63 -3.374 5.384 -12.810 1.00 0.00 H new ATOM 0 HA MET A 63 -6.089 4.219 -12.602 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.289 2.896 -13.516 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.349 3.136 -12.057 1.00 0.00 H new ATOM 0 HG2 MET A 63 -5.064 1.970 -10.725 1.00 0.00 H new ATOM 0 HG3 MET A 63 -6.074 1.788 -12.147 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.435 -0.985 -14.236 1.00 0.00 H new ATOM 0 HE2 MET A 63 -5.936 -0.117 -13.835 1.00 0.00 H new ATOM 0 HE3 MET A 63 -4.552 0.768 -14.519 1.00 0.00 H new ATOM 996 N ASP A 64 -6.329 5.539 -10.469 1.00 0.00 N ATOM 997 CA ASP A 64 -6.843 5.914 -9.149 1.00 0.00 C ATOM 998 C ASP A 64 -6.810 4.680 -8.241 1.00 0.00 C ATOM 999 O ASP A 64 -7.107 3.568 -8.686 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.274 6.471 -9.290 1.00 0.00 C ATOM 1001 CG ASP A 64 -8.450 7.902 -8.785 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -7.708 8.799 -9.235 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.404 8.179 -8.025 1.00 0.00 O ATOM 0 H ASP A 64 -6.881 5.949 -11.222 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.224 6.693 -8.704 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.564 6.432 -10.340 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.959 5.820 -8.746 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.450 4.837 -6.968 1.00 0.00 N ATOM 1009 CA GLY A 65 -6.030 3.701 -6.154 1.00 0.00 C ATOM 1010 C GLY A 65 -7.114 2.658 -5.905 1.00 0.00 C ATOM 1011 O GLY A 65 -6.795 1.508 -5.594 1.00 0.00 O ATOM 0 H GLY A 65 -6.441 5.734 -6.482 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.184 3.216 -6.641 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.675 4.072 -5.193 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.390 3.029 -6.050 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.500 2.083 -5.986 1.00 0.00 C ATOM 1017 C LEU A 66 -9.487 1.188 -7.226 1.00 0.00 C ATOM 1018 O LEU A 66 -9.720 -0.011 -7.113 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.829 2.850 -5.826 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.962 2.118 -5.093 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.426 0.818 -5.735 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.592 1.786 -3.650 1.00 0.00 C ATOM 0 H LEU A 66 -8.679 3.993 -6.215 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.393 1.435 -5.116 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.624 3.779 -5.294 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.186 3.123 -6.819 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.779 2.837 -5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.228 0.383 -5.138 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.792 1.020 -6.742 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.591 0.119 -5.786 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.423 1.269 -3.171 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.711 1.145 -3.639 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.377 2.707 -3.108 1.00 0.00 H new ATOM 1034 N GLU A 67 -9.161 1.745 -8.392 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.993 1.001 -9.630 1.00 0.00 C ATOM 1036 C GLU A 67 -7.762 0.103 -9.534 1.00 0.00 C ATOM 1037 O GLU A 67 -7.844 -1.047 -9.956 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.864 1.932 -10.851 1.00 0.00 C ATOM 1039 CG GLU A 67 -9.902 3.063 -10.953 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.349 2.620 -11.202 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.738 1.466 -10.899 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -12.158 3.476 -11.630 1.00 0.00 O ATOM 0 H GLU A 67 -9.004 2.747 -8.500 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.886 0.392 -9.771 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.870 2.379 -10.838 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.929 1.325 -11.754 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.873 3.642 -10.030 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.603 3.733 -11.759 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.644 0.573 -8.957 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.464 -0.287 -8.771 1.00 0.00 C ATOM 1051 C LEU A 68 -5.830 -1.501 -7.920 1.00 0.00 C ATOM 1052 O LEU A 68 -5.577 -2.636 -8.328 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.270 0.469 -8.157 1.00 0.00 C ATOM 1054 CG LEU A 68 -3.039 -0.443 -7.918 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.441 -1.018 -9.212 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -1.963 0.331 -7.159 1.00 0.00 C ATOM 0 H LEU A 68 -6.532 1.528 -8.616 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.147 -0.620 -9.759 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.986 1.288 -8.817 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.576 0.914 -7.210 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.391 -1.291 -7.331 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.584 -1.646 -8.969 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -3.194 -1.615 -9.727 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.121 -0.201 -9.859 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -1.100 -0.314 -6.993 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.660 1.200 -7.743 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.360 0.660 -6.199 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.458 -1.266 -6.762 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.981 -2.325 -5.909 1.00 0.00 C ATOM 1070 C LEU A 69 -7.884 -3.222 -6.739 1.00 0.00 C ATOM 1071 O LEU A 69 -7.623 -4.410 -6.780 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.700 -1.737 -4.684 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.848 -2.549 -4.035 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.591 -4.003 -3.598 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.235 -1.774 -2.777 1.00 0.00 C ATOM 0 H LEU A 69 -6.616 -0.328 -6.393 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.162 -2.930 -5.519 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.949 -1.555 -3.916 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.103 -0.766 -4.972 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.596 -2.649 -4.821 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.501 -4.419 -3.165 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.297 -4.597 -4.464 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.793 -4.024 -2.856 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.045 -2.293 -2.265 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.373 -1.703 -2.114 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.563 -0.772 -3.053 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.927 -2.717 -7.402 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.885 -3.591 -8.084 1.00 0.00 C ATOM 1089 C LYS A 70 -9.296 -4.326 -9.287 1.00 0.00 C ATOM 1090 O LYS A 70 -9.800 -5.409 -9.605 1.00 0.00 O ATOM 1091 CB LYS A 70 -11.135 -2.813 -8.493 1.00 0.00 C ATOM 1092 CG LYS A 70 -12.018 -2.530 -7.273 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.347 -1.928 -7.742 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.412 -1.998 -6.647 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.748 -1.669 -7.177 1.00 0.00 N ATOM 0 H LYS A 70 -9.129 -1.720 -7.481 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.157 -4.359 -7.359 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.847 -1.874 -8.966 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.699 -3.382 -9.232 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.198 -3.451 -6.718 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.513 -1.842 -6.595 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.194 -0.890 -8.036 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.697 -2.461 -8.626 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.426 -2.998 -6.214 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.157 -1.307 -5.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.449 -1.725 -6.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.739 -0.705 -7.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -16.000 -2.344 -7.927 1.00 0.00 H new ATOM 1109 N THR A 71 -8.247 -3.804 -9.916 1.00 0.00 N ATOM 1110 CA THR A 71 -7.450 -4.521 -10.899 1.00 0.00 C ATOM 1111 C THR A 71 -6.778 -5.699 -10.187 1.00 0.00 C ATOM 1112 O THR A 71 -6.957 -6.845 -10.587 1.00 0.00 O ATOM 1113 CB THR A 71 -6.458 -3.560 -11.581 1.00 0.00 C ATOM 1114 OG1 THR A 71 -7.151 -2.456 -12.129 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.707 -4.217 -12.741 1.00 0.00 C ATOM 0 H THR A 71 -7.923 -2.851 -9.751 1.00 0.00 H new ATOM 0 HA THR A 71 -8.066 -4.922 -11.704 1.00 0.00 H new ATOM 0 HB THR A 71 -5.750 -3.260 -10.808 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.329 -1.799 -11.424 1.00 0.00 H new ATOM 0 HG21 THR A 71 -5.021 -3.496 -13.186 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.143 -5.073 -12.371 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.421 -4.551 -13.494 1.00 0.00 H new ATOM 1123 N ILE A 72 -6.084 -5.446 -9.072 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.409 -6.486 -8.303 1.00 0.00 C ATOM 1125 C ILE A 72 -6.469 -7.456 -7.734 1.00 0.00 C ATOM 1126 O ILE A 72 -6.197 -8.640 -7.541 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.570 -5.801 -7.198 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.261 -5.218 -7.779 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.146 -6.831 -6.140 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.621 -4.179 -6.837 1.00 0.00 C ATOM 0 H ILE A 72 -5.977 -4.510 -8.680 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.733 -7.075 -8.922 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.190 -5.014 -6.769 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.553 -6.027 -7.960 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.468 -4.754 -8.743 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.556 -6.337 -5.368 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.033 -7.277 -5.690 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.547 -7.611 -6.611 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.704 -3.797 -7.286 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.317 -3.356 -6.677 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.388 -4.649 -5.881 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.694 -6.997 -7.476 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.815 -7.768 -6.951 1.00 0.00 C ATOM 1144 C ARG A 73 -9.656 -8.374 -8.089 1.00 0.00 C ATOM 1145 O ARG A 73 -10.780 -8.794 -7.818 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.653 -6.913 -5.972 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.846 -7.582 -4.605 1.00 0.00 C ATOM 1148 CD ARG A 73 -10.690 -8.861 -4.648 1.00 0.00 C ATOM 1149 NE ARG A 73 -10.851 -9.426 -3.300 1.00 0.00 N ATOM 1150 CZ ARG A 73 -11.731 -9.041 -2.369 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -12.622 -8.082 -2.604 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -11.685 -9.632 -1.182 1.00 0.00 N ATOM 0 H ARG A 73 -7.942 -6.021 -7.638 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.424 -8.610 -6.380 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -9.166 -5.948 -5.832 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.629 -6.716 -6.415 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.868 -7.819 -4.187 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -10.318 -6.870 -3.928 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.669 -8.642 -5.075 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -10.215 -9.594 -5.300 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.226 -10.192 -3.048 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -12.646 -7.620 -3.513 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -13.281 -7.809 -1.875 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -10.992 -10.358 -1.000 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -12.343 -9.360 -0.451 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.195 -8.378 -9.349 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.914 -8.996 -10.472 1.00 0.00 C ATOM 1168 C ALA A 74 -10.068 -10.513 -10.304 1.00 0.00 C ATOM 1169 O ALA A 74 -10.901 -11.137 -10.967 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.179 -8.708 -11.784 1.00 0.00 C ATOM 0 H ALA A 74 -8.309 -7.951 -9.618 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.912 -8.559 -10.491 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.718 -9.169 -12.612 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.125 -7.631 -11.942 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.171 -9.119 -11.734 1.00 0.00 H new ATOM 1205 N MET A 78 -3.816 -12.393 -8.308 1.00 0.00 N ATOM 1206 CA MET A 78 -3.354 -11.503 -7.227 1.00 0.00 C ATOM 1207 C MET A 78 -4.450 -11.060 -6.251 1.00 0.00 C ATOM 1208 O MET A 78 -4.221 -10.142 -5.470 1.00 0.00 O ATOM 1209 CB MET A 78 -2.515 -10.307 -7.707 1.00 0.00 C ATOM 1210 CG MET A 78 -1.412 -10.743 -8.682 1.00 0.00 C ATOM 1211 SD MET A 78 0.092 -9.738 -8.623 1.00 0.00 S ATOM 1212 CE MET A 78 1.104 -10.613 -9.840 1.00 0.00 C ATOM 0 HA MET A 78 -2.683 -12.147 -6.659 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.164 -9.579 -8.194 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.066 -9.809 -6.848 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.148 -11.779 -8.471 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.811 -10.716 -9.696 1.00 0.00 H new ATOM 0 HE1 MET A 78 2.073 -10.122 -9.928 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.248 -11.645 -9.519 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.602 -10.601 -10.807 1.00 0.00 H new ATOM 1222 N SER A 79 -5.605 -11.724 -6.193 1.00 0.00 N ATOM 1223 CA SER A 79 -6.671 -11.407 -5.234 1.00 0.00 C ATOM 1224 C SER A 79 -6.222 -11.478 -3.761 1.00 0.00 C ATOM 1225 O SER A 79 -6.880 -10.901 -2.889 1.00 0.00 O ATOM 1226 CB SER A 79 -7.867 -12.333 -5.497 1.00 0.00 C ATOM 1227 OG SER A 79 -7.442 -13.608 -5.969 1.00 0.00 O ATOM 0 H SER A 79 -5.831 -12.502 -6.813 1.00 0.00 H new ATOM 0 HA SER A 79 -6.957 -10.367 -5.392 1.00 0.00 H new ATOM 0 HB2 SER A 79 -8.443 -12.456 -4.580 1.00 0.00 H new ATOM 0 HB3 SER A 79 -8.530 -11.874 -6.230 1.00 0.00 H new ATOM 0 HG SER A 79 -8.225 -14.176 -6.126 1.00 0.00 H new ATOM 1233 N ALA A 80 -5.100 -12.154 -3.487 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.459 -12.269 -2.185 1.00 0.00 C ATOM 1235 C ALA A 80 -3.431 -11.162 -1.912 1.00 0.00 C ATOM 1236 O ALA A 80 -2.719 -11.235 -0.908 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.763 -13.630 -2.113 1.00 0.00 C ATOM 0 H ALA A 80 -4.592 -12.661 -4.212 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.235 -12.168 -1.426 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.275 -13.738 -1.144 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.500 -14.423 -2.239 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.017 -13.700 -2.905 1.00 0.00 H new ATOM 1243 N LEU A 81 -3.261 -10.170 -2.788 1.00 0.00 N ATOM 1244 CA LEU A 81 -2.357 -9.060 -2.508 1.00 0.00 C ATOM 1245 C LEU A 81 -2.997 -8.149 -1.451 1.00 0.00 C ATOM 1246 O LEU A 81 -4.151 -7.746 -1.617 1.00 0.00 O ATOM 1247 CB LEU A 81 -2.031 -8.259 -3.774 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.758 -8.693 -4.522 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.587 -7.776 -5.740 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.485 -8.602 -3.627 1.00 0.00 C ATOM 0 H LEU A 81 -3.735 -10.115 -3.690 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.417 -9.465 -2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.877 -8.333 -4.458 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.932 -7.208 -3.503 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.863 -9.734 -4.827 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.310 -8.063 -6.289 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.456 -7.870 -6.391 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.493 -6.742 -5.407 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.363 -8.917 -4.191 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.618 -7.573 -3.292 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.358 -9.252 -2.761 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.295 -7.824 -0.356 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.766 -6.962 0.724 1.00 0.00 C ATOM 1264 C PRO A 82 -2.600 -5.469 0.376 1.00 0.00 C ATOM 1265 O PRO A 82 -1.929 -4.735 1.099 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.924 -7.401 1.924 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.576 -7.712 1.288 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.994 -8.370 -0.017 1.00 0.00 C ATOM 0 HA PRO A 82 -3.833 -7.061 0.921 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.846 -6.614 2.674 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.349 -8.274 2.420 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.015 -6.812 1.121 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.025 -8.378 1.908 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.270 -8.164 -0.805 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.045 -9.453 0.094 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.284 -5.001 -0.666 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.318 -3.609 -1.130 1.00 0.00 C ATOM 1278 C VAL A 83 -3.758 -2.652 -0.017 1.00 0.00 C ATOM 1279 O VAL A 83 -4.906 -2.711 0.431 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.222 -3.470 -2.370 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.478 -3.827 -3.655 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.478 -4.345 -2.325 1.00 0.00 C ATOM 0 H VAL A 83 -3.862 -5.613 -1.243 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.303 -3.330 -1.414 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.519 -2.421 -2.361 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.149 -3.717 -4.507 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.624 -3.161 -3.778 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -3.129 -4.858 -3.599 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.062 -4.191 -3.233 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.189 -5.393 -2.254 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.079 -4.075 -1.457 1.00 0.00 H new ATOM 1292 N LEU A 84 -2.858 -1.793 0.462 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.070 -0.887 1.585 1.00 0.00 C ATOM 1294 C LEU A 84 -3.072 0.551 1.076 1.00 0.00 C ATOM 1295 O LEU A 84 -2.052 1.051 0.604 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.992 -1.137 2.654 1.00 0.00 C ATOM 1297 CG LEU A 84 -2.074 -0.178 3.860 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.451 -0.194 4.539 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -1.000 -0.561 4.884 1.00 0.00 C ATOM 0 H LEU A 84 -1.924 -1.708 0.060 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.037 -1.069 2.053 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.080 -2.163 3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.009 -1.043 2.193 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.910 0.832 3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.450 0.499 5.380 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.214 0.107 3.821 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.668 -1.200 4.898 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.054 0.114 5.738 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.166 -1.585 5.220 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.015 -0.485 4.424 1.00 0.00 H new ATOM 1311 N MET A 85 -4.222 1.216 1.183 1.00 0.00 N ATOM 1312 CA MET A 85 -4.344 2.610 0.781 1.00 0.00 C ATOM 1313 C MET A 85 -3.692 3.475 1.861 1.00 0.00 C ATOM 1314 O MET A 85 -3.996 3.304 3.048 1.00 0.00 O ATOM 1315 CB MET A 85 -5.819 2.987 0.638 1.00 0.00 C ATOM 1316 CG MET A 85 -6.588 2.249 -0.464 1.00 0.00 C ATOM 1317 SD MET A 85 -6.851 3.263 -1.943 1.00 0.00 S ATOM 1318 CE MET A 85 -8.295 2.415 -2.621 1.00 0.00 C ATOM 0 H MET A 85 -5.083 0.807 1.546 1.00 0.00 H new ATOM 0 HA MET A 85 -3.853 2.767 -0.179 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.317 2.802 1.590 1.00 0.00 H new ATOM 0 HB3 MET A 85 -5.885 4.058 0.447 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.041 1.348 -0.740 1.00 0.00 H new ATOM 0 HG3 MET A 85 -7.554 1.928 -0.073 1.00 0.00 H new ATOM 0 HE1 MET A 85 -8.763 3.043 -3.379 1.00 0.00 H new ATOM 0 HE2 MET A 85 -7.985 1.472 -3.072 1.00 0.00 H new ATOM 0 HE3 MET A 85 -9.009 2.217 -1.822 1.00 0.00 H new ATOM 1328 N VAL A 86 -2.827 4.405 1.466 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.130 5.350 2.323 1.00 0.00 C ATOM 1330 C VAL A 86 -2.146 6.690 1.590 1.00 0.00 C ATOM 1331 O VAL A 86 -1.441 6.850 0.598 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.697 4.853 2.622 1.00 0.00 C ATOM 1333 CG1 VAL A 86 0.052 5.834 3.530 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.676 3.476 3.302 1.00 0.00 C ATOM 0 H VAL A 86 -2.582 4.523 0.483 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.614 5.454 3.294 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.207 4.778 1.651 1.00 0.00 H new ATOM 0 HG11 VAL A 86 1.057 5.457 3.722 1.00 0.00 H new ATOM 0 HG12 VAL A 86 0.117 6.806 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.484 5.938 4.474 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.356 3.178 3.488 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.214 3.529 4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.154 2.742 2.653 1.00 0.00 H new ATOM 1344 N THR A 87 -2.982 7.627 2.034 1.00 0.00 N ATOM 1345 CA THR A 87 -3.221 8.877 1.324 1.00 0.00 C ATOM 1346 C THR A 87 -3.324 10.049 2.309 1.00 0.00 C ATOM 1347 O THR A 87 -3.207 9.891 3.532 1.00 0.00 O ATOM 1348 CB THR A 87 -4.447 8.686 0.407 1.00 0.00 C ATOM 1349 OG1 THR A 87 -4.712 9.841 -0.363 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.729 8.299 1.143 1.00 0.00 C ATOM 0 H THR A 87 -3.514 7.538 2.900 1.00 0.00 H new ATOM 0 HA THR A 87 -2.381 9.139 0.680 1.00 0.00 H new ATOM 0 HB THR A 87 -4.166 7.852 -0.237 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.536 9.651 -1.308 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.541 8.185 0.425 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.576 7.357 1.670 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.986 9.078 1.860 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.519 11.254 1.772 1.00 0.00 N ATOM 1359 CA ALA A 88 -3.835 12.445 2.538 1.00 0.00 C ATOM 1360 C ALA A 88 -5.344 12.642 2.684 1.00 0.00 C ATOM 1361 O ALA A 88 -5.762 13.306 3.631 1.00 0.00 O ATOM 1362 CB ALA A 88 -3.213 13.665 1.845 1.00 0.00 C ATOM 0 H ALA A 88 -3.459 11.426 0.768 1.00 0.00 H new ATOM 0 HA ALA A 88 -3.422 12.328 3.540 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.446 14.565 2.414 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.132 13.540 1.790 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.619 13.758 0.838 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.161 12.132 1.757 1.00 0.00 N ATOM 1369 CA GLU A 89 -7.583 12.462 1.673 1.00 0.00 C ATOM 1370 C GLU A 89 -8.438 11.485 2.483 1.00 0.00 C ATOM 1371 O GLU A 89 -8.238 10.275 2.393 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.027 12.525 0.206 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.229 13.611 -0.538 1.00 0.00 C ATOM 1374 CD GLU A 89 -7.812 14.020 -1.893 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -8.527 13.216 -2.534 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -7.557 15.171 -2.335 1.00 0.00 O ATOM 0 H GLU A 89 -5.850 11.475 1.041 1.00 0.00 H new ATOM 0 HA GLU A 89 -7.732 13.447 2.115 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.873 11.557 -0.271 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.094 12.742 0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.166 14.495 0.097 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -6.210 13.254 -0.689 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.401 11.992 3.259 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.394 11.162 3.937 1.00 0.00 C ATOM 1385 C ALA A 90 -11.503 10.804 2.944 1.00 0.00 C ATOM 1386 O ALA A 90 -11.317 9.872 2.176 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.895 11.854 5.211 1.00 0.00 C ATOM 0 H ALA A 90 -9.512 12.991 3.433 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.951 10.225 4.274 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.634 11.221 5.702 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.057 12.024 5.886 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -11.351 12.809 4.951 1.00 0.00 H new ATOM 1393 N LYS A 91 -12.611 11.556 2.929 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.848 11.300 2.188 1.00 0.00 C ATOM 1395 C LYS A 91 -14.479 9.959 2.580 1.00 0.00 C ATOM 1396 O LYS A 91 -13.972 8.874 2.285 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.642 11.464 0.668 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.920 11.340 -0.187 1.00 0.00 C ATOM 1399 CD LYS A 91 -15.721 12.639 -0.369 1.00 0.00 C ATOM 1400 CE LYS A 91 -16.321 13.160 0.941 1.00 0.00 C ATOM 1401 NZ LYS A 91 -17.227 14.306 0.743 1.00 0.00 N ATOM 0 H LYS A 91 -12.668 12.418 3.472 1.00 0.00 H new ATOM 0 HA LYS A 91 -14.574 12.061 2.475 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -13.193 12.440 0.482 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.926 10.714 0.332 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.643 10.963 -1.172 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.570 10.593 0.268 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -15.071 13.404 -0.794 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -16.523 12.467 -1.087 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.866 12.353 1.431 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -15.514 13.453 1.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -17.602 14.615 1.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -16.705 15.089 0.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -18.015 14.023 0.125 1.00 0.00 H new ATOM 1415 N LYS A 92 -15.642 10.027 3.236 1.00 0.00 N ATOM 1416 CA LYS A 92 -16.353 8.831 3.671 1.00 0.00 C ATOM 1417 C LYS A 92 -16.535 7.855 2.517 1.00 0.00 C ATOM 1418 O LYS A 92 -16.225 6.686 2.709 1.00 0.00 O ATOM 1419 CB LYS A 92 -17.700 9.180 4.311 1.00 0.00 C ATOM 1420 CG LYS A 92 -17.527 9.748 5.728 1.00 0.00 C ATOM 1421 CD LYS A 92 -18.879 10.047 6.384 1.00 0.00 C ATOM 1422 CE LYS A 92 -19.591 11.219 5.707 1.00 0.00 C ATOM 1423 NZ LYS A 92 -20.970 11.363 6.206 1.00 0.00 N ATOM 0 H LYS A 92 -16.108 10.902 3.476 1.00 0.00 H new ATOM 0 HA LYS A 92 -15.743 8.345 4.433 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -18.221 9.908 3.689 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -18.326 8.288 4.350 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -16.974 9.036 6.341 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -16.933 10.661 5.685 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -19.511 9.160 6.335 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -18.729 10.273 7.440 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.037 12.140 5.890 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -19.606 11.065 4.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -21.429 12.165 5.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -21.503 10.492 6.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -20.952 11.533 7.232 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.983 8.279 1.332 1.00 0.00 N ATOM 1438 CA GLU A 93 -17.157 7.319 0.243 1.00 0.00 C ATOM 1439 C GLU A 93 -15.859 6.638 -0.178 1.00 0.00 C ATOM 1440 O GLU A 93 -15.936 5.489 -0.606 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.841 7.935 -0.983 1.00 0.00 C ATOM 1442 CG GLU A 93 -19.340 7.630 -0.900 1.00 0.00 C ATOM 1443 CD GLU A 93 -20.112 8.157 -2.105 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -20.482 9.354 -2.080 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -20.412 7.364 -3.030 1.00 0.00 O ATOM 0 H GLU A 93 -17.224 9.244 1.108 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.813 6.553 0.657 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -17.673 9.012 -1.011 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -17.420 7.523 -1.900 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -19.484 6.552 -0.823 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.747 8.072 0.010 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.696 7.278 -0.020 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.409 6.608 -0.217 1.00 0.00 C ATOM 1454 C ASN A 94 -13.249 5.525 0.841 1.00 0.00 C ATOM 1455 O ASN A 94 -12.895 4.399 0.491 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.182 7.528 -0.115 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.071 8.622 -1.162 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -12.998 8.891 -1.918 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -10.946 9.314 -1.192 1.00 0.00 N ATOM 0 H ASN A 94 -14.621 8.260 0.244 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.437 6.217 -1.234 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.187 7.996 0.869 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.286 6.910 -0.170 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.839 10.085 -1.851 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.184 9.077 -0.556 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.517 5.837 2.121 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.446 4.823 3.184 1.00 0.00 C ATOM 1468 C ILE A 95 -14.357 3.638 2.808 1.00 0.00 C ATOM 1469 O ILE A 95 -13.899 2.492 2.861 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.778 5.386 4.598 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.601 6.159 5.234 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -14.100 4.227 5.573 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -12.426 7.585 4.702 1.00 0.00 C ATOM 0 H ILE A 95 -13.781 6.769 2.440 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.413 4.481 3.255 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.623 6.058 4.451 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.750 6.201 6.313 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.680 5.603 5.061 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -14.330 4.633 6.558 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.958 3.667 5.202 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.238 3.564 5.647 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -11.579 8.058 5.200 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.244 7.553 3.628 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.330 8.161 4.900 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.629 3.904 2.467 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.590 2.872 2.083 1.00 0.00 C ATOM 1487 C ILE A 96 -15.994 2.086 0.922 1.00 0.00 C ATOM 1488 O ILE A 96 -15.857 0.877 1.041 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.998 3.438 1.747 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.847 3.757 2.999 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.840 2.433 0.938 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.600 5.138 3.591 1.00 0.00 C ATOM 0 H ILE A 96 -16.015 4.848 2.452 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.760 2.213 2.934 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.785 4.347 1.185 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.902 3.670 2.740 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.643 3.006 3.762 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.817 2.866 0.723 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.331 2.203 0.002 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -18.968 1.518 1.516 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -19.236 5.278 4.465 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.554 5.226 3.885 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.833 5.900 2.847 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.657 2.743 -0.189 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.222 2.096 -1.417 1.00 0.00 C ATOM 1506 C ALA A 97 -14.026 1.194 -1.151 1.00 0.00 C ATOM 1507 O ALA A 97 -14.004 0.052 -1.602 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.852 3.155 -2.452 1.00 0.00 C ATOM 0 H ALA A 97 -15.681 3.760 -0.256 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.039 1.484 -1.799 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.526 2.668 -3.371 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.721 3.779 -2.661 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.044 3.776 -2.065 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.020 1.700 -0.434 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.822 0.946 -0.118 1.00 0.00 C ATOM 1516 C ALA A 98 -12.200 -0.306 0.680 1.00 0.00 C ATOM 1517 O ALA A 98 -11.751 -1.401 0.341 1.00 0.00 O ATOM 1518 CB ALA A 98 -10.828 1.859 0.607 1.00 0.00 C ATOM 0 H ALA A 98 -13.021 2.648 -0.059 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.327 0.597 -1.024 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -9.926 1.297 0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.571 2.701 -0.036 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.279 2.230 1.527 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.050 -0.179 1.707 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.508 -1.344 2.455 1.00 0.00 C ATOM 1526 C ALA A 99 -14.363 -2.294 1.600 1.00 0.00 C ATOM 1527 O ALA A 99 -14.225 -3.510 1.734 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.268 -0.883 3.698 1.00 0.00 C ATOM 0 H ALA A 99 -13.428 0.711 2.032 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.631 -1.916 2.758 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.611 -1.753 4.258 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.609 -0.284 4.326 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.127 -0.283 3.398 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.231 -1.772 0.732 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.108 -2.525 -0.161 1.00 0.00 C ATOM 1536 C GLN A 100 -15.267 -3.389 -1.095 1.00 0.00 C ATOM 1537 O GLN A 100 -15.448 -4.608 -1.156 1.00 0.00 O ATOM 1538 CB GLN A 100 -16.974 -1.567 -1.001 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.110 -0.886 -0.235 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.405 -1.679 -0.285 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.127 -1.656 -1.282 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.764 -2.360 0.779 1.00 0.00 N ATOM 0 H GLN A 100 -15.346 -0.764 0.629 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.760 -3.156 0.443 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.330 -0.797 -1.427 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.401 -2.123 -1.836 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.812 -0.749 0.804 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.280 0.107 -0.651 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.162 -2.375 1.602 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.645 -2.874 0.782 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.333 -2.756 -1.808 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.401 -3.398 -2.717 1.00 0.00 C ATOM 1553 C ALA A 101 -12.458 -4.366 -1.994 1.00 0.00 C ATOM 1554 O ALA A 101 -11.797 -5.162 -2.653 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.617 -2.309 -3.452 1.00 0.00 C ATOM 0 H ALA A 101 -14.206 -1.745 -1.761 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.962 -4.002 -3.430 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.910 -2.772 -4.141 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.308 -1.678 -4.011 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -12.074 -1.701 -2.729 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.408 -4.336 -0.659 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.677 -5.303 0.138 1.00 0.00 C ATOM 1563 C GLY A 102 -10.221 -4.904 0.350 1.00 0.00 C ATOM 1564 O GLY A 102 -9.377 -5.788 0.546 1.00 0.00 O ATOM 0 H GLY A 102 -12.884 -3.626 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.165 -5.414 1.107 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.716 -6.276 -0.351 1.00 0.00 H new ATOM 1568 N ALA A 103 -9.911 -3.602 0.308 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.558 -3.117 0.532 1.00 0.00 C ATOM 1570 C ALA A 103 -8.128 -3.535 1.946 1.00 0.00 C ATOM 1571 O ALA A 103 -8.960 -3.603 2.857 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.481 -1.582 0.407 1.00 0.00 C ATOM 0 H ALA A 103 -10.591 -2.866 0.119 1.00 0.00 H new ATOM 0 HA ALA A 103 -7.898 -3.546 -0.222 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.456 -1.254 0.580 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.794 -1.282 -0.593 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.139 -1.123 1.145 1.00 0.00 H new ATOM 1578 N SER A 104 -6.830 -3.715 2.167 1.00 0.00 N ATOM 1579 CA SER A 104 -6.253 -3.984 3.478 1.00 0.00 C ATOM 1580 C SER A 104 -6.625 -2.917 4.502 1.00 0.00 C ATOM 1581 O SER A 104 -6.845 -3.232 5.675 1.00 0.00 O ATOM 1582 CB SER A 104 -4.739 -4.045 3.319 1.00 0.00 C ATOM 1583 OG SER A 104 -4.421 -5.177 2.557 1.00 0.00 O ATOM 0 H SER A 104 -6.134 -3.677 1.422 1.00 0.00 H new ATOM 0 HA SER A 104 -6.649 -4.929 3.850 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.372 -3.143 2.830 1.00 0.00 H new ATOM 0 HB3 SER A 104 -4.257 -4.097 4.295 1.00 0.00 H new ATOM 0 HG SER A 104 -4.595 -5.985 3.083 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.736 -1.663 4.075 1.00 0.00 N ATOM 1590 CA GLY A 105 -7.166 -0.574 4.921 1.00 0.00 C ATOM 1591 C GLY A 105 -7.030 0.747 4.190 1.00 0.00 C ATOM 1592 O GLY A 105 -6.580 0.775 3.040 1.00 0.00 O ATOM 0 H GLY A 105 -6.525 -1.379 3.118 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -8.203 -0.726 5.222 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -6.569 -0.556 5.833 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.408 1.814 4.890 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.408 3.179 4.407 1.00 0.00 C ATOM 1598 C TYR A 106 -6.738 4.050 5.465 1.00 0.00 C ATOM 1599 O TYR A 106 -7.360 4.452 6.450 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.847 3.592 4.061 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.922 4.841 3.215 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.555 4.779 1.860 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.325 6.066 3.773 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.546 5.942 1.077 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.407 7.213 2.965 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.007 7.160 1.615 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.035 8.275 0.840 1.00 0.00 O ATOM 0 H TYR A 106 -7.736 1.739 5.853 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.837 3.297 3.486 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.336 2.773 3.532 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -9.404 3.753 4.984 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.279 3.832 1.420 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.572 6.126 4.823 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.185 5.904 0.060 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -9.778 8.138 3.380 1.00 0.00 H new ATOM 0 HH TYR A 106 -8.835 9.061 1.390 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.429 4.249 5.339 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.685 5.211 6.136 1.00 0.00 C ATOM 1619 C VAL A 107 -4.877 6.580 5.486 1.00 0.00 C ATOM 1620 O VAL A 107 -4.770 6.717 4.267 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.204 4.793 6.195 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.320 5.886 6.802 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -3.031 3.514 7.026 1.00 0.00 C ATOM 0 H VAL A 107 -4.851 3.739 4.671 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.042 5.252 7.165 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.893 4.619 5.165 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.284 5.546 6.823 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.393 6.790 6.198 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.652 6.100 7.818 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.977 3.238 7.054 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.387 3.689 8.041 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.606 2.706 6.574 1.00 0.00 H new ATOM 1633 N VAL A 108 -5.105 7.592 6.319 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.227 8.984 5.919 1.00 0.00 C ATOM 1635 C VAL A 108 -4.250 9.767 6.793 1.00 0.00 C ATOM 1636 O VAL A 108 -4.056 9.416 7.962 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.683 9.461 6.088 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.866 10.871 5.524 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.669 8.535 5.365 1.00 0.00 C ATOM 0 H VAL A 108 -5.213 7.457 7.324 1.00 0.00 H new ATOM 0 HA VAL A 108 -4.984 9.133 4.867 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.888 9.451 7.158 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.902 11.184 5.656 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.208 11.562 6.051 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.618 10.873 4.462 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.685 8.903 5.507 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.436 8.515 4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.588 7.528 5.773 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.611 10.807 6.256 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.743 11.670 7.060 1.00 0.00 C ATOM 1651 C LYS A 109 -3.541 12.345 8.195 1.00 0.00 C ATOM 1652 O LYS A 109 -4.757 12.525 8.054 1.00 0.00 O ATOM 1653 CB LYS A 109 -1.982 12.645 6.140 1.00 0.00 C ATOM 1654 CG LYS A 109 -2.710 13.962 5.801 1.00 0.00 C ATOM 1655 CD LYS A 109 -2.124 15.134 6.599 1.00 0.00 C ATOM 1656 CE LYS A 109 -2.766 16.456 6.178 1.00 0.00 C ATOM 1657 NZ LYS A 109 -2.017 17.611 6.712 1.00 0.00 N ATOM 0 H LYS A 109 -3.677 11.072 5.273 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.982 11.076 7.567 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.030 12.890 6.611 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.753 12.129 5.208 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -2.624 14.165 4.734 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -3.773 13.862 6.022 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.285 14.970 7.665 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -1.046 15.183 6.443 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.802 16.515 5.090 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.796 16.492 6.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.477 18.493 6.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.004 17.566 7.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.041 17.588 6.352 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.901 12.783 9.292 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.530 12.476 9.662 1.00 0.00 C ATOM 1673 C PRO A 110 -1.437 11.015 10.111 1.00 0.00 C ATOM 1674 O PRO A 110 -2.292 10.525 10.856 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.204 13.444 10.802 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.544 13.660 11.495 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.533 13.578 10.333 1.00 0.00 C ATOM 0 HA PRO A 110 -0.826 12.592 8.838 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.465 13.023 11.484 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.794 14.381 10.425 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.739 12.897 12.249 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.589 14.625 11.999 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.468 13.119 10.654 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.777 14.574 9.963 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.392 10.313 9.673 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.174 8.920 10.038 1.00 0.00 C ATOM 1687 C PHE A 111 1.300 8.676 10.321 1.00 0.00 C ATOM 1688 O PHE A 111 2.171 9.373 9.796 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.685 7.988 8.933 1.00 0.00 C ATOM 1690 CG PHE A 111 0.077 8.052 7.625 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.283 7.343 7.474 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.442 8.777 6.540 1.00 0.00 C ATOM 1693 CE1 PHE A 111 1.986 7.405 6.262 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.261 8.841 5.329 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.486 8.166 5.197 1.00 0.00 C ATOM 0 H PHE A 111 0.324 10.696 9.056 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.736 8.702 10.946 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.654 6.963 9.302 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.731 8.224 8.737 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.667 6.751 8.291 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.388 9.288 6.639 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.915 6.865 6.149 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.138 9.407 4.500 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.043 8.234 4.274 1.00 0.00 H new ATOM 1705 N THR A 112 1.572 7.663 11.126 1.00 0.00 N ATOM 1706 CA THR A 112 2.887 7.310 11.630 1.00 0.00 C ATOM 1707 C THR A 112 2.981 5.820 11.911 1.00 0.00 C ATOM 1708 O THR A 112 2.067 5.060 11.570 1.00 0.00 O ATOM 1709 CB THR A 112 3.223 8.182 12.854 1.00 0.00 C ATOM 1710 OG1 THR A 112 2.098 8.408 13.686 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.892 9.483 12.466 1.00 0.00 C ATOM 0 H THR A 112 0.844 7.033 11.462 1.00 0.00 H new ATOM 0 HA THR A 112 3.640 7.516 10.869 1.00 0.00 H new ATOM 0 HB THR A 112 3.943 7.610 13.440 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.362 8.964 14.449 1.00 0.00 H new ATOM 0 HG21 THR A 112 4.109 10.062 13.363 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.821 9.271 11.938 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.228 10.054 11.817 1.00 0.00 H new ATOM 1719 N ALA A 113 4.091 5.403 12.528 1.00 0.00 N ATOM 1720 CA ALA A 113 4.344 4.036 12.926 1.00 0.00 C ATOM 1721 C ALA A 113 3.183 3.500 13.771 1.00 0.00 C ATOM 1722 O ALA A 113 2.894 2.312 13.697 1.00 0.00 O ATOM 1723 CB ALA A 113 5.692 3.946 13.645 1.00 0.00 C ATOM 0 H ALA A 113 4.855 6.036 12.767 1.00 0.00 H new ATOM 0 HA ALA A 113 4.405 3.400 12.043 1.00 0.00 H new ATOM 0 HB1 ALA A 113 5.877 2.914 13.943 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.485 4.278 12.975 1.00 0.00 H new ATOM 0 HB3 ALA A 113 5.675 4.581 14.530 1.00 0.00 H new ATOM 1729 N ALA A 114 2.456 4.379 14.475 1.00 0.00 N ATOM 1730 CA ALA A 114 1.291 4.012 15.270 1.00 0.00 C ATOM 1731 C ALA A 114 0.170 3.389 14.432 1.00 0.00 C ATOM 1732 O ALA A 114 -0.470 2.455 14.907 1.00 0.00 O ATOM 1733 CB ALA A 114 0.758 5.240 16.017 1.00 0.00 C ATOM 0 H ALA A 114 2.669 5.376 14.504 1.00 0.00 H new ATOM 0 HA ALA A 114 1.620 3.253 15.980 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -0.113 4.957 16.609 1.00 0.00 H new ATOM 0 HB2 ALA A 114 1.534 5.630 16.676 1.00 0.00 H new ATOM 0 HB3 ALA A 114 0.474 6.008 15.298 1.00 0.00 H new ATOM 1739 N THR A 115 -0.098 3.875 13.216 1.00 0.00 N ATOM 1740 CA THR A 115 -1.059 3.200 12.349 1.00 0.00 C ATOM 1741 C THR A 115 -0.350 2.082 11.584 1.00 0.00 C ATOM 1742 O THR A 115 -0.959 1.044 11.356 1.00 0.00 O ATOM 1743 CB THR A 115 -1.813 4.198 11.445 1.00 0.00 C ATOM 1744 OG1 THR A 115 -3.137 3.754 11.207 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.177 4.441 10.076 1.00 0.00 C ATOM 0 H THR A 115 0.327 4.713 12.820 1.00 0.00 H new ATOM 0 HA THR A 115 -1.838 2.735 12.954 1.00 0.00 H new ATOM 0 HB THR A 115 -1.778 5.134 12.003 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.600 4.400 10.634 1.00 0.00 H new ATOM 0 HG21 THR A 115 -1.780 5.156 9.516 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.171 4.839 10.208 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.126 3.501 9.527 1.00 0.00 H new ATOM 1753 N LEU A 116 0.926 2.268 11.211 1.00 0.00 N ATOM 1754 CA LEU A 116 1.702 1.304 10.435 1.00 0.00 C ATOM 1755 C LEU A 116 1.627 -0.053 11.141 1.00 0.00 C ATOM 1756 O LEU A 116 1.163 -1.017 10.537 1.00 0.00 O ATOM 1757 CB LEU A 116 3.143 1.836 10.264 1.00 0.00 C ATOM 1758 CG LEU A 116 4.059 1.222 9.184 1.00 0.00 C ATOM 1759 CD1 LEU A 116 4.242 -0.280 9.350 1.00 0.00 C ATOM 1760 CD2 LEU A 116 3.625 1.529 7.744 1.00 0.00 C ATOM 0 H LEU A 116 1.451 3.110 11.448 1.00 0.00 H new ATOM 0 HA LEU A 116 1.301 1.169 9.431 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.074 2.905 10.064 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.648 1.723 11.223 1.00 0.00 H new ATOM 0 HG LEU A 116 5.017 1.715 9.348 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.895 -0.656 8.563 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.689 -0.487 10.322 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.273 -0.774 9.284 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.321 1.062 7.047 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.623 1.136 7.575 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.623 2.608 7.587 1.00 0.00 H new ATOM 1772 N GLU A 117 2.013 -0.121 12.417 1.00 0.00 N ATOM 1773 CA GLU A 117 2.021 -1.343 13.220 1.00 0.00 C ATOM 1774 C GLU A 117 0.621 -1.931 13.406 1.00 0.00 C ATOM 1775 O GLU A 117 0.439 -3.142 13.301 1.00 0.00 O ATOM 1776 CB GLU A 117 2.719 -1.072 14.562 1.00 0.00 C ATOM 1777 CG GLU A 117 2.036 -0.067 15.508 1.00 0.00 C ATOM 1778 CD GLU A 117 1.399 -0.723 16.731 1.00 0.00 C ATOM 1779 OE1 GLU A 117 2.130 -1.361 17.525 1.00 0.00 O ATOM 1780 OE2 GLU A 117 0.197 -0.508 16.995 1.00 0.00 O ATOM 0 H GLU A 117 2.338 0.696 12.934 1.00 0.00 H new ATOM 0 HA GLU A 117 2.586 -2.103 12.680 1.00 0.00 H new ATOM 0 HB2 GLU A 117 2.821 -2.020 15.090 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.727 -0.713 14.354 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.771 0.666 15.840 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.270 0.477 14.956 1.00 0.00 H new ATOM 1787 N GLU A 118 -0.381 -1.089 13.645 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.733 -1.546 13.908 1.00 0.00 C ATOM 1789 C GLU A 118 -2.335 -2.166 12.639 1.00 0.00 C ATOM 1790 O GLU A 118 -2.948 -3.236 12.685 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.552 -0.354 14.418 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.943 -0.793 14.883 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.796 0.387 15.336 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -4.913 1.379 14.591 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -5.485 0.281 16.379 1.00 0.00 O ATOM 0 H GLU A 118 -0.274 -0.075 13.661 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.739 -2.324 14.671 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -2.025 0.126 15.243 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.649 0.389 13.626 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.449 -1.314 14.070 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.843 -1.503 15.704 1.00 0.00 H new ATOM 1802 N LYS A 119 -2.164 -1.504 11.489 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.598 -2.007 10.190 1.00 0.00 C ATOM 1804 C LYS A 119 -1.803 -3.269 9.823 1.00 0.00 C ATOM 1805 O LYS A 119 -2.414 -4.198 9.289 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.443 -0.927 9.106 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.289 0.353 9.267 1.00 0.00 C ATOM 1808 CD LYS A 119 -4.800 0.169 9.075 1.00 0.00 C ATOM 1809 CE LYS A 119 -5.516 1.513 8.842 1.00 0.00 C ATOM 1810 NZ LYS A 119 -5.379 2.477 9.960 1.00 0.00 N ATOM 0 H LYS A 119 -1.713 -0.591 11.439 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.655 -2.267 10.252 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.393 -0.636 9.065 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.687 -1.376 8.143 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.113 0.762 10.262 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.936 1.095 8.550 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.981 -0.491 8.226 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -5.221 -0.319 9.954 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.122 1.969 7.934 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.575 1.322 8.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -5.901 3.347 9.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.765 2.057 10.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.374 2.704 10.102 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.495 -3.325 10.134 1.00 0.00 N ATOM 1825 CA LEU A 120 0.330 -4.519 9.943 1.00 0.00 C ATOM 1826 C LEU A 120 -0.328 -5.672 10.675 1.00 0.00 C ATOM 1827 O LEU A 120 -0.690 -6.649 10.031 1.00 0.00 O ATOM 1828 CB LEU A 120 1.785 -4.393 10.456 1.00 0.00 C ATOM 1829 CG LEU A 120 2.811 -3.672 9.574 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.180 -3.648 10.267 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.968 -4.297 8.192 1.00 0.00 C ATOM 0 H LEU A 120 0.017 -2.535 10.527 1.00 0.00 H new ATOM 0 HA LEU A 120 0.396 -4.675 8.866 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.755 -3.879 11.417 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.159 -5.400 10.644 1.00 0.00 H new ATOM 0 HG LEU A 120 2.430 -2.661 9.433 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.901 -3.134 9.631 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.097 -3.124 11.219 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.516 -4.670 10.444 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.709 -3.737 7.621 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.296 -5.331 8.296 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.012 -4.270 7.670 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.501 -5.570 11.997 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.034 -6.689 12.766 1.00 0.00 C ATOM 1845 C ASN A 121 -2.425 -7.095 12.285 1.00 0.00 C ATOM 1846 O ASN A 121 -2.739 -8.286 12.266 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.060 -6.394 14.261 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.491 -7.656 14.999 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -0.847 -8.697 14.893 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -2.577 -7.630 15.742 1.00 0.00 N ATOM 0 H ASN A 121 -0.283 -4.738 12.545 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.356 -7.526 12.599 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.075 -6.075 14.601 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.750 -5.577 14.473 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -2.882 -8.473 16.228 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -3.113 -6.767 15.831 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.240 -6.123 11.853 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.503 -6.365 11.158 1.00 0.00 C ATOM 1859 C LYS A 122 -4.279 -7.381 10.041 1.00 0.00 C ATOM 1860 O LYS A 122 -4.774 -8.498 10.150 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.102 -5.035 10.653 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.531 -4.768 11.149 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.879 -3.274 11.024 1.00 0.00 C ATOM 1864 CE LYS A 122 -6.184 -2.422 12.098 1.00 0.00 C ATOM 1865 NZ LYS A 122 -6.824 -2.572 13.423 1.00 0.00 N ATOM 0 H LYS A 122 -3.033 -5.132 11.981 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.235 -6.790 11.844 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.459 -4.214 10.970 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.101 -5.038 9.563 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.239 -5.361 10.570 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -6.626 -5.083 12.188 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.589 -2.917 10.036 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -7.959 -3.147 11.105 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.135 -2.710 12.167 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -6.207 -1.374 11.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.569 -1.763 14.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.857 -2.606 13.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -6.496 -3.452 13.869 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.550 -7.033 8.978 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.412 -7.942 7.833 1.00 0.00 C ATOM 1881 C ILE A 123 -2.542 -9.175 8.113 1.00 0.00 C ATOM 1882 O ILE A 123 -2.730 -10.216 7.472 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.972 -7.190 6.560 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.679 -6.357 6.743 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.175 -6.378 6.048 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.511 -5.171 5.784 1.00 0.00 C ATOM 0 H ILE A 123 -3.054 -6.147 8.884 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.410 -8.341 7.653 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.682 -7.912 5.797 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.653 -5.980 7.766 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.822 -7.020 6.626 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.891 -5.835 5.146 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.999 -7.054 5.820 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.488 -5.669 6.814 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.574 -4.658 6.000 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.498 -5.533 4.756 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.342 -4.478 5.914 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.635 -9.094 9.085 1.00 0.00 N ATOM 1899 CA PHE A 124 -0.849 -10.222 9.543 1.00 0.00 C ATOM 1900 C PHE A 124 -1.782 -11.326 10.006 1.00 0.00 C ATOM 1901 O PHE A 124 -1.800 -12.397 9.406 1.00 0.00 O ATOM 1902 CB PHE A 124 0.086 -9.811 10.680 1.00 0.00 C ATOM 1903 CG PHE A 124 1.313 -8.972 10.362 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.745 -8.720 9.041 1.00 0.00 C ATOM 1905 CD2 PHE A 124 2.085 -8.501 11.438 1.00 0.00 C ATOM 1906 CE1 PHE A 124 2.968 -8.066 8.810 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.290 -7.821 11.205 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.743 -7.623 9.894 1.00 0.00 C ATOM 0 H PHE A 124 -1.428 -8.226 9.580 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.235 -10.582 8.718 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.507 -9.261 11.411 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.429 -10.723 11.169 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.134 -9.031 8.206 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.748 -8.664 12.451 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.311 -7.904 7.799 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.869 -7.450 12.037 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.688 -7.130 9.717 1.00 0.00 H new ATOM 1918 N GLU A 125 -2.564 -11.085 11.056 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.435 -12.125 11.585 1.00 0.00 C ATOM 1920 C GLU A 125 -4.560 -12.386 10.581 1.00 0.00 C ATOM 1921 O GLU A 125 -4.749 -13.521 10.143 1.00 0.00 O ATOM 1922 CB GLU A 125 -3.967 -11.753 12.977 1.00 0.00 C ATOM 1923 CG GLU A 125 -2.842 -11.435 13.974 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.372 -11.250 15.397 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -3.889 -10.156 15.729 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -3.251 -12.201 16.205 1.00 0.00 O ATOM 0 H GLU A 125 -2.611 -10.193 11.549 1.00 0.00 H new ATOM 0 HA GLU A 125 -2.868 -13.047 11.718 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.626 -10.889 12.891 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -4.568 -12.576 13.364 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.109 -12.241 13.962 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -2.324 -10.529 13.659 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.295 -11.336 10.194 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.574 -11.458 9.511 1.00 0.00 C ATOM 1935 C LYS A 126 -6.448 -12.217 8.197 1.00 0.00 C ATOM 1936 O LYS A 126 -7.244 -13.121 7.954 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.152 -10.058 9.303 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.610 -10.098 8.860 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.124 -8.683 8.599 1.00 0.00 C ATOM 1940 CE LYS A 126 -8.813 -8.222 7.169 1.00 0.00 C ATOM 1941 NZ LYS A 126 -9.985 -7.636 6.488 1.00 0.00 N ATOM 0 H LYS A 126 -5.009 -10.370 10.352 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.255 -12.043 10.129 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.071 -9.492 10.231 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.561 -9.530 8.555 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.706 -10.700 7.956 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.217 -10.577 9.628 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -10.201 -8.650 8.766 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.670 -7.994 9.311 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -8.009 -7.486 7.196 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.449 -9.071 6.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -9.717 -7.342 5.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.745 -8.344 6.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -10.319 -6.809 7.022 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.526 -11.793 7.328 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.280 -12.434 6.044 1.00 0.00 C ATOM 1957 C LEU A 127 -4.336 -13.617 6.242 1.00 0.00 C ATOM 1958 O LEU A 127 -4.608 -14.711 5.736 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.663 -11.459 5.022 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.143 -10.001 5.058 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.540 -9.215 3.896 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.660 -9.882 5.036 1.00 0.00 C ATOM 0 H LEU A 127 -4.926 -10.987 7.503 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.239 -12.770 5.651 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.582 -11.461 5.164 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.854 -11.852 4.023 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.801 -9.579 6.003 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.889 -8.183 3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.453 -9.233 3.970 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.847 -9.667 2.953 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.943 -8.830 5.063 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.048 -10.339 4.125 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.078 -10.392 5.904 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.243 -13.397 6.980 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.114 -14.308 7.102 1.00 0.00 C ATOM 1976 C GLY A 128 -0.789 -13.665 6.688 1.00 0.00 C ATOM 1977 O GLY A 128 0.137 -14.405 6.337 1.00 0.00 O ATOM 0 H GLY A 128 -3.122 -12.545 7.527 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.040 -14.652 8.134 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -2.294 -15.188 6.485 1.00 0.00 H new ATOM 1981 N MET A 129 -0.672 -12.329 6.647 1.00 0.00 N ATOM 1982 CA MET A 129 0.521 -11.671 6.104 1.00 0.00 C ATOM 1983 C MET A 129 1.653 -11.566 7.120 1.00 0.00 C ATOM 1984 O MET A 129 1.584 -12.137 8.233 1.00 0.00 O ATOM 1985 CB MET A 129 0.151 -10.310 5.497 1.00 0.00 C ATOM 1986 CG MET A 129 -0.627 -10.467 4.182 1.00 0.00 C ATOM 1987 SD MET A 129 0.182 -11.398 2.838 1.00 0.00 S ATOM 1988 CE MET A 129 1.843 -10.668 2.778 1.00 0.00 C ATOM 1989 OXT MET A 129 2.678 -10.948 6.780 1.00 0.00 O ATOM 0 H MET A 129 -1.389 -11.686 6.983 1.00 0.00 H new ATOM 0 HA MET A 129 0.910 -12.302 5.305 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.449 -9.745 6.210 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.058 -9.733 5.316 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.575 -10.955 4.407 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.862 -9.471 3.808 1.00 0.00 H new ATOM 0 HE1 MET A 129 2.312 -10.909 1.824 1.00 0.00 H new ATOM 0 HE2 MET A 129 1.769 -9.586 2.882 1.00 0.00 H new ATOM 0 HE3 MET A 129 2.447 -11.070 3.591 1.00 0.00 H new