USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 570 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 123 MET CE :methyl -121:sc= -4.52! (180deg=-5.04!) USER MOD Set 1.2: A 125 ASN : amide:sc= -0.855 K(o=-5.4,f=-6.6!) USER MOD Single : A 81 HIS : no HD1:sc= -7.22! C(o=-7.2!,f=-6.2!) USER MOD Single : A 85 SER OG : rot -108:sc= -0.514 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.138 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 56:sc= 0.0118 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -0.0979 K(o=-0.098,f=-1.6) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -0.558 K(o=-0.56,f=-4.1!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0878 USER MOD Single : A 116 CYS SG : rot -126:sc= -4.05! USER MOD Single : A 121 MET CE :methyl 178:sc= -3.25! (180deg=-3.3!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl 151:sc= -0.248 (180deg=-0.93) USER MOD Single : A 126 GLN : amide:sc= -5.82! K(o=-5.8!,f=-3.3) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= -0.011 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 160:sc= -0.0313 USER MOD Single : A 144 GLN : amide:sc= -0.826 X(o=-0.83,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 46 N GLY A 80 11.645 10.626 -1.733 1.00 0.00 N ATOM 47 CA GLY A 80 11.478 9.263 -2.198 1.00 0.00 C ATOM 48 C GLY A 80 10.320 9.115 -3.165 1.00 0.00 C ATOM 49 O GLY A 80 10.212 9.868 -4.133 1.00 0.00 O ATOM 0 HA2 GLY A 80 12.397 8.934 -2.684 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.318 8.608 -1.342 1.00 0.00 H new ATOM 53 N HIS A 81 9.452 8.144 -2.903 1.00 0.00 N ATOM 54 CA HIS A 81 8.296 7.899 -3.759 1.00 0.00 C ATOM 55 C HIS A 81 7.047 7.641 -2.923 1.00 0.00 C ATOM 56 O HIS A 81 7.084 6.890 -1.948 1.00 0.00 O ATOM 57 CB HIS A 81 8.557 6.709 -4.688 1.00 0.00 C ATOM 58 CG HIS A 81 9.865 6.025 -4.440 1.00 0.00 C ATOM 59 ND1 HIS A 81 11.083 6.664 -4.550 1.00 0.00 N ATOM 60 CD2 HIS A 81 10.144 4.748 -4.082 1.00 0.00 C ATOM 61 CE1 HIS A 81 12.052 5.811 -4.273 1.00 0.00 C ATOM 62 NE2 HIS A 81 11.509 4.642 -3.986 1.00 0.00 N ATOM 0 H HIS A 81 9.527 7.513 -2.105 1.00 0.00 H new ATOM 0 HA HIS A 81 8.132 8.790 -4.364 1.00 0.00 H new ATOM 0 HB2 HIS A 81 7.751 5.985 -4.571 1.00 0.00 H new ATOM 0 HB3 HIS A 81 8.528 7.054 -5.722 1.00 0.00 H new ATOM 0 HD2 HIS A 81 9.426 3.961 -3.905 1.00 0.00 H new ATOM 0 HE1 HIS A 81 13.109 6.032 -4.280 1.00 0.00 H new ATOM 0 HE2 HIS A 81 12.021 3.797 -3.734 1.00 0.00 H new ATOM 71 N ILE A 82 5.941 8.265 -3.313 1.00 0.00 N ATOM 72 CA ILE A 82 4.680 8.101 -2.600 1.00 0.00 C ATOM 73 C ILE A 82 3.633 7.431 -3.482 1.00 0.00 C ATOM 74 O ILE A 82 3.410 7.844 -4.621 1.00 0.00 O ATOM 75 CB ILE A 82 4.132 9.454 -2.107 1.00 0.00 C ATOM 76 CG1 ILE A 82 5.231 10.239 -1.385 1.00 0.00 C ATOM 77 CG2 ILE A 82 2.932 9.238 -1.196 1.00 0.00 C ATOM 78 CD1 ILE A 82 4.703 11.248 -0.388 1.00 0.00 C ATOM 0 H ILE A 82 5.892 8.889 -4.119 1.00 0.00 H new ATOM 0 HA ILE A 82 4.885 7.466 -1.738 1.00 0.00 H new ATOM 0 HB ILE A 82 3.805 10.037 -2.968 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.886 9.538 -0.867 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.841 10.757 -2.125 1.00 0.00 H new ATOM 0 HG21 ILE A 82 2.555 10.203 -0.855 1.00 0.00 H new ATOM 0 HG22 ILE A 82 2.148 8.716 -1.744 1.00 0.00 H new ATOM 0 HG23 ILE A 82 3.232 8.641 -0.335 1.00 0.00 H new ATOM 0 HD11 ILE A 82 5.539 11.765 0.084 1.00 0.00 H new ATOM 0 HD12 ILE A 82 4.072 11.972 -0.903 1.00 0.00 H new ATOM 0 HD13 ILE A 82 4.117 10.734 0.374 1.00 0.00 H new ATOM 90 N VAL A 83 2.993 6.396 -2.951 1.00 0.00 N ATOM 91 CA VAL A 83 1.970 5.667 -3.690 1.00 0.00 C ATOM 92 C VAL A 83 0.571 6.095 -3.257 1.00 0.00 C ATOM 93 O VAL A 83 0.139 5.802 -2.141 1.00 0.00 O ATOM 94 CB VAL A 83 2.112 4.146 -3.495 1.00 0.00 C ATOM 95 CG1 VAL A 83 1.271 3.395 -4.516 1.00 0.00 C ATOM 96 CG2 VAL A 83 3.574 3.731 -3.589 1.00 0.00 C ATOM 0 H VAL A 83 3.165 6.042 -2.010 1.00 0.00 H new ATOM 0 HA VAL A 83 2.111 5.905 -4.744 1.00 0.00 H new ATOM 0 HB VAL A 83 1.747 3.890 -2.500 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.384 2.322 -4.362 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.223 3.670 -4.397 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.602 3.654 -5.522 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.656 2.653 -3.449 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.966 4.000 -4.570 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.148 4.242 -2.816 1.00 0.00 H new ATOM 106 N ARG A 84 -0.133 6.789 -4.145 1.00 0.00 N ATOM 107 CA ARG A 84 -1.483 7.257 -3.852 1.00 0.00 C ATOM 108 C ARG A 84 -2.527 6.285 -4.393 1.00 0.00 C ATOM 109 O ARG A 84 -2.451 5.851 -5.543 1.00 0.00 O ATOM 110 CB ARG A 84 -1.705 8.647 -4.452 1.00 0.00 C ATOM 111 CG ARG A 84 -1.890 9.736 -3.407 1.00 0.00 C ATOM 112 CD ARG A 84 -2.184 11.081 -4.050 1.00 0.00 C ATOM 113 NE ARG A 84 -0.961 11.800 -4.398 1.00 0.00 N ATOM 114 CZ ARG A 84 -0.306 11.625 -5.540 1.00 0.00 C ATOM 115 NH1 ARG A 84 -0.757 10.764 -6.441 1.00 0.00 N ATOM 116 NH2 ARG A 84 0.802 12.313 -5.783 1.00 0.00 N ATOM 0 H ARG A 84 0.208 7.040 -5.073 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.593 7.314 -2.769 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.854 8.901 -5.084 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -2.584 8.620 -5.096 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.707 9.465 -2.738 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -0.990 9.812 -2.796 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -2.784 10.930 -4.948 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -2.779 11.687 -3.367 1.00 0.00 H new ATOM 0 HE ARG A 84 -0.590 12.473 -3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -1.609 10.234 -6.258 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -0.252 10.631 -7.317 1.00 0.00 H new ATOM 0 HH21 ARG A 84 1.152 12.977 -5.092 1.00 0.00 H new ATOM 0 HH22 ARG A 84 1.304 12.178 -6.660 1.00 0.00 H new ATOM 130 N SER A 85 -3.502 5.947 -3.555 1.00 0.00 N ATOM 131 CA SER A 85 -4.563 5.026 -3.945 1.00 0.00 C ATOM 132 C SER A 85 -5.215 5.468 -5.252 1.00 0.00 C ATOM 133 O SER A 85 -5.622 6.620 -5.397 1.00 0.00 O ATOM 134 CB SER A 85 -5.617 4.932 -2.841 1.00 0.00 C ATOM 135 OG SER A 85 -6.833 5.539 -3.243 1.00 0.00 O ATOM 0 H SER A 85 -3.579 6.298 -2.600 1.00 0.00 H new ATOM 0 HA SER A 85 -4.118 4.043 -4.097 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.794 3.886 -2.591 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.246 5.417 -1.938 1.00 0.00 H new ATOM 0 HG SER A 85 -6.958 6.377 -2.751 1.00 0.00 H new ATOM 141 N PRO A 86 -5.321 4.548 -6.223 1.00 0.00 N ATOM 142 CA PRO A 86 -5.924 4.835 -7.526 1.00 0.00 C ATOM 143 C PRO A 86 -7.447 4.883 -7.461 1.00 0.00 C ATOM 144 O PRO A 86 -8.093 5.512 -8.300 1.00 0.00 O ATOM 145 CB PRO A 86 -5.463 3.658 -8.384 1.00 0.00 C ATOM 146 CG PRO A 86 -5.303 2.533 -7.421 1.00 0.00 C ATOM 147 CD PRO A 86 -4.855 3.152 -6.121 1.00 0.00 C ATOM 0 HA PRO A 86 -5.627 5.810 -7.913 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -6.195 3.419 -9.155 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.525 3.881 -8.893 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.242 1.994 -7.292 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -4.569 1.813 -7.782 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -5.295 2.644 -5.263 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -3.773 3.098 -6.003 1.00 0.00 H new ATOM 155 N MET A 87 -8.013 4.213 -6.463 1.00 0.00 N ATOM 156 CA MET A 87 -9.461 4.179 -6.293 1.00 0.00 C ATOM 157 C MET A 87 -9.841 4.181 -4.816 1.00 0.00 C ATOM 158 O MET A 87 -9.010 4.454 -3.950 1.00 0.00 O ATOM 159 CB MET A 87 -10.045 2.942 -6.977 1.00 0.00 C ATOM 160 CG MET A 87 -10.938 3.268 -8.162 1.00 0.00 C ATOM 161 SD MET A 87 -10.360 2.517 -9.695 1.00 0.00 S ATOM 162 CE MET A 87 -10.814 0.806 -9.425 1.00 0.00 C ATOM 0 H MET A 87 -7.492 3.687 -5.761 1.00 0.00 H new ATOM 0 HA MET A 87 -9.875 5.075 -6.755 1.00 0.00 H new ATOM 0 HB2 MET A 87 -9.228 2.303 -7.313 1.00 0.00 H new ATOM 0 HB3 MET A 87 -10.618 2.370 -6.247 1.00 0.00 H new ATOM 0 HG2 MET A 87 -11.951 2.925 -7.953 1.00 0.00 H new ATOM 0 HG3 MET A 87 -10.987 4.350 -8.288 1.00 0.00 H new ATOM 0 HE1 MET A 87 -10.521 0.211 -10.290 1.00 0.00 H new ATOM 0 HE2 MET A 87 -10.306 0.430 -8.537 1.00 0.00 H new ATOM 0 HE3 MET A 87 -11.892 0.734 -9.284 1.00 0.00 H new ATOM 172 N VAL A 88 -11.105 3.875 -4.537 1.00 0.00 N ATOM 173 CA VAL A 88 -11.600 3.841 -3.167 1.00 0.00 C ATOM 174 C VAL A 88 -11.852 2.409 -2.709 1.00 0.00 C ATOM 175 O VAL A 88 -12.324 1.574 -3.480 1.00 0.00 O ATOM 176 CB VAL A 88 -12.902 4.652 -3.023 1.00 0.00 C ATOM 177 CG1 VAL A 88 -13.559 4.380 -1.677 1.00 0.00 C ATOM 178 CG2 VAL A 88 -12.629 6.137 -3.200 1.00 0.00 C ATOM 0 H VAL A 88 -11.805 3.647 -5.243 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.829 4.289 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 88 -13.591 4.336 -3.806 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -14.477 4.962 -1.596 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -13.794 3.319 -1.595 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -12.877 4.664 -0.875 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -13.560 6.693 -3.095 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -11.920 6.470 -2.442 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -12.210 6.314 -4.191 1.00 0.00 H new ATOM 188 N GLY A 89 -11.534 2.132 -1.448 1.00 0.00 N ATOM 189 CA GLY A 89 -11.733 0.801 -0.907 1.00 0.00 C ATOM 190 C GLY A 89 -11.453 0.732 0.581 1.00 0.00 C ATOM 191 O GLY A 89 -12.070 1.448 1.370 1.00 0.00 O ATOM 0 H GLY A 89 -11.142 2.807 -0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -12.759 0.485 -1.095 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -11.083 0.099 -1.429 1.00 0.00 H new ATOM 195 N THR A 90 -10.520 -0.132 0.966 1.00 0.00 N ATOM 196 CA THR A 90 -10.159 -0.293 2.369 1.00 0.00 C ATOM 197 C THR A 90 -8.709 -0.748 2.508 1.00 0.00 C ATOM 198 O THR A 90 -8.375 -1.892 2.197 1.00 0.00 O ATOM 199 CB THR A 90 -11.089 -1.301 3.044 1.00 0.00 C ATOM 200 OG1 THR A 90 -12.445 -0.944 2.843 1.00 0.00 O ATOM 201 CG2 THR A 90 -10.863 -1.419 4.536 1.00 0.00 C ATOM 0 H THR A 90 -10.000 -0.732 0.325 1.00 0.00 H new ATOM 0 HA THR A 90 -10.266 0.674 2.860 1.00 0.00 H new ATOM 0 HB THR A 90 -10.859 -2.261 2.581 1.00 0.00 H new ATOM 0 HG1 THR A 90 -13.025 -1.602 3.281 1.00 0.00 H new ATOM 0 HG21 THR A 90 -11.556 -2.151 4.952 1.00 0.00 H new ATOM 0 HG22 THR A 90 -9.839 -1.741 4.725 1.00 0.00 H new ATOM 0 HG23 THR A 90 -11.032 -0.451 5.007 1.00 0.00 H new ATOM 209 N PHE A 91 -7.853 0.154 2.977 1.00 0.00 N ATOM 210 CA PHE A 91 -6.439 -0.155 3.156 1.00 0.00 C ATOM 211 C PHE A 91 -6.246 -1.225 4.226 1.00 0.00 C ATOM 212 O PHE A 91 -7.173 -1.547 4.970 1.00 0.00 O ATOM 213 CB PHE A 91 -5.665 1.108 3.536 1.00 0.00 C ATOM 214 CG PHE A 91 -4.176 0.959 3.413 1.00 0.00 C ATOM 215 CD1 PHE A 91 -3.607 0.487 2.235 1.00 0.00 C ATOM 216 CD2 PHE A 91 -3.340 1.292 4.474 1.00 0.00 C ATOM 217 CE1 PHE A 91 -2.232 0.349 2.118 1.00 0.00 C ATOM 218 CE2 PHE A 91 -1.966 1.155 4.363 1.00 0.00 C ATOM 219 CZ PHE A 91 -1.411 0.683 3.184 1.00 0.00 C ATOM 0 H PHE A 91 -8.114 1.104 3.240 1.00 0.00 H new ATOM 0 HA PHE A 91 -6.054 -0.539 2.211 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.993 1.931 2.901 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.911 1.380 4.562 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -4.243 0.225 1.402 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.767 1.661 5.395 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.802 -0.018 1.198 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -1.328 1.416 5.194 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.340 0.575 3.096 1.00 0.00 H new ATOM 229 N TYR A 92 -5.037 -1.774 4.296 1.00 0.00 N ATOM 230 CA TYR A 92 -4.724 -2.809 5.275 1.00 0.00 C ATOM 231 C TYR A 92 -3.219 -3.049 5.356 1.00 0.00 C ATOM 232 O TYR A 92 -2.473 -2.689 4.444 1.00 0.00 O ATOM 233 CB TYR A 92 -5.434 -4.111 4.909 1.00 0.00 C ATOM 234 CG TYR A 92 -6.892 -4.146 5.310 1.00 0.00 C ATOM 235 CD1 TYR A 92 -7.316 -3.603 6.521 1.00 0.00 C ATOM 236 CD2 TYR A 92 -7.847 -4.724 4.475 1.00 0.00 C ATOM 237 CE1 TYR A 92 -8.651 -3.636 6.890 1.00 0.00 C ATOM 238 CE2 TYR A 92 -9.185 -4.761 4.837 1.00 0.00 C ATOM 239 CZ TYR A 92 -9.581 -4.215 6.045 1.00 0.00 C ATOM 240 OH TYR A 92 -10.908 -4.250 6.408 1.00 0.00 O ATOM 0 H TYR A 92 -4.259 -1.520 3.687 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.073 -2.468 6.250 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -5.359 -4.264 3.832 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -4.916 -4.943 5.386 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -6.593 -3.149 7.182 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -7.540 -5.150 3.531 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -8.964 -3.212 7.833 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -9.913 -5.213 4.180 1.00 0.00 H new ATOM 0 HH TYR A 92 -11.428 -4.690 5.703 1.00 0.00 H new ATOM 250 N ARG A 93 -2.779 -3.664 6.450 1.00 0.00 N ATOM 251 CA ARG A 93 -1.362 -3.957 6.646 1.00 0.00 C ATOM 252 C ARG A 93 -1.133 -5.455 6.803 1.00 0.00 C ATOM 253 O ARG A 93 -0.043 -5.958 6.526 1.00 0.00 O ATOM 254 CB ARG A 93 -0.826 -3.231 7.879 1.00 0.00 C ATOM 255 CG ARG A 93 -1.492 -1.890 8.133 1.00 0.00 C ATOM 256 CD ARG A 93 -0.470 -0.807 8.441 1.00 0.00 C ATOM 257 NE ARG A 93 -0.651 -0.245 9.777 1.00 0.00 N ATOM 258 CZ ARG A 93 0.028 0.803 10.231 1.00 0.00 C ATOM 259 NH1 ARG A 93 0.927 1.399 9.460 1.00 0.00 N ATOM 260 NH2 ARG A 93 -0.193 1.257 11.457 1.00 0.00 N ATOM 0 H ARG A 93 -3.382 -3.969 7.214 1.00 0.00 H new ATOM 0 HA ARG A 93 -0.828 -3.607 5.763 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.964 -3.867 8.753 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.247 -3.078 7.762 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -2.076 -1.602 7.259 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -2.189 -1.981 8.966 1.00 0.00 H new ATOM 0 HD2 ARG A 93 0.534 -1.222 8.356 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -0.550 -0.012 7.700 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.336 -0.681 10.395 1.00 0.00 H new ATOM 0 HH11 ARG A 93 1.099 1.053 8.516 1.00 0.00 H new ATOM 0 HH12 ARG A 93 1.447 2.203 9.811 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -0.885 0.802 12.052 1.00 0.00 H new ATOM 0 HH22 ARG A 93 0.329 2.062 11.805 1.00 0.00 H new ATOM 274 N THR A 94 -2.161 -6.163 7.256 1.00 0.00 N ATOM 275 CA THR A 94 -2.062 -7.601 7.456 1.00 0.00 C ATOM 276 C THR A 94 -3.304 -8.310 6.941 1.00 0.00 C ATOM 277 O THR A 94 -4.283 -8.470 7.668 1.00 0.00 O ATOM 278 CB THR A 94 -1.868 -7.916 8.939 1.00 0.00 C ATOM 279 OG1 THR A 94 -2.661 -7.061 9.742 1.00 0.00 O ATOM 280 CG2 THR A 94 -0.434 -7.776 9.397 1.00 0.00 C ATOM 0 H THR A 94 -3.070 -5.764 7.491 1.00 0.00 H new ATOM 0 HA THR A 94 -1.200 -7.960 6.894 1.00 0.00 H new ATOM 0 HB THR A 94 -2.170 -8.957 9.055 1.00 0.00 H new ATOM 0 HG1 THR A 94 -3.599 -7.131 9.467 1.00 0.00 H new ATOM 0 HG21 THR A 94 -0.366 -8.014 10.459 1.00 0.00 H new ATOM 0 HG22 THR A 94 0.197 -8.461 8.831 1.00 0.00 H new ATOM 0 HG23 THR A 94 -0.098 -6.752 9.232 1.00 0.00 H new ATOM 288 N PRO A 95 -3.274 -8.755 5.677 1.00 0.00 N ATOM 289 CA PRO A 95 -4.398 -9.466 5.066 1.00 0.00 C ATOM 290 C PRO A 95 -4.783 -10.695 5.876 1.00 0.00 C ATOM 291 O PRO A 95 -4.810 -10.645 7.104 1.00 0.00 O ATOM 292 CB PRO A 95 -3.871 -9.855 3.681 1.00 0.00 C ATOM 293 CG PRO A 95 -2.754 -8.906 3.414 1.00 0.00 C ATOM 294 CD PRO A 95 -2.140 -8.608 4.752 1.00 0.00 C ATOM 0 HA PRO A 95 -5.302 -8.860 5.018 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.523 -10.888 3.667 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -4.651 -9.770 2.924 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -2.021 -9.345 2.737 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -3.120 -7.995 2.940 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -1.333 -9.302 4.989 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.718 -7.604 4.788 1.00 0.00 H new ATOM 349 N LYS A 100 1.697 -13.051 6.884 1.00 0.00 N ATOM 350 CA LYS A 100 2.969 -12.576 7.415 1.00 0.00 C ATOM 351 C LYS A 100 3.070 -11.057 7.301 1.00 0.00 C ATOM 352 O LYS A 100 4.160 -10.506 7.152 1.00 0.00 O ATOM 353 CB LYS A 100 4.134 -13.232 6.672 1.00 0.00 C ATOM 354 CG LYS A 100 5.049 -14.046 7.574 1.00 0.00 C ATOM 355 CD LYS A 100 6.402 -14.286 6.923 1.00 0.00 C ATOM 356 CE LYS A 100 7.535 -14.143 7.926 1.00 0.00 C ATOM 357 NZ LYS A 100 8.857 -14.001 7.254 1.00 0.00 N ATOM 0 HA LYS A 100 3.020 -12.850 8.469 1.00 0.00 H new ATOM 0 HB2 LYS A 100 3.737 -13.880 5.891 1.00 0.00 H new ATOM 0 HB3 LYS A 100 4.720 -12.458 6.177 1.00 0.00 H new ATOM 0 HG2 LYS A 100 5.187 -13.524 8.521 1.00 0.00 H new ATOM 0 HG3 LYS A 100 4.579 -15.003 7.803 1.00 0.00 H new ATOM 0 HD2 LYS A 100 6.425 -15.284 6.486 1.00 0.00 H new ATOM 0 HD3 LYS A 100 6.545 -13.578 6.107 1.00 0.00 H new ATOM 0 HE2 LYS A 100 7.353 -13.273 8.557 1.00 0.00 H new ATOM 0 HE3 LYS A 100 7.552 -15.014 8.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 9.603 -13.906 7.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 9.042 -14.842 6.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 8.850 -13.155 6.649 1.00 0.00 H new ATOM 371 N ALA A 101 1.924 -10.388 7.373 1.00 0.00 N ATOM 372 CA ALA A 101 1.880 -8.934 7.278 1.00 0.00 C ATOM 373 C ALA A 101 2.460 -8.451 5.954 1.00 0.00 C ATOM 374 O ALA A 101 3.487 -8.950 5.494 1.00 0.00 O ATOM 375 CB ALA A 101 2.627 -8.308 8.444 1.00 0.00 C ATOM 0 H ALA A 101 1.013 -10.830 7.497 1.00 0.00 H new ATOM 0 HA ALA A 101 0.836 -8.623 7.320 1.00 0.00 H new ATOM 0 HB1 ALA A 101 2.587 -7.222 8.361 1.00 0.00 H new ATOM 0 HB2 ALA A 101 2.164 -8.618 9.381 1.00 0.00 H new ATOM 0 HB3 ALA A 101 3.667 -8.635 8.427 1.00 0.00 H new ATOM 381 N PHE A 102 1.794 -7.476 5.345 1.00 0.00 N ATOM 382 CA PHE A 102 2.241 -6.921 4.073 1.00 0.00 C ATOM 383 C PHE A 102 3.468 -6.037 4.269 1.00 0.00 C ATOM 384 O PHE A 102 4.086 -6.044 5.334 1.00 0.00 O ATOM 385 CB PHE A 102 1.114 -6.118 3.421 1.00 0.00 C ATOM 386 CG PHE A 102 0.414 -6.857 2.317 1.00 0.00 C ATOM 387 CD1 PHE A 102 1.141 -7.559 1.363 1.00 0.00 C ATOM 388 CD2 PHE A 102 -0.974 -6.848 2.229 1.00 0.00 C ATOM 389 CE1 PHE A 102 0.498 -8.242 0.342 1.00 0.00 C ATOM 390 CE2 PHE A 102 -1.623 -7.529 1.211 1.00 0.00 C ATOM 391 CZ PHE A 102 -0.887 -8.226 0.267 1.00 0.00 C ATOM 0 H PHE A 102 0.942 -7.053 5.712 1.00 0.00 H new ATOM 0 HA PHE A 102 2.514 -7.748 3.417 1.00 0.00 H new ATOM 0 HB2 PHE A 102 0.385 -5.845 4.184 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.523 -5.189 3.023 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.220 -7.573 1.418 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -1.552 -6.305 2.962 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.074 -8.785 -0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -2.701 -7.516 1.154 1.00 0.00 H new ATOM 0 HZ PHE A 102 -1.391 -8.757 -0.527 1.00 0.00 H new ATOM 401 N ILE A 103 3.817 -5.276 3.236 1.00 0.00 N ATOM 402 CA ILE A 103 4.971 -4.388 3.299 1.00 0.00 C ATOM 403 C ILE A 103 4.727 -3.238 4.269 1.00 0.00 C ATOM 404 O ILE A 103 4.191 -2.196 3.891 1.00 0.00 O ATOM 405 CB ILE A 103 5.311 -3.811 1.912 1.00 0.00 C ATOM 406 CG1 ILE A 103 5.232 -4.904 0.846 1.00 0.00 C ATOM 407 CG2 ILE A 103 6.696 -3.178 1.927 1.00 0.00 C ATOM 408 CD1 ILE A 103 5.975 -6.167 1.219 1.00 0.00 C ATOM 0 H ILE A 103 3.317 -5.257 2.347 1.00 0.00 H new ATOM 0 HA ILE A 103 5.811 -4.986 3.652 1.00 0.00 H new ATOM 0 HB ILE A 103 4.581 -3.039 1.668 1.00 0.00 H new ATOM 0 HG12 ILE A 103 4.185 -5.148 0.665 1.00 0.00 H new ATOM 0 HG13 ILE A 103 5.636 -4.517 -0.090 1.00 0.00 H new ATOM 0 HG21 ILE A 103 6.922 -2.775 0.940 1.00 0.00 H new ATOM 0 HG22 ILE A 103 6.720 -2.374 2.662 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.438 -3.932 2.190 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.876 -6.898 0.417 1.00 0.00 H new ATOM 0 HD12 ILE A 103 7.029 -5.937 1.372 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.556 -6.578 2.138 1.00 0.00 H new ATOM 420 N GLU A 104 5.124 -3.432 5.523 1.00 0.00 N ATOM 421 CA GLU A 104 4.950 -2.410 6.548 1.00 0.00 C ATOM 422 C GLU A 104 6.150 -1.470 6.590 1.00 0.00 C ATOM 423 O GLU A 104 7.066 -1.580 5.775 1.00 0.00 O ATOM 424 CB GLU A 104 4.747 -3.059 7.916 1.00 0.00 C ATOM 425 CG GLU A 104 3.355 -2.849 8.488 1.00 0.00 C ATOM 426 CD GLU A 104 3.345 -1.883 9.656 1.00 0.00 C ATOM 427 OE1 GLU A 104 3.613 -2.324 10.794 1.00 0.00 O ATOM 428 OE2 GLU A 104 3.070 -0.685 9.434 1.00 0.00 O ATOM 0 H GLU A 104 5.569 -4.288 5.853 1.00 0.00 H new ATOM 0 HA GLU A 104 4.064 -1.827 6.296 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.939 -4.129 7.834 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.482 -2.656 8.613 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.697 -2.473 7.705 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.950 -3.808 8.811 1.00 0.00 H new ATOM 435 N VAL A 105 6.139 -0.544 7.544 1.00 0.00 N ATOM 436 CA VAL A 105 7.228 0.414 7.691 1.00 0.00 C ATOM 437 C VAL A 105 8.561 -0.297 7.896 1.00 0.00 C ATOM 438 O VAL A 105 8.602 -1.452 8.322 1.00 0.00 O ATOM 439 CB VAL A 105 6.981 1.368 8.874 1.00 0.00 C ATOM 440 CG1 VAL A 105 8.069 2.429 8.940 1.00 0.00 C ATOM 441 CG2 VAL A 105 5.606 2.009 8.765 1.00 0.00 C ATOM 0 H VAL A 105 5.388 -0.437 8.226 1.00 0.00 H new ATOM 0 HA VAL A 105 7.266 0.994 6.769 1.00 0.00 H new ATOM 0 HB VAL A 105 7.014 0.789 9.797 1.00 0.00 H new ATOM 0 HG11 VAL A 105 7.878 3.094 9.782 1.00 0.00 H new ATOM 0 HG12 VAL A 105 9.039 1.948 9.070 1.00 0.00 H new ATOM 0 HG13 VAL A 105 8.071 3.006 8.015 1.00 0.00 H new ATOM 0 HG21 VAL A 105 5.449 2.680 9.610 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.541 2.575 7.835 1.00 0.00 H new ATOM 0 HG23 VAL A 105 4.841 1.233 8.772 1.00 0.00 H new ATOM 451 N GLY A 106 9.651 0.400 7.591 1.00 0.00 N ATOM 452 CA GLY A 106 10.971 -0.182 7.748 1.00 0.00 C ATOM 453 C GLY A 106 11.124 -1.483 6.987 1.00 0.00 C ATOM 454 O GLY A 106 12.044 -2.259 7.247 1.00 0.00 O ATOM 0 H GLY A 106 9.644 1.357 7.238 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.722 0.528 7.402 1.00 0.00 H new ATOM 0 HA3 GLY A 106 11.163 -0.359 8.806 1.00 0.00 H new ATOM 458 N GLN A 107 10.219 -1.724 6.043 1.00 0.00 N ATOM 459 CA GLN A 107 10.256 -2.941 5.241 1.00 0.00 C ATOM 460 C GLN A 107 11.036 -2.711 3.949 1.00 0.00 C ATOM 461 O GLN A 107 11.254 -1.570 3.540 1.00 0.00 O ATOM 462 CB GLN A 107 8.835 -3.406 4.919 1.00 0.00 C ATOM 463 CG GLN A 107 8.779 -4.725 4.166 1.00 0.00 C ATOM 464 CD GLN A 107 9.222 -5.900 5.016 1.00 0.00 C ATOM 465 OE1 GLN A 107 9.424 -5.767 6.223 1.00 0.00 O ATOM 466 NE2 GLN A 107 9.375 -7.059 4.388 1.00 0.00 N ATOM 0 H GLN A 107 9.451 -1.092 5.815 1.00 0.00 H new ATOM 0 HA GLN A 107 10.761 -3.716 5.818 1.00 0.00 H new ATOM 0 HB2 GLN A 107 8.275 -3.505 5.849 1.00 0.00 H new ATOM 0 HB3 GLN A 107 8.337 -2.638 4.327 1.00 0.00 H new ATOM 0 HG2 GLN A 107 7.761 -4.897 3.817 1.00 0.00 H new ATOM 0 HG3 GLN A 107 9.413 -4.662 3.281 1.00 0.00 H new ATOM 0 HE21 GLN A 107 9.196 -7.124 3.386 1.00 0.00 H new ATOM 0 HE22 GLN A 107 9.671 -7.885 4.907 1.00 0.00 H new ATOM 475 N LYS A 108 11.457 -3.800 3.307 1.00 0.00 N ATOM 476 CA LYS A 108 12.212 -3.706 2.062 1.00 0.00 C ATOM 477 C LYS A 108 11.433 -4.323 0.905 1.00 0.00 C ATOM 478 O LYS A 108 11.017 -5.480 0.971 1.00 0.00 O ATOM 479 CB LYS A 108 13.567 -4.400 2.209 1.00 0.00 C ATOM 480 CG LYS A 108 13.495 -5.725 2.949 1.00 0.00 C ATOM 481 CD LYS A 108 13.455 -5.519 4.455 1.00 0.00 C ATOM 482 CE LYS A 108 14.839 -5.641 5.070 1.00 0.00 C ATOM 483 NZ LYS A 108 15.179 -7.054 5.397 1.00 0.00 N ATOM 0 H LYS A 108 11.288 -4.753 3.628 1.00 0.00 H new ATOM 0 HA LYS A 108 12.375 -2.651 1.844 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.988 -4.569 1.218 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.251 -3.735 2.737 1.00 0.00 H new ATOM 0 HG2 LYS A 108 12.608 -6.273 2.632 1.00 0.00 H new ATOM 0 HG3 LYS A 108 14.358 -6.337 2.687 1.00 0.00 H new ATOM 0 HD2 LYS A 108 13.042 -4.535 4.678 1.00 0.00 H new ATOM 0 HD3 LYS A 108 12.789 -6.254 4.906 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.580 -5.240 4.379 1.00 0.00 H new ATOM 0 HE3 LYS A 108 14.888 -5.037 5.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 16.131 -7.094 5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 14.487 -7.429 6.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 15.157 -7.626 4.529 1.00 0.00 H new ATOM 497 N VAL A 109 11.241 -3.543 -0.154 1.00 0.00 N ATOM 498 CA VAL A 109 10.513 -4.013 -1.325 1.00 0.00 C ATOM 499 C VAL A 109 11.290 -3.726 -2.604 1.00 0.00 C ATOM 500 O VAL A 109 11.917 -2.675 -2.740 1.00 0.00 O ATOM 501 CB VAL A 109 9.125 -3.356 -1.424 1.00 0.00 C ATOM 502 CG1 VAL A 109 8.071 -4.229 -0.762 1.00 0.00 C ATOM 503 CG2 VAL A 109 9.146 -1.968 -0.802 1.00 0.00 C ATOM 0 H VAL A 109 11.580 -2.583 -0.224 1.00 0.00 H new ATOM 0 HA VAL A 109 10.389 -5.090 -1.210 1.00 0.00 H new ATOM 0 HB VAL A 109 8.867 -3.253 -2.478 1.00 0.00 H new ATOM 0 HG11 VAL A 109 7.097 -3.747 -0.843 1.00 0.00 H new ATOM 0 HG12 VAL A 109 8.038 -5.199 -1.258 1.00 0.00 H new ATOM 0 HG13 VAL A 109 8.321 -4.367 0.290 1.00 0.00 H new ATOM 0 HG21 VAL A 109 8.156 -1.519 -0.881 1.00 0.00 H new ATOM 0 HG22 VAL A 109 9.427 -2.044 0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 109 9.870 -1.345 -1.327 1.00 0.00 H new ATOM 513 N ASN A 110 11.247 -4.668 -3.542 1.00 0.00 N ATOM 514 CA ASN A 110 11.948 -4.515 -4.811 1.00 0.00 C ATOM 515 C ASN A 110 10.982 -4.643 -5.985 1.00 0.00 C ATOM 516 O ASN A 110 10.056 -5.453 -5.954 1.00 0.00 O ATOM 517 CB ASN A 110 13.059 -5.560 -4.932 1.00 0.00 C ATOM 518 CG ASN A 110 12.617 -6.931 -4.461 1.00 0.00 C ATOM 519 OD1 ASN A 110 12.110 -7.085 -3.349 1.00 0.00 O ATOM 520 ND2 ASN A 110 12.808 -7.938 -5.306 1.00 0.00 N ATOM 0 H ASN A 110 10.734 -5.544 -3.446 1.00 0.00 H new ATOM 0 HA ASN A 110 12.391 -3.519 -4.836 1.00 0.00 H new ATOM 0 HB2 ASN A 110 13.383 -5.623 -5.971 1.00 0.00 H new ATOM 0 HB3 ASN A 110 13.921 -5.239 -4.348 1.00 0.00 H new ATOM 0 HD21 ASN A 110 12.531 -8.884 -5.043 1.00 0.00 H new ATOM 0 HD22 ASN A 110 13.232 -7.765 -6.218 1.00 0.00 H new ATOM 527 N VAL A 111 11.205 -3.838 -7.019 1.00 0.00 N ATOM 528 CA VAL A 111 10.354 -3.861 -8.202 1.00 0.00 C ATOM 529 C VAL A 111 9.914 -5.282 -8.535 1.00 0.00 C ATOM 530 O VAL A 111 10.697 -6.081 -9.050 1.00 0.00 O ATOM 531 CB VAL A 111 11.073 -3.260 -9.424 1.00 0.00 C ATOM 532 CG1 VAL A 111 10.244 -3.456 -10.683 1.00 0.00 C ATOM 533 CG2 VAL A 111 11.368 -1.785 -9.196 1.00 0.00 C ATOM 0 H VAL A 111 11.968 -3.162 -7.061 1.00 0.00 H new ATOM 0 HA VAL A 111 9.477 -3.256 -7.972 1.00 0.00 H new ATOM 0 HB VAL A 111 12.021 -3.782 -9.557 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.769 -3.025 -11.535 1.00 0.00 H new ATOM 0 HG12 VAL A 111 10.088 -4.521 -10.854 1.00 0.00 H new ATOM 0 HG13 VAL A 111 9.279 -2.963 -10.564 1.00 0.00 H new ATOM 0 HG21 VAL A 111 11.876 -1.376 -10.069 1.00 0.00 H new ATOM 0 HG22 VAL A 111 10.433 -1.248 -9.036 1.00 0.00 H new ATOM 0 HG23 VAL A 111 12.006 -1.673 -8.319 1.00 0.00 H new ATOM 543 N GLY A 112 8.657 -5.591 -8.237 1.00 0.00 N ATOM 544 CA GLY A 112 8.134 -6.916 -8.511 1.00 0.00 C ATOM 545 C GLY A 112 7.595 -7.595 -7.267 1.00 0.00 C ATOM 546 O GLY A 112 7.032 -8.687 -7.342 1.00 0.00 O ATOM 0 H GLY A 112 7.991 -4.947 -7.810 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.340 -6.843 -9.254 1.00 0.00 H new ATOM 0 HA3 GLY A 112 8.922 -7.532 -8.945 1.00 0.00 H new ATOM 550 N ASP A 113 7.768 -6.946 -6.120 1.00 0.00 N ATOM 551 CA ASP A 113 7.295 -7.492 -4.854 1.00 0.00 C ATOM 552 C ASP A 113 5.894 -6.986 -4.531 1.00 0.00 C ATOM 553 O ASP A 113 5.467 -5.946 -5.033 1.00 0.00 O ATOM 554 CB ASP A 113 8.257 -7.120 -3.726 1.00 0.00 C ATOM 555 CG ASP A 113 8.988 -8.325 -3.168 1.00 0.00 C ATOM 556 OD1 ASP A 113 9.728 -8.978 -3.935 1.00 0.00 O ATOM 557 OD2 ASP A 113 8.823 -8.615 -1.964 1.00 0.00 O ATOM 0 H ASP A 113 8.232 -6.041 -6.042 1.00 0.00 H new ATOM 0 HA ASP A 113 7.255 -8.577 -4.947 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.984 -6.397 -4.096 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.702 -6.632 -2.925 1.00 0.00 H new ATOM 562 N THR A 114 5.181 -7.729 -3.690 1.00 0.00 N ATOM 563 CA THR A 114 3.827 -7.356 -3.300 1.00 0.00 C ATOM 564 C THR A 114 3.834 -6.076 -2.469 1.00 0.00 C ATOM 565 O THR A 114 4.889 -5.605 -2.046 1.00 0.00 O ATOM 566 CB THR A 114 3.171 -8.488 -2.508 1.00 0.00 C ATOM 567 OG1 THR A 114 3.911 -9.688 -2.643 1.00 0.00 O ATOM 568 CG2 THR A 114 1.748 -8.775 -2.938 1.00 0.00 C ATOM 0 H THR A 114 5.519 -8.593 -3.266 1.00 0.00 H new ATOM 0 HA THR A 114 3.251 -7.176 -4.208 1.00 0.00 H new ATOM 0 HB THR A 114 3.158 -8.146 -1.473 1.00 0.00 H new ATOM 0 HG1 THR A 114 3.477 -10.400 -2.128 1.00 0.00 H new ATOM 0 HG21 THR A 114 1.343 -9.588 -2.336 1.00 0.00 H new ATOM 0 HG22 THR A 114 1.139 -7.882 -2.799 1.00 0.00 H new ATOM 0 HG23 THR A 114 1.736 -9.062 -3.990 1.00 0.00 H new ATOM 576 N LEU A 115 2.649 -5.519 -2.240 1.00 0.00 N ATOM 577 CA LEU A 115 2.518 -4.293 -1.461 1.00 0.00 C ATOM 578 C LEU A 115 1.368 -4.403 -0.465 1.00 0.00 C ATOM 579 O LEU A 115 1.586 -4.531 0.740 1.00 0.00 O ATOM 580 CB LEU A 115 2.295 -3.097 -2.388 1.00 0.00 C ATOM 581 CG LEU A 115 2.447 -1.726 -1.726 1.00 0.00 C ATOM 582 CD1 LEU A 115 3.790 -1.109 -2.084 1.00 0.00 C ATOM 583 CD2 LEU A 115 1.308 -0.807 -2.140 1.00 0.00 C ATOM 0 H LEU A 115 1.766 -5.897 -2.583 1.00 0.00 H new ATOM 0 HA LEU A 115 3.443 -4.144 -0.904 1.00 0.00 H new ATOM 0 HB2 LEU A 115 3.000 -3.163 -3.217 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.294 -3.169 -2.814 1.00 0.00 H new ATOM 0 HG LEU A 115 2.407 -1.857 -0.645 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.882 -0.134 -1.605 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.593 -1.760 -1.739 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.859 -0.990 -3.165 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.431 0.164 -1.660 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.318 -0.681 -3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.358 -1.245 -1.834 1.00 0.00 H new ATOM 595 N CYS A 116 0.142 -4.353 -0.976 1.00 0.00 N ATOM 596 CA CYS A 116 -1.043 -4.447 -0.131 1.00 0.00 C ATOM 597 C CYS A 116 -2.314 -4.458 -0.972 1.00 0.00 C ATOM 598 O CYS A 116 -2.291 -4.122 -2.156 1.00 0.00 O ATOM 599 CB CYS A 116 -1.083 -3.284 0.861 1.00 0.00 C ATOM 600 SG CYS A 116 -0.712 -3.754 2.566 1.00 0.00 S ATOM 0 H CYS A 116 -0.057 -4.248 -1.971 1.00 0.00 H new ATOM 0 HA CYS A 116 -0.988 -5.385 0.422 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -0.370 -2.524 0.542 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -2.072 -2.827 0.829 1.00 0.00 H new ATOM 0 HG CYS A 116 -1.673 -3.355 3.345 1.00 0.00 H new ATOM 606 N ILE A 117 -3.423 -4.847 -0.351 1.00 0.00 N ATOM 607 CA ILE A 117 -4.706 -4.901 -1.041 1.00 0.00 C ATOM 608 C ILE A 117 -5.582 -3.710 -0.669 1.00 0.00 C ATOM 609 O ILE A 117 -5.508 -3.195 0.447 1.00 0.00 O ATOM 610 CB ILE A 117 -5.470 -6.198 -0.709 1.00 0.00 C ATOM 611 CG1 ILE A 117 -4.737 -7.413 -1.278 1.00 0.00 C ATOM 612 CG2 ILE A 117 -6.887 -6.130 -1.255 1.00 0.00 C ATOM 613 CD1 ILE A 117 -4.536 -8.524 -0.271 1.00 0.00 C ATOM 0 H ILE A 117 -3.459 -5.129 0.629 1.00 0.00 H new ATOM 0 HA ILE A 117 -4.488 -4.875 -2.109 1.00 0.00 H new ATOM 0 HB ILE A 117 -5.519 -6.303 0.375 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -5.299 -7.801 -2.128 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -3.765 -7.096 -1.656 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.415 -7.053 -1.013 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -7.409 -5.285 -0.807 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -6.854 -6.004 -2.337 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -4.010 -9.353 -0.744 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -3.948 -8.152 0.568 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -5.505 -8.868 0.090 1.00 0.00 H new ATOM 625 N VAL A 118 -6.415 -3.278 -1.610 1.00 0.00 N ATOM 626 CA VAL A 118 -7.310 -2.152 -1.379 1.00 0.00 C ATOM 627 C VAL A 118 -8.655 -2.631 -0.842 1.00 0.00 C ATOM 628 O VAL A 118 -9.268 -1.976 -0.001 1.00 0.00 O ATOM 629 CB VAL A 118 -7.546 -1.341 -2.668 1.00 0.00 C ATOM 630 CG1 VAL A 118 -8.538 -0.217 -2.419 1.00 0.00 C ATOM 631 CG2 VAL A 118 -6.232 -0.793 -3.203 1.00 0.00 C ATOM 0 H VAL A 118 -6.488 -3.691 -2.540 1.00 0.00 H new ATOM 0 HA VAL A 118 -6.828 -1.509 -0.642 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.969 -2.007 -3.420 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.691 0.344 -3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -9.488 -0.637 -2.087 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -8.147 0.449 -1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -6.419 -0.223 -4.113 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -5.777 -0.143 -2.455 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.556 -1.619 -3.424 1.00 0.00 H new ATOM 641 N GLU A 119 -9.103 -3.781 -1.333 1.00 0.00 N ATOM 642 CA GLU A 119 -10.374 -4.356 -0.904 1.00 0.00 C ATOM 643 C GLU A 119 -11.547 -3.507 -1.386 1.00 0.00 C ATOM 644 O GLU A 119 -12.364 -3.050 -0.588 1.00 0.00 O ATOM 645 CB GLU A 119 -10.412 -4.482 0.621 1.00 0.00 C ATOM 646 CG GLU A 119 -11.576 -5.312 1.139 1.00 0.00 C ATOM 647 CD GLU A 119 -11.806 -5.128 2.625 1.00 0.00 C ATOM 648 OE1 GLU A 119 -12.073 -3.984 3.048 1.00 0.00 O ATOM 649 OE2 GLU A 119 -11.718 -6.129 3.368 1.00 0.00 O ATOM 0 H GLU A 119 -8.604 -4.335 -2.030 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.463 -5.348 -1.346 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.479 -4.929 0.963 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -10.466 -3.485 1.057 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -12.482 -5.038 0.598 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -11.387 -6.365 0.932 1.00 0.00 H new ATOM 656 N ALA A 120 -11.621 -3.303 -2.697 1.00 0.00 N ATOM 657 CA ALA A 120 -12.693 -2.510 -3.286 1.00 0.00 C ATOM 658 C ALA A 120 -13.748 -3.406 -3.928 1.00 0.00 C ATOM 659 O ALA A 120 -13.561 -3.903 -5.039 1.00 0.00 O ATOM 660 CB ALA A 120 -12.128 -1.540 -4.312 1.00 0.00 C ATOM 0 H ALA A 120 -10.952 -3.676 -3.371 1.00 0.00 H new ATOM 0 HA ALA A 120 -13.172 -1.941 -2.489 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -12.939 -0.954 -4.744 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -11.416 -0.872 -3.828 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -11.623 -2.098 -5.101 1.00 0.00 H new ATOM 666 N MET A 121 -14.854 -3.608 -3.219 1.00 0.00 N ATOM 667 CA MET A 121 -15.942 -4.445 -3.714 1.00 0.00 C ATOM 668 C MET A 121 -15.496 -5.901 -3.837 1.00 0.00 C ATOM 669 O MET A 121 -16.046 -6.665 -4.630 1.00 0.00 O ATOM 670 CB MET A 121 -16.449 -3.917 -5.065 1.00 0.00 C ATOM 671 CG MET A 121 -15.915 -4.670 -6.275 1.00 0.00 C ATOM 672 SD MET A 121 -15.689 -3.605 -7.711 1.00 0.00 S ATOM 673 CE MET A 121 -14.110 -2.851 -7.328 1.00 0.00 C ATOM 0 H MET A 121 -15.021 -3.203 -2.298 1.00 0.00 H new ATOM 0 HA MET A 121 -16.761 -4.404 -2.996 1.00 0.00 H new ATOM 0 HB2 MET A 121 -17.538 -3.965 -5.074 1.00 0.00 H new ATOM 0 HB3 MET A 121 -16.175 -2.866 -5.156 1.00 0.00 H new ATOM 0 HG2 MET A 121 -14.963 -5.134 -6.018 1.00 0.00 H new ATOM 0 HG3 MET A 121 -16.604 -5.476 -6.530 1.00 0.00 H new ATOM 0 HE1 MET A 121 -13.815 -2.190 -8.143 1.00 0.00 H new ATOM 0 HE2 MET A 121 -14.196 -2.275 -6.406 1.00 0.00 H new ATOM 0 HE3 MET A 121 -13.357 -3.629 -7.201 1.00 0.00 H new ATOM 683 N LYS A 122 -14.497 -6.277 -3.044 1.00 0.00 N ATOM 684 CA LYS A 122 -13.979 -7.640 -3.061 1.00 0.00 C ATOM 685 C LYS A 122 -13.219 -7.920 -4.354 1.00 0.00 C ATOM 686 O LYS A 122 -13.543 -8.856 -5.086 1.00 0.00 O ATOM 687 CB LYS A 122 -15.122 -8.643 -2.902 1.00 0.00 C ATOM 688 CG LYS A 122 -14.713 -9.924 -2.192 1.00 0.00 C ATOM 689 CD LYS A 122 -13.913 -9.631 -0.933 1.00 0.00 C ATOM 690 CE LYS A 122 -14.579 -8.560 -0.086 1.00 0.00 C ATOM 691 NZ LYS A 122 -14.271 -8.714 1.333 1.00 0.00 N ATOM 0 H LYS A 122 -14.031 -5.657 -2.382 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.288 -7.749 -2.225 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -15.933 -8.172 -2.346 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -15.515 -8.893 -3.888 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.603 -10.498 -1.934 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -14.120 -10.542 -2.866 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -13.806 -10.544 -0.348 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.908 -9.308 -1.206 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.252 -7.576 -0.423 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -15.659 -8.604 -0.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -14.745 -7.963 1.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -14.605 -9.642 1.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -13.243 -8.646 1.474 1.00 0.00 H new ATOM 702 N MET A 123 -12.206 -7.106 -4.627 1.00 0.00 N ATOM 703 CA MET A 123 -11.399 -7.268 -5.831 1.00 0.00 C ATOM 704 C MET A 123 -9.957 -7.619 -5.477 1.00 0.00 C ATOM 705 O MET A 123 -9.165 -7.985 -6.345 1.00 0.00 O ATOM 706 CB MET A 123 -11.438 -5.989 -6.672 1.00 0.00 C ATOM 707 CG MET A 123 -10.291 -5.873 -7.663 1.00 0.00 C ATOM 708 SD MET A 123 -8.886 -4.959 -6.997 1.00 0.00 S ATOM 709 CE MET A 123 -9.624 -3.351 -6.723 1.00 0.00 C ATOM 0 H MET A 123 -11.924 -6.327 -4.031 1.00 0.00 H new ATOM 0 HA MET A 123 -11.819 -8.088 -6.413 1.00 0.00 H new ATOM 0 HB2 MET A 123 -12.382 -5.951 -7.216 1.00 0.00 H new ATOM 0 HB3 MET A 123 -11.420 -5.126 -6.006 1.00 0.00 H new ATOM 0 HG2 MET A 123 -9.965 -6.872 -7.954 1.00 0.00 H new ATOM 0 HG3 MET A 123 -10.646 -5.378 -8.567 1.00 0.00 H new ATOM 0 HE1 MET A 123 -9.084 -2.600 -7.299 1.00 0.00 H new ATOM 0 HE2 MET A 123 -10.667 -3.371 -7.040 1.00 0.00 H new ATOM 0 HE3 MET A 123 -9.571 -3.102 -5.663 1.00 0.00 H new ATOM 719 N MET A 124 -9.623 -7.511 -4.194 1.00 0.00 N ATOM 720 CA MET A 124 -8.278 -7.820 -3.726 1.00 0.00 C ATOM 721 C MET A 124 -7.235 -7.013 -4.493 1.00 0.00 C ATOM 722 O MET A 124 -6.331 -7.576 -5.110 1.00 0.00 O ATOM 723 CB MET A 124 -7.994 -9.315 -3.877 1.00 0.00 C ATOM 724 CG MET A 124 -8.645 -10.169 -2.800 1.00 0.00 C ATOM 725 SD MET A 124 -10.299 -9.597 -2.365 1.00 0.00 S ATOM 726 CE MET A 124 -10.244 -9.726 -0.579 1.00 0.00 C ATOM 0 H MET A 124 -10.266 -7.212 -3.461 1.00 0.00 H new ATOM 0 HA MET A 124 -8.217 -7.550 -2.672 1.00 0.00 H new ATOM 0 HB2 MET A 124 -8.346 -9.646 -4.854 1.00 0.00 H new ATOM 0 HB3 MET A 124 -6.916 -9.476 -3.855 1.00 0.00 H new ATOM 0 HG2 MET A 124 -8.701 -11.201 -3.145 1.00 0.00 H new ATOM 0 HG3 MET A 124 -8.017 -10.164 -1.909 1.00 0.00 H new ATOM 0 HE1 MET A 124 -10.908 -8.982 -0.140 1.00 0.00 H new ATOM 0 HE2 MET A 124 -10.565 -10.723 -0.276 1.00 0.00 H new ATOM 0 HE3 MET A 124 -9.225 -9.552 -0.233 1.00 0.00 H new ATOM 736 N ASN A 125 -7.367 -5.691 -4.450 1.00 0.00 N ATOM 737 CA ASN A 125 -6.433 -4.808 -5.140 1.00 0.00 C ATOM 738 C ASN A 125 -5.041 -4.909 -4.526 1.00 0.00 C ATOM 739 O ASN A 125 -4.499 -3.923 -4.027 1.00 0.00 O ATOM 740 CB ASN A 125 -6.925 -3.361 -5.081 1.00 0.00 C ATOM 741 CG ASN A 125 -6.516 -2.562 -6.303 1.00 0.00 C ATOM 742 OD1 ASN A 125 -5.763 -3.043 -7.150 1.00 0.00 O ATOM 743 ND2 ASN A 125 -7.010 -1.333 -6.399 1.00 0.00 N ATOM 0 H ASN A 125 -8.110 -5.208 -3.945 1.00 0.00 H new ATOM 0 HA ASN A 125 -6.377 -5.121 -6.183 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -8.011 -3.353 -4.992 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -6.528 -2.881 -4.187 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -6.769 -0.747 -7.198 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -7.631 -0.975 -5.673 1.00 0.00 H new ATOM 750 N GLN A 126 -4.469 -6.107 -4.566 1.00 0.00 N ATOM 751 CA GLN A 126 -3.141 -6.340 -4.013 1.00 0.00 C ATOM 752 C GLN A 126 -2.066 -5.705 -4.889 1.00 0.00 C ATOM 753 O GLN A 126 -1.656 -6.276 -5.900 1.00 0.00 O ATOM 754 CB GLN A 126 -2.885 -7.842 -3.874 1.00 0.00 C ATOM 755 CG GLN A 126 -1.449 -8.186 -3.516 1.00 0.00 C ATOM 756 CD GLN A 126 -0.783 -9.065 -4.556 1.00 0.00 C ATOM 757 OE1 GLN A 126 -1.070 -10.259 -4.652 1.00 0.00 O ATOM 758 NE2 GLN A 126 0.112 -8.479 -5.343 1.00 0.00 N ATOM 0 H GLN A 126 -4.905 -6.933 -4.976 1.00 0.00 H new ATOM 0 HA GLN A 126 -3.096 -5.877 -3.027 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -3.548 -8.245 -3.108 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -3.144 -8.334 -4.811 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.876 -7.266 -3.403 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -1.431 -8.693 -2.551 1.00 0.00 H new ATOM 0 HE21 GLN A 126 0.319 -7.487 -5.229 1.00 0.00 H new ATOM 0 HE22 GLN A 126 0.592 -9.021 -6.062 1.00 0.00 H new ATOM 767 N ILE A 127 -1.615 -4.518 -4.495 1.00 0.00 N ATOM 768 CA ILE A 127 -0.588 -3.803 -5.243 1.00 0.00 C ATOM 769 C ILE A 127 0.782 -4.441 -5.044 1.00 0.00 C ATOM 770 O ILE A 127 1.011 -5.150 -4.064 1.00 0.00 O ATOM 771 CB ILE A 127 -0.515 -2.321 -4.825 1.00 0.00 C ATOM 772 CG1 ILE A 127 -1.920 -1.722 -4.738 1.00 0.00 C ATOM 773 CG2 ILE A 127 0.341 -1.535 -5.808 1.00 0.00 C ATOM 774 CD1 ILE A 127 -2.691 -1.797 -6.037 1.00 0.00 C ATOM 0 H ILE A 127 -1.945 -4.031 -3.662 1.00 0.00 H new ATOM 0 HA ILE A 127 -0.866 -3.863 -6.295 1.00 0.00 H new ATOM 0 HB ILE A 127 -0.053 -2.260 -3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -2.481 -2.243 -3.962 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -1.843 -0.679 -4.430 1.00 0.00 H new ATOM 0 HG21 ILE A 127 0.383 -0.490 -5.500 1.00 0.00 H new ATOM 0 HG22 ILE A 127 1.349 -1.949 -5.825 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -0.095 -1.602 -6.805 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -3.678 -1.354 -5.901 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -2.152 -1.252 -6.812 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.800 -2.840 -6.336 1.00 0.00 H new ATOM 786 N GLU A 128 1.690 -4.183 -5.978 1.00 0.00 N ATOM 787 CA GLU A 128 3.039 -4.732 -5.904 1.00 0.00 C ATOM 788 C GLU A 128 4.083 -3.643 -6.132 1.00 0.00 C ATOM 789 O GLU A 128 4.132 -3.031 -7.199 1.00 0.00 O ATOM 790 CB GLU A 128 3.216 -5.846 -6.936 1.00 0.00 C ATOM 791 CG GLU A 128 2.159 -6.935 -6.842 1.00 0.00 C ATOM 792 CD GLU A 128 1.984 -7.691 -8.144 1.00 0.00 C ATOM 793 OE1 GLU A 128 2.766 -8.634 -8.393 1.00 0.00 O ATOM 794 OE2 GLU A 128 1.066 -7.342 -8.915 1.00 0.00 O ATOM 0 H GLU A 128 1.517 -3.597 -6.795 1.00 0.00 H new ATOM 0 HA GLU A 128 3.182 -5.145 -4.905 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.191 -5.412 -7.935 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.201 -6.295 -6.809 1.00 0.00 H new ATOM 0 HG2 GLU A 128 2.434 -7.636 -6.053 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.207 -6.489 -6.555 1.00 0.00 H new ATOM 801 N ALA A 129 4.915 -3.407 -5.123 1.00 0.00 N ATOM 802 CA ALA A 129 5.956 -2.393 -5.215 1.00 0.00 C ATOM 803 C ALA A 129 6.724 -2.513 -6.527 1.00 0.00 C ATOM 804 O ALA A 129 7.286 -3.564 -6.834 1.00 0.00 O ATOM 805 CB ALA A 129 6.908 -2.505 -4.033 1.00 0.00 C ATOM 0 H ALA A 129 4.888 -3.905 -4.233 1.00 0.00 H new ATOM 0 HA ALA A 129 5.478 -1.414 -5.191 1.00 0.00 H new ATOM 0 HB1 ALA A 129 7.681 -1.741 -4.115 1.00 0.00 H new ATOM 0 HB2 ALA A 129 6.354 -2.363 -3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 129 7.372 -3.491 -4.031 1.00 0.00 H new ATOM 811 N ASP A 130 6.742 -1.431 -7.298 1.00 0.00 N ATOM 812 CA ASP A 130 7.440 -1.417 -8.579 1.00 0.00 C ATOM 813 C ASP A 130 8.426 -0.255 -8.649 1.00 0.00 C ATOM 814 O ASP A 130 8.837 0.158 -9.732 1.00 0.00 O ATOM 815 CB ASP A 130 6.438 -1.321 -9.730 1.00 0.00 C ATOM 816 CG ASP A 130 5.523 -0.117 -9.600 1.00 0.00 C ATOM 817 OD1 ASP A 130 5.006 0.118 -8.488 1.00 0.00 O ATOM 818 OD2 ASP A 130 5.325 0.589 -10.611 1.00 0.00 O ATOM 0 H ASP A 130 6.282 -0.553 -7.059 1.00 0.00 H new ATOM 0 HA ASP A 130 7.998 -2.349 -8.670 1.00 0.00 H new ATOM 0 HB2 ASP A 130 6.978 -1.263 -10.675 1.00 0.00 H new ATOM 0 HB3 ASP A 130 5.837 -2.230 -9.762 1.00 0.00 H new ATOM 823 N LYS A 131 8.800 0.268 -7.485 1.00 0.00 N ATOM 824 CA LYS A 131 9.737 1.382 -7.415 1.00 0.00 C ATOM 825 C LYS A 131 10.900 1.064 -6.479 1.00 0.00 C ATOM 826 O LYS A 131 11.797 1.885 -6.288 1.00 0.00 O ATOM 827 CB LYS A 131 9.021 2.650 -6.946 1.00 0.00 C ATOM 828 CG LYS A 131 8.378 3.440 -8.075 1.00 0.00 C ATOM 829 CD LYS A 131 9.425 4.134 -8.933 1.00 0.00 C ATOM 830 CE LYS A 131 8.894 4.435 -10.325 1.00 0.00 C ATOM 831 NZ LYS A 131 8.876 5.895 -10.610 1.00 0.00 N ATOM 0 H LYS A 131 8.468 -0.062 -6.579 1.00 0.00 H new ATOM 0 HA LYS A 131 10.137 1.547 -8.415 1.00 0.00 H new ATOM 0 HB2 LYS A 131 8.253 2.377 -6.222 1.00 0.00 H new ATOM 0 HB3 LYS A 131 9.735 3.290 -6.427 1.00 0.00 H new ATOM 0 HG2 LYS A 131 7.782 2.771 -8.696 1.00 0.00 H new ATOM 0 HG3 LYS A 131 7.696 4.182 -7.660 1.00 0.00 H new ATOM 0 HD2 LYS A 131 9.734 5.062 -8.452 1.00 0.00 H new ATOM 0 HD3 LYS A 131 10.311 3.504 -9.009 1.00 0.00 H new ATOM 0 HE2 LYS A 131 9.512 3.928 -11.066 1.00 0.00 H new ATOM 0 HE3 LYS A 131 7.885 4.034 -10.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 8.507 6.057 -11.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 8.266 6.376 -9.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 9.842 6.274 -10.542 1.00 0.00 H new ATOM 845 N SER A 132 10.879 -0.132 -5.896 1.00 0.00 N ATOM 846 CA SER A 132 11.934 -0.553 -4.981 1.00 0.00 C ATOM 847 C SER A 132 12.133 0.473 -3.871 1.00 0.00 C ATOM 848 O SER A 132 11.669 1.609 -3.971 1.00 0.00 O ATOM 849 CB SER A 132 13.246 -0.759 -5.744 1.00 0.00 C ATOM 850 OG SER A 132 14.266 0.088 -5.248 1.00 0.00 O ATOM 0 H SER A 132 10.144 -0.825 -6.041 1.00 0.00 H new ATOM 0 HA SER A 132 11.633 -1.497 -4.527 1.00 0.00 H new ATOM 0 HB2 SER A 132 13.560 -1.799 -5.658 1.00 0.00 H new ATOM 0 HB3 SER A 132 13.088 -0.560 -6.804 1.00 0.00 H new ATOM 0 HG SER A 132 15.092 -0.065 -5.752 1.00 0.00 H new ATOM 856 N GLY A 133 12.827 0.067 -2.812 1.00 0.00 N ATOM 857 CA GLY A 133 13.075 0.964 -1.699 1.00 0.00 C ATOM 858 C GLY A 133 12.595 0.399 -0.376 1.00 0.00 C ATOM 859 O GLY A 133 12.223 -0.771 -0.292 1.00 0.00 O ATOM 0 H GLY A 133 13.222 -0.867 -2.705 1.00 0.00 H new ATOM 0 HA2 GLY A 133 14.143 1.171 -1.635 1.00 0.00 H new ATOM 0 HA3 GLY A 133 12.577 1.915 -1.886 1.00 0.00 H new ATOM 863 N THR A 134 12.606 1.234 0.658 1.00 0.00 N ATOM 864 CA THR A 134 12.169 0.814 1.985 1.00 0.00 C ATOM 865 C THR A 134 11.017 1.684 2.479 1.00 0.00 C ATOM 866 O THR A 134 11.187 2.881 2.715 1.00 0.00 O ATOM 867 CB THR A 134 13.334 0.881 2.974 1.00 0.00 C ATOM 868 OG1 THR A 134 14.227 -0.199 2.769 1.00 0.00 O ATOM 869 CG2 THR A 134 12.894 0.845 4.421 1.00 0.00 C ATOM 0 H THR A 134 12.913 2.205 0.603 1.00 0.00 H new ATOM 0 HA THR A 134 11.819 -0.216 1.916 1.00 0.00 H new ATOM 0 HB THR A 134 13.820 1.838 2.784 1.00 0.00 H new ATOM 0 HG1 THR A 134 14.966 -0.138 3.410 1.00 0.00 H new ATOM 0 HG21 THR A 134 13.769 0.896 5.069 1.00 0.00 H new ATOM 0 HG22 THR A 134 12.242 1.695 4.624 1.00 0.00 H new ATOM 0 HG23 THR A 134 12.353 -0.082 4.614 1.00 0.00 H new ATOM 877 N VAL A 135 9.846 1.076 2.634 1.00 0.00 N ATOM 878 CA VAL A 135 8.667 1.794 3.101 1.00 0.00 C ATOM 879 C VAL A 135 9.020 2.757 4.229 1.00 0.00 C ATOM 880 O VAL A 135 9.761 2.407 5.148 1.00 0.00 O ATOM 881 CB VAL A 135 7.577 0.824 3.592 1.00 0.00 C ATOM 882 CG1 VAL A 135 6.276 1.570 3.854 1.00 0.00 C ATOM 883 CG2 VAL A 135 7.364 -0.297 2.586 1.00 0.00 C ATOM 0 H VAL A 135 9.688 0.087 2.443 1.00 0.00 H new ATOM 0 HA VAL A 135 8.284 2.359 2.251 1.00 0.00 H new ATOM 0 HB VAL A 135 7.910 0.379 4.530 1.00 0.00 H new ATOM 0 HG11 VAL A 135 5.517 0.868 4.200 1.00 0.00 H new ATOM 0 HG12 VAL A 135 6.440 2.332 4.616 1.00 0.00 H new ATOM 0 HG13 VAL A 135 5.937 2.045 2.933 1.00 0.00 H new ATOM 0 HG21 VAL A 135 6.590 -0.972 2.952 1.00 0.00 H new ATOM 0 HG22 VAL A 135 7.055 0.126 1.630 1.00 0.00 H new ATOM 0 HG23 VAL A 135 8.294 -0.850 2.455 1.00 0.00 H new ATOM 893 N LYS A 136 8.487 3.972 4.153 1.00 0.00 N ATOM 894 CA LYS A 136 8.747 4.984 5.169 1.00 0.00 C ATOM 895 C LYS A 136 7.607 5.046 6.180 1.00 0.00 C ATOM 896 O LYS A 136 7.838 5.094 7.388 1.00 0.00 O ATOM 897 CB LYS A 136 8.941 6.355 4.517 1.00 0.00 C ATOM 898 CG LYS A 136 10.219 7.056 4.948 1.00 0.00 C ATOM 899 CD LYS A 136 10.362 7.076 6.461 1.00 0.00 C ATOM 900 CE LYS A 136 9.274 7.916 7.111 1.00 0.00 C ATOM 901 NZ LYS A 136 9.731 9.309 7.374 1.00 0.00 N ATOM 0 H LYS A 136 7.873 4.279 3.399 1.00 0.00 H new ATOM 0 HA LYS A 136 9.661 4.707 5.695 1.00 0.00 H new ATOM 0 HB2 LYS A 136 8.949 6.235 3.434 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.088 6.989 4.761 1.00 0.00 H new ATOM 0 HG2 LYS A 136 11.078 6.551 4.507 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.220 8.078 4.568 1.00 0.00 H new ATOM 0 HD2 LYS A 136 10.316 6.057 6.846 1.00 0.00 H new ATOM 0 HD3 LYS A 136 11.340 7.474 6.730 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.397 7.938 6.464 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.968 7.451 8.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.961 9.849 7.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 10.552 9.290 8.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 9.999 9.762 6.477 1.00 0.00 H new ATOM 915 N ALA A 137 6.376 5.042 5.679 1.00 0.00 N ATOM 916 CA ALA A 137 5.201 5.096 6.539 1.00 0.00 C ATOM 917 C ALA A 137 3.915 5.026 5.723 1.00 0.00 C ATOM 918 O ALA A 137 3.951 4.863 4.503 1.00 0.00 O ATOM 919 CB ALA A 137 5.223 6.361 7.384 1.00 0.00 C ATOM 0 H ALA A 137 6.167 5.002 4.681 1.00 0.00 H new ATOM 0 HA ALA A 137 5.227 4.229 7.199 1.00 0.00 H new ATOM 0 HB1 ALA A 137 4.339 6.388 8.022 1.00 0.00 H new ATOM 0 HB2 ALA A 137 6.119 6.368 8.005 1.00 0.00 H new ATOM 0 HB3 ALA A 137 5.227 7.234 6.732 1.00 0.00 H new ATOM 925 N ILE A 138 2.781 5.150 6.405 1.00 0.00 N ATOM 926 CA ILE A 138 1.482 5.100 5.744 1.00 0.00 C ATOM 927 C ILE A 138 0.601 6.268 6.179 1.00 0.00 C ATOM 928 O ILE A 138 0.580 6.637 7.353 1.00 0.00 O ATOM 929 CB ILE A 138 0.754 3.777 6.044 1.00 0.00 C ATOM 930 CG1 ILE A 138 1.579 2.592 5.541 1.00 0.00 C ATOM 931 CG2 ILE A 138 -0.628 3.774 5.407 1.00 0.00 C ATOM 932 CD1 ILE A 138 0.926 1.250 5.788 1.00 0.00 C ATOM 0 H ILE A 138 2.735 5.286 7.415 1.00 0.00 H new ATOM 0 HA ILE A 138 1.665 5.169 4.672 1.00 0.00 H new ATOM 0 HB ILE A 138 0.635 3.683 7.123 1.00 0.00 H new ATOM 0 HG12 ILE A 138 1.754 2.710 4.472 1.00 0.00 H new ATOM 0 HG13 ILE A 138 2.554 2.607 6.027 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -1.129 2.832 5.629 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -1.215 4.600 5.808 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -0.531 3.888 4.327 1.00 0.00 H new ATOM 0 HD11 ILE A 138 1.568 0.457 5.405 1.00 0.00 H new ATOM 0 HD12 ILE A 138 0.776 1.110 6.858 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -0.037 1.215 5.279 1.00 0.00 H new ATOM 944 N LEU A 139 -0.121 6.846 5.225 1.00 0.00 N ATOM 945 CA LEU A 139 -0.999 7.976 5.511 1.00 0.00 C ATOM 946 C LEU A 139 -2.467 7.569 5.421 1.00 0.00 C ATOM 947 O LEU A 139 -3.327 8.170 6.065 1.00 0.00 O ATOM 948 CB LEU A 139 -0.718 9.124 4.540 1.00 0.00 C ATOM 949 CG LEU A 139 0.498 9.982 4.888 1.00 0.00 C ATOM 950 CD1 LEU A 139 1.773 9.156 4.814 1.00 0.00 C ATOM 951 CD2 LEU A 139 0.585 11.184 3.959 1.00 0.00 C ATOM 0 H LEU A 139 -0.116 6.552 4.248 1.00 0.00 H new ATOM 0 HA LEU A 139 -0.797 8.308 6.529 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -0.577 8.709 3.542 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -1.597 9.767 4.497 1.00 0.00 H new ATOM 0 HG LEU A 139 0.383 10.344 5.910 1.00 0.00 H new ATOM 0 HD11 LEU A 139 2.628 9.784 5.065 1.00 0.00 H new ATOM 0 HD12 LEU A 139 1.711 8.328 5.520 1.00 0.00 H new ATOM 0 HD13 LEU A 139 1.894 8.764 3.804 1.00 0.00 H new ATOM 0 HD21 LEU A 139 1.456 11.784 4.221 1.00 0.00 H new ATOM 0 HD22 LEU A 139 0.677 10.841 2.928 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.316 11.789 4.061 1.00 0.00 H new ATOM 963 N VAL A 140 -2.749 6.549 4.617 1.00 0.00 N ATOM 964 CA VAL A 140 -4.115 6.069 4.446 1.00 0.00 C ATOM 965 C VAL A 140 -4.654 5.473 5.743 1.00 0.00 C ATOM 966 O VAL A 140 -5.858 5.512 6.001 1.00 0.00 O ATOM 967 CB VAL A 140 -4.205 5.015 3.326 1.00 0.00 C ATOM 968 CG1 VAL A 140 -5.549 4.302 3.363 1.00 0.00 C ATOM 969 CG2 VAL A 140 -3.976 5.661 1.968 1.00 0.00 C ATOM 0 H VAL A 140 -2.051 6.040 4.075 1.00 0.00 H new ATOM 0 HA VAL A 140 -4.722 6.931 4.168 1.00 0.00 H new ATOM 0 HB VAL A 140 -3.424 4.273 3.490 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.591 3.562 2.564 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -5.670 3.804 4.325 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -6.350 5.028 3.227 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -4.043 4.902 1.188 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -4.734 6.426 1.796 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -2.987 6.119 1.945 1.00 0.00 H new ATOM 979 N GLU A 141 -3.758 4.923 6.554 1.00 0.00 N ATOM 980 CA GLU A 141 -4.145 4.319 7.824 1.00 0.00 C ATOM 981 C GLU A 141 -5.001 3.078 7.596 1.00 0.00 C ATOM 982 O GLU A 141 -6.227 3.160 7.508 1.00 0.00 O ATOM 983 CB GLU A 141 -4.907 5.329 8.684 1.00 0.00 C ATOM 984 CG GLU A 141 -4.001 6.289 9.438 1.00 0.00 C ATOM 985 CD GLU A 141 -4.737 7.056 10.519 1.00 0.00 C ATOM 986 OE1 GLU A 141 -5.597 7.893 10.172 1.00 0.00 O ATOM 987 OE2 GLU A 141 -4.453 6.820 11.712 1.00 0.00 O ATOM 0 H GLU A 141 -2.758 4.883 6.355 1.00 0.00 H new ATOM 0 HA GLU A 141 -3.237 4.021 8.348 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -5.580 5.902 8.047 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -5.528 4.790 9.400 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -3.180 5.731 9.888 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -3.559 6.994 8.734 1.00 0.00 H new ATOM 994 N SER A 142 -4.345 1.928 7.504 1.00 0.00 N ATOM 995 CA SER A 142 -5.043 0.670 7.288 1.00 0.00 C ATOM 996 C SER A 142 -6.323 0.614 8.117 1.00 0.00 C ATOM 997 O SER A 142 -6.508 1.404 9.042 1.00 0.00 O ATOM 998 CB SER A 142 -4.133 -0.504 7.648 1.00 0.00 C ATOM 999 OG SER A 142 -4.731 -1.335 8.627 1.00 0.00 O ATOM 0 H SER A 142 -3.331 1.842 7.576 1.00 0.00 H new ATOM 0 HA SER A 142 -5.312 0.602 6.234 1.00 0.00 H new ATOM 0 HB2 SER A 142 -3.918 -1.088 6.753 1.00 0.00 H new ATOM 0 HB3 SER A 142 -3.180 -0.128 8.020 1.00 0.00 H new ATOM 0 HG SER A 142 -4.306 -2.218 8.610 1.00 0.00 H new ATOM 1005 N GLY A 143 -7.206 -0.321 7.778 1.00 0.00 N ATOM 1006 CA GLY A 143 -8.454 -0.453 8.503 1.00 0.00 C ATOM 1007 C GLY A 143 -9.384 0.724 8.273 1.00 0.00 C ATOM 1008 O GLY A 143 -10.451 0.807 8.881 1.00 0.00 O ATOM 0 H GLY A 143 -7.079 -0.987 7.016 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -8.953 -1.372 8.197 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -8.244 -0.544 9.569 1.00 0.00 H new ATOM 1012 N GLN A 144 -8.978 1.635 7.393 1.00 0.00 N ATOM 1013 CA GLN A 144 -9.784 2.812 7.086 1.00 0.00 C ATOM 1014 C GLN A 144 -10.050 2.915 5.589 1.00 0.00 C ATOM 1015 O GLN A 144 -9.162 2.674 4.771 1.00 0.00 O ATOM 1016 CB GLN A 144 -9.083 4.079 7.580 1.00 0.00 C ATOM 1017 CG GLN A 144 -9.783 5.363 7.169 1.00 0.00 C ATOM 1018 CD GLN A 144 -8.817 6.425 6.685 1.00 0.00 C ATOM 1019 OE1 GLN A 144 -8.531 7.390 7.392 1.00 0.00 O ATOM 1020 NE2 GLN A 144 -8.307 6.250 5.471 1.00 0.00 N ATOM 0 H GLN A 144 -8.097 1.581 6.881 1.00 0.00 H new ATOM 0 HA GLN A 144 -10.740 2.710 7.600 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -9.014 4.045 8.667 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -8.063 4.093 7.196 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -10.501 5.144 6.379 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -10.349 5.751 8.016 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -8.572 5.434 4.919 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -7.650 6.931 5.091 1.00 0.00 H new ATOM 1029 N PRO A 145 -11.285 3.279 5.211 1.00 0.00 N ATOM 1030 CA PRO A 145 -11.675 3.418 3.805 1.00 0.00 C ATOM 1031 C PRO A 145 -10.654 4.208 2.994 1.00 0.00 C ATOM 1032 O PRO A 145 -10.052 5.160 3.492 1.00 0.00 O ATOM 1033 CB PRO A 145 -12.998 4.178 3.887 1.00 0.00 C ATOM 1034 CG PRO A 145 -13.570 3.795 5.208 1.00 0.00 C ATOM 1035 CD PRO A 145 -12.397 3.586 6.129 1.00 0.00 C ATOM 0 HA PRO A 145 -11.748 2.454 3.301 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -12.842 5.255 3.820 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -13.665 3.901 3.071 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -14.229 4.576 5.588 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -14.167 2.887 5.125 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -12.191 4.476 6.724 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -12.577 2.769 6.828 1.00 0.00 H new ATOM 1043 N VAL A 146 -10.462 3.805 1.742 1.00 0.00 N ATOM 1044 CA VAL A 146 -9.513 4.474 0.861 1.00 0.00 C ATOM 1045 C VAL A 146 -10.227 5.425 -0.095 1.00 0.00 C ATOM 1046 O VAL A 146 -11.373 5.190 -0.478 1.00 0.00 O ATOM 1047 CB VAL A 146 -8.697 3.457 0.041 1.00 0.00 C ATOM 1048 CG1 VAL A 146 -7.449 4.110 -0.534 1.00 0.00 C ATOM 1049 CG2 VAL A 146 -8.330 2.254 0.896 1.00 0.00 C ATOM 0 H VAL A 146 -10.951 3.018 1.315 1.00 0.00 H new ATOM 0 HA VAL A 146 -8.836 5.044 1.498 1.00 0.00 H new ATOM 0 HB VAL A 146 -9.313 3.111 -0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -6.886 3.375 -1.110 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -7.737 4.937 -1.184 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -6.828 4.487 0.279 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -7.754 1.546 0.300 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -7.734 2.581 1.748 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -9.239 1.771 1.254 1.00 0.00 H new ATOM 1059 N GLU A 147 -9.543 6.499 -0.475 1.00 0.00 N ATOM 1060 CA GLU A 147 -10.114 7.485 -1.385 1.00 0.00 C ATOM 1061 C GLU A 147 -9.202 7.705 -2.588 1.00 0.00 C ATOM 1062 O GLU A 147 -8.003 7.430 -2.529 1.00 0.00 O ATOM 1063 CB GLU A 147 -10.344 8.810 -0.657 1.00 0.00 C ATOM 1064 CG GLU A 147 -9.278 9.128 0.379 1.00 0.00 C ATOM 1065 CD GLU A 147 -9.756 8.891 1.799 1.00 0.00 C ATOM 1066 OE1 GLU A 147 -10.937 9.180 2.084 1.00 0.00 O ATOM 1067 OE2 GLU A 147 -8.948 8.416 2.624 1.00 0.00 O ATOM 0 H GLU A 147 -8.593 6.709 -0.167 1.00 0.00 H new ATOM 0 HA GLU A 147 -11.071 7.103 -1.740 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -10.379 9.616 -1.390 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -11.318 8.782 -0.168 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -8.397 8.515 0.189 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -8.971 10.168 0.272 1.00 0.00 H new ATOM 1074 N PHE A 148 -9.776 8.205 -3.677 1.00 0.00 N ATOM 1075 CA PHE A 148 -9.013 8.463 -4.892 1.00 0.00 C ATOM 1076 C PHE A 148 -7.806 9.347 -4.597 1.00 0.00 C ATOM 1077 O PHE A 148 -7.943 10.436 -4.038 1.00 0.00 O ATOM 1078 CB PHE A 148 -9.899 9.122 -5.945 1.00 0.00 C ATOM 1079 CG PHE A 148 -9.128 9.756 -7.068 1.00 0.00 C ATOM 1080 CD1 PHE A 148 -8.525 8.968 -8.043 1.00 0.00 C ATOM 1081 CD2 PHE A 148 -9.003 11.137 -7.149 1.00 0.00 C ATOM 1082 CE1 PHE A 148 -7.813 9.548 -9.081 1.00 0.00 C ATOM 1083 CE2 PHE A 148 -8.291 11.724 -8.185 1.00 0.00 C ATOM 1084 CZ PHE A 148 -7.696 10.927 -9.151 1.00 0.00 C ATOM 0 H PHE A 148 -10.767 8.439 -3.743 1.00 0.00 H new ATOM 0 HA PHE A 148 -8.655 7.508 -5.277 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -10.577 8.374 -6.357 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -10.516 9.881 -5.465 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -8.613 7.893 -7.991 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -9.465 11.760 -6.398 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -7.350 8.927 -9.834 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -8.200 12.799 -8.239 1.00 0.00 H new ATOM 0 HZ PHE A 148 -7.141 11.381 -9.959 1.00 0.00 H new ATOM 1094 N ASP A 149 -6.624 8.872 -4.975 1.00 0.00 N ATOM 1095 CA ASP A 149 -5.392 9.619 -4.749 1.00 0.00 C ATOM 1096 C ASP A 149 -5.098 9.736 -3.257 1.00 0.00 C ATOM 1097 O ASP A 149 -5.114 10.831 -2.693 1.00 0.00 O ATOM 1098 CB ASP A 149 -5.493 11.012 -5.373 1.00 0.00 C ATOM 1099 CG ASP A 149 -5.212 10.997 -6.863 1.00 0.00 C ATOM 1100 OD1 ASP A 149 -5.562 9.996 -7.524 1.00 0.00 O ATOM 1101 OD2 ASP A 149 -4.644 11.987 -7.371 1.00 0.00 O ATOM 0 H ASP A 149 -6.493 7.973 -5.439 1.00 0.00 H new ATOM 0 HA ASP A 149 -4.573 9.077 -5.223 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -6.491 11.415 -5.198 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -4.788 11.681 -4.879 1.00 0.00 H new ATOM 1106 N GLU A 150 -4.830 8.599 -2.625 1.00 0.00 N ATOM 1107 CA GLU A 150 -4.531 8.568 -1.199 1.00 0.00 C ATOM 1108 C GLU A 150 -3.187 7.893 -0.944 1.00 0.00 C ATOM 1109 O GLU A 150 -2.981 6.738 -1.315 1.00 0.00 O ATOM 1110 CB GLU A 150 -5.635 7.829 -0.442 1.00 0.00 C ATOM 1111 CG GLU A 150 -6.112 8.557 0.804 1.00 0.00 C ATOM 1112 CD GLU A 150 -5.007 8.751 1.824 1.00 0.00 C ATOM 1113 OE1 GLU A 150 -3.867 8.317 1.553 1.00 0.00 O ATOM 1114 OE2 GLU A 150 -5.282 9.336 2.892 1.00 0.00 O ATOM 0 H GLU A 150 -4.814 7.686 -3.079 1.00 0.00 H new ATOM 0 HA GLU A 150 -4.479 9.596 -0.840 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -6.483 7.677 -1.110 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -5.271 6.841 -0.158 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -6.515 9.529 0.521 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -6.927 7.995 1.259 1.00 0.00 H new ATOM 1121 N PRO A 151 -2.254 8.611 -0.303 1.00 0.00 N ATOM 1122 CA PRO A 151 -0.923 8.082 0.004 1.00 0.00 C ATOM 1123 C PRO A 151 -0.991 6.770 0.778 1.00 0.00 C ATOM 1124 O PRO A 151 -0.849 6.748 2.001 1.00 0.00 O ATOM 1125 CB PRO A 151 -0.275 9.181 0.862 1.00 0.00 C ATOM 1126 CG PRO A 151 -1.394 10.085 1.265 1.00 0.00 C ATOM 1127 CD PRO A 151 -2.419 9.988 0.173 1.00 0.00 C ATOM 0 HA PRO A 151 -0.361 7.854 -0.901 1.00 0.00 H new ATOM 0 HB2 PRO A 151 0.220 8.756 1.735 1.00 0.00 H new ATOM 0 HB3 PRO A 151 0.484 9.723 0.298 1.00 0.00 H new ATOM 0 HG2 PRO A 151 -1.815 9.781 2.223 1.00 0.00 H new ATOM 0 HG3 PRO A 151 -1.044 11.111 1.382 1.00 0.00 H new ATOM 0 HD2 PRO A 151 -3.427 10.169 0.546 1.00 0.00 H new ATOM 0 HD3 PRO A 151 -2.237 10.715 -0.619 1.00 0.00 H new ATOM 1135 N LEU A 152 -1.211 5.676 0.055 1.00 0.00 N ATOM 1136 CA LEU A 152 -1.299 4.356 0.669 1.00 0.00 C ATOM 1137 C LEU A 152 -0.016 4.017 1.418 1.00 0.00 C ATOM 1138 O LEU A 152 -0.055 3.533 2.548 1.00 0.00 O ATOM 1139 CB LEU A 152 -1.579 3.292 -0.395 1.00 0.00 C ATOM 1140 CG LEU A 152 -3.035 3.202 -0.854 1.00 0.00 C ATOM 1141 CD1 LEU A 152 -3.114 2.706 -2.289 1.00 0.00 C ATOM 1142 CD2 LEU A 152 -3.828 2.290 0.071 1.00 0.00 C ATOM 0 H LEU A 152 -1.332 5.678 -0.958 1.00 0.00 H new ATOM 0 HA LEU A 152 -2.122 4.370 1.384 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.952 3.495 -1.263 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -1.277 2.321 -0.004 1.00 0.00 H new ATOM 0 HG LEU A 152 -3.471 4.200 -0.813 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -4.158 2.649 -2.597 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -2.580 3.396 -2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -2.661 1.717 -2.358 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -4.862 2.237 -0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -3.391 1.292 0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -3.800 2.688 1.086 1.00 0.00 H new ATOM 1154 N VAL A 153 1.120 4.276 0.781 1.00 0.00 N ATOM 1155 CA VAL A 153 2.415 3.999 1.389 1.00 0.00 C ATOM 1156 C VAL A 153 3.519 4.824 0.738 1.00 0.00 C ATOM 1157 O VAL A 153 3.641 4.862 -0.487 1.00 0.00 O ATOM 1158 CB VAL A 153 2.777 2.506 1.283 1.00 0.00 C ATOM 1159 CG1 VAL A 153 3.712 2.100 2.412 1.00 0.00 C ATOM 1160 CG2 VAL A 153 1.518 1.650 1.289 1.00 0.00 C ATOM 0 H VAL A 153 1.170 4.677 -0.155 1.00 0.00 H new ATOM 0 HA VAL A 153 2.334 4.273 2.441 1.00 0.00 H new ATOM 0 HB VAL A 153 3.296 2.343 0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 153 3.956 1.042 2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 153 4.627 2.690 2.356 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.224 2.277 3.370 1.00 0.00 H new ATOM 0 HG21 VAL A 153 1.793 0.598 1.213 1.00 0.00 H new ATOM 0 HG22 VAL A 153 0.970 1.816 2.216 1.00 0.00 H new ATOM 0 HG23 VAL A 153 0.889 1.922 0.442 1.00 0.00 H new ATOM 1170 N VAL A 154 4.319 5.485 1.567 1.00 0.00 N ATOM 1171 CA VAL A 154 5.414 6.312 1.076 1.00 0.00 C ATOM 1172 C VAL A 154 6.756 5.614 1.266 1.00 0.00 C ATOM 1173 O VAL A 154 7.157 5.311 2.389 1.00 0.00 O ATOM 1174 CB VAL A 154 5.452 7.674 1.794 1.00 0.00 C ATOM 1175 CG1 VAL A 154 4.064 8.295 1.830 1.00 0.00 C ATOM 1176 CG2 VAL A 154 6.012 7.522 3.199 1.00 0.00 C ATOM 0 H VAL A 154 4.229 5.464 2.583 1.00 0.00 H new ATOM 0 HA VAL A 154 5.238 6.474 0.013 1.00 0.00 H new ATOM 0 HB VAL A 154 6.110 8.341 1.237 1.00 0.00 H new ATOM 0 HG11 VAL A 154 4.109 9.257 2.341 1.00 0.00 H new ATOM 0 HG12 VAL A 154 3.704 8.441 0.812 1.00 0.00 H new ATOM 0 HG13 VAL A 154 3.383 7.632 2.364 1.00 0.00 H new ATOM 0 HG21 VAL A 154 6.031 8.495 3.690 1.00 0.00 H new ATOM 0 HG22 VAL A 154 5.382 6.839 3.770 1.00 0.00 H new ATOM 0 HG23 VAL A 154 7.025 7.123 3.146 1.00 0.00 H new ATOM 1186 N ILE A 155 7.446 5.358 0.159 1.00 0.00 N ATOM 1187 CA ILE A 155 8.742 4.692 0.203 1.00 0.00 C ATOM 1188 C ILE A 155 9.870 5.693 0.428 1.00 0.00 C ATOM 1189 O ILE A 155 9.776 6.851 0.021 1.00 0.00 O ATOM 1190 CB ILE A 155 9.015 3.910 -1.096 1.00 0.00 C ATOM 1191 CG1 ILE A 155 7.717 3.310 -1.637 1.00 0.00 C ATOM 1192 CG2 ILE A 155 10.049 2.821 -0.853 1.00 0.00 C ATOM 1193 CD1 ILE A 155 7.177 4.032 -2.853 1.00 0.00 C ATOM 0 H ILE A 155 7.129 5.602 -0.779 1.00 0.00 H new ATOM 0 HA ILE A 155 8.710 3.994 1.039 1.00 0.00 H new ATOM 0 HB ILE A 155 9.413 4.599 -1.841 1.00 0.00 H new ATOM 0 HG12 ILE A 155 7.888 2.264 -1.892 1.00 0.00 H new ATOM 0 HG13 ILE A 155 6.963 3.327 -0.850 1.00 0.00 H new ATOM 0 HG21 ILE A 155 10.230 2.278 -1.781 1.00 0.00 H new ATOM 0 HG22 ILE A 155 10.979 3.273 -0.509 1.00 0.00 H new ATOM 0 HG23 ILE A 155 9.679 2.131 -0.095 1.00 0.00 H new ATOM 0 HD11 ILE A 155 6.255 3.552 -3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 155 6.973 5.072 -2.598 1.00 0.00 H new ATOM 0 HD13 ILE A 155 7.913 3.993 -3.656 1.00 0.00 H new ATOM 1205 N GLU A 156 10.937 5.238 1.077 1.00 0.00 N ATOM 1206 CA GLU A 156 12.085 6.093 1.358 1.00 0.00 C ATOM 1207 C GLU A 156 13.036 6.135 0.165 1.00 0.00 C ATOM 1208 O GLU A 156 13.579 7.224 -0.118 1.00 0.00 O ATOM 1209 CB GLU A 156 12.827 5.593 2.599 1.00 0.00 C ATOM 1210 CG GLU A 156 13.880 6.562 3.111 1.00 0.00 C ATOM 1211 CD GLU A 156 15.195 5.879 3.430 1.00 0.00 C ATOM 1212 OE1 GLU A 156 15.877 5.433 2.484 1.00 0.00 O ATOM 1213 OE2 GLU A 156 15.543 5.789 4.626 1.00 0.00 O ATOM 1214 OXT GLU A 156 13.228 5.080 -0.475 1.00 0.00 O ATOM 0 H GLU A 156 11.031 4.281 1.418 1.00 0.00 H new ATOM 0 HA GLU A 156 11.719 7.103 1.544 1.00 0.00 H new ATOM 0 HB2 GLU A 156 12.104 5.403 3.392 1.00 0.00 H new ATOM 0 HB3 GLU A 156 13.304 4.641 2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 156 14.049 7.337 2.363 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.506 7.059 4.006 1.00 0.00 H new