USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 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 105 MET CE :methyl -117:sc= 0 (180deg=-0.128) USER MOD Set 1.2: A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.3: B 7 THR OG1 : rot 70:sc= 1.08 USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.222 K(o=0.39,f=-1.7) USER MOD Set 2.2: A 107 ASN : amide:sc= 0.169 K(o=0.39,f=-1.7!) USER MOD Set 3.1: A 71 LYS NZ :NH3+ -178:sc= 1.87 (180deg=1.11) USER MOD Set 3.2: A 77 SER OG : rot 180:sc= 0.618 USER MOD Set 4.1: A 56 ASN : amide:sc= 1.46 K(o=1.6,f=-5.3!) USER MOD Set 4.2: A 58 THR OG1 : rot 9:sc= 0.151 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 9 LYS NZ :NH3+ -161:sc= -0.135 (180deg=-1.04) USER MOD Single : A 13 SER OG : rot 80:sc= 0.0782 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -71:sc= 1.2 USER MOD Single : A 25 THR OG1 : rot 174:sc= 1.21 USER MOD Single : A 26 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.24) USER MOD Single : A 30 THR OG1 : rot 92:sc= 1.25 USER MOD Single : A 32 MET CE :methyl 175:sc= 0 (180deg=-0.0383) USER MOD Single : A 34 SER OG : rot -154:sc= 0.25 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -0.0102 K(o=-0.01,f=-1) USER MOD Single : A 66 THR OG1 : rot 75:sc= 1.3 USER MOD Single : A 67 MET CE :methyl 157:sc= -0.15 (180deg=-0.534) USER MOD Single : A 68 MET CE :methyl -129:sc= -0.59 (180deg=-1.41) USER MOD Single : A 72 MET CE :methyl 142:sc= -0.296 (180deg=-1.78!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0976 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -0.404 K(o=-0.4,f=-3.8!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -68:sc= 0.896 USER MOD Single : A 106 THR OG1 : rot 67:sc= 1.16 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 103:sc= 0.706 USER MOD Single : A 131 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 133 ASN : amide:sc= -0.0166 K(o=-0.017,f=-1) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.0375 USER MOD Single : A 139 GLN : amide:sc= -0.264 K(o=-0.26,f=-1.4) USER MOD Single : A 140 MET CE :methyl -114:sc= 0 (180deg=-0.0312) USER MOD Single : A 141 MET CE :methyl -140:sc= -0.0509 (180deg=-1.42!) USER MOD Single : A 142 THR OG1 : rot 41:sc= 0.0751 USER MOD Single : B 1 ARG N :NH3+ 149:sc= 0.876 (180deg=0.2) USER MOD Single : B 3 LYS NZ :NH3+ -141:sc= 1.25 (180deg=-0.217!) USER MOD Single : B 5 GLN : amide:sc= 0.973 K(o=0.97,f=-0.062) USER MOD Single : B 6 LYS NZ :NH3+ -161:sc= 2.46 (180deg=2.25) USER MOD Single : B 9 HIS : no HE2:sc= -0.766 X(o=-0.77,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 1.238 1.524 16.661 1.00 0.00 N ATOM 30 CA GLU A 3 0.261 0.863 15.853 1.00 0.00 C ATOM 31 C GLU A 3 0.606 0.807 14.404 1.00 0.00 C ATOM 32 O GLU A 3 0.496 -0.225 13.745 1.00 0.00 O ATOM 33 CB GLU A 3 -1.025 1.705 15.821 1.00 0.00 C ATOM 34 CG GLU A 3 -1.899 1.746 17.077 1.00 0.00 C ATOM 35 CD GLU A 3 -2.953 0.648 17.040 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.579 -0.478 17.464 1.00 0.00 O ATOM 37 OE2 GLU A 3 -4.107 0.843 16.574 1.00 0.00 O ATOM 0 HA GLU A 3 0.181 -0.132 16.291 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.745 2.730 15.578 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.641 1.339 14.999 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.275 1.628 17.963 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -2.384 2.719 17.156 1.00 0.00 H new ATOM 44 N GLN A 4 1.309 1.861 13.950 1.00 0.00 N ATOM 45 CA GLN A 4 1.958 1.755 12.681 1.00 0.00 C ATOM 46 C GLN A 4 3.099 0.819 12.475 1.00 0.00 C ATOM 47 O GLN A 4 3.308 0.239 11.411 1.00 0.00 O ATOM 48 CB GLN A 4 2.408 3.133 12.165 1.00 0.00 C ATOM 49 CG GLN A 4 1.344 4.232 12.178 1.00 0.00 C ATOM 50 CD GLN A 4 1.815 5.538 11.555 1.00 0.00 C ATOM 51 OE1 GLN A 4 2.867 5.588 10.920 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.010 6.609 11.787 1.00 0.00 N ATOM 0 H GLN A 4 1.426 2.750 14.437 1.00 0.00 H new ATOM 0 HA GLN A 4 1.143 1.294 12.122 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.254 3.466 12.766 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.770 3.016 11.143 1.00 0.00 H new ATOM 0 HG2 GLN A 4 0.462 3.880 11.642 1.00 0.00 H new ATOM 0 HG3 GLN A 4 1.038 4.419 13.207 1.00 0.00 H new ATOM 0 HE21 GLN A 4 0.150 6.494 12.323 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.266 7.527 11.425 1.00 0.00 H new ATOM 61 N ILE A 5 3.826 0.593 13.584 1.00 0.00 N ATOM 62 CA ILE A 5 4.829 -0.424 13.522 1.00 0.00 C ATOM 63 C ILE A 5 4.183 -1.757 13.370 1.00 0.00 C ATOM 64 O ILE A 5 4.575 -2.682 12.659 1.00 0.00 O ATOM 65 CB ILE A 5 5.644 -0.345 14.779 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.554 0.887 14.637 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.412 -1.664 14.974 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.826 0.561 13.854 1.00 0.00 C ATOM 0 H ILE A 5 3.731 1.081 14.474 1.00 0.00 H new ATOM 0 HA ILE A 5 5.483 -0.279 12.662 1.00 0.00 H new ATOM 0 HB ILE A 5 5.034 -0.224 15.674 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.010 1.685 14.132 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.821 1.259 15.626 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.005 -1.608 15.887 1.00 0.00 H new ATOM 0 HG22 ILE A 5 5.704 -2.489 15.051 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.072 -1.830 14.123 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.444 1.456 13.774 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.383 -0.219 14.373 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.560 0.214 12.856 1.00 0.00 H new ATOM 80 N ALA A 6 3.098 -1.962 14.137 1.00 0.00 N ATOM 81 CA ALA A 6 2.321 -3.162 14.118 1.00 0.00 C ATOM 82 C ALA A 6 1.709 -3.583 12.826 1.00 0.00 C ATOM 83 O ALA A 6 1.752 -4.735 12.399 1.00 0.00 O ATOM 84 CB ALA A 6 1.242 -3.067 15.210 1.00 0.00 C ATOM 0 H ALA A 6 2.749 -1.266 14.795 1.00 0.00 H new ATOM 0 HA ALA A 6 3.048 -3.953 14.302 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.641 -3.976 15.208 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.719 -2.950 16.183 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.601 -2.208 15.014 1.00 0.00 H new ATOM 90 N GLU A 7 1.082 -2.576 12.192 1.00 0.00 N ATOM 91 CA GLU A 7 0.456 -2.619 10.907 1.00 0.00 C ATOM 92 C GLU A 7 1.434 -2.874 9.812 1.00 0.00 C ATOM 93 O GLU A 7 1.139 -3.479 8.783 1.00 0.00 O ATOM 94 CB GLU A 7 -0.294 -1.300 10.659 1.00 0.00 C ATOM 95 CG GLU A 7 -1.478 -1.318 11.628 1.00 0.00 C ATOM 96 CD GLU A 7 -2.102 0.061 11.791 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.928 0.959 10.925 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.806 0.264 12.817 1.00 0.00 O ATOM 0 H GLU A 7 1.008 -1.652 12.617 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.248 -3.451 10.904 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.351 -0.441 10.843 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.633 -1.229 9.626 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.232 -2.017 11.266 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.146 -1.683 12.600 1.00 0.00 H new ATOM 105 N PHE A 8 2.668 -2.374 10.004 1.00 0.00 N ATOM 106 CA PHE A 8 3.671 -2.704 9.040 1.00 0.00 C ATOM 107 C PHE A 8 4.455 -3.941 9.317 1.00 0.00 C ATOM 108 O PHE A 8 4.886 -4.552 8.340 1.00 0.00 O ATOM 109 CB PHE A 8 4.620 -1.530 8.749 1.00 0.00 C ATOM 110 CG PHE A 8 4.063 -0.593 7.732 1.00 0.00 C ATOM 111 CD1 PHE A 8 3.234 0.454 8.058 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.417 -0.834 6.426 1.00 0.00 C ATOM 113 CE1 PHE A 8 2.894 1.339 7.062 1.00 0.00 C ATOM 114 CE2 PHE A 8 4.035 0.047 5.442 1.00 0.00 C ATOM 115 CZ PHE A 8 3.307 1.170 5.761 1.00 0.00 C ATOM 0 H PHE A 8 2.961 -1.777 10.777 1.00 0.00 H new ATOM 0 HA PHE A 8 3.084 -2.923 8.148 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.816 -0.986 9.673 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.577 -1.917 8.398 1.00 0.00 H new ATOM 0 HD1 PHE A 8 2.862 0.578 9.064 1.00 0.00 H new ATOM 0 HD2 PHE A 8 4.993 -1.712 6.174 1.00 0.00 H new ATOM 0 HE1 PHE A 8 2.283 2.194 7.309 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.308 -0.143 4.414 1.00 0.00 H new ATOM 0 HZ PHE A 8 3.065 1.903 5.006 1.00 0.00 H new ATOM 125 N LYS A 9 4.695 -4.399 10.558 1.00 0.00 N ATOM 126 CA LYS A 9 5.332 -5.614 10.961 1.00 0.00 C ATOM 127 C LYS A 9 4.550 -6.766 10.431 1.00 0.00 C ATOM 128 O LYS A 9 5.099 -7.738 9.913 1.00 0.00 O ATOM 129 CB LYS A 9 5.452 -5.584 12.494 1.00 0.00 C ATOM 130 CG LYS A 9 5.856 -6.956 13.037 1.00 0.00 C ATOM 131 CD LYS A 9 5.976 -7.005 14.562 1.00 0.00 C ATOM 132 CE LYS A 9 6.291 -8.367 15.184 1.00 0.00 C ATOM 133 NZ LYS A 9 5.332 -9.291 14.538 1.00 0.00 N ATOM 0 H LYS A 9 4.408 -3.852 11.370 1.00 0.00 H new ATOM 0 HA LYS A 9 6.338 -5.722 10.556 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.191 -4.839 12.790 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.501 -5.281 12.931 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.121 -7.694 12.716 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.811 -7.244 12.597 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.755 -6.305 14.865 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.040 -6.645 14.989 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.322 -8.664 14.991 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.161 -8.350 16.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.244 -10.155 15.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 4.403 -8.830 14.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 5.674 -9.538 13.587 1.00 0.00 H new ATOM 147 N GLU A 10 3.213 -6.697 10.556 1.00 0.00 N ATOM 148 CA GLU A 10 2.275 -7.551 9.895 1.00 0.00 C ATOM 149 C GLU A 10 2.494 -7.666 8.425 1.00 0.00 C ATOM 150 O GLU A 10 2.572 -8.755 7.858 1.00 0.00 O ATOM 151 CB GLU A 10 0.862 -7.068 10.263 1.00 0.00 C ATOM 152 CG GLU A 10 0.312 -7.577 11.596 1.00 0.00 C ATOM 153 CD GLU A 10 0.274 -9.095 11.691 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.494 -9.720 10.912 1.00 0.00 O ATOM 155 OE2 GLU A 10 1.145 -9.688 12.382 1.00 0.00 O ATOM 0 H GLU A 10 2.761 -6.005 11.153 1.00 0.00 H new ATOM 0 HA GLU A 10 2.417 -8.574 10.244 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.865 -5.978 10.285 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.177 -7.369 9.470 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.925 -7.184 12.408 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.695 -7.186 11.739 1.00 0.00 H new ATOM 162 N ALA A 11 2.668 -6.587 7.642 1.00 0.00 N ATOM 163 CA ALA A 11 2.883 -6.589 6.228 1.00 0.00 C ATOM 164 C ALA A 11 4.200 -7.115 5.770 1.00 0.00 C ATOM 165 O ALA A 11 4.280 -7.886 4.815 1.00 0.00 O ATOM 166 CB ALA A 11 2.667 -5.188 5.632 1.00 0.00 C ATOM 0 H ALA A 11 2.657 -5.643 8.027 1.00 0.00 H new ATOM 0 HA ALA A 11 2.137 -7.293 5.859 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.837 -5.220 4.556 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.645 -4.863 5.828 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.365 -4.487 6.089 1.00 0.00 H new ATOM 172 N PHE A 12 5.315 -6.916 6.494 1.00 0.00 N ATOM 173 CA PHE A 12 6.572 -7.590 6.390 1.00 0.00 C ATOM 174 C PHE A 12 6.462 -9.067 6.545 1.00 0.00 C ATOM 175 O PHE A 12 7.008 -9.881 5.801 1.00 0.00 O ATOM 176 CB PHE A 12 7.469 -6.985 7.484 1.00 0.00 C ATOM 177 CG PHE A 12 8.917 -7.218 7.222 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.684 -6.633 6.242 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.571 -7.948 8.187 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.013 -6.947 6.083 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.924 -8.177 8.096 1.00 0.00 C ATOM 182 CZ PHE A 12 11.661 -7.687 7.044 1.00 0.00 C ATOM 0 H PHE A 12 5.335 -6.208 7.228 1.00 0.00 H new ATOM 0 HA PHE A 12 6.988 -7.447 5.393 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.282 -5.913 7.552 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.203 -7.417 8.449 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.231 -5.909 5.581 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.017 -8.345 9.024 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.547 -6.613 5.205 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.417 -8.753 8.866 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.722 -7.878 6.974 1.00 0.00 H new ATOM 192 N SER A 13 5.773 -9.544 7.597 1.00 0.00 N ATOM 193 CA SER A 13 5.516 -10.941 7.762 1.00 0.00 C ATOM 194 C SER A 13 4.771 -11.696 6.716 1.00 0.00 C ATOM 195 O SER A 13 5.011 -12.889 6.537 1.00 0.00 O ATOM 196 CB SER A 13 4.703 -11.162 9.049 1.00 0.00 C ATOM 197 OG SER A 13 5.502 -10.876 10.187 1.00 0.00 O ATOM 0 H SER A 13 5.391 -8.957 8.339 1.00 0.00 H new ATOM 0 HA SER A 13 6.533 -11.332 7.739 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.820 -10.522 9.045 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.350 -12.192 9.093 1.00 0.00 H new ATOM 0 HG SER A 13 5.540 -9.906 10.325 1.00 0.00 H new ATOM 203 N LEU A 14 3.876 -10.982 6.010 1.00 0.00 N ATOM 204 CA LEU A 14 3.045 -11.370 4.913 1.00 0.00 C ATOM 205 C LEU A 14 3.953 -11.716 3.783 1.00 0.00 C ATOM 206 O LEU A 14 3.721 -12.708 3.095 1.00 0.00 O ATOM 207 CB LEU A 14 2.157 -10.212 4.428 1.00 0.00 C ATOM 208 CG LEU A 14 1.098 -10.620 3.390 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.230 -11.813 3.828 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.177 -9.445 3.021 1.00 0.00 C ATOM 0 H LEU A 14 3.718 -10.002 6.244 1.00 0.00 H new ATOM 0 HA LEU A 14 2.407 -12.194 5.232 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.655 -9.770 5.288 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.792 -9.438 3.997 1.00 0.00 H new ATOM 0 HG LEU A 14 1.673 -10.928 2.517 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.494 -12.043 3.046 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.866 -12.681 4.001 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.298 -11.561 4.748 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.557 -9.775 2.285 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.338 -9.092 3.914 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.772 -8.634 2.601 1.00 0.00 H new ATOM 222 N PHE A 15 5.074 -11.028 3.502 1.00 0.00 N ATOM 223 CA PHE A 15 6.000 -11.170 2.421 1.00 0.00 C ATOM 224 C PHE A 15 6.945 -12.263 2.783 1.00 0.00 C ATOM 225 O PHE A 15 7.122 -13.175 1.977 1.00 0.00 O ATOM 226 CB PHE A 15 6.809 -9.888 2.161 1.00 0.00 C ATOM 227 CG PHE A 15 5.895 -8.958 1.441 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.456 -9.160 0.153 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.464 -7.793 2.029 1.00 0.00 C ATOM 230 CE1 PHE A 15 4.636 -8.269 -0.498 1.00 0.00 C ATOM 231 CE2 PHE A 15 4.705 -6.862 1.359 1.00 0.00 C ATOM 232 CZ PHE A 15 4.284 -7.065 0.066 1.00 0.00 C ATOM 0 H PHE A 15 5.366 -10.271 4.120 1.00 0.00 H new ATOM 0 HA PHE A 15 5.438 -11.388 1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.153 -9.448 3.097 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.696 -10.102 1.564 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.768 -10.054 -0.367 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.732 -7.601 3.058 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.258 -8.521 -1.478 1.00 0.00 H new ATOM 0 HE2 PHE A 15 4.432 -5.946 1.862 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.712 -6.325 -0.474 1.00 0.00 H new ATOM 242 N ASP A 16 7.551 -12.082 3.970 1.00 0.00 N ATOM 243 CA ASP A 16 8.452 -13.096 4.424 1.00 0.00 C ATOM 244 C ASP A 16 7.908 -14.477 4.556 1.00 0.00 C ATOM 245 O ASP A 16 6.975 -14.768 5.303 1.00 0.00 O ATOM 246 CB ASP A 16 9.092 -12.674 5.757 1.00 0.00 C ATOM 247 CG ASP A 16 10.483 -13.264 5.940 1.00 0.00 C ATOM 248 OD1 ASP A 16 10.581 -14.518 5.862 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.495 -12.534 6.115 1.00 0.00 O ATOM 0 H ASP A 16 7.429 -11.279 4.587 1.00 0.00 H new ATOM 0 HA ASP A 16 9.183 -13.167 3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.152 -11.587 5.801 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.453 -12.992 6.581 1.00 0.00 H new ATOM 254 N LYS A 17 8.460 -15.365 3.711 1.00 0.00 N ATOM 255 CA LYS A 17 8.103 -16.750 3.669 1.00 0.00 C ATOM 256 C LYS A 17 8.465 -17.559 4.867 1.00 0.00 C ATOM 257 O LYS A 17 7.653 -18.248 5.483 1.00 0.00 O ATOM 258 CB LYS A 17 8.737 -17.321 2.390 1.00 0.00 C ATOM 259 CG LYS A 17 8.098 -18.608 1.864 1.00 0.00 C ATOM 260 CD LYS A 17 6.708 -18.324 1.293 1.00 0.00 C ATOM 261 CE LYS A 17 5.934 -19.513 0.719 1.00 0.00 C ATOM 262 NZ LYS A 17 6.038 -20.785 1.468 1.00 0.00 N ATOM 0 H LYS A 17 9.179 -15.111 3.034 1.00 0.00 H new ATOM 0 HA LYS A 17 7.015 -16.815 3.667 1.00 0.00 H new ATOM 0 HB2 LYS A 17 8.685 -16.563 1.608 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.793 -17.511 2.581 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.731 -19.046 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.024 -19.339 2.669 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.103 -17.876 2.081 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.812 -17.576 0.507 1.00 0.00 H new ATOM 0 HE2 LYS A 17 4.881 -19.238 0.656 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.280 -19.687 -0.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.476 -21.517 0.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.033 -21.084 1.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 5.678 -20.649 2.434 1.00 0.00 H new ATOM 276 N ASP A 18 9.778 -17.437 5.132 1.00 0.00 N ATOM 277 CA ASP A 18 10.409 -18.175 6.181 1.00 0.00 C ATOM 278 C ASP A 18 9.900 -17.754 7.517 1.00 0.00 C ATOM 279 O ASP A 18 9.631 -18.580 8.387 1.00 0.00 O ATOM 280 CB ASP A 18 11.946 -18.143 6.123 1.00 0.00 C ATOM 281 CG ASP A 18 12.355 -17.868 4.683 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.245 -18.752 3.792 1.00 0.00 O ATOM 283 OD2 ASP A 18 12.814 -16.713 4.474 1.00 0.00 O ATOM 0 H ASP A 18 10.407 -16.822 4.615 1.00 0.00 H new ATOM 0 HA ASP A 18 10.134 -19.218 6.022 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.337 -17.370 6.785 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.360 -19.092 6.463 1.00 0.00 H new ATOM 288 N GLY A 19 9.855 -16.432 7.759 1.00 0.00 N ATOM 289 CA GLY A 19 9.419 -15.850 8.990 1.00 0.00 C ATOM 290 C GLY A 19 10.461 -15.621 10.031 1.00 0.00 C ATOM 291 O GLY A 19 10.350 -15.561 11.255 1.00 0.00 O ATOM 0 H GLY A 19 10.135 -15.738 7.066 1.00 0.00 H new ATOM 0 HA2 GLY A 19 8.947 -14.893 8.765 1.00 0.00 H new ATOM 0 HA3 GLY A 19 8.649 -16.493 9.416 1.00 0.00 H new ATOM 295 N ASP A 20 11.643 -15.448 9.413 1.00 0.00 N ATOM 296 CA ASP A 20 12.854 -15.400 10.172 1.00 0.00 C ATOM 297 C ASP A 20 13.205 -14.002 10.546 1.00 0.00 C ATOM 298 O ASP A 20 13.208 -13.771 11.754 1.00 0.00 O ATOM 299 CB ASP A 20 13.944 -16.029 9.287 1.00 0.00 C ATOM 300 CG ASP A 20 14.223 -15.422 7.919 1.00 0.00 C ATOM 301 OD1 ASP A 20 13.258 -14.926 7.279 1.00 0.00 O ATOM 302 OD2 ASP A 20 15.381 -15.544 7.437 1.00 0.00 O ATOM 0 H ASP A 20 11.760 -15.343 8.405 1.00 0.00 H new ATOM 0 HA ASP A 20 12.747 -15.945 11.110 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.877 -16.012 9.851 1.00 0.00 H new ATOM 0 HB3 ASP A 20 13.682 -17.076 9.135 1.00 0.00 H new ATOM 307 N GLY A 21 13.310 -13.056 9.596 1.00 0.00 N ATOM 308 CA GLY A 21 13.562 -11.688 9.928 1.00 0.00 C ATOM 309 C GLY A 21 13.811 -10.737 8.808 1.00 0.00 C ATOM 310 O GLY A 21 13.731 -9.516 8.938 1.00 0.00 O ATOM 0 H GLY A 21 13.220 -13.239 8.597 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.709 -11.319 10.498 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.426 -11.658 10.592 1.00 0.00 H new ATOM 314 N THR A 22 14.151 -11.229 7.603 1.00 0.00 N ATOM 315 CA THR A 22 14.571 -10.457 6.476 1.00 0.00 C ATOM 316 C THR A 22 14.129 -11.091 5.202 1.00 0.00 C ATOM 317 O THR A 22 14.047 -12.307 5.031 1.00 0.00 O ATOM 318 CB THR A 22 16.051 -10.208 6.483 1.00 0.00 C ATOM 319 OG1 THR A 22 16.775 -11.429 6.489 1.00 0.00 O ATOM 320 CG2 THR A 22 16.657 -9.341 7.599 1.00 0.00 C ATOM 0 H THR A 22 14.131 -12.229 7.405 1.00 0.00 H new ATOM 0 HA THR A 22 14.089 -9.482 6.551 1.00 0.00 H new ATOM 0 HB THR A 22 16.154 -9.625 5.568 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.736 -11.239 6.492 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.735 -9.263 7.454 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.213 -8.346 7.568 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.453 -9.799 8.567 1.00 0.00 H new ATOM 328 N ILE A 23 13.784 -10.229 4.229 1.00 0.00 N ATOM 329 CA ILE A 23 13.213 -10.580 2.966 1.00 0.00 C ATOM 330 C ILE A 23 14.222 -10.540 1.870 1.00 0.00 C ATOM 331 O ILE A 23 14.882 -9.537 1.604 1.00 0.00 O ATOM 332 CB ILE A 23 11.932 -9.877 2.629 1.00 0.00 C ATOM 333 CG1 ILE A 23 10.923 -9.754 3.785 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.260 -10.374 1.338 1.00 0.00 C ATOM 335 CD1 ILE A 23 9.916 -8.650 3.466 1.00 0.00 C ATOM 0 H ILE A 23 13.913 -9.222 4.332 1.00 0.00 H new ATOM 0 HA ILE A 23 12.902 -11.619 3.074 1.00 0.00 H new ATOM 0 HB ILE A 23 12.272 -8.860 2.434 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.405 -10.702 3.933 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.445 -9.528 4.715 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.341 -9.814 1.168 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.936 -10.227 0.496 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.026 -11.434 1.434 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.201 -8.562 4.284 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.442 -7.703 3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.386 -8.896 2.546 1.00 0.00 H new ATOM 347 N THR A 24 14.402 -11.749 1.309 1.00 0.00 N ATOM 348 CA THR A 24 15.292 -12.040 0.228 1.00 0.00 C ATOM 349 C THR A 24 14.677 -11.864 -1.117 1.00 0.00 C ATOM 350 O THR A 24 13.455 -11.836 -1.254 1.00 0.00 O ATOM 351 CB THR A 24 15.933 -13.385 0.407 1.00 0.00 C ATOM 352 OG1 THR A 24 14.962 -14.420 0.370 1.00 0.00 O ATOM 353 CG2 THR A 24 16.584 -13.494 1.796 1.00 0.00 C ATOM 0 H THR A 24 13.895 -12.573 1.630 1.00 0.00 H new ATOM 0 HA THR A 24 16.084 -11.292 0.264 1.00 0.00 H new ATOM 0 HB THR A 24 16.662 -13.487 -0.397 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.423 -14.393 1.188 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.043 -14.476 1.906 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.347 -12.723 1.902 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.824 -13.360 2.566 1.00 0.00 H new ATOM 361 N THR A 25 15.466 -11.732 -2.198 1.00 0.00 N ATOM 362 CA THR A 25 14.966 -11.735 -3.538 1.00 0.00 C ATOM 363 C THR A 25 14.025 -12.827 -3.915 1.00 0.00 C ATOM 364 O THR A 25 12.976 -12.534 -4.487 1.00 0.00 O ATOM 365 CB THR A 25 16.009 -11.680 -4.615 1.00 0.00 C ATOM 366 OG1 THR A 25 17.018 -12.652 -4.381 1.00 0.00 O ATOM 367 CG2 THR A 25 16.673 -10.301 -4.763 1.00 0.00 C ATOM 0 H THR A 25 16.478 -11.620 -2.139 1.00 0.00 H new ATOM 0 HA THR A 25 14.409 -10.799 -3.492 1.00 0.00 H new ATOM 0 HB THR A 25 15.480 -11.888 -5.545 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.634 -12.674 -5.143 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.415 -10.338 -5.560 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.915 -9.557 -5.007 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.160 -10.029 -3.826 1.00 0.00 H new ATOM 375 N LYS A 26 14.349 -14.103 -3.639 1.00 0.00 N ATOM 376 CA LYS A 26 13.606 -15.320 -3.743 1.00 0.00 C ATOM 377 C LYS A 26 12.212 -15.291 -3.219 1.00 0.00 C ATOM 378 O LYS A 26 11.346 -16.021 -3.699 1.00 0.00 O ATOM 379 CB LYS A 26 14.503 -16.423 -3.158 1.00 0.00 C ATOM 380 CG LYS A 26 15.975 -16.435 -3.576 1.00 0.00 C ATOM 381 CD LYS A 26 16.703 -17.717 -3.165 1.00 0.00 C ATOM 382 CE LYS A 26 18.108 -17.754 -3.770 1.00 0.00 C ATOM 383 NZ LYS A 26 18.910 -16.712 -3.091 1.00 0.00 N ATOM 0 H LYS A 26 15.285 -14.304 -3.287 1.00 0.00 H new ATOM 0 HA LYS A 26 13.388 -15.520 -4.792 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.463 -16.347 -2.071 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.070 -17.386 -3.427 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.041 -16.317 -4.658 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.480 -15.578 -3.131 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.767 -17.773 -2.078 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.135 -18.587 -3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 26 18.559 -18.736 -3.632 1.00 0.00 H new ATOM 0 HE3 LYS A 26 18.069 -17.569 -4.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.917 -16.850 -3.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.608 -15.773 -3.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.769 -16.781 -2.063 1.00 0.00 H new ATOM 397 N GLU A 27 12.007 -14.532 -2.128 1.00 0.00 N ATOM 398 CA GLU A 27 10.768 -14.474 -1.416 1.00 0.00 C ATOM 399 C GLU A 27 9.904 -13.500 -2.140 1.00 0.00 C ATOM 400 O GLU A 27 8.675 -13.532 -2.187 1.00 0.00 O ATOM 401 CB GLU A 27 10.903 -14.195 0.090 1.00 0.00 C ATOM 402 CG GLU A 27 11.721 -15.207 0.895 1.00 0.00 C ATOM 403 CD GLU A 27 12.101 -14.649 2.260 1.00 0.00 C ATOM 404 OE1 GLU A 27 11.226 -14.567 3.163 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.274 -14.269 2.517 1.00 0.00 O ATOM 0 H GLU A 27 12.731 -13.936 -1.727 1.00 0.00 H new ATOM 0 HA GLU A 27 10.304 -15.460 -1.411 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.355 -13.211 0.217 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.903 -14.144 0.520 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.146 -16.124 1.022 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.623 -15.470 0.343 1.00 0.00 H new ATOM 412 N LEU A 28 10.485 -12.464 -2.771 1.00 0.00 N ATOM 413 CA LEU A 28 9.789 -11.424 -3.463 1.00 0.00 C ATOM 414 C LEU A 28 9.474 -11.982 -4.808 1.00 0.00 C ATOM 415 O LEU A 28 8.391 -11.756 -5.345 1.00 0.00 O ATOM 416 CB LEU A 28 10.724 -10.227 -3.706 1.00 0.00 C ATOM 417 CG LEU A 28 11.184 -9.499 -2.431 1.00 0.00 C ATOM 418 CD1 LEU A 28 12.290 -8.491 -2.787 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.040 -8.668 -1.826 1.00 0.00 C ATOM 0 H LEU A 28 11.498 -12.346 -2.799 1.00 0.00 H new ATOM 0 HA LEU A 28 8.917 -11.104 -2.893 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.604 -10.575 -4.246 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.215 -9.512 -4.352 1.00 0.00 H new ATOM 0 HG LEU A 28 11.525 -10.260 -1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.616 -7.975 -1.884 1.00 0.00 H new ATOM 0 HD12 LEU A 28 13.135 -9.019 -3.229 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.903 -7.764 -3.501 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.393 -8.164 -0.926 1.00 0.00 H new ATOM 0 HD22 LEU A 28 9.707 -7.925 -2.551 1.00 0.00 H new ATOM 0 HD23 LEU A 28 9.208 -9.325 -1.572 1.00 0.00 H new ATOM 431 N GLY A 29 10.377 -12.734 -5.462 1.00 0.00 N ATOM 432 CA GLY A 29 10.033 -13.486 -6.628 1.00 0.00 C ATOM 433 C GLY A 29 8.830 -14.357 -6.507 1.00 0.00 C ATOM 434 O GLY A 29 7.901 -14.325 -7.313 1.00 0.00 O ATOM 0 H GLY A 29 11.353 -12.821 -5.180 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.873 -12.790 -7.452 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.884 -14.110 -6.899 1.00 0.00 H new ATOM 438 N THR A 30 8.842 -15.165 -5.433 1.00 0.00 N ATOM 439 CA THR A 30 7.739 -16.006 -5.085 1.00 0.00 C ATOM 440 C THR A 30 6.501 -15.229 -4.794 1.00 0.00 C ATOM 441 O THR A 30 5.427 -15.801 -4.973 1.00 0.00 O ATOM 442 CB THR A 30 8.136 -16.975 -4.011 1.00 0.00 C ATOM 443 OG1 THR A 30 9.326 -17.605 -4.463 1.00 0.00 O ATOM 444 CG2 THR A 30 7.160 -18.158 -3.900 1.00 0.00 C ATOM 0 H THR A 30 9.633 -15.236 -4.793 1.00 0.00 H new ATOM 0 HA THR A 30 7.472 -16.609 -5.953 1.00 0.00 H new ATOM 0 HB THR A 30 8.196 -16.422 -3.073 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.104 -17.113 -4.127 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.492 -18.830 -3.109 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.163 -17.786 -3.666 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.133 -18.697 -4.847 1.00 0.00 H new ATOM 452 N VAL A 31 6.507 -14.009 -4.229 1.00 0.00 N ATOM 453 CA VAL A 31 5.335 -13.298 -3.821 1.00 0.00 C ATOM 454 C VAL A 31 4.601 -12.776 -5.008 1.00 0.00 C ATOM 455 O VAL A 31 3.419 -12.970 -5.289 1.00 0.00 O ATOM 456 CB VAL A 31 5.477 -12.357 -2.661 1.00 0.00 C ATOM 457 CG1 VAL A 31 5.849 -10.950 -3.159 1.00 0.00 C ATOM 458 CG2 VAL A 31 4.219 -12.379 -1.776 1.00 0.00 C ATOM 0 H VAL A 31 7.369 -13.494 -4.048 1.00 0.00 H new ATOM 0 HA VAL A 31 4.688 -14.036 -3.347 1.00 0.00 H new ATOM 0 HB VAL A 31 6.296 -12.691 -2.024 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.949 -10.277 -2.307 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.794 -10.994 -3.700 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.068 -10.581 -3.823 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.348 -11.688 -0.943 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.354 -12.078 -2.366 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.063 -13.387 -1.391 1.00 0.00 H new ATOM 468 N MET A 32 5.407 -12.210 -5.923 1.00 0.00 N ATOM 469 CA MET A 32 4.891 -11.673 -7.144 1.00 0.00 C ATOM 470 C MET A 32 4.371 -12.723 -8.065 1.00 0.00 C ATOM 471 O MET A 32 3.372 -12.490 -8.744 1.00 0.00 O ATOM 472 CB MET A 32 5.978 -10.752 -7.725 1.00 0.00 C ATOM 473 CG MET A 32 6.499 -9.589 -6.880 1.00 0.00 C ATOM 474 SD MET A 32 7.541 -8.423 -7.807 1.00 0.00 S ATOM 475 CE MET A 32 7.422 -7.208 -6.463 1.00 0.00 C ATOM 0 H MET A 32 6.418 -12.124 -5.817 1.00 0.00 H new ATOM 0 HA MET A 32 3.997 -11.074 -6.968 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.832 -11.377 -7.986 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.592 -10.335 -8.655 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.651 -9.049 -6.458 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.071 -9.988 -6.042 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.059 -6.353 -6.688 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.389 -6.875 -6.364 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.747 -7.666 -5.529 1.00 0.00 H new ATOM 485 N ARG A 33 5.024 -13.898 -8.052 1.00 0.00 N ATOM 486 CA ARG A 33 4.554 -15.026 -8.795 1.00 0.00 C ATOM 487 C ARG A 33 3.264 -15.608 -8.329 1.00 0.00 C ATOM 488 O ARG A 33 2.470 -16.003 -9.181 1.00 0.00 O ATOM 489 CB ARG A 33 5.704 -16.034 -8.632 1.00 0.00 C ATOM 490 CG ARG A 33 5.548 -17.301 -9.475 1.00 0.00 C ATOM 491 CD ARG A 33 6.477 -18.424 -9.010 1.00 0.00 C ATOM 492 NE ARG A 33 7.882 -18.065 -9.352 1.00 0.00 N ATOM 493 CZ ARG A 33 8.869 -18.050 -8.409 1.00 0.00 C ATOM 494 NH1 ARG A 33 8.857 -18.856 -7.308 1.00 0.00 N ATOM 495 NH2 ARG A 33 9.887 -17.149 -8.531 1.00 0.00 N ATOM 0 H ARG A 33 5.881 -14.068 -7.525 1.00 0.00 H new ATOM 0 HA ARG A 33 4.323 -14.744 -9.822 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.641 -15.546 -8.899 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.779 -16.316 -7.582 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.514 -17.643 -9.425 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.757 -17.068 -10.519 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.378 -18.574 -7.935 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.201 -19.363 -9.489 1.00 0.00 H new ATOM 0 HE ARG A 33 8.112 -17.824 -10.316 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.086 -19.508 -7.161 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.619 -18.807 -6.632 1.00 0.00 H new ATOM 0 HH21 ARG A 33 9.902 -16.500 -9.318 1.00 0.00 H new ATOM 0 HH22 ARG A 33 10.632 -17.124 -7.835 1.00 0.00 H new ATOM 509 N SER A 34 3.045 -15.654 -7.003 1.00 0.00 N ATOM 510 CA SER A 34 1.782 -16.018 -6.439 1.00 0.00 C ATOM 511 C SER A 34 0.642 -15.094 -6.693 1.00 0.00 C ATOM 512 O SER A 34 -0.516 -15.508 -6.717 1.00 0.00 O ATOM 513 CB SER A 34 1.998 -16.217 -4.929 1.00 0.00 C ATOM 514 OG SER A 34 0.852 -16.721 -4.260 1.00 0.00 O ATOM 0 H SER A 34 3.759 -15.434 -6.309 1.00 0.00 H new ATOM 0 HA SER A 34 1.467 -16.929 -6.948 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.831 -16.903 -4.775 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.282 -15.265 -4.481 1.00 0.00 H new ATOM 0 HG SER A 34 0.880 -16.454 -3.317 1.00 0.00 H new ATOM 520 N LEU A 35 0.896 -13.790 -6.905 1.00 0.00 N ATOM 521 CA LEU A 35 0.027 -12.932 -7.650 1.00 0.00 C ATOM 522 C LEU A 35 -0.017 -13.310 -9.091 1.00 0.00 C ATOM 523 O LEU A 35 -1.014 -13.923 -9.469 1.00 0.00 O ATOM 524 CB LEU A 35 0.435 -11.449 -7.633 1.00 0.00 C ATOM 525 CG LEU A 35 0.519 -10.997 -6.165 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.876 -9.503 -6.105 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.690 -11.501 -5.359 1.00 0.00 C ATOM 0 H LEU A 35 1.728 -13.320 -6.549 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.935 -13.058 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.396 -11.312 -8.130 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.293 -10.847 -8.176 1.00 0.00 H new ATOM 0 HG LEU A 35 1.344 -11.472 -5.634 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.935 -9.185 -5.064 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.838 -9.339 -6.590 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.108 -8.924 -6.618 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.603 -11.166 -4.325 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.608 -11.104 -5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -0.717 -12.590 -5.387 1.00 0.00 H new ATOM 539 N GLY A 36 0.981 -12.889 -9.888 1.00 0.00 N ATOM 540 CA GLY A 36 0.923 -13.070 -11.306 1.00 0.00 C ATOM 541 C GLY A 36 2.083 -12.520 -12.062 1.00 0.00 C ATOM 542 O GLY A 36 1.903 -11.849 -13.077 1.00 0.00 O ATOM 0 H GLY A 36 1.825 -12.425 -9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.844 -14.136 -11.517 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.012 -12.603 -11.679 1.00 0.00 H new ATOM 546 N GLN A 37 3.360 -12.664 -11.666 1.00 0.00 N ATOM 547 CA GLN A 37 4.439 -11.938 -12.259 1.00 0.00 C ATOM 548 C GLN A 37 5.660 -12.792 -12.264 1.00 0.00 C ATOM 549 O GLN A 37 5.927 -13.596 -11.372 1.00 0.00 O ATOM 550 CB GLN A 37 4.639 -10.736 -11.321 1.00 0.00 C ATOM 551 CG GLN A 37 5.326 -9.546 -11.993 1.00 0.00 C ATOM 552 CD GLN A 37 4.527 -8.679 -12.954 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.592 -7.950 -12.625 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.838 -8.772 -14.275 1.00 0.00 N ATOM 0 H GLN A 37 3.648 -13.297 -10.920 1.00 0.00 H new ATOM 0 HA GLN A 37 4.243 -11.636 -13.288 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.669 -10.417 -10.939 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.232 -11.050 -10.462 1.00 0.00 H new ATOM 0 HG2 GLN A 37 5.707 -8.898 -11.204 1.00 0.00 H new ATOM 0 HG3 GLN A 37 6.190 -9.929 -12.536 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.608 -9.369 -14.577 1.00 0.00 H new ATOM 0 HE22 GLN A 37 4.301 -8.245 -14.964 1.00 0.00 H new ATOM 563 N ASN A 38 6.577 -12.656 -13.239 1.00 0.00 N ATOM 564 CA ASN A 38 7.936 -13.096 -13.293 1.00 0.00 C ATOM 565 C ASN A 38 8.941 -12.001 -13.182 1.00 0.00 C ATOM 566 O ASN A 38 9.447 -11.579 -14.220 1.00 0.00 O ATOM 567 CB ASN A 38 8.188 -13.837 -14.617 1.00 0.00 C ATOM 568 CG ASN A 38 7.205 -14.972 -14.864 1.00 0.00 C ATOM 569 OD1 ASN A 38 6.852 -15.731 -13.963 1.00 0.00 O ATOM 570 ND2 ASN A 38 6.543 -14.962 -16.052 1.00 0.00 N ATOM 0 H ASN A 38 6.326 -12.172 -14.101 1.00 0.00 H new ATOM 0 HA ASN A 38 8.066 -13.745 -12.427 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.127 -13.126 -15.441 1.00 0.00 H new ATOM 0 HB3 ASN A 38 9.202 -14.237 -14.615 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.750 -15.586 -16.199 1.00 0.00 H new ATOM 0 HD22 ASN A 38 6.840 -14.331 -16.796 1.00 0.00 H new ATOM 577 N PRO A 39 9.233 -11.400 -12.066 1.00 0.00 N ATOM 578 CA PRO A 39 10.267 -10.408 -12.101 1.00 0.00 C ATOM 579 C PRO A 39 11.637 -10.984 -12.208 1.00 0.00 C ATOM 580 O PRO A 39 11.827 -12.191 -12.065 1.00 0.00 O ATOM 581 CB PRO A 39 10.181 -9.843 -10.685 1.00 0.00 C ATOM 582 CG PRO A 39 9.628 -11.019 -9.864 1.00 0.00 C ATOM 583 CD PRO A 39 8.578 -11.651 -10.792 1.00 0.00 C ATOM 0 HA PRO A 39 10.131 -9.730 -12.943 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.157 -9.523 -10.321 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.523 -8.976 -10.638 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.412 -11.730 -9.605 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.183 -10.680 -8.929 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.426 -12.713 -10.597 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.603 -11.170 -10.716 1.00 0.00 H new ATOM 591 N THR A 40 12.649 -10.168 -12.552 1.00 0.00 N ATOM 592 CA THR A 40 14.010 -10.604 -12.610 1.00 0.00 C ATOM 593 C THR A 40 14.804 -10.095 -11.457 1.00 0.00 C ATOM 594 O THR A 40 14.404 -9.086 -10.878 1.00 0.00 O ATOM 595 CB THR A 40 14.664 -10.318 -13.929 1.00 0.00 C ATOM 596 OG1 THR A 40 15.655 -11.309 -14.157 1.00 0.00 O ATOM 597 CG2 THR A 40 15.409 -8.997 -14.183 1.00 0.00 C ATOM 0 H THR A 40 12.520 -9.186 -12.795 1.00 0.00 H new ATOM 0 HA THR A 40 13.987 -11.691 -12.526 1.00 0.00 H new ATOM 0 HB THR A 40 13.789 -10.283 -14.578 1.00 0.00 H new ATOM 0 HG1 THR A 40 16.094 -11.141 -15.017 1.00 0.00 H new ATOM 0 HG21 THR A 40 15.807 -8.993 -15.198 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.720 -8.161 -14.060 1.00 0.00 H new ATOM 0 HG23 THR A 40 16.229 -8.899 -13.472 1.00 0.00 H new ATOM 605 N GLU A 41 15.891 -10.781 -11.061 1.00 0.00 N ATOM 606 CA GLU A 41 16.502 -10.527 -9.794 1.00 0.00 C ATOM 607 C GLU A 41 17.135 -9.182 -9.891 1.00 0.00 C ATOM 608 O GLU A 41 17.086 -8.485 -8.879 1.00 0.00 O ATOM 609 CB GLU A 41 17.491 -11.651 -9.440 1.00 0.00 C ATOM 610 CG GLU A 41 17.877 -11.633 -7.960 1.00 0.00 C ATOM 611 CD GLU A 41 18.604 -12.915 -7.579 1.00 0.00 C ATOM 612 OE1 GLU A 41 19.714 -13.155 -8.126 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.122 -13.564 -6.612 1.00 0.00 O ATOM 0 H GLU A 41 16.345 -11.508 -11.615 1.00 0.00 H new ATOM 0 HA GLU A 41 15.778 -10.521 -8.979 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.047 -12.615 -9.687 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.389 -11.549 -10.050 1.00 0.00 H new ATOM 0 HG2 GLU A 41 18.514 -10.773 -7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.983 -11.520 -7.347 1.00 0.00 H new ATOM 620 N ALA A 42 17.665 -8.687 -11.024 1.00 0.00 N ATOM 621 CA ALA A 42 18.133 -7.345 -11.181 1.00 0.00 C ATOM 622 C ALA A 42 17.203 -6.232 -10.842 1.00 0.00 C ATOM 623 O ALA A 42 17.608 -5.171 -10.369 1.00 0.00 O ATOM 624 CB ALA A 42 18.731 -7.168 -12.587 1.00 0.00 C ATOM 0 H ALA A 42 17.772 -9.248 -11.869 1.00 0.00 H new ATOM 0 HA ALA A 42 18.891 -7.242 -10.404 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.087 -6.145 -12.705 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.564 -7.859 -12.718 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.967 -7.375 -13.336 1.00 0.00 H new ATOM 630 N GLU A 43 15.907 -6.461 -11.120 1.00 0.00 N ATOM 631 CA GLU A 43 14.856 -5.537 -10.828 1.00 0.00 C ATOM 632 C GLU A 43 14.534 -5.516 -9.373 1.00 0.00 C ATOM 633 O GLU A 43 14.187 -4.523 -8.736 1.00 0.00 O ATOM 634 CB GLU A 43 13.600 -5.895 -11.641 1.00 0.00 C ATOM 635 CG GLU A 43 13.667 -5.577 -13.136 1.00 0.00 C ATOM 636 CD GLU A 43 12.430 -6.117 -13.840 1.00 0.00 C ATOM 637 OE1 GLU A 43 12.029 -7.292 -13.625 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.825 -5.298 -14.582 1.00 0.00 O ATOM 0 H GLU A 43 15.580 -7.319 -11.563 1.00 0.00 H new ATOM 0 HA GLU A 43 15.198 -4.541 -11.108 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.404 -6.961 -11.523 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.749 -5.365 -11.213 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.738 -4.499 -13.284 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.564 -6.018 -13.570 1.00 0.00 H new ATOM 645 N LEU A 44 14.778 -6.688 -8.759 1.00 0.00 N ATOM 646 CA LEU A 44 14.530 -6.870 -7.363 1.00 0.00 C ATOM 647 C LEU A 44 15.641 -6.268 -6.574 1.00 0.00 C ATOM 648 O LEU A 44 15.335 -5.558 -5.617 1.00 0.00 O ATOM 649 CB LEU A 44 14.232 -8.334 -7.000 1.00 0.00 C ATOM 650 CG LEU A 44 12.908 -8.815 -7.618 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.795 -10.341 -7.462 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.690 -8.128 -6.980 1.00 0.00 C ATOM 0 H LEU A 44 15.148 -7.512 -9.232 1.00 0.00 H new ATOM 0 HA LEU A 44 13.616 -6.340 -7.097 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.047 -8.968 -7.347 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.187 -8.438 -5.916 1.00 0.00 H new ATOM 0 HG LEU A 44 12.914 -8.547 -8.675 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.857 -10.683 -7.900 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.630 -10.822 -7.972 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.818 -10.601 -6.404 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.777 -8.498 -7.447 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.666 -8.348 -5.913 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.762 -7.050 -7.127 1.00 0.00 H new ATOM 664 N GLN A 45 16.867 -6.397 -7.113 1.00 0.00 N ATOM 665 CA GLN A 45 17.943 -5.824 -6.366 1.00 0.00 C ATOM 666 C GLN A 45 17.971 -4.344 -6.542 1.00 0.00 C ATOM 667 O GLN A 45 18.579 -3.661 -5.719 1.00 0.00 O ATOM 668 CB GLN A 45 19.256 -6.284 -7.022 1.00 0.00 C ATOM 669 CG GLN A 45 19.526 -7.753 -6.690 1.00 0.00 C ATOM 670 CD GLN A 45 20.766 -8.277 -7.399 1.00 0.00 C ATOM 671 OE1 GLN A 45 21.264 -7.727 -8.380 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.231 -9.494 -7.006 1.00 0.00 N ATOM 0 H GLN A 45 17.104 -6.858 -7.992 1.00 0.00 H new ATOM 0 HA GLN A 45 17.826 -6.111 -5.321 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.197 -6.153 -8.102 1.00 0.00 H new ATOM 0 HB3 GLN A 45 20.083 -5.666 -6.671 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.649 -7.865 -5.613 1.00 0.00 H new ATOM 0 HG3 GLN A 45 18.663 -8.354 -6.976 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.824 -9.957 -6.194 1.00 0.00 H new ATOM 0 HE22 GLN A 45 21.987 -9.943 -7.524 1.00 0.00 H new ATOM 681 N ASP A 46 17.416 -3.774 -7.626 1.00 0.00 N ATOM 682 CA ASP A 46 17.330 -2.366 -7.859 1.00 0.00 C ATOM 683 C ASP A 46 16.478 -1.657 -6.862 1.00 0.00 C ATOM 684 O ASP A 46 16.763 -0.584 -6.332 1.00 0.00 O ATOM 685 CB ASP A 46 16.955 -2.193 -9.340 1.00 0.00 C ATOM 686 CG ASP A 46 16.885 -0.741 -9.791 1.00 0.00 C ATOM 687 OD1 ASP A 46 17.918 -0.046 -9.601 1.00 0.00 O ATOM 688 OD2 ASP A 46 15.828 -0.266 -10.287 1.00 0.00 O ATOM 0 H ASP A 46 17.006 -4.325 -8.380 1.00 0.00 H new ATOM 0 HA ASP A 46 18.284 -1.865 -7.693 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.686 -2.719 -9.954 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.989 -2.666 -9.518 1.00 0.00 H new ATOM 693 N MET A 47 15.407 -2.383 -6.496 1.00 0.00 N ATOM 694 CA MET A 47 14.456 -2.014 -5.494 1.00 0.00 C ATOM 695 C MET A 47 15.022 -2.106 -4.119 1.00 0.00 C ATOM 696 O MET A 47 14.902 -1.188 -3.308 1.00 0.00 O ATOM 697 CB MET A 47 13.147 -2.812 -5.609 1.00 0.00 C ATOM 698 CG MET A 47 12.024 -2.465 -4.629 1.00 0.00 C ATOM 699 SD MET A 47 11.559 -3.808 -3.495 1.00 0.00 S ATOM 700 CE MET A 47 10.591 -4.962 -4.509 1.00 0.00 C ATOM 0 H MET A 47 15.192 -3.283 -6.926 1.00 0.00 H new ATOM 0 HA MET A 47 14.214 -0.967 -5.678 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.763 -2.685 -6.621 1.00 0.00 H new ATOM 0 HB3 MET A 47 13.385 -3.869 -5.489 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.329 -1.600 -4.040 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.143 -2.168 -5.198 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.271 -5.805 -3.896 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.715 -4.450 -4.907 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.205 -5.325 -5.333 1.00 0.00 H new ATOM 710 N ILE A 48 15.770 -3.200 -3.886 1.00 0.00 N ATOM 711 CA ILE A 48 16.454 -3.357 -2.641 1.00 0.00 C ATOM 712 C ILE A 48 17.506 -2.327 -2.410 1.00 0.00 C ATOM 713 O ILE A 48 17.499 -1.502 -1.498 1.00 0.00 O ATOM 714 CB ILE A 48 16.997 -4.750 -2.517 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.834 -5.752 -2.428 1.00 0.00 C ATOM 716 CG2 ILE A 48 18.016 -4.932 -1.380 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.180 -7.153 -2.931 1.00 0.00 C ATOM 0 H ILE A 48 15.900 -3.965 -4.549 1.00 0.00 H new ATOM 0 HA ILE A 48 15.720 -3.198 -1.851 1.00 0.00 H new ATOM 0 HB ILE A 48 17.573 -4.950 -3.420 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.506 -5.820 -1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.992 -5.368 -3.004 1.00 0.00 H new ATOM 0 HG21 ILE A 48 18.358 -5.967 -1.360 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.867 -4.271 -1.545 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.546 -4.687 -0.428 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.308 -7.800 -2.835 1.00 0.00 H new ATOM 0 HD12 ILE A 48 16.479 -7.100 -3.978 1.00 0.00 H new ATOM 0 HD13 ILE A 48 17.000 -7.560 -2.339 1.00 0.00 H new ATOM 729 N ASN A 49 18.476 -2.160 -3.327 1.00 0.00 N ATOM 730 CA ASN A 49 19.607 -1.298 -3.184 1.00 0.00 C ATOM 731 C ASN A 49 19.341 0.162 -3.050 1.00 0.00 C ATOM 732 O ASN A 49 20.144 0.898 -2.479 1.00 0.00 O ATOM 733 CB ASN A 49 20.620 -1.504 -4.324 1.00 0.00 C ATOM 734 CG ASN A 49 21.348 -2.834 -4.199 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.428 -3.466 -3.147 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.839 -3.295 -5.381 1.00 0.00 N ATOM 0 H ASN A 49 18.469 -2.655 -4.219 1.00 0.00 H new ATOM 0 HA ASN A 49 20.007 -1.610 -2.219 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.102 -1.462 -5.282 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.345 -0.690 -4.317 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.299 -4.204 -5.422 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.747 -2.731 -6.226 1.00 0.00 H new ATOM 743 N GLU A 50 18.144 0.670 -3.395 1.00 0.00 N ATOM 744 CA GLU A 50 17.733 2.019 -3.159 1.00 0.00 C ATOM 745 C GLU A 50 17.633 2.277 -1.695 1.00 0.00 C ATOM 746 O GLU A 50 18.101 3.326 -1.256 1.00 0.00 O ATOM 747 CB GLU A 50 16.352 2.212 -3.807 1.00 0.00 C ATOM 748 CG GLU A 50 16.055 3.712 -3.856 1.00 0.00 C ATOM 749 CD GLU A 50 14.882 3.986 -4.786 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.950 3.607 -5.985 1.00 0.00 O ATOM 751 OE2 GLU A 50 13.867 4.602 -4.364 1.00 0.00 O ATOM 0 H GLU A 50 17.428 0.112 -3.861 1.00 0.00 H new ATOM 0 HA GLU A 50 18.460 2.711 -3.584 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.340 1.789 -4.811 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.586 1.691 -3.233 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.828 4.078 -2.855 1.00 0.00 H new ATOM 0 HG3 GLU A 50 16.936 4.253 -4.201 1.00 0.00 H new ATOM 758 N VAL A 51 17.052 1.358 -0.904 1.00 0.00 N ATOM 759 CA VAL A 51 16.747 1.459 0.490 1.00 0.00 C ATOM 760 C VAL A 51 17.657 0.618 1.318 1.00 0.00 C ATOM 761 O VAL A 51 17.686 0.689 2.545 1.00 0.00 O ATOM 762 CB VAL A 51 15.320 1.067 0.737 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.408 2.051 -0.015 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.093 -0.399 0.332 1.00 0.00 C ATOM 0 H VAL A 51 16.768 0.454 -1.281 1.00 0.00 H new ATOM 0 HA VAL A 51 16.895 2.498 0.785 1.00 0.00 H new ATOM 0 HB VAL A 51 15.076 1.127 1.798 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.365 1.782 0.153 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.585 3.063 0.350 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.627 2.007 -1.082 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.054 -0.671 0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.318 -0.523 -0.727 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.746 -1.044 0.920 1.00 0.00 H new ATOM 774 N ASP A 52 18.511 -0.279 0.795 1.00 0.00 N ATOM 775 CA ASP A 52 19.520 -0.983 1.524 1.00 0.00 C ATOM 776 C ASP A 52 20.622 -0.119 2.036 1.00 0.00 C ATOM 777 O ASP A 52 21.654 0.133 1.416 1.00 0.00 O ATOM 778 CB ASP A 52 19.907 -2.159 0.612 1.00 0.00 C ATOM 779 CG ASP A 52 20.806 -3.236 1.203 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.311 -3.939 2.124 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.912 -3.551 0.689 1.00 0.00 O ATOM 0 H ASP A 52 18.496 -0.527 -0.194 1.00 0.00 H new ATOM 0 HA ASP A 52 19.162 -1.369 2.478 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.989 -2.637 0.270 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.403 -1.753 -0.270 1.00 0.00 H new ATOM 786 N ALA A 53 20.391 0.249 3.309 1.00 0.00 N ATOM 787 CA ALA A 53 21.257 0.985 4.176 1.00 0.00 C ATOM 788 C ALA A 53 22.482 0.263 4.620 1.00 0.00 C ATOM 789 O ALA A 53 23.576 0.820 4.699 1.00 0.00 O ATOM 790 CB ALA A 53 20.428 1.406 5.401 1.00 0.00 C ATOM 0 H ALA A 53 19.515 0.007 3.772 1.00 0.00 H new ATOM 0 HA ALA A 53 21.634 1.834 3.605 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.056 1.972 6.089 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.592 2.027 5.079 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.047 0.518 5.905 1.00 0.00 H new ATOM 796 N ASP A 54 22.324 -1.025 4.976 1.00 0.00 N ATOM 797 CA ASP A 54 23.399 -1.804 5.506 1.00 0.00 C ATOM 798 C ASP A 54 24.341 -2.310 4.469 1.00 0.00 C ATOM 799 O ASP A 54 25.569 -2.255 4.525 1.00 0.00 O ATOM 800 CB ASP A 54 22.956 -3.027 6.326 1.00 0.00 C ATOM 801 CG ASP A 54 21.700 -3.617 5.700 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.692 -3.913 4.476 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.722 -3.797 6.475 1.00 0.00 O ATOM 0 H ASP A 54 21.442 -1.530 4.895 1.00 0.00 H new ATOM 0 HA ASP A 54 23.896 -1.085 6.157 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.751 -3.773 6.349 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.761 -2.737 7.359 1.00 0.00 H new ATOM 808 N GLY A 55 23.858 -2.800 3.313 1.00 0.00 N ATOM 809 CA GLY A 55 24.675 -3.480 2.356 1.00 0.00 C ATOM 810 C GLY A 55 24.566 -4.962 2.462 1.00 0.00 C ATOM 811 O GLY A 55 25.594 -5.475 2.021 1.00 0.00 O ATOM 0 H GLY A 55 22.879 -2.722 3.037 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.388 -3.169 1.352 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.715 -3.185 2.496 1.00 0.00 H new ATOM 815 N ASN A 56 23.438 -5.471 2.988 1.00 0.00 N ATOM 816 CA ASN A 56 23.342 -6.894 3.080 1.00 0.00 C ATOM 817 C ASN A 56 22.726 -7.494 1.863 1.00 0.00 C ATOM 818 O ASN A 56 23.008 -8.653 1.561 1.00 0.00 O ATOM 819 CB ASN A 56 22.628 -7.340 4.367 1.00 0.00 C ATOM 820 CG ASN A 56 21.200 -6.869 4.606 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.405 -6.441 3.772 1.00 0.00 O ATOM 822 ND2 ASN A 56 20.788 -6.930 5.901 1.00 0.00 N ATOM 0 H ASN A 56 22.639 -4.938 3.330 1.00 0.00 H new ATOM 0 HA ASN A 56 24.362 -7.275 3.136 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.625 -8.430 4.384 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.232 -7.010 5.212 1.00 0.00 H new ATOM 0 HD21 ASN A 56 19.847 -6.626 6.152 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.420 -7.280 6.621 1.00 0.00 H new ATOM 829 N GLY A 57 21.997 -6.723 1.038 1.00 0.00 N ATOM 830 CA GLY A 57 21.314 -7.192 -0.128 1.00 0.00 C ATOM 831 C GLY A 57 19.926 -7.645 0.169 1.00 0.00 C ATOM 832 O GLY A 57 19.325 -8.177 -0.762 1.00 0.00 O ATOM 0 H GLY A 57 21.878 -5.722 1.192 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.282 -6.396 -0.872 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.876 -8.016 -0.568 1.00 0.00 H new ATOM 836 N THR A 58 19.400 -7.513 1.400 1.00 0.00 N ATOM 837 CA THR A 58 18.081 -7.959 1.725 1.00 0.00 C ATOM 838 C THR A 58 17.285 -6.793 2.201 1.00 0.00 C ATOM 839 O THR A 58 17.846 -5.761 2.565 1.00 0.00 O ATOM 840 CB THR A 58 18.049 -9.111 2.685 1.00 0.00 C ATOM 841 OG1 THR A 58 18.781 -8.900 3.883 1.00 0.00 O ATOM 842 CG2 THR A 58 18.700 -10.382 2.113 1.00 0.00 C ATOM 0 H THR A 58 19.899 -7.090 2.182 1.00 0.00 H new ATOM 0 HA THR A 58 17.627 -8.363 0.820 1.00 0.00 H new ATOM 0 HB THR A 58 16.980 -9.212 2.872 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.062 -7.963 3.934 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.647 -11.182 2.852 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.171 -10.687 1.210 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.743 -10.179 1.871 1.00 0.00 H new ATOM 850 N ILE A 59 15.942 -6.862 2.218 1.00 0.00 N ATOM 851 CA ILE A 59 15.168 -5.787 2.758 1.00 0.00 C ATOM 852 C ILE A 59 14.816 -6.115 4.168 1.00 0.00 C ATOM 853 O ILE A 59 14.190 -7.152 4.379 1.00 0.00 O ATOM 854 CB ILE A 59 14.122 -5.278 1.811 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.556 -3.935 2.299 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.104 -6.355 1.396 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.883 -3.248 1.112 1.00 0.00 C ATOM 0 H ILE A 59 15.398 -7.649 1.864 1.00 0.00 H new ATOM 0 HA ILE A 59 15.741 -4.864 2.849 1.00 0.00 H new ATOM 0 HB ILE A 59 14.590 -5.045 0.855 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.839 -4.094 3.104 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.353 -3.309 2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.375 -5.922 0.711 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.624 -7.176 0.902 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.591 -6.731 2.281 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.472 -2.290 1.431 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.617 -3.083 0.323 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.080 -3.880 0.734 1.00 0.00 H new ATOM 869 N ASP A 60 15.368 -5.342 5.121 1.00 0.00 N ATOM 870 CA ASP A 60 15.035 -5.521 6.501 1.00 0.00 C ATOM 871 C ASP A 60 13.913 -4.564 6.711 1.00 0.00 C ATOM 872 O ASP A 60 13.563 -3.818 5.797 1.00 0.00 O ATOM 873 CB ASP A 60 16.183 -4.921 7.330 1.00 0.00 C ATOM 874 CG ASP A 60 17.486 -5.668 7.087 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.173 -5.427 6.058 1.00 0.00 O ATOM 876 OD2 ASP A 60 17.910 -6.353 8.055 1.00 0.00 O ATOM 0 H ASP A 60 16.041 -4.597 4.938 1.00 0.00 H new ATOM 0 HA ASP A 60 14.832 -6.561 6.757 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.310 -3.870 7.072 1.00 0.00 H new ATOM 0 HB3 ASP A 60 15.930 -4.961 8.389 1.00 0.00 H new ATOM 881 N PHE A 61 13.248 -4.567 7.879 1.00 0.00 N ATOM 882 CA PHE A 61 12.035 -3.863 8.161 1.00 0.00 C ATOM 883 C PHE A 61 12.133 -2.376 8.122 1.00 0.00 C ATOM 884 O PHE A 61 11.325 -1.887 7.335 1.00 0.00 O ATOM 885 CB PHE A 61 11.539 -4.300 9.549 1.00 0.00 C ATOM 886 CG PHE A 61 10.227 -3.760 10.007 1.00 0.00 C ATOM 887 CD1 PHE A 61 9.168 -3.960 9.154 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.053 -3.059 11.177 1.00 0.00 C ATOM 889 CE1 PHE A 61 7.909 -3.617 9.587 1.00 0.00 C ATOM 890 CE2 PHE A 61 8.806 -2.623 11.557 1.00 0.00 C ATOM 891 CZ PHE A 61 7.721 -2.986 10.794 1.00 0.00 C ATOM 0 H PHE A 61 13.582 -5.099 8.683 1.00 0.00 H new ATOM 0 HA PHE A 61 11.340 -4.123 7.362 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.478 -5.388 9.558 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.295 -4.017 10.282 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.321 -4.376 8.169 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.906 -2.848 11.805 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.054 -3.847 8.969 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.681 -2.008 12.436 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.721 -2.775 11.143 1.00 0.00 H new ATOM 901 N PRO A 62 13.021 -1.677 8.764 1.00 0.00 N ATOM 902 CA PRO A 62 13.202 -0.266 8.579 1.00 0.00 C ATOM 903 C PRO A 62 13.548 0.198 7.206 1.00 0.00 C ATOM 904 O PRO A 62 13.554 1.382 6.873 1.00 0.00 O ATOM 905 CB PRO A 62 14.105 0.176 9.729 1.00 0.00 C ATOM 906 CG PRO A 62 15.002 -1.048 9.970 1.00 0.00 C ATOM 907 CD PRO A 62 13.938 -2.142 9.793 1.00 0.00 C ATOM 0 HA PRO A 62 12.248 0.258 8.633 1.00 0.00 H new ATOM 0 HB2 PRO A 62 14.690 1.057 9.464 1.00 0.00 H new ATOM 0 HB3 PRO A 62 13.528 0.432 10.617 1.00 0.00 H new ATOM 0 HG2 PRO A 62 15.815 -1.127 9.248 1.00 0.00 H new ATOM 0 HG3 PRO A 62 15.455 -1.053 10.962 1.00 0.00 H new ATOM 0 HD2 PRO A 62 14.399 -3.086 9.501 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.409 -2.321 10.729 1.00 0.00 H new ATOM 915 N GLU A 63 13.945 -0.728 6.315 1.00 0.00 N ATOM 916 CA GLU A 63 14.122 -0.465 4.920 1.00 0.00 C ATOM 917 C GLU A 63 12.846 -0.476 4.151 1.00 0.00 C ATOM 918 O GLU A 63 12.444 0.558 3.620 1.00 0.00 O ATOM 919 CB GLU A 63 15.298 -1.337 4.449 1.00 0.00 C ATOM 920 CG GLU A 63 16.650 -1.148 5.140 1.00 0.00 C ATOM 921 CD GLU A 63 17.699 -2.127 4.635 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.259 -3.158 4.060 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.911 -2.087 4.978 1.00 0.00 O ATOM 0 H GLU A 63 14.150 -1.693 6.574 1.00 0.00 H new ATOM 0 HA GLU A 63 14.415 0.564 4.713 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.007 -2.381 4.563 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.440 -1.160 3.383 1.00 0.00 H new ATOM 0 HG2 GLU A 63 16.999 -0.129 4.977 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.526 -1.274 6.216 1.00 0.00 H new ATOM 930 N PHE A 64 12.061 -1.565 4.228 1.00 0.00 N ATOM 931 CA PHE A 64 10.661 -1.602 3.940 1.00 0.00 C ATOM 932 C PHE A 64 9.881 -0.428 4.424 1.00 0.00 C ATOM 933 O PHE A 64 9.281 0.280 3.617 1.00 0.00 O ATOM 934 CB PHE A 64 10.194 -2.969 4.467 1.00 0.00 C ATOM 935 CG PHE A 64 8.778 -3.343 4.195 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.347 -3.528 2.902 1.00 0.00 C ATOM 937 CD2 PHE A 64 7.932 -3.704 5.217 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.050 -3.875 2.608 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.639 -4.053 4.905 1.00 0.00 C ATOM 940 CZ PHE A 64 6.150 -4.106 3.621 1.00 0.00 C ATOM 0 H PHE A 64 12.427 -2.475 4.509 1.00 0.00 H new ATOM 0 HA PHE A 64 10.474 -1.509 2.870 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.837 -3.737 4.037 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.350 -2.989 5.546 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.050 -3.396 2.092 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.275 -3.713 6.241 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.737 -3.966 1.578 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.969 -4.300 5.715 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.111 -4.319 3.418 1.00 0.00 H new ATOM 950 N LEU A 65 9.972 -0.156 5.738 1.00 0.00 N ATOM 951 CA LEU A 65 9.282 0.972 6.283 1.00 0.00 C ATOM 952 C LEU A 65 9.641 2.303 5.717 1.00 0.00 C ATOM 953 O LEU A 65 8.775 3.175 5.662 1.00 0.00 O ATOM 954 CB LEU A 65 9.565 1.271 7.765 1.00 0.00 C ATOM 955 CG LEU A 65 9.023 0.190 8.715 1.00 0.00 C ATOM 956 CD1 LEU A 65 9.549 0.315 10.155 1.00 0.00 C ATOM 957 CD2 LEU A 65 7.487 0.250 8.745 1.00 0.00 C ATOM 0 H LEU A 65 10.510 -0.703 6.410 1.00 0.00 H new ATOM 0 HA LEU A 65 8.269 0.638 6.057 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.641 1.367 7.911 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.121 2.231 8.027 1.00 0.00 H new ATOM 0 HG LEU A 65 9.376 -0.764 8.323 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.124 -0.480 10.768 1.00 0.00 H new ATOM 0 HD12 LEU A 65 10.636 0.231 10.154 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.260 1.283 10.565 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.106 -0.517 9.419 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.168 1.232 9.095 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.097 0.078 7.742 1.00 0.00 H new ATOM 969 N THR A 66 10.859 2.390 5.155 1.00 0.00 N ATOM 970 CA THR A 66 11.371 3.613 4.619 1.00 0.00 C ATOM 971 C THR A 66 10.847 3.846 3.244 1.00 0.00 C ATOM 972 O THR A 66 10.109 4.758 2.874 1.00 0.00 O ATOM 973 CB THR A 66 12.866 3.742 4.631 1.00 0.00 C ATOM 974 OG1 THR A 66 13.216 3.887 5.999 1.00 0.00 O ATOM 975 CG2 THR A 66 13.342 4.954 3.812 1.00 0.00 C ATOM 0 H THR A 66 11.499 1.600 5.071 1.00 0.00 H new ATOM 0 HA THR A 66 11.010 4.385 5.299 1.00 0.00 H new ATOM 0 HB THR A 66 13.341 2.874 4.174 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.139 3.020 6.450 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.430 5.012 3.846 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.017 4.844 2.777 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.917 5.866 4.231 1.00 0.00 H new ATOM 983 N MET A 67 10.956 2.803 2.403 1.00 0.00 N ATOM 984 CA MET A 67 10.459 2.562 1.084 1.00 0.00 C ATOM 985 C MET A 67 9.019 2.865 0.848 1.00 0.00 C ATOM 986 O MET A 67 8.642 3.483 -0.147 1.00 0.00 O ATOM 987 CB MET A 67 10.874 1.126 0.724 1.00 0.00 C ATOM 988 CG MET A 67 10.721 0.674 -0.730 1.00 0.00 C ATOM 989 SD MET A 67 10.613 -1.131 -0.909 1.00 0.00 S ATOM 990 CE MET A 67 8.877 -1.196 -0.382 1.00 0.00 C ATOM 0 H MET A 67 11.489 1.990 2.712 1.00 0.00 H new ATOM 0 HA MET A 67 10.907 3.285 0.403 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.920 1.001 1.003 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.294 0.445 1.347 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.826 1.129 -1.153 1.00 0.00 H new ATOM 0 HG3 MET A 67 11.569 1.040 -1.309 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.413 -2.103 -0.769 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.827 -1.198 0.707 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.347 -0.325 -0.767 1.00 0.00 H new ATOM 1000 N MET A 68 8.182 2.507 1.837 1.00 0.00 N ATOM 1001 CA MET A 68 6.774 2.753 1.886 1.00 0.00 C ATOM 1002 C MET A 68 6.361 4.053 2.483 1.00 0.00 C ATOM 1003 O MET A 68 5.310 4.591 2.137 1.00 0.00 O ATOM 1004 CB MET A 68 6.111 1.503 2.490 1.00 0.00 C ATOM 1005 CG MET A 68 5.854 0.503 1.361 1.00 0.00 C ATOM 1006 SD MET A 68 4.366 0.855 0.377 1.00 0.00 S ATOM 1007 CE MET A 68 4.938 1.588 -1.183 1.00 0.00 C ATOM 0 H MET A 68 8.515 2.009 2.663 1.00 0.00 H new ATOM 0 HA MET A 68 6.405 2.902 0.871 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.756 1.061 3.250 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.175 1.769 2.982 1.00 0.00 H new ATOM 0 HG2 MET A 68 6.719 0.490 0.698 1.00 0.00 H new ATOM 0 HG3 MET A 68 5.765 -0.496 1.789 1.00 0.00 H new ATOM 0 HE1 MET A 68 4.397 2.515 -1.369 1.00 0.00 H new ATOM 0 HE2 MET A 68 6.005 1.798 -1.116 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.756 0.891 -2.001 1.00 0.00 H new ATOM 1017 N ALA A 69 7.147 4.632 3.409 1.00 0.00 N ATOM 1018 CA ALA A 69 6.872 5.894 4.024 1.00 0.00 C ATOM 1019 C ALA A 69 6.963 7.068 3.111 1.00 0.00 C ATOM 1020 O ALA A 69 6.169 8.007 3.137 1.00 0.00 O ATOM 1021 CB ALA A 69 7.763 6.289 5.214 1.00 0.00 C ATOM 0 H ALA A 69 8.010 4.203 3.743 1.00 0.00 H new ATOM 0 HA ALA A 69 5.852 5.695 4.353 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.455 7.264 5.591 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.664 5.546 6.005 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.803 6.337 4.890 1.00 0.00 H new ATOM 1027 N ARG A 70 8.031 7.032 2.294 1.00 0.00 N ATOM 1028 CA ARG A 70 8.470 8.081 1.427 1.00 0.00 C ATOM 1029 C ARG A 70 7.755 8.072 0.120 1.00 0.00 C ATOM 1030 O ARG A 70 7.800 7.138 -0.679 1.00 0.00 O ATOM 1031 CB ARG A 70 9.974 7.843 1.210 1.00 0.00 C ATOM 1032 CG ARG A 70 10.830 8.047 2.462 1.00 0.00 C ATOM 1033 CD ARG A 70 12.342 7.975 2.242 1.00 0.00 C ATOM 1034 NE ARG A 70 12.957 8.345 3.548 1.00 0.00 N ATOM 1035 CZ ARG A 70 14.321 8.366 3.601 1.00 0.00 C ATOM 1036 NH1 ARG A 70 15.104 8.494 2.490 1.00 0.00 N ATOM 1037 NH2 ARG A 70 14.868 8.157 4.834 1.00 0.00 N ATOM 0 H ARG A 70 8.631 6.209 2.236 1.00 0.00 H new ATOM 0 HA ARG A 70 8.263 9.053 1.875 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.120 6.826 0.846 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.328 8.516 0.429 1.00 0.00 H new ATOM 0 HG2 ARG A 70 10.588 9.019 2.892 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.551 7.294 3.199 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.646 6.974 1.936 1.00 0.00 H new ATOM 0 HD3 ARG A 70 12.656 8.659 1.453 1.00 0.00 H new ATOM 0 HE ARG A 70 12.387 8.572 4.363 1.00 0.00 H new ATOM 0 HH11 ARG A 70 14.673 8.579 1.569 1.00 0.00 H new ATOM 0 HH12 ARG A 70 16.120 8.504 2.581 1.00 0.00 H new ATOM 0 HH21 ARG A 70 14.263 7.999 5.640 1.00 0.00 H new ATOM 0 HH22 ARG A 70 15.881 8.159 4.949 1.00 0.00 H new ATOM 1051 N LYS A 71 6.986 9.157 -0.078 1.00 0.00 N ATOM 1052 CA LYS A 71 6.277 9.572 -1.249 1.00 0.00 C ATOM 1053 C LYS A 71 6.292 11.062 -1.240 1.00 0.00 C ATOM 1054 O LYS A 71 6.205 11.641 -0.158 1.00 0.00 O ATOM 1055 CB LYS A 71 4.872 8.979 -1.448 1.00 0.00 C ATOM 1056 CG LYS A 71 4.080 9.396 -2.689 1.00 0.00 C ATOM 1057 CD LYS A 71 2.707 8.766 -2.932 1.00 0.00 C ATOM 1058 CE LYS A 71 1.965 8.348 -1.661 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.696 7.648 -1.960 1.00 0.00 N ATOM 0 H LYS A 71 6.846 9.824 0.681 1.00 0.00 H new ATOM 0 HA LYS A 71 6.789 9.165 -2.121 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.968 7.893 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.276 9.234 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.945 10.477 -2.647 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.699 9.186 -3.562 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.088 9.475 -3.482 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.831 7.890 -3.569 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.605 7.697 -1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 71 1.757 9.231 -1.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.211 7.414 -1.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.087 8.264 -2.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.897 6.773 -2.485 1.00 0.00 H new ATOM 1073 N MET A 72 6.585 11.729 -2.371 1.00 0.00 N ATOM 1074 CA MET A 72 6.512 13.145 -2.556 1.00 0.00 C ATOM 1075 C MET A 72 5.269 13.500 -3.297 1.00 0.00 C ATOM 1076 O MET A 72 4.345 14.097 -2.746 1.00 0.00 O ATOM 1077 CB MET A 72 7.775 13.591 -3.312 1.00 0.00 C ATOM 1078 CG MET A 72 7.943 15.101 -3.494 1.00 0.00 C ATOM 1079 SD MET A 72 8.064 16.025 -1.933 1.00 0.00 S ATOM 1080 CE MET A 72 9.637 15.230 -1.495 1.00 0.00 C ATOM 0 H MET A 72 6.894 11.244 -3.214 1.00 0.00 H new ATOM 0 HA MET A 72 6.470 13.661 -1.597 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.647 13.209 -2.782 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.770 13.124 -4.297 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.839 15.288 -4.085 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.098 15.484 -4.066 1.00 0.00 H new ATOM 0 HE1 MET A 72 10.292 15.958 -1.017 1.00 0.00 H new ATOM 0 HE2 MET A 72 9.449 14.405 -0.808 1.00 0.00 H new ATOM 0 HE3 MET A 72 10.116 14.849 -2.397 1.00 0.00 H new ATOM 1090 N LYS A 73 5.231 13.152 -4.595 1.00 0.00 N ATOM 1091 CA LYS A 73 4.279 13.454 -5.619 1.00 0.00 C ATOM 1092 C LYS A 73 2.970 12.807 -5.321 1.00 0.00 C ATOM 1093 O LYS A 73 2.873 11.667 -4.871 1.00 0.00 O ATOM 1094 CB LYS A 73 4.858 13.032 -6.980 1.00 0.00 C ATOM 1095 CG LYS A 73 6.260 13.587 -7.238 1.00 0.00 C ATOM 1096 CD LYS A 73 6.908 13.097 -8.535 1.00 0.00 C ATOM 1097 CE LYS A 73 7.439 11.662 -8.537 1.00 0.00 C ATOM 1098 NZ LYS A 73 8.188 11.423 -9.790 1.00 0.00 N ATOM 0 H LYS A 73 5.980 12.574 -4.976 1.00 0.00 H new ATOM 0 HA LYS A 73 4.088 14.527 -5.655 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.890 11.944 -7.032 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.190 13.369 -7.772 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.207 14.675 -7.262 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.904 13.317 -6.401 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.176 13.190 -9.338 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.734 13.766 -8.777 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.087 11.500 -7.675 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.613 10.956 -8.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 8.551 10.449 -9.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.556 11.563 -10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.984 12.090 -9.851 1.00 0.00 H new ATOM 1112 N ASP A 74 1.888 13.576 -5.538 1.00 0.00 N ATOM 1113 CA ASP A 74 0.550 13.118 -5.325 1.00 0.00 C ATOM 1114 C ASP A 74 0.048 12.557 -6.611 1.00 0.00 C ATOM 1115 O ASP A 74 -1.050 12.026 -6.769 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.362 14.246 -4.814 1.00 0.00 C ATOM 1117 CG ASP A 74 0.079 14.768 -3.454 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.015 13.939 -2.507 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.302 15.988 -3.232 1.00 0.00 O ATOM 0 H ASP A 74 1.944 14.539 -5.869 1.00 0.00 H new ATOM 0 HA ASP A 74 0.544 12.349 -4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.362 15.065 -5.533 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.387 13.880 -4.747 1.00 0.00 H new ATOM 1124 N THR A 75 0.890 12.733 -7.645 1.00 0.00 N ATOM 1125 CA THR A 75 0.674 12.050 -8.883 1.00 0.00 C ATOM 1126 C THR A 75 0.949 10.585 -8.910 1.00 0.00 C ATOM 1127 O THR A 75 0.428 9.865 -9.760 1.00 0.00 O ATOM 1128 CB THR A 75 1.395 12.699 -10.027 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.775 12.747 -9.695 1.00 0.00 O ATOM 1130 CG2 THR A 75 0.917 14.103 -10.434 1.00 0.00 C ATOM 0 H THR A 75 1.710 13.340 -7.626 1.00 0.00 H new ATOM 0 HA THR A 75 -0.406 12.146 -8.995 1.00 0.00 H new ATOM 0 HB THR A 75 1.180 12.085 -10.901 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.273 13.166 -10.427 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.516 14.463 -11.271 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.131 14.059 -10.731 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.027 14.784 -9.590 1.00 0.00 H new ATOM 1138 N ASP A 76 1.784 10.181 -7.936 1.00 0.00 N ATOM 1139 CA ASP A 76 2.035 8.799 -7.667 1.00 0.00 C ATOM 1140 C ASP A 76 0.823 8.096 -7.162 1.00 0.00 C ATOM 1141 O ASP A 76 0.657 6.931 -7.521 1.00 0.00 O ATOM 1142 CB ASP A 76 3.210 8.762 -6.675 1.00 0.00 C ATOM 1143 CG ASP A 76 4.538 8.925 -7.400 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.478 9.162 -8.636 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.564 8.736 -6.693 1.00 0.00 O ATOM 0 H ASP A 76 2.292 10.822 -7.327 1.00 0.00 H new ATOM 0 HA ASP A 76 2.293 8.260 -8.579 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.094 9.556 -5.938 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.202 7.818 -6.130 1.00 0.00 H new ATOM 1150 N SER A 77 0.023 8.823 -6.362 1.00 0.00 N ATOM 1151 CA SER A 77 -1.136 8.295 -5.711 1.00 0.00 C ATOM 1152 C SER A 77 -2.218 7.751 -6.579 1.00 0.00 C ATOM 1153 O SER A 77 -3.065 6.931 -6.225 1.00 0.00 O ATOM 1154 CB SER A 77 -1.777 9.221 -4.663 1.00 0.00 C ATOM 1155 OG SER A 77 -0.758 9.541 -3.727 1.00 0.00 O ATOM 0 H SER A 77 0.188 9.809 -6.162 1.00 0.00 H new ATOM 0 HA SER A 77 -0.670 7.446 -5.211 1.00 0.00 H new ATOM 0 HB2 SER A 77 -2.170 10.123 -5.132 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.615 8.727 -4.170 1.00 0.00 H new ATOM 0 HG SER A 77 -1.122 10.134 -3.037 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.217 8.182 -7.852 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.195 7.807 -8.826 1.00 0.00 C ATOM 1163 C GLU A 78 -2.839 6.454 -9.340 1.00 0.00 C ATOM 1164 O GLU A 78 -3.622 5.513 -9.220 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.050 8.712 -10.061 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.189 10.209 -9.780 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.614 10.504 -9.333 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -5.543 10.349 -10.169 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -4.840 11.045 -8.218 1.00 0.00 O ATOM 0 H GLU A 78 -1.507 8.817 -8.218 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.184 7.863 -8.372 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.075 8.531 -10.514 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.802 8.423 -10.796 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.483 10.513 -9.008 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -2.950 10.783 -10.675 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.567 6.249 -9.727 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.952 5.029 -10.151 1.00 0.00 C ATOM 1178 C GLU A 79 -1.035 3.975 -9.101 1.00 0.00 C ATOM 1179 O GLU A 79 -1.474 2.877 -9.438 1.00 0.00 O ATOM 1180 CB GLU A 79 0.500 5.288 -10.586 1.00 0.00 C ATOM 1181 CG GLU A 79 0.534 6.483 -11.541 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.317 6.497 -12.803 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -0.055 5.732 -13.769 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -1.327 7.251 -12.801 1.00 0.00 O ATOM 0 H GLU A 79 -0.901 7.022 -9.744 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.502 4.652 -11.013 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.123 5.486 -9.714 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.909 4.404 -11.076 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.261 7.364 -10.961 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.570 6.615 -11.852 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.682 4.247 -7.832 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.515 3.335 -6.744 1.00 0.00 C ATOM 1193 C GLU A 80 -1.705 2.480 -6.474 1.00 0.00 C ATOM 1194 O GLU A 80 -1.631 1.256 -6.374 1.00 0.00 O ATOM 1195 CB GLU A 80 -0.096 3.976 -5.410 1.00 0.00 C ATOM 1196 CG GLU A 80 1.358 4.452 -5.453 1.00 0.00 C ATOM 1197 CD GLU A 80 1.687 5.158 -4.145 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.721 5.503 -3.413 1.00 0.00 O ATOM 1199 OE2 GLU A 80 2.903 5.304 -3.853 1.00 0.00 O ATOM 0 H GLU A 80 -0.495 5.207 -7.541 1.00 0.00 H new ATOM 0 HA GLU A 80 0.307 2.720 -7.111 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.750 4.819 -5.188 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.221 3.255 -4.603 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.027 3.605 -5.602 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.508 5.129 -6.294 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.884 3.124 -6.402 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.152 2.510 -6.161 1.00 0.00 C ATOM 1208 C ILE A 81 -4.642 1.797 -7.374 1.00 0.00 C ATOM 1209 O ILE A 81 -5.210 0.708 -7.309 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.058 3.656 -5.817 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -4.779 4.072 -4.363 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -6.550 3.311 -5.964 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -5.780 5.062 -3.769 1.00 0.00 C ATOM 0 H ILE A 81 -2.955 4.135 -6.519 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.104 1.761 -5.371 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.850 4.465 -6.517 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -4.765 3.177 -3.742 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.783 4.511 -4.312 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.152 4.181 -5.701 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.757 3.025 -6.995 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.799 2.483 -5.300 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.497 5.293 -2.742 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.780 5.978 -4.360 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.777 4.622 -3.781 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.322 2.398 -8.533 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.886 1.865 -9.734 1.00 0.00 C ATOM 1227 C ARG A 82 -4.228 0.563 -10.036 1.00 0.00 C ATOM 1228 O ARG A 82 -4.829 -0.400 -10.509 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.814 2.876 -10.891 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.635 2.477 -12.119 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.374 3.278 -13.396 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.289 4.734 -13.092 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.075 5.350 -13.201 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -2.867 4.732 -13.353 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -4.027 6.705 -13.048 1.00 0.00 N ATOM 0 H ARG A 82 -3.709 3.206 -8.641 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.951 1.677 -9.595 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.161 3.846 -10.534 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.772 2.999 -11.188 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.446 1.425 -12.330 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.692 2.567 -11.868 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -4.446 2.943 -13.859 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.173 3.097 -14.115 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.117 5.258 -12.809 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -2.817 3.714 -13.394 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.015 5.288 -13.425 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.882 7.227 -12.858 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.136 7.196 -13.123 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.892 0.510 -9.891 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.095 -0.671 -10.022 1.00 0.00 C ATOM 1251 C GLU A 83 -2.394 -1.698 -8.985 1.00 0.00 C ATOM 1252 O GLU A 83 -2.374 -2.890 -9.285 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.601 -0.307 -9.995 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.227 0.451 -11.270 1.00 0.00 C ATOM 1255 CD GLU A 83 -0.151 -0.509 -12.448 1.00 0.00 C ATOM 1256 OE1 GLU A 83 0.866 -1.236 -12.599 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -1.201 -0.609 -13.139 1.00 0.00 O ATOM 0 H GLU A 83 -2.337 1.337 -9.670 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.350 -1.116 -10.984 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.383 0.305 -9.120 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.001 -1.212 -9.909 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.966 1.227 -11.471 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.732 0.951 -11.136 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.608 -1.263 -7.730 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.871 -2.161 -6.649 1.00 0.00 C ATOM 1266 C ALA A 84 -4.256 -2.701 -6.746 1.00 0.00 C ATOM 1267 O ALA A 84 -4.506 -3.863 -6.432 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.632 -1.331 -5.376 1.00 0.00 C ATOM 0 H ALA A 84 -2.598 -0.279 -7.463 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.226 -3.040 -6.656 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.814 -1.951 -4.498 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.602 -0.975 -5.362 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.311 -0.478 -5.365 1.00 0.00 H new ATOM 1274 N PHE A 85 -5.240 -1.926 -7.237 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.465 -2.499 -7.704 1.00 0.00 C ATOM 1276 C PHE A 85 -6.315 -3.499 -8.798 1.00 0.00 C ATOM 1277 O PHE A 85 -6.943 -4.553 -8.886 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.425 -1.386 -8.157 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.868 -1.678 -7.930 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.635 -2.476 -8.747 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.491 -1.123 -6.837 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.955 -2.810 -8.555 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.832 -1.351 -6.638 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.536 -2.181 -7.479 1.00 0.00 C ATOM 0 H PHE A 85 -5.189 -0.910 -7.311 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.868 -3.048 -6.853 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -7.167 -0.467 -7.631 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -7.269 -1.200 -9.220 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.153 -2.880 -9.625 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.932 -0.514 -6.142 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.487 -3.503 -9.191 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.338 -0.873 -5.812 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.586 -2.345 -7.287 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.461 -3.221 -9.799 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.100 -4.055 -10.903 1.00 0.00 C ATOM 1296 C ARG A 86 -4.691 -5.428 -10.491 1.00 0.00 C ATOM 1297 O ARG A 86 -5.082 -6.413 -11.116 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.140 -3.357 -11.881 1.00 0.00 C ATOM 1299 CG ARG A 86 -3.965 -3.879 -13.309 1.00 0.00 C ATOM 1300 CD ARG A 86 -3.310 -2.984 -14.363 1.00 0.00 C ATOM 1301 NE ARG A 86 -1.897 -2.943 -13.890 1.00 0.00 N ATOM 1302 CZ ARG A 86 -0.899 -3.653 -14.493 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -1.072 -4.449 -15.589 1.00 0.00 N ATOM 1304 NH2 ARG A 86 0.390 -3.414 -14.115 1.00 0.00 N ATOM 0 H ARG A 86 -4.977 -2.324 -9.837 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.008 -4.218 -11.483 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -4.458 -2.317 -11.956 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.154 -3.356 -11.417 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.381 -4.798 -13.252 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.953 -4.152 -13.680 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.394 -3.404 -15.365 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -3.760 -1.992 -14.394 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.667 -2.362 -13.084 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.996 -4.542 -16.011 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.277 -4.950 -15.986 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.590 -2.718 -13.397 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.153 -3.931 -14.551 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.900 -5.520 -9.408 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.613 -6.738 -8.716 1.00 0.00 C ATOM 1320 C VAL A 87 -4.781 -7.616 -8.425 1.00 0.00 C ATOM 1321 O VAL A 87 -4.812 -8.778 -8.827 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.830 -6.559 -7.449 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.399 -7.948 -6.948 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.561 -5.782 -7.838 1.00 0.00 C ATOM 0 H VAL A 87 -3.439 -4.709 -8.996 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.996 -7.247 -9.457 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.410 -6.045 -6.682 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.827 -7.841 -6.026 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.283 -8.557 -6.758 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.781 -8.432 -7.704 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.947 -5.620 -6.952 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.994 -6.355 -8.572 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.841 -4.819 -8.266 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.780 -7.109 -7.680 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.870 -7.865 -7.146 1.00 0.00 C ATOM 1336 C PHE A 88 -7.876 -8.345 -8.134 1.00 0.00 C ATOM 1337 O PHE A 88 -8.368 -9.465 -8.007 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.684 -6.909 -6.257 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.186 -6.879 -4.853 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.338 -8.006 -4.079 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.710 -5.752 -4.226 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.717 -8.184 -2.866 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.255 -5.842 -2.932 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.225 -7.047 -2.269 1.00 0.00 C ATOM 0 H PHE A 88 -5.829 -6.119 -7.438 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.409 -8.729 -6.667 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.643 -5.904 -6.676 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.730 -7.214 -6.262 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.980 -8.794 -4.444 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.694 -4.805 -4.745 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.621 -9.158 -2.409 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.915 -4.950 -2.427 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.812 -7.100 -1.272 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.430 -7.451 -8.972 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.587 -7.557 -9.806 1.00 0.00 C ATOM 1356 C ASP A 89 -9.307 -8.291 -11.071 1.00 0.00 C ATOM 1357 O ASP A 89 -8.917 -7.603 -12.013 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.078 -6.135 -10.127 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.565 -6.002 -10.426 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.338 -6.867 -9.934 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.993 -5.019 -11.088 1.00 0.00 O ATOM 0 H ASP A 89 -8.004 -6.530 -9.075 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.349 -8.125 -9.272 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.836 -5.488 -9.284 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.519 -5.762 -10.985 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.449 -9.626 -11.158 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.972 -10.427 -12.243 1.00 0.00 C ATOM 1368 C LYS A 90 -9.681 -10.175 -13.529 1.00 0.00 C ATOM 1369 O LYS A 90 -9.018 -10.091 -14.561 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.104 -11.938 -11.985 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.359 -12.743 -13.052 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.075 -14.197 -12.673 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.156 -14.413 -11.469 1.00 0.00 C ATOM 1374 NZ LYS A 90 -5.784 -13.905 -11.693 1.00 0.00 N ATOM 0 H LYS A 90 -9.919 -10.173 -10.437 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.926 -10.131 -12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.706 -12.178 -10.999 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.157 -12.219 -11.981 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.943 -12.729 -13.972 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.413 -12.247 -13.268 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.026 -14.691 -12.472 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.633 -14.696 -13.535 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.584 -13.917 -10.598 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.111 -15.478 -11.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.207 -14.078 -10.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.361 -14.396 -12.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.819 -12.883 -11.885 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.984 -9.860 -13.420 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.740 -9.206 -14.443 1.00 0.00 C ATOM 1390 C ASP A 91 -11.314 -7.833 -14.833 1.00 0.00 C ATOM 1391 O ASP A 91 -10.636 -7.628 -15.839 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.247 -9.432 -14.238 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.629 -9.060 -12.813 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.794 -7.875 -12.418 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -13.915 -9.951 -11.969 1.00 0.00 O ATOM 0 H ASP A 91 -11.533 -10.069 -12.586 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.477 -9.710 -15.373 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.815 -8.830 -14.947 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.499 -10.475 -14.432 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.713 -6.889 -13.963 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.630 -5.467 -14.089 1.00 0.00 C ATOM 1402 C GLY A 92 -12.906 -4.715 -14.256 1.00 0.00 C ATOM 1403 O GLY A 92 -12.998 -3.873 -15.148 1.00 0.00 O ATOM 0 H GLY A 92 -12.140 -7.154 -13.075 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.125 -5.080 -13.204 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.993 -5.242 -14.944 1.00 0.00 H new ATOM 1407 N ASN A 93 -13.978 -5.012 -13.501 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.257 -4.382 -13.614 1.00 0.00 C ATOM 1409 C ASN A 93 -15.292 -3.186 -12.726 1.00 0.00 C ATOM 1410 O ASN A 93 -15.896 -2.173 -13.075 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.395 -5.368 -13.301 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.296 -6.227 -12.048 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.420 -6.247 -11.185 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.445 -6.890 -11.748 1.00 0.00 N ATOM 0 H ASN A 93 -13.951 -5.728 -12.775 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.410 -4.055 -14.643 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.320 -4.795 -13.236 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.495 -6.039 -14.154 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.540 -7.365 -10.850 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.211 -6.912 -12.421 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.587 -3.313 -11.587 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.421 -2.246 -10.650 1.00 0.00 C ATOM 1423 C GLY A 94 -14.936 -2.622 -9.303 1.00 0.00 C ATOM 1424 O GLY A 94 -15.359 -1.751 -8.544 1.00 0.00 O ATOM 0 H GLY A 94 -14.122 -4.178 -11.311 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.365 -1.984 -10.578 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.946 -1.360 -11.008 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.071 -3.938 -9.059 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.681 -4.565 -7.928 1.00 0.00 C ATOM 1430 C TYR A 95 -14.914 -5.791 -7.570 1.00 0.00 C ATOM 1431 O TYR A 95 -14.847 -6.678 -8.418 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.136 -4.958 -8.234 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.956 -3.732 -8.450 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.474 -3.089 -7.351 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.504 -3.406 -9.667 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.532 -2.214 -7.438 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.542 -2.513 -9.795 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.024 -1.876 -8.677 1.00 0.00 C ATOM 1439 OH TYR A 95 -20.950 -0.819 -8.815 1.00 0.00 O ATOM 0 H TYR A 95 -14.717 -4.629 -9.721 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.676 -3.857 -7.099 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.172 -5.592 -9.120 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.546 -5.540 -7.409 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.034 -3.278 -6.383 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.104 -3.869 -10.557 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -19.971 -1.797 -6.544 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.974 -2.314 -10.765 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.191 -0.716 -9.759 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.366 -5.740 -6.343 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.571 -6.802 -5.808 1.00 0.00 C ATOM 1451 C ILE A 96 -14.510 -7.557 -4.933 1.00 0.00 C ATOM 1452 O ILE A 96 -14.951 -7.158 -3.856 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.350 -6.435 -5.017 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.420 -5.508 -5.819 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.675 -7.736 -4.551 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.412 -4.674 -5.030 1.00 0.00 C ATOM 0 H ILE A 96 -14.477 -4.947 -5.711 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.147 -7.348 -6.651 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.622 -5.857 -4.134 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.867 -6.120 -6.532 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.042 -4.826 -6.399 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.783 -7.496 -3.973 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.368 -8.303 -3.930 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.395 -8.332 -5.420 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.823 -4.068 -5.718 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.943 -4.022 -4.336 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.750 -5.336 -4.472 1.00 0.00 H new ATOM 1468 N SER A 97 -14.806 -8.789 -5.386 1.00 0.00 N ATOM 1469 CA SER A 97 -15.541 -9.792 -4.680 1.00 0.00 C ATOM 1470 C SER A 97 -14.695 -10.437 -3.638 1.00 0.00 C ATOM 1471 O SER A 97 -13.466 -10.485 -3.625 1.00 0.00 O ATOM 1472 CB SER A 97 -16.090 -10.954 -5.525 1.00 0.00 C ATOM 1473 OG SER A 97 -15.128 -11.636 -6.315 1.00 0.00 O ATOM 0 H SER A 97 -14.511 -9.105 -6.310 1.00 0.00 H new ATOM 0 HA SER A 97 -16.383 -9.226 -4.281 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.565 -11.674 -4.858 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.868 -10.567 -6.183 1.00 0.00 H new ATOM 0 HG SER A 97 -14.809 -11.042 -7.026 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.382 -10.966 -2.609 1.00 0.00 N ATOM 1480 CA ALA A 98 -14.836 -11.681 -1.497 1.00 0.00 C ATOM 1481 C ALA A 98 -13.967 -12.812 -1.929 1.00 0.00 C ATOM 1482 O ALA A 98 -12.960 -13.110 -1.289 1.00 0.00 O ATOM 1483 CB ALA A 98 -15.979 -12.249 -0.640 1.00 0.00 C ATOM 0 H ALA A 98 -16.397 -10.887 -2.552 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.229 -10.978 -0.926 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.562 -12.794 0.207 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.601 -11.432 -0.275 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.585 -12.925 -1.243 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.306 -13.468 -3.052 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.666 -14.584 -3.676 1.00 0.00 C ATOM 1491 C ALA A 99 -12.336 -14.281 -4.277 1.00 0.00 C ATOM 1492 O ALA A 99 -11.326 -14.918 -3.983 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.541 -15.143 -4.810 1.00 0.00 C ATOM 0 H ALA A 99 -15.127 -13.179 -3.583 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.523 -15.298 -2.865 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.038 -15.992 -5.273 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.499 -15.467 -4.404 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.707 -14.367 -5.558 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.321 -13.114 -4.945 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.113 -12.494 -5.394 1.00 0.00 C ATOM 1501 C GLU A 100 -10.226 -12.113 -4.258 1.00 0.00 C ATOM 1502 O GLU A 100 -9.103 -12.607 -4.170 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.481 -11.287 -6.274 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.233 -11.541 -7.582 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.791 -10.248 -8.159 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.853 -9.740 -7.710 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.333 -9.853 -9.264 1.00 0.00 O ATOM 0 H GLU A 100 -13.165 -12.590 -5.178 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.539 -13.207 -5.986 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.084 -10.608 -5.671 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.558 -10.761 -6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.562 -12.005 -8.305 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.047 -12.244 -7.405 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.709 -11.307 -3.297 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.002 -10.830 -2.149 1.00 0.00 C ATOM 1516 C LEU A 101 -9.327 -11.934 -1.412 1.00 0.00 C ATOM 1517 O LEU A 101 -8.140 -11.924 -1.087 1.00 0.00 O ATOM 1518 CB LEU A 101 -10.882 -9.957 -1.238 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.340 -9.470 0.116 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.584 -8.149 -0.109 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.530 -9.060 1.000 1.00 0.00 C ATOM 0 H LEU A 101 -11.669 -10.963 -3.326 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.211 -10.176 -2.516 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.165 -9.074 -1.810 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.797 -10.515 -1.039 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.724 -10.255 0.555 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.192 -7.788 0.842 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.759 -8.315 -0.802 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.265 -7.407 -0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.163 -8.712 1.965 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.086 -8.259 0.513 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.185 -9.918 1.149 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.097 -12.988 -1.086 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.733 -14.156 -0.346 1.00 0.00 C ATOM 1535 C ARG A 102 -8.657 -14.930 -1.026 1.00 0.00 C ATOM 1536 O ARG A 102 -7.686 -15.325 -0.383 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.932 -15.069 -0.033 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.506 -16.261 0.826 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.791 -16.973 1.256 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.672 -17.924 2.397 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.787 -18.454 2.978 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.056 -18.012 2.735 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.636 -19.374 3.975 1.00 0.00 N ATOM 0 H ARG A 102 -11.075 -13.022 -1.372 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.348 -13.791 0.606 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.702 -14.499 0.487 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.374 -15.426 -0.963 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.861 -16.934 0.262 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -9.938 -15.929 1.695 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.530 -16.216 1.518 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.184 -17.517 0.397 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.749 -18.181 2.747 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.212 -17.241 2.085 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.848 -18.453 3.203 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.702 -19.654 4.273 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.458 -19.782 4.422 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.641 -15.021 -2.368 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.591 -15.677 -3.083 1.00 0.00 C ATOM 1559 C HIS A 103 -6.346 -14.858 -3.084 1.00 0.00 C ATOM 1560 O HIS A 103 -5.209 -15.283 -2.889 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.054 -15.976 -4.518 1.00 0.00 C ATOM 1562 CG HIS A 103 -6.920 -16.456 -5.375 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -6.176 -17.594 -5.138 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.531 -16.041 -6.610 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.357 -17.750 -6.213 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.563 -16.856 -7.162 1.00 0.00 N ATOM 0 H HIS A 103 -9.370 -14.632 -2.967 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.360 -16.617 -2.582 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.840 -16.731 -4.498 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.487 -15.077 -4.956 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.935 -15.170 -7.105 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -4.612 -18.529 -6.283 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.117 -16.785 -8.077 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.413 -13.522 -3.227 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.225 -12.745 -3.054 1.00 0.00 C ATOM 1576 C VAL A 104 -4.686 -12.754 -1.665 1.00 0.00 C ATOM 1577 O VAL A 104 -3.483 -12.641 -1.432 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.464 -11.424 -3.723 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.246 -10.534 -3.424 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.834 -11.591 -5.207 1.00 0.00 C ATOM 0 H VAL A 104 -7.256 -12.995 -3.454 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.368 -13.197 -3.552 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.342 -10.917 -3.323 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.382 -9.561 -3.895 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.146 -10.405 -2.346 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.346 -11.005 -3.818 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.999 -10.610 -5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.022 -12.096 -5.730 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.744 -12.185 -5.290 1.00 0.00 H new ATOM 1590 N MET A 105 -5.469 -12.935 -0.586 1.00 0.00 N ATOM 1591 CA MET A 105 -4.950 -13.006 0.745 1.00 0.00 C ATOM 1592 C MET A 105 -4.363 -14.347 1.019 1.00 0.00 C ATOM 1593 O MET A 105 -3.286 -14.445 1.604 1.00 0.00 O ATOM 1594 CB MET A 105 -6.042 -12.773 1.804 1.00 0.00 C ATOM 1595 CG MET A 105 -6.542 -11.328 1.742 1.00 0.00 C ATOM 1596 SD MET A 105 -5.368 -10.124 2.432 1.00 0.00 S ATOM 1597 CE MET A 105 -5.753 -10.277 4.200 1.00 0.00 C ATOM 0 H MET A 105 -6.483 -13.034 -0.639 1.00 0.00 H new ATOM 0 HA MET A 105 -4.193 -12.225 0.810 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.872 -13.460 1.638 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.646 -12.986 2.797 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.749 -11.068 0.704 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.485 -11.255 2.283 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.136 -9.327 4.573 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.505 -11.053 4.343 1.00 0.00 H new ATOM 0 HE3 MET A 105 -4.849 -10.543 4.748 1.00 0.00 H new ATOM 1607 N THR A 106 -4.876 -15.402 0.361 1.00 0.00 N ATOM 1608 CA THR A 106 -4.312 -16.708 0.216 1.00 0.00 C ATOM 1609 C THR A 106 -2.981 -16.693 -0.454 1.00 0.00 C ATOM 1610 O THR A 106 -2.017 -17.287 0.027 1.00 0.00 O ATOM 1611 CB THR A 106 -5.252 -17.757 -0.301 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.503 -17.725 0.370 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.608 -19.138 -0.093 1.00 0.00 C ATOM 0 H THR A 106 -5.775 -15.330 -0.116 1.00 0.00 H new ATOM 0 HA THR A 106 -4.124 -17.039 1.237 1.00 0.00 H new ATOM 0 HB THR A 106 -5.434 -17.561 -1.358 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.973 -16.895 0.146 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.280 -19.912 -0.464 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.664 -19.185 -0.637 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.423 -19.297 0.969 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.903 -16.102 -1.659 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.687 -15.898 -2.384 1.00 0.00 C ATOM 1623 C ASN A 107 -0.625 -15.275 -1.543 1.00 0.00 C ATOM 1624 O ASN A 107 0.492 -15.758 -1.364 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.959 -15.028 -3.622 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.750 -15.868 -4.615 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.984 -17.052 -4.376 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.239 -15.189 -5.687 1.00 0.00 N ATOM 0 H ASN A 107 -3.725 -15.750 -2.151 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.321 -16.877 -2.693 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.519 -14.135 -3.346 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.022 -14.692 -4.066 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.844 -15.663 -6.358 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.001 -14.206 -5.820 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.922 -14.070 -1.027 1.00 0.00 N ATOM 1636 CA LEU A 108 0.016 -13.324 -0.247 1.00 0.00 C ATOM 1637 C LEU A 108 0.458 -14.023 0.993 1.00 0.00 C ATOM 1638 O LEU A 108 1.653 -13.964 1.281 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.508 -11.899 -0.007 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.492 -11.029 -1.275 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -1.137 -9.687 -0.889 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.901 -10.691 -1.834 1.00 0.00 C ATOM 0 H LEU A 108 -1.823 -13.608 -1.152 1.00 0.00 H new ATOM 0 HA LEU A 108 0.935 -13.241 -0.828 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.527 -11.953 0.377 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.098 -11.420 0.763 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.008 -11.600 -2.047 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.152 -9.027 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.157 -9.859 -0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.560 -9.222 -0.090 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.795 -10.075 -2.727 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.472 -10.146 -1.082 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.424 -11.613 -2.089 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.424 -14.680 1.767 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.027 -15.672 2.717 1.00 0.00 C ATOM 1656 C GLY A 109 -0.653 -15.405 4.042 1.00 0.00 C ATOM 1657 O GLY A 109 -0.036 -15.680 5.069 1.00 0.00 O ATOM 0 H GLY A 109 -1.431 -14.520 1.733 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.319 -16.661 2.363 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.059 -15.676 2.815 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.899 -14.899 4.071 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.734 -14.821 5.229 1.00 0.00 C ATOM 1663 C GLU A 110 -3.589 -16.033 5.372 1.00 0.00 C ATOM 1664 O GLU A 110 -3.963 -16.604 4.349 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.570 -13.530 5.208 1.00 0.00 C ATOM 1666 CG GLU A 110 -4.397 -13.258 6.466 1.00 0.00 C ATOM 1667 CD GLU A 110 -3.624 -13.316 7.775 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.210 -14.430 8.197 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.404 -12.209 8.336 1.00 0.00 O ATOM 0 H GLU A 110 -2.349 -14.522 3.237 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.090 -14.786 6.108 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.899 -12.686 5.047 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.245 -13.569 4.353 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.853 -12.272 6.375 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.210 -13.983 6.510 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.991 -16.524 6.558 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.794 -17.705 6.642 1.00 0.00 C ATOM 1678 C LYS A 111 -6.075 -17.345 7.312 1.00 0.00 C ATOM 1679 O LYS A 111 -6.231 -17.382 8.532 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.119 -18.785 7.505 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.642 -19.027 7.190 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.396 -19.649 5.814 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.950 -19.907 5.386 1.00 0.00 C ATOM 1684 NZ LYS A 111 -0.893 -20.334 3.970 1.00 0.00 N ATOM 0 H LYS A 111 -3.760 -16.104 7.458 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.942 -18.092 5.634 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.211 -18.502 8.554 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.661 -19.722 7.379 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.108 -18.079 7.250 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.220 -19.680 7.954 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -2.929 -20.599 5.778 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.853 -18.999 5.068 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -0.358 -19.002 5.522 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.509 -20.675 6.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.096 -20.504 3.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -1.441 -21.210 3.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -1.294 -19.588 3.366 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.086 -16.992 6.499 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.402 -16.573 6.869 1.00 0.00 C ATOM 1700 C LEU A 112 -9.396 -17.663 7.078 1.00 0.00 C ATOM 1701 O LEU A 112 -9.397 -18.675 6.378 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.995 -15.603 5.833 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.317 -14.243 5.597 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.134 -13.270 4.729 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.922 -13.568 6.921 1.00 0.00 C ATOM 0 H LEU A 112 -6.968 -17.002 5.486 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.241 -16.093 7.834 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.024 -16.124 4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.028 -15.408 6.121 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.416 -14.478 5.030 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.584 -12.336 4.613 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.307 -13.714 3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.091 -13.069 5.210 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.446 -12.610 6.713 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.813 -13.406 7.527 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.226 -14.209 7.463 1.00 0.00 H new ATOM 1717 N THR A 113 -10.260 -17.441 8.084 1.00 0.00 N ATOM 1718 CA THR A 113 -11.425 -18.246 8.283 1.00 0.00 C ATOM 1719 C THR A 113 -12.602 -17.455 7.825 1.00 0.00 C ATOM 1720 O THR A 113 -12.517 -16.247 7.611 1.00 0.00 O ATOM 1721 CB THR A 113 -11.640 -18.806 9.658 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.782 -17.780 10.629 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.442 -19.678 10.072 1.00 0.00 C ATOM 0 H THR A 113 -10.149 -16.693 8.769 1.00 0.00 H new ATOM 0 HA THR A 113 -11.276 -19.150 7.693 1.00 0.00 H new ATOM 0 HB THR A 113 -12.556 -19.396 9.617 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.729 -17.677 10.860 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.611 -20.078 11.072 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.330 -20.501 9.366 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.535 -19.074 10.072 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.784 -18.072 7.645 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.851 -17.350 7.024 1.00 0.00 C ATOM 1733 C ASP A 114 -15.510 -16.282 7.827 1.00 0.00 C ATOM 1734 O ASP A 114 -16.178 -15.399 7.290 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.970 -18.336 6.650 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.577 -19.136 5.416 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.883 -20.182 5.527 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.994 -18.793 4.277 1.00 0.00 O ATOM 0 H ASP A 114 -13.997 -19.032 7.917 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.363 -16.856 6.184 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.163 -19.011 7.484 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.895 -17.792 6.460 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.420 -16.385 9.165 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.725 -15.382 10.137 1.00 0.00 C ATOM 1745 C GLU A 115 -14.870 -14.178 9.940 1.00 0.00 C ATOM 1746 O GLU A 115 -15.381 -13.065 9.817 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.545 -15.880 11.581 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.009 -17.275 12.005 1.00 0.00 C ATOM 1749 CD GLU A 115 -14.866 -18.272 11.882 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.407 -18.444 10.722 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.489 -18.857 12.933 1.00 0.00 O ATOM 0 H GLU A 115 -15.105 -17.250 9.604 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.775 -15.130 9.990 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.481 -15.816 11.809 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.053 -15.166 12.229 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.369 -17.249 13.034 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -16.846 -17.592 11.383 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.547 -14.367 9.785 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.660 -13.270 9.549 1.00 0.00 C ATOM 1760 C GLU A 116 -12.806 -12.530 8.264 1.00 0.00 C ATOM 1761 O GLU A 116 -12.658 -11.310 8.210 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.214 -13.790 9.487 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.812 -14.415 10.825 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.321 -14.725 10.816 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.918 -15.575 9.977 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -8.611 -14.042 11.600 1.00 0.00 O ATOM 0 H GLU A 116 -13.092 -15.279 9.823 1.00 0.00 H new ATOM 0 HA GLU A 116 -12.907 -12.594 10.368 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.121 -14.529 8.691 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.537 -12.971 9.243 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.047 -13.733 11.642 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.383 -15.328 10.998 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.061 -13.230 7.144 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.444 -12.617 5.910 1.00 0.00 C ATOM 1775 C VAL A 117 -14.642 -11.756 6.115 1.00 0.00 C ATOM 1776 O VAL A 117 -14.608 -10.558 5.838 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.768 -13.735 4.963 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.108 -13.186 3.567 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.516 -14.597 4.727 1.00 0.00 C ATOM 0 H VAL A 117 -12.999 -14.247 7.095 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.646 -11.986 5.518 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.596 -14.290 5.403 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.340 -14.014 2.897 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.971 -12.523 3.637 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.255 -12.631 3.177 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.757 -15.407 4.039 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.725 -13.981 4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.178 -15.015 5.675 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.738 -12.255 6.715 1.00 0.00 N ATOM 1790 CA ASP A 118 -16.931 -11.528 7.022 1.00 0.00 C ATOM 1791 C ASP A 118 -16.760 -10.253 7.774 1.00 0.00 C ATOM 1792 O ASP A 118 -17.282 -9.200 7.412 1.00 0.00 O ATOM 1793 CB ASP A 118 -17.866 -12.388 7.889 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.290 -11.867 7.764 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.734 -11.709 6.595 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.037 -11.734 8.770 1.00 0.00 O ATOM 0 H ASP A 118 -15.793 -13.231 7.005 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.325 -11.283 6.036 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.819 -13.430 7.572 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.546 -12.357 8.930 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.025 -10.341 8.897 1.00 0.00 N ATOM 1802 CA GLU A 119 -15.727 -9.223 9.737 1.00 0.00 C ATOM 1803 C GLU A 119 -14.838 -8.197 9.124 1.00 0.00 C ATOM 1804 O GLU A 119 -15.042 -6.991 9.251 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.168 -9.744 11.072 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.460 -8.937 12.338 1.00 0.00 C ATOM 1807 CD GLU A 119 -16.917 -8.816 12.760 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -17.667 -9.822 12.871 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -17.386 -7.648 12.709 1.00 0.00 O ATOM 0 H GLU A 119 -15.625 -11.218 9.231 1.00 0.00 H new ATOM 0 HA GLU A 119 -16.662 -8.686 9.900 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.552 -10.753 11.223 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.086 -9.827 10.971 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.905 -9.386 13.162 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.063 -7.931 12.198 1.00 0.00 H new ATOM 1816 N MET A 120 -13.867 -8.642 8.306 1.00 0.00 N ATOM 1817 CA MET A 120 -13.033 -7.854 7.453 1.00 0.00 C ATOM 1818 C MET A 120 -13.800 -7.050 6.460 1.00 0.00 C ATOM 1819 O MET A 120 -13.607 -5.839 6.365 1.00 0.00 O ATOM 1820 CB MET A 120 -12.007 -8.695 6.675 1.00 0.00 C ATOM 1821 CG MET A 120 -11.073 -8.009 5.676 1.00 0.00 C ATOM 1822 SD MET A 120 -9.912 -9.153 4.871 1.00 0.00 S ATOM 1823 CE MET A 120 -8.901 -8.013 3.883 1.00 0.00 C ATOM 0 H MET A 120 -13.649 -9.636 8.237 1.00 0.00 H new ATOM 0 HA MET A 120 -12.517 -7.185 8.142 1.00 0.00 H new ATOM 0 HB2 MET A 120 -11.383 -9.208 7.407 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.558 -9.463 6.132 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.671 -7.513 4.912 1.00 0.00 H new ATOM 0 HG3 MET A 120 -10.508 -7.233 6.192 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.146 -8.577 3.335 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.538 -7.480 3.177 1.00 0.00 H new ATOM 0 HE3 MET A 120 -8.411 -7.297 4.542 1.00 0.00 H new ATOM 1833 N ILE A 121 -14.754 -7.654 5.730 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.568 -7.081 4.702 1.00 0.00 C ATOM 1835 C ILE A 121 -16.508 -6.042 5.209 1.00 0.00 C ATOM 1836 O ILE A 121 -16.636 -4.957 4.645 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.153 -8.116 3.787 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.124 -8.984 3.044 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.133 -7.551 2.745 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.844 -10.286 2.699 1.00 0.00 C ATOM 0 H ILE A 121 -14.976 -8.639 5.875 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.910 -6.509 4.048 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.693 -8.747 4.492 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.769 -8.484 2.143 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -14.251 -9.174 3.668 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -17.511 -8.363 2.123 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.966 -7.066 3.254 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -16.618 -6.823 2.118 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.162 -10.949 2.167 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.179 -10.770 3.616 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -16.706 -10.069 2.068 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.281 -6.429 6.240 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.162 -5.509 6.890 1.00 0.00 C ATOM 1854 C ARG A 122 -17.557 -4.256 7.422 1.00 0.00 C ATOM 1855 O ARG A 122 -18.077 -3.161 7.213 1.00 0.00 O ATOM 1856 CB ARG A 122 -18.985 -6.210 7.984 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.137 -7.009 7.371 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.103 -7.744 8.302 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.282 -8.846 8.879 1.00 0.00 N ATOM 1860 CZ ARG A 122 -19.743 -8.854 10.133 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -19.714 -7.761 10.951 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -19.212 -10.025 10.589 1.00 0.00 N ATOM 0 H ARG A 122 -17.296 -7.375 6.622 1.00 0.00 H new ATOM 0 HA ARG A 122 -18.806 -5.168 6.079 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -18.341 -6.875 8.559 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.380 -5.469 8.679 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.725 -6.324 6.760 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -19.704 -7.747 6.696 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.487 -7.084 9.080 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.964 -8.131 7.758 1.00 0.00 H new ATOM 0 HE ARG A 122 -20.109 -9.660 8.289 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.110 -6.876 10.634 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -19.297 -7.830 11.879 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -19.227 -10.856 9.998 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -18.800 -10.069 11.521 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.294 -4.309 7.882 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.443 -3.202 8.191 1.00 0.00 C ATOM 1878 C GLU A 123 -15.240 -2.141 7.165 1.00 0.00 C ATOM 1879 O GLU A 123 -15.332 -0.955 7.478 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.180 -3.649 8.945 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.321 -2.430 9.288 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.301 -2.957 10.287 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -11.466 -3.818 9.899 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.311 -2.647 11.508 1.00 0.00 O ATOM 0 H GLU A 123 -15.831 -5.202 8.051 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.048 -2.614 8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.458 -4.177 9.857 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.609 -4.347 8.334 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.835 -2.023 8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.922 -1.629 9.718 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.010 -2.587 5.917 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.876 -1.795 4.733 1.00 0.00 C ATOM 1893 C ALA A 124 -16.151 -1.155 4.303 1.00 0.00 C ATOM 1894 O ALA A 124 -16.145 0.064 4.142 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.257 -2.692 3.648 1.00 0.00 C ATOM 0 H ALA A 124 -14.910 -3.583 5.722 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.221 -0.947 4.933 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.139 -2.121 2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.282 -3.047 3.982 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.910 -3.545 3.465 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.260 -1.912 4.222 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.329 -1.636 3.313 1.00 0.00 C ATOM 1903 C ASP A 125 -19.210 -0.496 3.692 1.00 0.00 C ATOM 1904 O ASP A 125 -19.683 -0.438 4.826 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.182 -2.890 3.058 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.634 -2.970 1.607 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.441 -2.089 1.207 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -19.113 -3.786 0.801 1.00 0.00 O ATOM 0 H ASP A 125 -17.417 -2.736 4.802 1.00 0.00 H new ATOM 0 HA ASP A 125 -17.825 -1.328 2.397 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.607 -3.781 3.311 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.054 -2.878 3.712 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.494 0.414 2.743 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.271 1.603 2.905 1.00 0.00 C ATOM 1915 C ILE A 126 -21.699 1.243 2.676 1.00 0.00 C ATOM 1916 O ILE A 126 -22.563 1.519 3.507 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.673 2.658 2.023 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.207 2.907 2.416 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.426 3.985 2.219 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.490 3.980 1.598 1.00 0.00 C ATOM 0 H ILE A 126 -19.152 0.308 1.788 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.252 2.035 3.905 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.742 2.317 0.990 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.172 3.190 3.468 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.657 1.971 2.320 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.989 4.750 1.577 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.476 3.849 1.959 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.347 4.298 3.260 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.464 4.081 1.951 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.486 3.693 0.546 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.009 4.932 1.712 1.00 0.00 H new ATOM 1932 N ASP A 127 -21.913 0.540 1.549 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.188 0.084 1.092 1.00 0.00 C ATOM 1934 C ASP A 127 -23.791 -0.995 1.924 1.00 0.00 C ATOM 1935 O ASP A 127 -24.926 -0.829 2.368 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.949 -0.634 -0.247 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.155 0.280 -1.169 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -22.746 1.317 -1.572 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.022 -0.129 -1.540 1.00 0.00 O ATOM 0 H ASP A 127 -21.153 0.276 0.923 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.835 0.961 1.084 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -22.407 -1.565 -0.083 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.901 -0.897 -0.708 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.061 -2.091 2.203 1.00 0.00 N ATOM 1945 CA GLY A 128 -23.431 -3.263 2.933 1.00 0.00 C ATOM 1946 C GLY A 128 -23.811 -4.326 1.960 1.00 0.00 C ATOM 1947 O GLY A 128 -24.687 -5.098 2.348 1.00 0.00 O ATOM 0 H GLY A 128 -22.097 -2.158 1.876 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -22.602 -3.599 3.556 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.264 -3.046 3.601 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.185 -4.356 0.771 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.445 -5.310 -0.262 1.00 0.00 C ATOM 1953 C ASP A 129 -22.544 -6.493 -0.361 1.00 0.00 C ATOM 1954 O ASP A 129 -22.939 -7.557 -0.835 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.358 -4.682 -1.664 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.060 -4.005 -2.080 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.422 -3.382 -1.190 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.703 -4.030 -3.288 1.00 0.00 O ATOM 0 H ASP A 129 -22.462 -3.682 0.517 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.439 -5.642 0.039 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.570 -5.466 -2.391 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.157 -3.945 -1.747 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.277 -6.273 0.034 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.266 -7.271 0.198 1.00 0.00 C ATOM 1965 C GLY A 130 -19.265 -7.337 -0.904 1.00 0.00 C ATOM 1966 O GLY A 130 -18.551 -8.338 -0.922 1.00 0.00 O ATOM 0 H GLY A 130 -20.938 -5.336 0.253 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -19.741 -7.085 1.135 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -20.748 -8.244 0.290 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.175 -6.328 -1.789 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.016 -6.192 -2.615 1.00 0.00 C ATOM 1972 C GLN A 131 -17.456 -4.826 -2.412 1.00 0.00 C ATOM 1973 O GLN A 131 -18.209 -3.877 -2.199 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.398 -6.555 -4.060 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.800 -6.124 -4.498 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.997 -6.400 -5.982 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -19.529 -7.416 -6.494 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.817 -5.569 -6.679 1.00 0.00 N ATOM 0 H GLN A 131 -19.892 -5.617 -1.932 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.213 -6.880 -2.350 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -17.670 -6.103 -4.734 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.315 -7.635 -4.179 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -20.551 -6.661 -3.918 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.941 -5.062 -4.297 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.193 -4.732 -6.233 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.056 -5.783 -7.647 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.113 -4.802 -2.476 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.290 -3.632 -2.465 1.00 0.00 C ATOM 1989 C VAL A 132 -15.448 -2.828 -3.710 1.00 0.00 C ATOM 1990 O VAL A 132 -15.107 -3.251 -4.813 1.00 0.00 O ATOM 1991 CB VAL A 132 -13.841 -3.963 -2.261 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.057 -2.640 -2.270 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -13.662 -4.723 -0.936 1.00 0.00 C ATOM 0 H VAL A 132 -15.565 -5.660 -2.540 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.630 -3.035 -1.619 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.467 -4.610 -3.054 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -11.996 -2.845 -2.124 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.201 -2.138 -3.227 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.417 -1.998 -1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -12.608 -4.961 -0.793 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.009 -4.102 -0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.242 -5.646 -0.965 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.965 -1.592 -3.596 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.080 -0.635 -4.652 1.00 0.00 C ATOM 2005 C ASN A 133 -14.836 0.185 -4.671 1.00 0.00 C ATOM 2006 O ASN A 133 -13.987 0.146 -3.782 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.178 0.413 -4.401 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.550 -0.179 -4.112 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -18.788 -1.008 -3.235 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.606 0.282 -4.833 1.00 0.00 N ATOM 0 H ASN A 133 -16.325 -1.239 -2.709 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.285 -1.207 -5.557 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.881 1.040 -3.561 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.251 1.062 -5.273 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -20.546 -0.060 -4.636 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.458 0.970 -5.571 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.639 0.888 -5.800 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.423 1.585 -6.080 1.00 0.00 C ATOM 2019 C TYR A 134 -13.099 2.565 -5.005 1.00 0.00 C ATOM 2020 O TYR A 134 -11.989 2.749 -4.508 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.497 2.256 -7.462 1.00 0.00 C ATOM 2022 CG TYR A 134 -12.108 2.414 -7.976 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -11.442 1.318 -8.473 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.340 3.542 -7.809 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -10.136 1.334 -8.902 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.067 3.631 -8.323 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.440 2.518 -8.831 1.00 0.00 C ATOM 2028 OH TYR A 134 -8.247 2.691 -9.565 1.00 0.00 O ATOM 0 H TYR A 134 -15.341 0.974 -6.535 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.609 0.861 -6.102 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -14.090 1.650 -8.148 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -13.988 3.226 -7.388 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.980 0.383 -8.530 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.746 4.379 -7.261 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -9.668 0.439 -9.285 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.556 4.583 -8.327 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.888 3.587 -9.399 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.155 3.299 -4.610 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.093 4.112 -3.435 1.00 0.00 C ATOM 2040 C GLU A 135 -13.686 3.502 -2.138 1.00 0.00 C ATOM 2041 O GLU A 135 -12.932 4.092 -1.367 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.441 4.822 -3.223 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.335 5.870 -2.114 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.572 6.723 -1.868 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.312 6.976 -2.856 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.766 7.058 -0.669 1.00 0.00 O ATOM 0 H GLU A 135 -15.048 3.330 -5.102 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.262 4.775 -3.675 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.756 5.299 -4.151 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.206 4.090 -2.965 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.082 5.360 -1.185 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.503 6.534 -2.350 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.163 2.277 -1.854 1.00 0.00 N ATOM 2054 CA GLU A 136 -13.925 1.642 -0.595 1.00 0.00 C ATOM 2055 C GLU A 136 -12.533 1.121 -0.480 1.00 0.00 C ATOM 2056 O GLU A 136 -12.067 0.956 0.646 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.890 0.459 -0.410 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.341 0.883 -0.172 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.473 -0.127 -0.297 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.172 -1.296 -0.659 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.657 0.112 0.059 1.00 0.00 O ATOM 0 H GLU A 136 -14.719 1.721 -2.504 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.082 2.400 0.172 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.846 -0.176 -1.295 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.554 -0.145 0.433 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.393 1.301 0.833 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.557 1.695 -0.866 1.00 0.00 H new ATOM 2068 N PHE A 137 -11.898 0.973 -1.656 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.492 0.762 -1.810 1.00 0.00 C ATOM 2070 C PHE A 137 -9.646 1.958 -1.538 1.00 0.00 C ATOM 2071 O PHE A 137 -8.694 1.857 -0.766 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.208 0.199 -3.212 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.019 -0.692 -3.326 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.033 -1.958 -2.790 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.836 -0.157 -3.780 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.941 -2.782 -2.932 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.715 -0.946 -3.886 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.786 -2.249 -3.453 1.00 0.00 C ATOM 0 H PHE A 137 -12.393 1.002 -2.548 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.207 0.042 -1.043 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.086 -0.354 -3.545 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.079 1.035 -3.899 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.904 -2.307 -2.256 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -7.787 0.886 -4.054 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.990 -3.821 -2.642 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.799 -0.551 -4.300 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.907 -2.873 -3.524 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.983 3.153 -2.055 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.185 4.322 -1.856 1.00 0.00 C ATOM 2090 C VAL A 138 -9.245 4.801 -0.446 1.00 0.00 C ATOM 2091 O VAL A 138 -8.212 5.234 0.062 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.687 5.434 -2.728 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.990 6.790 -2.530 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.633 5.107 -4.230 1.00 0.00 C ATOM 0 H VAL A 138 -10.819 3.310 -2.618 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.158 4.052 -2.104 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.721 5.525 -2.394 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.426 7.525 -3.207 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.123 7.121 -1.500 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.926 6.687 -2.743 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.011 5.955 -4.801 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.602 4.904 -4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.247 4.230 -4.434 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.367 4.578 0.262 1.00 0.00 N ATOM 2105 CA GLN A 139 -10.504 4.706 1.680 1.00 0.00 C ATOM 2106 C GLN A 139 -9.620 3.860 2.531 1.00 0.00 C ATOM 2107 O GLN A 139 -8.901 4.290 3.432 1.00 0.00 O ATOM 2108 CB GLN A 139 -11.962 4.441 2.089 1.00 0.00 C ATOM 2109 CG GLN A 139 -12.276 5.028 3.467 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.700 4.756 3.930 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.608 5.021 3.144 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.951 4.264 5.173 1.00 0.00 N ATOM 0 H GLN A 139 -11.236 4.289 -0.187 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.184 5.730 1.871 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.633 4.874 1.347 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -12.148 3.367 2.099 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -11.580 4.615 4.197 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.110 6.105 3.441 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.178 4.053 5.804 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.913 4.106 5.474 1.00 0.00 H new ATOM 2121 N MET A 140 -9.522 2.574 2.150 1.00 0.00 N ATOM 2122 CA MET A 140 -8.547 1.645 2.630 1.00 0.00 C ATOM 2123 C MET A 140 -7.155 2.164 2.514 1.00 0.00 C ATOM 2124 O MET A 140 -6.350 1.976 3.424 1.00 0.00 O ATOM 2125 CB MET A 140 -8.850 0.198 2.206 1.00 0.00 C ATOM 2126 CG MET A 140 -7.935 -0.922 2.705 1.00 0.00 C ATOM 2127 SD MET A 140 -6.295 -1.079 1.936 1.00 0.00 S ATOM 2128 CE MET A 140 -6.825 -1.862 0.386 1.00 0.00 C ATOM 0 H MET A 140 -10.159 2.160 1.469 1.00 0.00 H new ATOM 0 HA MET A 140 -8.634 1.555 3.713 1.00 0.00 H new ATOM 0 HB2 MET A 140 -9.864 -0.035 2.530 1.00 0.00 H new ATOM 0 HB3 MET A 140 -8.848 0.166 1.116 1.00 0.00 H new ATOM 0 HG2 MET A 140 -7.791 -0.785 3.777 1.00 0.00 H new ATOM 0 HG3 MET A 140 -8.460 -1.868 2.572 1.00 0.00 H new ATOM 0 HE1 MET A 140 -6.431 -2.877 0.338 1.00 0.00 H new ATOM 0 HE2 MET A 140 -7.914 -1.893 0.348 1.00 0.00 H new ATOM 0 HE3 MET A 140 -6.448 -1.287 -0.460 1.00 0.00 H new ATOM 2138 N MET A 141 -6.705 2.755 1.392 1.00 0.00 N ATOM 2139 CA MET A 141 -5.354 3.165 1.163 1.00 0.00 C ATOM 2140 C MET A 141 -4.986 4.466 1.789 1.00 0.00 C ATOM 2141 O MET A 141 -3.802 4.647 2.071 1.00 0.00 O ATOM 2142 CB MET A 141 -5.041 3.262 -0.340 1.00 0.00 C ATOM 2143 CG MET A 141 -3.605 2.853 -0.675 1.00 0.00 C ATOM 2144 SD MET A 141 -3.128 1.099 -0.642 1.00 0.00 S ATOM 2145 CE MET A 141 -3.670 0.514 -2.273 1.00 0.00 C ATOM 0 H MET A 141 -7.318 2.957 0.602 1.00 0.00 H new ATOM 0 HA MET A 141 -4.761 2.385 1.640 1.00 0.00 H new ATOM 0 HB2 MET A 141 -5.733 2.626 -0.892 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.210 4.285 -0.676 1.00 0.00 H new ATOM 0 HG2 MET A 141 -3.385 3.230 -1.674 1.00 0.00 H new ATOM 0 HG3 MET A 141 -2.948 3.381 0.016 1.00 0.00 H new ATOM 0 HE1 MET A 141 -4.105 -0.481 -2.177 1.00 0.00 H new ATOM 0 HE2 MET A 141 -4.416 1.199 -2.676 1.00 0.00 H new ATOM 0 HE3 MET A 141 -2.815 0.472 -2.947 1.00 0.00 H new ATOM 2155 N THR A 142 -5.882 5.448 1.989 1.00 0.00 N ATOM 2156 CA THR A 142 -5.464 6.664 2.615 1.00 0.00 C ATOM 2157 C THR A 142 -5.418 6.512 4.129 1.00 0.00 C ATOM 2158 O THR A 142 -6.367 5.936 4.726 1.00 0.00 O ATOM 2159 CB THR A 142 -6.489 7.730 2.364 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.843 7.343 2.551 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.554 8.223 0.908 1.00 0.00 C ATOM 0 H THR A 142 -6.867 5.406 1.727 1.00 0.00 H new ATOM 0 HA THR A 142 -4.483 6.913 2.211 1.00 0.00 H new ATOM 0 HB THR A 142 -6.141 8.469 3.086 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.914 6.777 3.348 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.321 8.992 0.818 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.588 8.639 0.621 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.799 7.388 0.252 1.00 0.00 H new ATOM 2170 N ARG B 1 -9.326 -3.563 11.840 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.289 -2.680 11.261 1.00 0.00 C ATOM 2172 C ARG B 1 -7.101 -3.330 10.639 1.00 0.00 C ATOM 2173 O ARG B 1 -6.795 -3.071 9.476 1.00 0.00 O ATOM 2174 CB ARG B 1 -7.824 -1.716 12.365 1.00 0.00 C ATOM 2175 CG ARG B 1 -6.745 -0.741 11.888 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.363 0.359 12.880 1.00 0.00 C ATOM 2177 NE ARG B 1 -5.264 1.156 12.267 1.00 0.00 N ATOM 2178 CZ ARG B 1 -5.383 2.084 11.273 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.552 2.606 10.799 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -4.207 2.522 10.737 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.779 -3.085 12.645 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.042 -3.778 11.117 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.886 -4.448 12.166 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.774 -2.186 10.419 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.681 -1.151 12.732 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -7.439 -2.293 13.206 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -5.849 -1.311 11.642 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -7.087 -0.271 10.966 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -7.222 0.994 13.097 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -6.040 -0.074 13.827 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.324 0.991 12.628 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.443 2.304 11.194 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -6.535 3.298 10.050 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -3.321 2.156 11.084 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -4.214 3.216 9.989 1.00 0.00 H new ATOM 2193 N ARG B 2 -6.445 -4.265 11.348 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.118 -4.707 11.049 1.00 0.00 C ATOM 2195 C ARG B 2 -5.001 -5.536 9.817 1.00 0.00 C ATOM 2196 O ARG B 2 -3.944 -5.453 9.193 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.447 -5.501 12.182 1.00 0.00 C ATOM 2198 CG ARG B 2 -3.935 -4.571 13.284 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.632 -5.211 14.640 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.058 -4.122 15.479 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.311 -4.397 16.588 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -2.335 -5.630 17.172 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.777 -3.363 17.301 1.00 0.00 N ATOM 0 H ARG B 2 -6.853 -4.730 12.159 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.605 -3.757 10.901 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.159 -6.210 12.603 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -3.618 -6.083 11.780 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.026 -4.088 12.926 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.675 -3.785 13.437 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.536 -5.618 15.092 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -2.928 -6.037 14.535 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.227 -3.150 15.219 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -2.919 -6.369 16.780 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -1.769 -5.813 18.000 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -1.938 -2.401 17.003 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.217 -3.552 18.132 1.00 0.00 H new ATOM 2217 N LYS B 3 -5.956 -6.408 9.447 1.00 0.00 N ATOM 2218 CA LYS B 3 -5.913 -7.151 8.226 1.00 0.00 C ATOM 2219 C LYS B 3 -5.869 -6.315 6.993 1.00 0.00 C ATOM 2220 O LYS B 3 -5.139 -6.397 6.006 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.024 -8.209 8.120 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.083 -9.289 9.202 1.00 0.00 C ATOM 2223 CD LYS B 3 -5.876 -10.215 9.360 1.00 0.00 C ATOM 2224 CE LYS B 3 -6.121 -11.361 10.344 1.00 0.00 C ATOM 2225 NZ LYS B 3 -4.912 -12.171 10.615 1.00 0.00 N ATOM 0 H LYS B 3 -6.782 -6.602 10.013 1.00 0.00 H new ATOM 0 HA LYS B 3 -4.956 -7.670 8.282 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.982 -7.689 8.112 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -6.923 -8.706 7.155 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.252 -8.794 10.159 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.957 -9.910 9.006 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -5.615 -10.630 8.387 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -5.020 -9.631 9.698 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -6.493 -10.951 11.283 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -6.903 -12.009 9.948 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.175 -13.175 10.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -4.228 -12.043 9.842 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -4.483 -11.865 11.512 1.00 0.00 H new ATOM 2239 N TRP B 4 -6.757 -5.308 6.913 1.00 0.00 N ATOM 2240 CA TRP B 4 -6.801 -4.387 5.820 1.00 0.00 C ATOM 2241 C TRP B 4 -5.649 -3.447 5.723 1.00 0.00 C ATOM 2242 O TRP B 4 -5.119 -3.287 4.625 1.00 0.00 O ATOM 2243 CB TRP B 4 -7.977 -3.398 5.900 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.351 -3.892 5.517 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.476 -4.008 6.282 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.756 -4.230 4.177 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.553 -4.375 5.519 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.107 -4.590 4.236 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.076 -4.372 2.998 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.742 -5.022 3.104 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.757 -4.823 1.891 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.091 -5.156 1.900 1.00 0.00 C ATOM 0 H TRP B 4 -7.463 -5.129 7.627 1.00 0.00 H new ATOM 0 HA TRP B 4 -6.845 -5.087 4.985 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.030 -3.026 6.923 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -7.740 -2.546 5.263 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.512 -3.834 7.347 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.515 -4.472 5.845 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.024 -4.134 2.938 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.793 -5.267 3.158 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.213 -4.921 0.963 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.599 -5.503 1.012 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.086 -3.019 6.867 1.00 0.00 N ATOM 2264 CA GLN B 5 -3.821 -2.355 6.931 1.00 0.00 C ATOM 2265 C GLN B 5 -2.757 -3.310 6.511 1.00 0.00 C ATOM 2266 O GLN B 5 -1.866 -2.860 5.792 1.00 0.00 O ATOM 2267 CB GLN B 5 -3.516 -1.799 8.332 1.00 0.00 C ATOM 2268 CG GLN B 5 -4.308 -0.532 8.664 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.926 0.733 7.909 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.540 1.194 6.949 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -2.760 1.302 8.319 1.00 0.00 N ATOM 0 H GLN B 5 -5.527 -3.139 7.779 1.00 0.00 H new ATOM 0 HA GLN B 5 -3.853 -1.498 6.258 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.739 -2.564 9.076 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -2.450 -1.583 8.406 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.363 -0.733 8.479 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -4.203 -0.336 9.731 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -2.256 0.914 9.116 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -2.390 2.116 7.829 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.890 -4.618 6.793 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.916 -5.535 6.286 1.00 0.00 C ATOM 2282 C LYS B 6 -1.967 -5.702 4.806 1.00 0.00 C ATOM 2283 O LYS B 6 -0.983 -5.931 4.104 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.026 -6.838 7.095 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.083 -7.975 6.696 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.419 -9.030 7.753 1.00 0.00 C ATOM 2287 CE LYS B 6 -0.586 -10.304 7.597 1.00 0.00 C ATOM 2288 NZ LYS B 6 -0.816 -11.196 8.755 1.00 0.00 N ATOM 0 H LYS B 6 -3.640 -5.030 7.349 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.914 -5.130 6.429 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.851 -6.603 8.145 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.050 -7.202 7.017 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.275 -8.332 5.684 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.036 -7.673 6.735 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.253 -8.611 8.745 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.477 -9.282 7.686 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.856 -10.815 6.673 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.472 -10.052 7.525 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.040 -11.886 8.821 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -0.852 -10.630 9.627 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.717 -11.700 8.632 1.00 0.00 H new ATOM 2302 N THR B 7 -3.144 -5.455 4.203 1.00 0.00 N ATOM 2303 CA THR B 7 -3.395 -5.636 2.807 1.00 0.00 C ATOM 2304 C THR B 7 -2.979 -4.394 2.097 1.00 0.00 C ATOM 2305 O THR B 7 -2.258 -4.488 1.104 1.00 0.00 O ATOM 2306 CB THR B 7 -4.864 -5.767 2.535 1.00 0.00 C ATOM 2307 OG1 THR B 7 -5.365 -6.823 3.342 1.00 0.00 O ATOM 2308 CG2 THR B 7 -5.166 -6.113 1.068 1.00 0.00 C ATOM 0 H THR B 7 -3.958 -5.113 4.713 1.00 0.00 H new ATOM 0 HA THR B 7 -2.859 -6.528 2.482 1.00 0.00 H new ATOM 0 HB THR B 7 -5.332 -4.808 2.758 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.365 -6.545 4.282 1.00 0.00 H new ATOM 0 HG21 THR B 7 -6.244 -6.196 0.928 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.775 -5.328 0.421 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.693 -7.062 0.813 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.349 -3.165 2.500 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.064 -1.958 1.789 1.00 0.00 C ATOM 2318 C GLY B 8 -1.583 -1.798 1.753 1.00 0.00 C ATOM 2319 O GLY B 8 -1.040 -1.552 0.677 1.00 0.00 O ATOM 0 H GLY B 8 -3.871 -3.006 3.362 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.469 -2.004 0.778 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.530 -1.104 2.281 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.865 -1.917 2.883 1.00 0.00 N ATOM 2324 CA HIS B 9 0.552 -1.723 2.870 1.00 0.00 C ATOM 2325 C HIS B 9 1.247 -2.723 2.012 1.00 0.00 C ATOM 2326 O HIS B 9 2.293 -2.407 1.448 1.00 0.00 O ATOM 2327 CB HIS B 9 1.197 -1.947 4.248 1.00 0.00 C ATOM 2328 CG HIS B 9 0.610 -0.979 5.232 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.376 -1.179 6.577 1.00 0.00 N ATOM 2330 CD2 HIS B 9 0.130 0.259 4.936 1.00 0.00 C ATOM 2331 CE1 HIS B 9 -0.046 0.026 7.047 1.00 0.00 C ATOM 2332 NE2 HIS B 9 -0.295 0.895 6.085 1.00 0.00 N ATOM 0 H HIS B 9 -1.259 -2.145 3.796 1.00 0.00 H new ATOM 0 HA HIS B 9 0.665 -0.698 2.516 1.00 0.00 H new ATOM 0 HB2 HIS B 9 1.026 -2.971 4.581 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.276 -1.809 4.184 1.00 0.00 H new ATOM 0 HD1 HIS B 9 0.494 -2.044 7.105 1.00 0.00 H new ATOM 0 HD2 HIS B 9 0.088 0.684 3.944 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.165 0.248 8.097 1.00 0.00 H new ATOM 2340 N ALA B 10 0.755 -3.965 1.864 1.00 0.00 N ATOM 2341 CA ALA B 10 1.234 -4.996 0.996 1.00 0.00 C ATOM 2342 C ALA B 10 1.043 -4.606 -0.429 1.00 0.00 C ATOM 2343 O ALA B 10 1.954 -4.414 -1.232 1.00 0.00 O ATOM 2344 CB ALA B 10 0.552 -6.324 1.368 1.00 0.00 C ATOM 0 H ALA B 10 -0.054 -4.275 2.403 1.00 0.00 H new ATOM 0 HA ALA B 10 2.307 -5.137 1.124 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.912 -7.115 0.710 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.787 -6.577 2.402 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.527 -6.223 1.256 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.224 -4.423 -0.841 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.553 -4.067 -2.187 1.00 0.00 C ATOM 2352 C VAL B 11 -0.088 -2.717 -2.613 1.00 0.00 C ATOM 2353 O VAL B 11 -0.003 -2.513 -3.823 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.994 -4.358 -2.482 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.988 -3.310 -1.955 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.223 -4.725 -3.958 1.00 0.00 C ATOM 0 H VAL B 11 -1.034 -4.524 -0.230 1.00 0.00 H new ATOM 0 HA VAL B 11 0.037 -4.719 -2.832 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.225 -5.247 -1.896 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -4.003 -3.607 -2.217 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.899 -3.237 -0.871 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.767 -2.341 -2.403 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.281 -4.927 -4.123 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.909 -3.896 -4.592 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.641 -5.613 -4.207 1.00 0.00 H new ATOM 2366 N ARG B 12 0.201 -1.785 -1.687 1.00 0.00 N ATOM 2367 CA ARG B 12 0.869 -0.577 -2.063 1.00 0.00 C ATOM 2368 C ARG B 12 2.320 -0.783 -2.329 1.00 0.00 C ATOM 2369 O ARG B 12 2.889 -0.087 -3.168 1.00 0.00 O ATOM 2370 CB ARG B 12 0.688 0.464 -0.946 1.00 0.00 C ATOM 2371 CG ARG B 12 1.014 1.881 -1.423 1.00 0.00 C ATOM 2372 CD ARG B 12 0.548 3.041 -0.541 1.00 0.00 C ATOM 2373 NE ARG B 12 1.257 4.218 -1.117 1.00 0.00 N ATOM 2374 CZ ARG B 12 2.507 4.477 -0.635 1.00 0.00 C ATOM 2375 NH1 ARG B 12 2.852 4.241 0.665 1.00 0.00 N ATOM 2376 NH2 ARG B 12 3.411 5.140 -1.413 1.00 0.00 N ATOM 0 H ARG B 12 -0.023 -1.864 -0.695 1.00 0.00 H new ATOM 0 HA ARG B 12 0.422 -0.226 -2.993 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.339 0.431 -0.583 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.332 0.208 -0.104 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.095 1.958 -1.539 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.577 2.013 -2.413 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.534 3.165 -0.579 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.814 2.883 0.504 1.00 0.00 H new ATOM 0 HE ARG B 12 0.829 4.801 -1.836 1.00 0.00 H new ATOM 0 HH11 ARG B 12 2.164 3.858 1.314 1.00 0.00 H new ATOM 0 HH12 ARG B 12 3.797 4.448 0.987 1.00 0.00 H new ATOM 0 HH21 ARG B 12 3.152 5.441 -2.353 1.00 0.00 H new ATOM 0 HH22 ARG B 12 4.346 5.335 -1.055 1.00 0.00 H new ATOM 2390 N ALA B 13 2.882 -1.813 -1.671 1.00 0.00 N ATOM 2391 CA ALA B 13 4.239 -2.171 -1.941 1.00 0.00 C ATOM 2392 C ALA B 13 4.456 -2.643 -3.338 1.00 0.00 C ATOM 2393 O ALA B 13 5.335 -2.279 -4.117 1.00 0.00 O ATOM 2394 CB ALA B 13 4.792 -3.205 -0.945 1.00 0.00 C ATOM 0 H ALA B 13 2.411 -2.385 -0.970 1.00 0.00 H new ATOM 0 HA ALA B 13 4.797 -1.244 -1.814 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.826 -3.439 -1.199 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.750 -2.796 0.065 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.192 -4.114 -0.993 1.00 0.00 H new ATOM 2400 N ILE B 14 3.478 -3.412 -3.849 1.00 0.00 N ATOM 2401 CA ILE B 14 3.343 -3.927 -5.176 1.00 0.00 C ATOM 2402 C ILE B 14 2.852 -2.961 -6.198 1.00 0.00 C ATOM 2403 O ILE B 14 3.418 -2.875 -7.287 1.00 0.00 O ATOM 2404 CB ILE B 14 2.439 -5.124 -5.161 1.00 0.00 C ATOM 2405 CG1 ILE B 14 2.921 -6.189 -4.162 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.235 -5.665 -6.586 1.00 0.00 C ATOM 2407 CD1 ILE B 14 4.179 -7.012 -4.436 1.00 0.00 C ATOM 0 H ILE B 14 2.696 -3.704 -3.263 1.00 0.00 H new ATOM 0 HA ILE B 14 4.358 -4.182 -5.481 1.00 0.00 H new ATOM 0 HB ILE B 14 1.457 -4.815 -4.801 1.00 0.00 H new ATOM 0 HG12 ILE B 14 3.070 -5.686 -3.206 1.00 0.00 H new ATOM 0 HG13 ILE B 14 2.101 -6.894 -4.027 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.577 -6.533 -6.555 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.786 -4.891 -7.208 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.198 -5.955 -7.006 1.00 0.00 H new ATOM 0 HD11 ILE B 14 4.347 -7.706 -3.612 1.00 0.00 H new ATOM 0 HD12 ILE B 14 4.053 -7.572 -5.362 1.00 0.00 H new ATOM 0 HD13 ILE B 14 5.037 -6.346 -4.529 1.00 0.00 H new ATOM 2419 N GLY B 15 1.847 -2.158 -5.805 1.00 0.00 N ATOM 2420 CA GLY B 15 1.313 -1.180 -6.702 1.00 0.00 C ATOM 2421 C GLY B 15 2.183 -0.017 -7.034 1.00 0.00 C ATOM 2422 O GLY B 15 2.019 0.490 -8.143 1.00 0.00 O ATOM 0 H GLY B 15 1.410 -2.183 -4.884 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.050 -1.682 -7.633 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.386 -0.798 -6.273 1.00 0.00 H new ATOM 2426 N ARG B 16 3.155 0.329 -6.171 1.00 0.00 N ATOM 2427 CA ARG B 16 4.177 1.272 -6.504 1.00 0.00 C ATOM 2428 C ARG B 16 5.234 0.574 -7.288 1.00 0.00 C ATOM 2429 O ARG B 16 5.327 0.711 -8.507 1.00 0.00 O ATOM 2430 CB ARG B 16 4.667 1.995 -5.238 1.00 0.00 C ATOM 2431 CG ARG B 16 5.552 3.226 -5.443 1.00 0.00 C ATOM 2432 CD ARG B 16 6.235 3.746 -4.176 1.00 0.00 C ATOM 2433 NE ARG B 16 7.096 4.944 -4.388 1.00 0.00 N ATOM 2434 CZ ARG B 16 6.633 6.171 -4.766 1.00 0.00 C ATOM 2435 NH1 ARG B 16 5.346 6.624 -4.807 1.00 0.00 N ATOM 2436 NH2 ARG B 16 7.537 7.118 -5.150 1.00 0.00 N ATOM 0 H ARG B 16 3.233 -0.052 -5.228 1.00 0.00 H new ATOM 0 HA ARG B 16 3.798 2.068 -7.145 1.00 0.00 H new ATOM 0 HB2 ARG B 16 3.793 2.298 -4.660 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.219 1.278 -4.630 1.00 0.00 H new ATOM 0 HG2 ARG B 16 6.319 2.986 -6.179 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.944 4.026 -5.865 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.470 3.990 -3.439 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.843 2.947 -3.752 1.00 0.00 H new ATOM 0 HE ARG B 16 8.100 4.840 -4.241 1.00 0.00 H new ATOM 0 HH11 ARG B 16 4.580 6.010 -4.530 1.00 0.00 H new ATOM 0 HH12 ARG B 16 5.150 7.577 -5.115 1.00 0.00 H new ATOM 0 HH21 ARG B 16 8.534 6.901 -5.150 1.00 0.00 H new ATOM 0 HH22 ARG B 16 7.216 8.043 -5.437 1.00 0.00 H new