USER MOD reduce.3.24.130724 H: found=0, std=0, add=1127, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1130 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 101 SER OG : rot 180:sc= 0.495 USER MOD Set 1.2: A 135 GLN : amide:sc= 0.548 X(o=1,f=0.62) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.95! USER MOD Single : A 8 GLN : amide:sc= -0.233 X(o=-0.23,f=-0.24) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 134:sc= -0.794 (180deg=-2.8!) USER MOD Single : A 26 THR OG1 : rot 12:sc= 1.24 USER MOD Single : A 28 THR OG1 : rot -85:sc= 0.542 USER MOD Single : A 29 THR OG1 : rot 161:sc= 1.28 USER MOD Single : A 30 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0565) USER MOD Single : A 34 THR OG1 : rot 95:sc= 1.26 USER MOD Single : A 36 MET CE :methyl 152:sc= 0 (180deg=-0.54) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.592 K(o=-0.59,f=0) USER MOD Single : A 42 ASN : amide:sc= -2.55! K(o=-2.6!,f=0) USER MOD Single : A 44 THR OG1 : rot -78:sc= 0.259 USER MOD Single : A 49 GLN : amide:sc= -0.464 K(o=-0.46,f=-3.8!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.0375 X(o=-0.038,f=0) USER MOD Single : A 60 ASN : amide:sc= -0.252 K(o=-0.25,f=-2.2!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0107 USER MOD Single : A 70 THR OG1 : rot 76:sc= 0.591 USER MOD Single : A 71 MET CE :methyl 150:sc= -0.103 (180deg=-1.1) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -125:sc= 1.22 (180deg=-0.302) USER MOD Single : A 76 MET CE :methyl -172:sc= -1.39 (180deg=-1.72) USER MOD Single : A 94 LYS NZ :NH3+ -172:sc=-0.00692 (180deg=-0.133) USER MOD Single : A 97 ASN : amide:sc= 0.943 K(o=0.94,f=-0.083) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HE2:sc= 1.16 K(o=1.2,f=-4.2!) USER MOD Single : A 109 MET CE :methyl -158:sc= -0.106 (180deg=-0.734) USER MOD Single : A 110 THR OG1 : rot 71:sc= 0.537 USER MOD Single : A 111 ASN : amide:sc=-0.00614 K(o=-0.0061,f=-1.4) USER MOD Single : A 115 LYS NZ :NH3+ 162:sc= -0.142 (180deg=-0.625) USER MOD Single : A 117 THR OG1 : rot -60:sc= 0.0655 USER MOD Single : A 124 MET CE :methyl -119:sc= 0 (180deg=-1.66) USER MOD Single : A 137 ASN : amide:sc= 1.09 K(o=1.1,f=-2.2!) USER MOD Single : A 138 TYR OH : rot 23:sc= 2.27 USER MOD Single : A 143 GLN : amide:sc= -0.659 K(o=-0.66,f=-0.14) USER MOD Single : A 144 MET CE :methyl -159:sc= -0.174 (180deg=-0.773) USER MOD Single : A 145 MET CE :methyl -112:sc= -0.541 (180deg=-0.955) USER MOD Single : B 82 LYS NZ :NH3+ 138:sc= 1.16 (180deg=0.614) USER MOD Single : B 86 LYS NZ :NH3+ -143:sc= 2.25 (180deg=-0.645!) USER MOD Single : B 87 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : B 90 GLN : amide:sc= -2.43! K(o=-2.4!,f=0.46) USER MOD Single : B 91 LYS NZ :NH3+ -140:sc= 2.37 (180deg=0.0963) USER MOD Single : B 93 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.12) USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 4 -9.646 4.838 -16.904 1.00 0.00 N ATOM 43 CA LEU A 4 -8.379 4.295 -16.522 1.00 0.00 C ATOM 44 C LEU A 4 -7.590 4.070 -17.779 1.00 0.00 C ATOM 45 O LEU A 4 -8.172 3.699 -18.806 1.00 0.00 O ATOM 46 CB LEU A 4 -8.613 2.944 -15.828 1.00 0.00 C ATOM 47 CG LEU A 4 -7.455 2.324 -15.046 1.00 0.00 C ATOM 48 CD1 LEU A 4 -6.850 3.337 -14.096 1.00 0.00 C ATOM 49 CD2 LEU A 4 -7.976 1.144 -14.252 1.00 0.00 C ATOM 0 HA LEU A 4 -7.849 4.967 -15.847 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -9.452 3.063 -15.142 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.922 2.228 -16.589 1.00 0.00 H new ATOM 0 HG LEU A 4 -6.686 2.000 -15.747 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.028 2.877 -13.549 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -6.476 4.190 -14.663 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -7.610 3.675 -13.392 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -7.158 0.694 -13.690 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -8.748 1.483 -13.561 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.398 0.405 -14.933 1.00 0.00 H new ATOM 61 N THR A 5 -6.309 4.308 -17.739 1.00 0.00 N ATOM 62 CA THR A 5 -5.513 4.033 -18.891 1.00 0.00 C ATOM 63 C THR A 5 -5.365 2.528 -19.038 1.00 0.00 C ATOM 64 O THR A 5 -5.246 1.796 -18.037 1.00 0.00 O ATOM 65 CB THR A 5 -4.147 4.759 -18.859 1.00 0.00 C ATOM 66 OG1 THR A 5 -3.463 4.477 -17.638 1.00 0.00 O ATOM 67 CG2 THR A 5 -4.331 6.260 -19.000 1.00 0.00 C ATOM 0 H THR A 5 -5.806 4.685 -16.936 1.00 0.00 H new ATOM 0 HA THR A 5 -6.021 4.428 -19.771 1.00 0.00 H new ATOM 0 HB THR A 5 -3.553 4.395 -19.698 1.00 0.00 H new ATOM 0 HG1 THR A 5 -2.600 4.941 -17.632 1.00 0.00 H new ATOM 0 HG21 THR A 5 -3.358 6.750 -18.975 1.00 0.00 H new ATOM 0 HG22 THR A 5 -4.823 6.479 -19.948 1.00 0.00 H new ATOM 0 HG23 THR A 5 -4.945 6.630 -18.179 1.00 0.00 H new ATOM 75 N GLU A 6 -5.372 2.063 -20.254 1.00 0.00 N ATOM 76 CA GLU A 6 -5.394 0.653 -20.526 1.00 0.00 C ATOM 77 C GLU A 6 -4.081 -0.032 -20.205 1.00 0.00 C ATOM 78 O GLU A 6 -4.042 -1.237 -20.032 1.00 0.00 O ATOM 79 CB GLU A 6 -5.895 0.398 -21.930 1.00 0.00 C ATOM 80 CG GLU A 6 -7.329 0.885 -22.093 1.00 0.00 C ATOM 81 CD GLU A 6 -7.843 0.804 -23.489 1.00 0.00 C ATOM 82 OE1 GLU A 6 -7.930 1.840 -24.162 1.00 0.00 O ATOM 83 OE2 GLU A 6 -8.187 -0.299 -23.953 1.00 0.00 O ATOM 0 H GLU A 6 -5.363 2.651 -21.087 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.105 0.186 -19.845 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -5.251 0.905 -22.648 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -5.841 -0.668 -22.151 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -7.977 0.297 -21.444 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.391 1.919 -21.754 1.00 0.00 H new ATOM 90 N GLU A 7 -3.015 0.741 -20.087 1.00 0.00 N ATOM 91 CA GLU A 7 -1.755 0.196 -19.633 1.00 0.00 C ATOM 92 C GLU A 7 -1.867 -0.134 -18.152 1.00 0.00 C ATOM 93 O GLU A 7 -1.338 -1.144 -17.690 1.00 0.00 O ATOM 94 CB GLU A 7 -0.613 1.169 -19.853 1.00 0.00 C ATOM 95 CG GLU A 7 0.750 0.584 -19.530 1.00 0.00 C ATOM 96 CD GLU A 7 1.112 -0.566 -20.428 1.00 0.00 C ATOM 97 OE1 GLU A 7 1.303 -0.345 -21.640 1.00 0.00 O ATOM 98 OE2 GLU A 7 1.258 -1.698 -19.948 1.00 0.00 O ATOM 0 H GLU A 7 -3.000 1.739 -20.298 1.00 0.00 H new ATOM 0 HA GLU A 7 -1.540 -0.703 -20.210 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.622 1.498 -20.892 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.776 2.053 -19.237 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.507 1.363 -19.621 1.00 0.00 H new ATOM 0 HG3 GLU A 7 0.761 0.248 -18.493 1.00 0.00 H new ATOM 105 N GLN A 8 -2.596 0.704 -17.406 1.00 0.00 N ATOM 106 CA GLN A 8 -2.799 0.420 -16.004 1.00 0.00 C ATOM 107 C GLN A 8 -3.695 -0.756 -15.894 1.00 0.00 C ATOM 108 O GLN A 8 -3.476 -1.610 -15.086 1.00 0.00 O ATOM 109 CB GLN A 8 -3.387 1.582 -15.197 1.00 0.00 C ATOM 110 CG GLN A 8 -2.580 2.858 -15.216 1.00 0.00 C ATOM 111 CD GLN A 8 -1.085 2.623 -15.137 1.00 0.00 C ATOM 112 OE1 GLN A 8 -0.407 2.509 -16.167 1.00 0.00 O ATOM 113 NE2 GLN A 8 -0.567 2.512 -13.958 1.00 0.00 N ATOM 0 H GLN A 8 -3.039 1.557 -17.748 1.00 0.00 H new ATOM 0 HA GLN A 8 -1.815 0.232 -15.575 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -4.385 1.798 -15.578 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.503 1.261 -14.162 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.806 3.409 -16.129 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -2.887 3.486 -14.380 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.156 2.612 -13.131 1.00 0.00 H new ATOM 0 HE22 GLN A 8 0.430 2.325 -13.855 1.00 0.00 H new ATOM 122 N ILE A 9 -4.699 -0.805 -16.754 1.00 0.00 N ATOM 123 CA ILE A 9 -5.605 -1.936 -16.789 1.00 0.00 C ATOM 124 C ILE A 9 -4.821 -3.234 -17.096 1.00 0.00 C ATOM 125 O ILE A 9 -5.057 -4.266 -16.481 1.00 0.00 O ATOM 126 CB ILE A 9 -6.778 -1.704 -17.796 1.00 0.00 C ATOM 127 CG1 ILE A 9 -7.575 -0.445 -17.370 1.00 0.00 C ATOM 128 CG2 ILE A 9 -7.687 -2.928 -17.871 1.00 0.00 C ATOM 129 CD1 ILE A 9 -8.832 -0.162 -18.159 1.00 0.00 C ATOM 0 H ILE A 9 -4.905 -0.075 -17.436 1.00 0.00 H new ATOM 0 HA ILE A 9 -6.063 -2.044 -15.806 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.366 -1.546 -18.793 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -7.844 -0.548 -16.319 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -6.918 0.421 -17.448 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.494 -2.739 -18.579 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -7.109 -3.791 -18.202 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.108 -3.130 -16.886 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -9.307 0.741 -17.775 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -8.578 -0.019 -19.209 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.519 -1.003 -18.063 1.00 0.00 H new ATOM 141 N ALA A 10 -3.844 -3.134 -17.992 1.00 0.00 N ATOM 142 CA ALA A 10 -2.953 -4.242 -18.336 1.00 0.00 C ATOM 143 C ALA A 10 -2.146 -4.695 -17.121 1.00 0.00 C ATOM 144 O ALA A 10 -2.058 -5.903 -16.827 1.00 0.00 O ATOM 145 CB ALA A 10 -2.017 -3.818 -19.447 1.00 0.00 C ATOM 0 H ALA A 10 -3.645 -2.275 -18.505 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.562 -5.081 -18.672 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.355 -4.646 -19.701 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.598 -3.536 -20.325 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.423 -2.966 -19.117 1.00 0.00 H new ATOM 151 N GLU A 11 -1.576 -3.733 -16.419 1.00 0.00 N ATOM 152 CA GLU A 11 -0.799 -3.993 -15.216 1.00 0.00 C ATOM 153 C GLU A 11 -1.670 -4.600 -14.133 1.00 0.00 C ATOM 154 O GLU A 11 -1.269 -5.554 -13.445 1.00 0.00 O ATOM 155 CB GLU A 11 -0.150 -2.702 -14.712 1.00 0.00 C ATOM 156 CG GLU A 11 0.593 -2.863 -13.398 1.00 0.00 C ATOM 157 CD GLU A 11 1.361 -1.642 -13.026 1.00 0.00 C ATOM 158 OE1 GLU A 11 0.873 -0.815 -12.254 1.00 0.00 O ATOM 159 OE2 GLU A 11 2.497 -1.505 -13.512 1.00 0.00 O ATOM 0 H GLU A 11 -1.638 -2.745 -16.666 1.00 0.00 H new ATOM 0 HA GLU A 11 -0.014 -4.707 -15.465 1.00 0.00 H new ATOM 0 HB2 GLU A 11 0.544 -2.336 -15.469 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.921 -1.941 -14.592 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -0.120 -3.095 -12.607 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.275 -3.710 -13.471 1.00 0.00 H new ATOM 166 N PHE A 12 -2.862 -4.065 -13.999 1.00 0.00 N ATOM 167 CA PHE A 12 -3.791 -4.537 -13.018 1.00 0.00 C ATOM 168 C PHE A 12 -4.206 -5.947 -13.336 1.00 0.00 C ATOM 169 O PHE A 12 -4.380 -6.714 -12.447 1.00 0.00 O ATOM 170 CB PHE A 12 -5.005 -3.598 -12.841 1.00 0.00 C ATOM 171 CG PHE A 12 -4.652 -2.179 -12.403 1.00 0.00 C ATOM 172 CD1 PHE A 12 -3.379 -1.858 -11.932 1.00 0.00 C ATOM 173 CD2 PHE A 12 -5.588 -1.167 -12.483 1.00 0.00 C ATOM 174 CE1 PHE A 12 -3.062 -0.571 -11.560 1.00 0.00 C ATOM 175 CE2 PHE A 12 -5.264 0.126 -12.103 1.00 0.00 C ATOM 176 CZ PHE A 12 -4.004 0.420 -11.643 1.00 0.00 C ATOM 0 H PHE A 12 -3.207 -3.293 -14.569 1.00 0.00 H new ATOM 0 HA PHE A 12 -3.283 -4.537 -12.054 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -5.550 -3.548 -13.784 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.681 -4.034 -12.105 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -2.629 -2.632 -11.858 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -6.582 -1.385 -12.845 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.069 -0.342 -11.202 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.007 0.907 -12.169 1.00 0.00 H new ATOM 0 HZ PHE A 12 -3.757 1.429 -11.348 1.00 0.00 H new ATOM 186 N LYS A 13 -4.314 -6.285 -14.633 1.00 0.00 N ATOM 187 CA LYS A 13 -4.600 -7.665 -15.061 1.00 0.00 C ATOM 188 C LYS A 13 -3.555 -8.631 -14.515 1.00 0.00 C ATOM 189 O LYS A 13 -3.895 -9.704 -14.009 1.00 0.00 O ATOM 190 CB LYS A 13 -4.651 -7.794 -16.599 1.00 0.00 C ATOM 191 CG LYS A 13 -5.876 -7.201 -17.244 1.00 0.00 C ATOM 192 CD LYS A 13 -5.875 -7.419 -18.734 1.00 0.00 C ATOM 193 CE LYS A 13 -7.160 -6.924 -19.367 1.00 0.00 C ATOM 194 NZ LYS A 13 -7.171 -7.122 -20.831 1.00 0.00 N ATOM 0 H LYS A 13 -4.208 -5.623 -15.401 1.00 0.00 H new ATOM 0 HA LYS A 13 -5.581 -7.919 -14.659 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -3.768 -7.313 -17.019 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -4.594 -8.850 -16.863 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.770 -7.649 -16.810 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -5.920 -6.133 -17.031 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -5.026 -6.900 -19.178 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -5.748 -8.480 -18.948 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -8.007 -7.448 -18.924 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -7.289 -5.865 -19.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -8.068 -6.770 -21.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -6.379 -6.601 -21.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.074 -8.135 -21.045 1.00 0.00 H new ATOM 208 N GLU A 14 -2.307 -8.223 -14.594 1.00 0.00 N ATOM 209 CA GLU A 14 -1.173 -9.015 -14.130 1.00 0.00 C ATOM 210 C GLU A 14 -1.329 -9.308 -12.618 1.00 0.00 C ATOM 211 O GLU A 14 -1.487 -10.480 -12.190 1.00 0.00 O ATOM 212 CB GLU A 14 0.123 -8.211 -14.452 1.00 0.00 C ATOM 213 CG GLU A 14 1.476 -8.905 -14.240 1.00 0.00 C ATOM 214 CD GLU A 14 1.830 -9.163 -12.797 1.00 0.00 C ATOM 215 OE1 GLU A 14 1.848 -8.209 -12.001 1.00 0.00 O ATOM 216 OE2 GLU A 14 2.142 -10.327 -12.446 1.00 0.00 O ATOM 0 H GLU A 14 -2.041 -7.320 -14.987 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.121 -9.981 -14.632 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.070 -7.896 -15.494 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.114 -7.306 -13.844 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.470 -9.855 -14.774 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.258 -8.292 -14.688 1.00 0.00 H new ATOM 223 N ALA A 15 -1.361 -8.254 -11.831 1.00 0.00 N ATOM 224 CA ALA A 15 -1.443 -8.380 -10.382 1.00 0.00 C ATOM 225 C ALA A 15 -2.770 -8.998 -9.940 1.00 0.00 C ATOM 226 O ALA A 15 -2.846 -9.649 -8.911 1.00 0.00 O ATOM 227 CB ALA A 15 -1.222 -7.035 -9.720 1.00 0.00 C ATOM 0 H ALA A 15 -1.331 -7.292 -12.168 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.651 -9.058 -10.062 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.287 -7.147 -8.638 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.236 -6.656 -9.987 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -1.985 -6.333 -10.058 1.00 0.00 H new ATOM 233 N PHE A 16 -3.784 -8.823 -10.749 1.00 0.00 N ATOM 234 CA PHE A 16 -5.110 -9.343 -10.487 1.00 0.00 C ATOM 235 C PHE A 16 -5.080 -10.859 -10.404 1.00 0.00 C ATOM 236 O PHE A 16 -5.589 -11.431 -9.464 1.00 0.00 O ATOM 237 CB PHE A 16 -6.051 -8.894 -11.593 1.00 0.00 C ATOM 238 CG PHE A 16 -7.482 -9.102 -11.327 1.00 0.00 C ATOM 239 CD1 PHE A 16 -8.231 -9.926 -12.125 1.00 0.00 C ATOM 240 CD2 PHE A 16 -8.086 -8.451 -10.280 1.00 0.00 C ATOM 241 CE1 PHE A 16 -9.562 -10.093 -11.880 1.00 0.00 C ATOM 242 CE2 PHE A 16 -9.413 -8.619 -10.030 1.00 0.00 C ATOM 243 CZ PHE A 16 -10.158 -9.438 -10.828 1.00 0.00 C ATOM 0 H PHE A 16 -3.714 -8.306 -11.626 1.00 0.00 H new ATOM 0 HA PHE A 16 -5.464 -8.958 -9.531 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.884 -7.833 -11.780 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.788 -9.425 -12.508 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -7.766 -10.445 -12.950 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -7.502 -7.799 -9.648 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.149 -10.741 -12.514 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -9.876 -8.105 -9.201 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.212 -9.571 -10.634 1.00 0.00 H new ATOM 253 N SER A 17 -4.436 -11.497 -11.363 1.00 0.00 N ATOM 254 CA SER A 17 -4.329 -12.945 -11.363 1.00 0.00 C ATOM 255 C SER A 17 -3.302 -13.422 -10.319 1.00 0.00 C ATOM 256 O SER A 17 -3.258 -14.599 -9.960 1.00 0.00 O ATOM 257 CB SER A 17 -3.991 -13.453 -12.760 1.00 0.00 C ATOM 258 OG SER A 17 -4.987 -13.041 -13.692 1.00 0.00 O ATOM 0 H SER A 17 -3.980 -11.037 -12.151 1.00 0.00 H new ATOM 0 HA SER A 17 -5.294 -13.365 -11.080 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.017 -13.072 -13.067 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.920 -14.541 -12.751 1.00 0.00 H new ATOM 0 HG SER A 17 -4.757 -13.372 -14.585 1.00 0.00 H new ATOM 264 N LEU A 18 -2.454 -12.507 -9.859 1.00 0.00 N ATOM 265 CA LEU A 18 -1.561 -12.814 -8.750 1.00 0.00 C ATOM 266 C LEU A 18 -2.422 -12.983 -7.472 1.00 0.00 C ATOM 267 O LEU A 18 -2.155 -13.845 -6.632 1.00 0.00 O ATOM 268 CB LEU A 18 -0.472 -11.695 -8.607 1.00 0.00 C ATOM 269 CG LEU A 18 0.659 -11.855 -7.582 1.00 0.00 C ATOM 270 CD1 LEU A 18 0.179 -11.478 -6.231 1.00 0.00 C ATOM 271 CD2 LEU A 18 1.222 -13.275 -7.588 1.00 0.00 C ATOM 0 H LEU A 18 -2.367 -11.561 -10.231 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.020 -13.744 -8.926 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.008 -11.567 -9.585 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.991 -10.765 -8.376 1.00 0.00 H new ATOM 0 HG LEU A 18 1.471 -11.185 -7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.989 -11.595 -5.511 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.152 -10.439 -6.239 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.654 -12.122 -5.948 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.021 -13.353 -6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 18 0.430 -13.982 -7.341 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.618 -13.505 -8.577 1.00 0.00 H new ATOM 283 N PHE A 19 -3.468 -12.175 -7.361 1.00 0.00 N ATOM 284 CA PHE A 19 -4.393 -12.263 -6.234 1.00 0.00 C ATOM 285 C PHE A 19 -5.470 -13.328 -6.457 1.00 0.00 C ATOM 286 O PHE A 19 -5.814 -14.077 -5.536 1.00 0.00 O ATOM 287 CB PHE A 19 -5.016 -10.894 -5.902 1.00 0.00 C ATOM 288 CG PHE A 19 -4.060 -9.947 -5.261 1.00 0.00 C ATOM 289 CD1 PHE A 19 -3.383 -9.003 -6.002 1.00 0.00 C ATOM 290 CD2 PHE A 19 -3.842 -10.011 -3.911 1.00 0.00 C ATOM 291 CE1 PHE A 19 -2.498 -8.138 -5.397 1.00 0.00 C ATOM 292 CE2 PHE A 19 -2.971 -9.159 -3.293 1.00 0.00 C ATOM 293 CZ PHE A 19 -2.293 -8.216 -4.037 1.00 0.00 C ATOM 0 H PHE A 19 -3.699 -11.449 -8.039 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.808 -12.575 -5.369 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.400 -10.446 -6.819 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -5.868 -11.042 -5.239 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.548 -8.941 -7.068 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.368 -10.749 -3.324 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.968 -7.403 -5.985 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.814 -9.224 -2.226 1.00 0.00 H new ATOM 0 HZ PHE A 19 -1.603 -7.540 -3.554 1.00 0.00 H new ATOM 303 N ASP A 20 -6.002 -13.396 -7.663 1.00 0.00 N ATOM 304 CA ASP A 20 -6.995 -14.410 -7.995 1.00 0.00 C ATOM 305 C ASP A 20 -6.294 -15.707 -8.297 1.00 0.00 C ATOM 306 O ASP A 20 -5.780 -15.919 -9.397 1.00 0.00 O ATOM 307 CB ASP A 20 -7.871 -14.016 -9.178 1.00 0.00 C ATOM 308 CG ASP A 20 -8.971 -15.040 -9.400 1.00 0.00 C ATOM 309 OD1 ASP A 20 -9.856 -15.174 -8.545 1.00 0.00 O ATOM 310 OD2 ASP A 20 -8.966 -15.727 -10.420 1.00 0.00 O ATOM 0 H ASP A 20 -5.767 -12.765 -8.429 1.00 0.00 H new ATOM 0 HA ASP A 20 -7.653 -14.516 -7.133 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -8.312 -13.035 -8.999 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -7.260 -13.932 -10.077 1.00 0.00 H new ATOM 315 N LYS A 21 -6.269 -16.565 -7.324 1.00 0.00 N ATOM 316 CA LYS A 21 -5.505 -17.783 -7.385 1.00 0.00 C ATOM 317 C LYS A 21 -6.076 -18.870 -8.297 1.00 0.00 C ATOM 318 O LYS A 21 -5.455 -19.917 -8.436 1.00 0.00 O ATOM 319 CB LYS A 21 -5.296 -18.328 -6.003 1.00 0.00 C ATOM 320 CG LYS A 21 -4.610 -17.367 -5.045 1.00 0.00 C ATOM 321 CD LYS A 21 -4.407 -17.922 -3.677 1.00 0.00 C ATOM 322 CE LYS A 21 -5.673 -17.983 -2.847 1.00 0.00 C ATOM 323 NZ LYS A 21 -6.608 -19.076 -3.227 1.00 0.00 N ATOM 0 H LYS A 21 -6.784 -16.442 -6.452 1.00 0.00 H new ATOM 0 HA LYS A 21 -4.556 -17.501 -7.841 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -6.263 -18.608 -5.586 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -4.702 -19.239 -6.071 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -3.642 -17.085 -5.460 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -5.204 -16.456 -4.973 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -3.990 -18.926 -3.761 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -3.670 -17.313 -3.154 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -5.400 -18.104 -1.799 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.195 -17.030 -2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.937 -19.565 -2.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -7.424 -18.675 -3.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -6.118 -19.753 -3.846 1.00 0.00 H new ATOM 337 N ASP A 22 -7.221 -18.652 -8.932 1.00 0.00 N ATOM 338 CA ASP A 22 -7.745 -19.720 -9.797 1.00 0.00 C ATOM 339 C ASP A 22 -7.815 -19.290 -11.256 1.00 0.00 C ATOM 340 O ASP A 22 -7.914 -20.122 -12.156 1.00 0.00 O ATOM 341 CB ASP A 22 -9.107 -20.236 -9.299 1.00 0.00 C ATOM 342 CG ASP A 22 -9.584 -21.487 -10.044 1.00 0.00 C ATOM 343 OD1 ASP A 22 -10.579 -21.421 -10.808 1.00 0.00 O ATOM 344 OD2 ASP A 22 -8.978 -22.566 -9.872 1.00 0.00 O ATOM 0 H ASP A 22 -7.782 -17.802 -8.877 1.00 0.00 H new ATOM 0 HA ASP A 22 -7.038 -20.548 -9.740 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -9.037 -20.459 -8.234 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -9.851 -19.447 -9.412 1.00 0.00 H new ATOM 349 N GLY A 23 -7.698 -18.009 -11.500 1.00 0.00 N ATOM 350 CA GLY A 23 -7.694 -17.524 -12.861 1.00 0.00 C ATOM 351 C GLY A 23 -9.086 -17.319 -13.409 1.00 0.00 C ATOM 352 O GLY A 23 -9.309 -17.418 -14.616 1.00 0.00 O ATOM 0 H GLY A 23 -7.605 -17.288 -10.784 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.148 -16.582 -12.905 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.159 -18.232 -13.494 1.00 0.00 H new ATOM 356 N ASP A 24 -10.013 -17.033 -12.531 1.00 0.00 N ATOM 357 CA ASP A 24 -11.400 -16.782 -12.918 1.00 0.00 C ATOM 358 C ASP A 24 -11.668 -15.287 -12.930 1.00 0.00 C ATOM 359 O ASP A 24 -12.635 -14.810 -13.553 1.00 0.00 O ATOM 360 CB ASP A 24 -12.387 -17.484 -11.959 1.00 0.00 C ATOM 361 CG ASP A 24 -12.202 -17.090 -10.504 1.00 0.00 C ATOM 362 OD1 ASP A 24 -11.605 -17.859 -9.732 1.00 0.00 O ATOM 363 OD2 ASP A 24 -12.624 -16.008 -10.081 1.00 0.00 O ATOM 0 H ASP A 24 -9.840 -16.965 -11.528 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.552 -17.190 -13.917 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.407 -17.249 -12.264 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.267 -18.563 -12.053 1.00 0.00 H new ATOM 368 N GLY A 25 -10.798 -14.551 -12.279 1.00 0.00 N ATOM 369 CA GLY A 25 -10.874 -13.116 -12.266 1.00 0.00 C ATOM 370 C GLY A 25 -11.941 -12.546 -11.354 1.00 0.00 C ATOM 371 O GLY A 25 -12.388 -11.425 -11.557 1.00 0.00 O ATOM 0 H GLY A 25 -10.018 -14.934 -11.744 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.906 -12.717 -11.963 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -11.059 -12.766 -13.282 1.00 0.00 H new ATOM 375 N THR A 26 -12.391 -13.296 -10.403 1.00 0.00 N ATOM 376 CA THR A 26 -13.262 -12.751 -9.400 1.00 0.00 C ATOM 377 C THR A 26 -12.739 -13.188 -8.040 1.00 0.00 C ATOM 378 O THR A 26 -12.515 -14.367 -7.809 1.00 0.00 O ATOM 379 CB THR A 26 -14.751 -13.188 -9.627 1.00 0.00 C ATOM 380 OG1 THR A 26 -14.848 -14.607 -9.868 1.00 0.00 O ATOM 381 CG2 THR A 26 -15.372 -12.449 -10.805 1.00 0.00 C ATOM 0 H THR A 26 -12.174 -14.287 -10.294 1.00 0.00 H new ATOM 0 HA THR A 26 -13.263 -11.663 -9.458 1.00 0.00 H new ATOM 0 HB THR A 26 -15.294 -12.936 -8.716 1.00 0.00 H new ATOM 0 HG1 THR A 26 -13.991 -15.034 -9.658 1.00 0.00 H new ATOM 0 HG21 THR A 26 -16.404 -12.775 -10.936 1.00 0.00 H new ATOM 0 HG22 THR A 26 -15.351 -11.376 -10.613 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.806 -12.667 -11.710 1.00 0.00 H new ATOM 389 N ILE A 27 -12.562 -12.271 -7.145 1.00 0.00 N ATOM 390 CA ILE A 27 -11.955 -12.590 -5.884 1.00 0.00 C ATOM 391 C ILE A 27 -13.017 -12.644 -4.804 1.00 0.00 C ATOM 392 O ILE A 27 -13.710 -11.646 -4.540 1.00 0.00 O ATOM 393 CB ILE A 27 -10.828 -11.573 -5.515 1.00 0.00 C ATOM 394 CG1 ILE A 27 -9.887 -11.378 -6.703 1.00 0.00 C ATOM 395 CG2 ILE A 27 -10.020 -12.117 -4.371 1.00 0.00 C ATOM 396 CD1 ILE A 27 -8.824 -10.312 -6.502 1.00 0.00 C ATOM 0 H ILE A 27 -12.828 -11.293 -7.259 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.485 -13.570 -5.966 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.291 -10.624 -5.245 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -9.395 -12.326 -6.919 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -10.480 -11.120 -7.580 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -9.233 -11.409 -4.112 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.668 -12.270 -3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -9.572 -13.067 -4.662 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -8.204 -10.244 -7.396 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -9.303 -9.350 -6.319 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -8.201 -10.576 -5.647 1.00 0.00 H new ATOM 408 N THR A 28 -13.191 -13.820 -4.251 1.00 0.00 N ATOM 409 CA THR A 28 -14.165 -14.073 -3.207 1.00 0.00 C ATOM 410 C THR A 28 -13.605 -13.696 -1.827 1.00 0.00 C ATOM 411 O THR A 28 -12.409 -13.378 -1.706 1.00 0.00 O ATOM 412 CB THR A 28 -14.580 -15.562 -3.222 1.00 0.00 C ATOM 413 OG1 THR A 28 -13.412 -16.394 -3.196 1.00 0.00 O ATOM 414 CG2 THR A 28 -15.399 -15.888 -4.455 1.00 0.00 C ATOM 0 H THR A 28 -12.652 -14.645 -4.516 1.00 0.00 H new ATOM 0 HA THR A 28 -15.041 -13.453 -3.399 1.00 0.00 H new ATOM 0 HB THR A 28 -15.190 -15.751 -2.339 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.077 -16.516 -4.109 1.00 0.00 H new ATOM 0 HG21 THR A 28 -15.677 -16.942 -4.439 1.00 0.00 H new ATOM 0 HG22 THR A 28 -16.300 -15.275 -4.466 1.00 0.00 H new ATOM 0 HG23 THR A 28 -14.810 -15.682 -5.348 1.00 0.00 H new ATOM 422 N THR A 29 -14.449 -13.752 -0.796 1.00 0.00 N ATOM 423 CA THR A 29 -14.043 -13.397 0.556 1.00 0.00 C ATOM 424 C THR A 29 -12.930 -14.322 1.056 1.00 0.00 C ATOM 425 O THR A 29 -11.929 -13.863 1.622 1.00 0.00 O ATOM 426 CB THR A 29 -15.247 -13.420 1.537 1.00 0.00 C ATOM 427 OG1 THR A 29 -15.924 -14.692 1.458 1.00 0.00 O ATOM 428 CG2 THR A 29 -16.235 -12.305 1.214 1.00 0.00 C ATOM 0 H THR A 29 -15.423 -14.042 -0.877 1.00 0.00 H new ATOM 0 HA THR A 29 -13.657 -12.378 0.521 1.00 0.00 H new ATOM 0 HB THR A 29 -14.863 -13.268 2.546 1.00 0.00 H new ATOM 0 HG1 THR A 29 -16.468 -14.823 2.262 1.00 0.00 H new ATOM 0 HG21 THR A 29 -17.069 -12.343 1.915 1.00 0.00 H new ATOM 0 HG22 THR A 29 -15.735 -11.340 1.297 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.609 -12.433 0.198 1.00 0.00 H new ATOM 436 N LYS A 30 -13.081 -15.618 0.790 1.00 0.00 N ATOM 437 CA LYS A 30 -12.093 -16.595 1.194 1.00 0.00 C ATOM 438 C LYS A 30 -10.770 -16.381 0.482 1.00 0.00 C ATOM 439 O LYS A 30 -9.713 -16.566 1.070 1.00 0.00 O ATOM 440 CB LYS A 30 -12.588 -18.027 1.009 1.00 0.00 C ATOM 441 CG LYS A 30 -13.688 -18.435 1.985 1.00 0.00 C ATOM 442 CD LYS A 30 -14.047 -19.915 1.850 1.00 0.00 C ATOM 443 CE LYS A 30 -14.711 -20.235 0.520 1.00 0.00 C ATOM 444 NZ LYS A 30 -16.064 -19.647 0.408 1.00 0.00 N ATOM 0 H LYS A 30 -13.883 -16.009 0.295 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.927 -16.445 2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -12.959 -18.144 -0.009 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -11.745 -18.709 1.122 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -13.362 -18.232 3.005 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -14.576 -17.828 1.807 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -13.143 -20.516 1.955 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -14.715 -20.199 2.663 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.088 -19.862 -0.293 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.777 -21.316 0.401 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -16.514 -19.976 -0.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -16.639 -19.941 1.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -15.991 -18.610 0.392 1.00 0.00 H new ATOM 458 N GLU A 31 -10.820 -15.954 -0.764 1.00 0.00 N ATOM 459 CA GLU A 31 -9.602 -15.678 -1.499 1.00 0.00 C ATOM 460 C GLU A 31 -8.927 -14.454 -0.940 1.00 0.00 C ATOM 461 O GLU A 31 -7.714 -14.473 -0.702 1.00 0.00 O ATOM 462 CB GLU A 31 -9.868 -15.510 -2.973 1.00 0.00 C ATOM 463 CG GLU A 31 -10.361 -16.763 -3.629 1.00 0.00 C ATOM 464 CD GLU A 31 -10.725 -16.540 -5.054 1.00 0.00 C ATOM 465 OE1 GLU A 31 -9.935 -16.855 -5.959 1.00 0.00 O ATOM 466 OE2 GLU A 31 -11.834 -16.053 -5.330 1.00 0.00 O ATOM 0 H GLU A 31 -11.682 -15.792 -1.285 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.938 -16.535 -1.383 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -10.604 -14.719 -3.115 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -8.952 -15.185 -3.466 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -9.591 -17.532 -3.568 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -11.229 -17.138 -3.087 1.00 0.00 H new ATOM 473 N LEU A 32 -9.725 -13.405 -0.696 1.00 0.00 N ATOM 474 CA LEU A 32 -9.227 -12.177 -0.099 1.00 0.00 C ATOM 475 C LEU A 32 -8.522 -12.464 1.201 1.00 0.00 C ATOM 476 O LEU A 32 -7.369 -12.156 1.335 1.00 0.00 O ATOM 477 CB LEU A 32 -10.342 -11.157 0.144 1.00 0.00 C ATOM 478 CG LEU A 32 -10.973 -10.497 -1.081 1.00 0.00 C ATOM 479 CD1 LEU A 32 -12.128 -9.622 -0.648 1.00 0.00 C ATOM 480 CD2 LEU A 32 -9.944 -9.656 -1.824 1.00 0.00 C ATOM 0 H LEU A 32 -10.723 -13.392 -0.908 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.523 -11.747 -0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.135 -11.652 0.705 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.944 -10.369 0.783 1.00 0.00 H new ATOM 0 HG LEU A 32 -11.336 -11.277 -1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -12.577 -9.152 -1.523 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -12.876 -10.231 -0.140 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.765 -8.851 0.032 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.411 -9.194 -2.693 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.562 -8.879 -1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.121 -10.292 -2.150 1.00 0.00 H new ATOM 492 N GLY A 33 -9.203 -13.117 2.125 1.00 0.00 N ATOM 493 CA GLY A 33 -8.611 -13.397 3.423 1.00 0.00 C ATOM 494 C GLY A 33 -7.363 -14.265 3.346 1.00 0.00 C ATOM 495 O GLY A 33 -6.456 -14.114 4.160 1.00 0.00 O ATOM 0 H GLY A 33 -10.156 -13.461 2.005 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -8.359 -12.455 3.910 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -9.351 -13.893 4.052 1.00 0.00 H new ATOM 499 N THR A 34 -7.303 -15.154 2.371 1.00 0.00 N ATOM 500 CA THR A 34 -6.145 -16.010 2.203 1.00 0.00 C ATOM 501 C THR A 34 -4.932 -15.195 1.697 1.00 0.00 C ATOM 502 O THR A 34 -3.835 -15.254 2.288 1.00 0.00 O ATOM 503 CB THR A 34 -6.465 -17.188 1.251 1.00 0.00 C ATOM 504 OG1 THR A 34 -7.599 -17.913 1.766 1.00 0.00 O ATOM 505 CG2 THR A 34 -5.285 -18.141 1.132 1.00 0.00 C ATOM 0 H THR A 34 -8.043 -15.301 1.684 1.00 0.00 H new ATOM 0 HA THR A 34 -5.885 -16.429 3.175 1.00 0.00 H new ATOM 0 HB THR A 34 -6.681 -16.781 0.263 1.00 0.00 H new ATOM 0 HG1 THR A 34 -8.418 -17.587 1.338 1.00 0.00 H new ATOM 0 HG21 THR A 34 -5.543 -18.957 0.456 1.00 0.00 H new ATOM 0 HG22 THR A 34 -4.422 -17.604 0.739 1.00 0.00 H new ATOM 0 HG23 THR A 34 -5.044 -18.546 2.115 1.00 0.00 H new ATOM 513 N VAL A 35 -5.140 -14.389 0.654 1.00 0.00 N ATOM 514 CA VAL A 35 -4.055 -13.575 0.127 1.00 0.00 C ATOM 515 C VAL A 35 -3.673 -12.490 1.131 1.00 0.00 C ATOM 516 O VAL A 35 -2.509 -12.183 1.309 1.00 0.00 O ATOM 517 CB VAL A 35 -4.353 -12.974 -1.288 1.00 0.00 C ATOM 518 CG1 VAL A 35 -4.550 -14.085 -2.304 1.00 0.00 C ATOM 519 CG2 VAL A 35 -5.565 -12.049 -1.276 1.00 0.00 C ATOM 0 H VAL A 35 -6.032 -14.286 0.169 1.00 0.00 H new ATOM 0 HA VAL A 35 -3.203 -14.240 -0.017 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.488 -12.375 -1.573 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.756 -13.651 -3.282 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.646 -14.692 -2.359 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.389 -14.711 -2.001 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.733 -11.656 -2.279 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.444 -12.606 -0.952 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -5.385 -11.223 -0.588 1.00 0.00 H new ATOM 529 N MET A 36 -4.667 -11.981 1.838 1.00 0.00 N ATOM 530 CA MET A 36 -4.469 -10.989 2.873 1.00 0.00 C ATOM 531 C MET A 36 -3.690 -11.557 4.027 1.00 0.00 C ATOM 532 O MET A 36 -2.917 -10.859 4.642 1.00 0.00 O ATOM 533 CB MET A 36 -5.798 -10.399 3.357 1.00 0.00 C ATOM 534 CG MET A 36 -6.436 -9.446 2.385 1.00 0.00 C ATOM 535 SD MET A 36 -7.984 -8.803 3.002 1.00 0.00 S ATOM 536 CE MET A 36 -8.533 -7.910 1.571 1.00 0.00 C ATOM 0 H MET A 36 -5.642 -12.249 1.706 1.00 0.00 H new ATOM 0 HA MET A 36 -3.888 -10.178 2.433 1.00 0.00 H new ATOM 0 HB2 MET A 36 -6.493 -11.214 3.560 1.00 0.00 H new ATOM 0 HB3 MET A 36 -5.631 -9.881 4.301 1.00 0.00 H new ATOM 0 HG2 MET A 36 -5.753 -8.620 2.185 1.00 0.00 H new ATOM 0 HG3 MET A 36 -6.607 -9.955 1.436 1.00 0.00 H new ATOM 0 HE1 MET A 36 -9.622 -7.869 1.563 1.00 0.00 H new ATOM 0 HE2 MET A 36 -8.132 -6.897 1.598 1.00 0.00 H new ATOM 0 HE3 MET A 36 -8.183 -8.415 0.671 1.00 0.00 H new ATOM 546 N ARG A 37 -3.875 -12.835 4.302 1.00 0.00 N ATOM 547 CA ARG A 37 -3.147 -13.517 5.365 1.00 0.00 C ATOM 548 C ARG A 37 -1.651 -13.499 5.035 1.00 0.00 C ATOM 549 O ARG A 37 -0.816 -13.199 5.893 1.00 0.00 O ATOM 550 CB ARG A 37 -3.670 -14.952 5.514 1.00 0.00 C ATOM 551 CG ARG A 37 -3.090 -15.743 6.676 1.00 0.00 C ATOM 552 CD ARG A 37 -3.696 -17.142 6.743 1.00 0.00 C ATOM 553 NE ARG A 37 -3.453 -17.907 5.510 1.00 0.00 N ATOM 554 CZ ARG A 37 -4.159 -18.980 5.103 1.00 0.00 C ATOM 555 NH1 ARG A 37 -5.204 -19.421 5.813 1.00 0.00 N ATOM 556 NH2 ARG A 37 -3.820 -19.605 3.981 1.00 0.00 N ATOM 0 H ARG A 37 -4.532 -13.431 3.798 1.00 0.00 H new ATOM 0 HA ARG A 37 -3.300 -13.006 6.316 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -4.753 -14.915 5.627 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -3.464 -15.493 4.590 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -2.008 -15.817 6.566 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -3.280 -15.215 7.611 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -3.274 -17.680 7.592 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -4.769 -17.064 6.916 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.685 -17.599 4.913 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -5.474 -18.944 6.673 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -5.730 -20.234 5.494 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -3.028 -19.272 3.431 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -4.352 -20.418 3.669 1.00 0.00 H new ATOM 570 N SER A 38 -1.334 -13.742 3.764 1.00 0.00 N ATOM 571 CA SER A 38 0.038 -13.683 3.271 1.00 0.00 C ATOM 572 C SER A 38 0.564 -12.227 3.289 1.00 0.00 C ATOM 573 O SER A 38 1.773 -11.987 3.276 1.00 0.00 O ATOM 574 CB SER A 38 0.088 -14.247 1.854 1.00 0.00 C ATOM 575 OG SER A 38 -0.482 -15.548 1.819 1.00 0.00 O ATOM 0 H SER A 38 -2.021 -13.985 3.050 1.00 0.00 H new ATOM 0 HA SER A 38 0.677 -14.280 3.922 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.452 -13.588 1.174 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.121 -14.286 1.507 1.00 0.00 H new ATOM 0 HG SER A 38 -0.445 -15.897 0.904 1.00 0.00 H new ATOM 581 N LEU A 39 -0.357 -11.270 3.317 1.00 0.00 N ATOM 582 CA LEU A 39 -0.020 -9.855 3.397 1.00 0.00 C ATOM 583 C LEU A 39 -0.182 -9.300 4.822 1.00 0.00 C ATOM 584 O LEU A 39 -0.152 -8.093 5.038 1.00 0.00 O ATOM 585 CB LEU A 39 -0.779 -8.997 2.357 1.00 0.00 C ATOM 586 CG LEU A 39 -0.205 -8.963 0.914 1.00 0.00 C ATOM 587 CD1 LEU A 39 1.229 -8.468 0.915 1.00 0.00 C ATOM 588 CD2 LEU A 39 -0.295 -10.309 0.217 1.00 0.00 C ATOM 0 H LEU A 39 -1.360 -11.455 3.285 1.00 0.00 H new ATOM 0 HA LEU A 39 1.037 -9.784 3.142 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.806 -9.359 2.304 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.821 -7.973 2.729 1.00 0.00 H new ATOM 0 HG LEU A 39 -0.824 -8.265 0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 39 1.609 -8.453 -0.106 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.266 -7.461 1.331 1.00 0.00 H new ATOM 0 HD13 LEU A 39 1.843 -9.134 1.521 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.120 -10.227 -0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 39 0.269 -11.050 0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -1.339 -10.617 0.154 1.00 0.00 H new ATOM 600 N GLY A 40 -0.311 -10.203 5.788 1.00 0.00 N ATOM 601 CA GLY A 40 -0.324 -9.819 7.192 1.00 0.00 C ATOM 602 C GLY A 40 -1.632 -9.217 7.669 1.00 0.00 C ATOM 603 O GLY A 40 -1.661 -8.432 8.630 1.00 0.00 O ATOM 0 H GLY A 40 -0.408 -11.205 5.623 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.101 -10.697 7.798 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.477 -9.100 7.366 1.00 0.00 H new ATOM 607 N GLN A 41 -2.699 -9.577 7.036 1.00 0.00 N ATOM 608 CA GLN A 41 -3.982 -9.062 7.388 1.00 0.00 C ATOM 609 C GLN A 41 -4.936 -10.211 7.620 1.00 0.00 C ATOM 610 O GLN A 41 -5.074 -11.088 6.783 1.00 0.00 O ATOM 611 CB GLN A 41 -4.465 -8.153 6.267 1.00 0.00 C ATOM 612 CG GLN A 41 -5.796 -7.463 6.500 1.00 0.00 C ATOM 613 CD GLN A 41 -6.104 -6.409 5.444 1.00 0.00 C ATOM 614 OE1 GLN A 41 -6.770 -5.424 5.724 1.00 0.00 O ATOM 615 NE2 GLN A 41 -5.613 -6.596 4.245 1.00 0.00 N ATOM 0 H GLN A 41 -2.707 -10.238 6.259 1.00 0.00 H new ATOM 0 HA GLN A 41 -3.927 -8.481 8.308 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -3.707 -7.389 6.093 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -4.539 -8.743 5.353 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.591 -8.209 6.506 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -5.791 -6.995 7.484 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.061 -7.430 4.044 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.783 -5.908 3.511 1.00 0.00 H new ATOM 624 N ASN A 42 -5.534 -10.241 8.772 1.00 0.00 N ATOM 625 CA ASN A 42 -6.513 -11.264 9.120 1.00 0.00 C ATOM 626 C ASN A 42 -7.856 -10.596 9.416 1.00 0.00 C ATOM 627 O ASN A 42 -8.191 -10.365 10.578 1.00 0.00 O ATOM 628 CB ASN A 42 -6.067 -12.096 10.357 1.00 0.00 C ATOM 629 CG ASN A 42 -4.913 -13.093 10.135 1.00 0.00 C ATOM 630 OD1 ASN A 42 -4.814 -14.092 10.852 1.00 0.00 O ATOM 631 ND2 ASN A 42 -4.076 -12.876 9.145 1.00 0.00 N ATOM 0 H ASN A 42 -5.366 -9.559 9.512 1.00 0.00 H new ATOM 0 HA ASN A 42 -6.603 -11.945 8.274 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.773 -11.404 11.146 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -6.931 -12.650 10.725 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.326 -13.541 8.957 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.177 -12.043 8.565 1.00 0.00 H new ATOM 638 N PRO A 43 -8.607 -10.197 8.381 1.00 0.00 N ATOM 639 CA PRO A 43 -9.888 -9.550 8.560 1.00 0.00 C ATOM 640 C PRO A 43 -11.030 -10.551 8.626 1.00 0.00 C ATOM 641 O PRO A 43 -10.903 -11.708 8.180 1.00 0.00 O ATOM 642 CB PRO A 43 -10.029 -8.691 7.309 1.00 0.00 C ATOM 643 CG PRO A 43 -9.150 -9.331 6.275 1.00 0.00 C ATOM 644 CD PRO A 43 -8.275 -10.335 6.958 1.00 0.00 C ATOM 0 HA PRO A 43 -9.931 -8.988 9.493 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -11.066 -8.655 6.974 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -9.721 -7.664 7.503 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -9.756 -9.814 5.508 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -8.543 -8.577 5.773 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -8.474 -11.345 6.599 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -7.220 -10.133 6.774 1.00 0.00 H new ATOM 652 N THR A 44 -12.125 -10.126 9.171 1.00 0.00 N ATOM 653 CA THR A 44 -13.295 -10.952 9.235 1.00 0.00 C ATOM 654 C THR A 44 -14.021 -10.899 7.888 1.00 0.00 C ATOM 655 O THR A 44 -13.806 -9.957 7.095 1.00 0.00 O ATOM 656 CB THR A 44 -14.234 -10.499 10.382 1.00 0.00 C ATOM 657 OG1 THR A 44 -14.533 -9.097 10.262 1.00 0.00 O ATOM 658 CG2 THR A 44 -13.595 -10.758 11.731 1.00 0.00 C ATOM 0 H THR A 44 -12.237 -9.200 9.584 1.00 0.00 H new ATOM 0 HA THR A 44 -12.995 -11.979 9.445 1.00 0.00 H new ATOM 0 HB THR A 44 -15.157 -11.075 10.307 1.00 0.00 H new ATOM 0 HG1 THR A 44 -13.773 -8.571 10.589 1.00 0.00 H new ATOM 0 HG21 THR A 44 -14.271 -10.433 12.522 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.395 -11.824 11.840 1.00 0.00 H new ATOM 0 HG23 THR A 44 -12.659 -10.204 11.803 1.00 0.00 H new ATOM 666 N GLU A 45 -14.859 -11.874 7.620 1.00 0.00 N ATOM 667 CA GLU A 45 -15.593 -11.935 6.373 1.00 0.00 C ATOM 668 C GLU A 45 -16.564 -10.755 6.259 1.00 0.00 C ATOM 669 O GLU A 45 -16.867 -10.298 5.163 1.00 0.00 O ATOM 670 CB GLU A 45 -16.288 -13.295 6.211 1.00 0.00 C ATOM 671 CG GLU A 45 -17.057 -13.455 4.911 1.00 0.00 C ATOM 672 CD GLU A 45 -17.534 -14.860 4.688 1.00 0.00 C ATOM 673 OE1 GLU A 45 -17.068 -15.509 3.720 1.00 0.00 O ATOM 674 OE2 GLU A 45 -18.368 -15.351 5.472 1.00 0.00 O ATOM 0 H GLU A 45 -15.052 -12.646 8.257 1.00 0.00 H new ATOM 0 HA GLU A 45 -14.889 -11.846 5.545 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -15.537 -14.083 6.274 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -16.974 -13.440 7.045 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.914 -12.781 4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -16.421 -13.155 4.078 1.00 0.00 H new ATOM 681 N ALA A 46 -16.990 -10.239 7.398 1.00 0.00 N ATOM 682 CA ALA A 46 -17.840 -9.056 7.453 1.00 0.00 C ATOM 683 C ALA A 46 -17.097 -7.845 6.862 1.00 0.00 C ATOM 684 O ALA A 46 -17.628 -7.123 6.017 1.00 0.00 O ATOM 685 CB ALA A 46 -18.258 -8.779 8.893 1.00 0.00 C ATOM 0 H ALA A 46 -16.758 -10.626 8.313 1.00 0.00 H new ATOM 0 HA ALA A 46 -18.738 -9.234 6.861 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -18.893 -7.893 8.924 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.810 -9.634 9.283 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.371 -8.611 9.503 1.00 0.00 H new ATOM 691 N GLU A 47 -15.845 -7.665 7.282 1.00 0.00 N ATOM 692 CA GLU A 47 -15.002 -6.578 6.790 1.00 0.00 C ATOM 693 C GLU A 47 -14.686 -6.780 5.318 1.00 0.00 C ATOM 694 O GLU A 47 -14.579 -5.819 4.553 1.00 0.00 O ATOM 695 CB GLU A 47 -13.712 -6.513 7.591 1.00 0.00 C ATOM 696 CG GLU A 47 -13.938 -6.293 9.062 1.00 0.00 C ATOM 697 CD GLU A 47 -12.678 -6.432 9.857 1.00 0.00 C ATOM 698 OE1 GLU A 47 -12.012 -5.402 10.143 1.00 0.00 O ATOM 699 OE2 GLU A 47 -12.324 -7.580 10.202 1.00 0.00 O ATOM 0 H GLU A 47 -15.389 -8.266 7.969 1.00 0.00 H new ATOM 0 HA GLU A 47 -15.542 -5.639 6.908 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.157 -7.441 7.450 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.090 -5.707 7.201 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -14.356 -5.298 9.218 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.675 -7.009 9.425 1.00 0.00 H new ATOM 706 N LEU A 48 -14.534 -8.031 4.932 1.00 0.00 N ATOM 707 CA LEU A 48 -14.276 -8.382 3.551 1.00 0.00 C ATOM 708 C LEU A 48 -15.468 -8.044 2.672 1.00 0.00 C ATOM 709 O LEU A 48 -15.317 -7.367 1.667 1.00 0.00 O ATOM 710 CB LEU A 48 -13.902 -9.861 3.427 1.00 0.00 C ATOM 711 CG LEU A 48 -12.566 -10.255 4.060 1.00 0.00 C ATOM 712 CD1 LEU A 48 -12.365 -11.756 4.012 1.00 0.00 C ATOM 713 CD2 LEU A 48 -11.428 -9.554 3.341 1.00 0.00 C ATOM 0 H LEU A 48 -14.586 -8.830 5.564 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.429 -7.791 3.204 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -14.691 -10.458 3.884 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -13.875 -10.124 2.370 1.00 0.00 H new ATOM 0 HG LEU A 48 -12.577 -9.946 5.105 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.408 -12.010 4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -13.169 -12.248 4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -12.373 -12.091 2.975 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -10.480 -9.839 3.797 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.428 -9.844 2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -11.558 -8.475 3.419 1.00 0.00 H new ATOM 725 N GLN A 49 -16.649 -8.476 3.088 1.00 0.00 N ATOM 726 CA GLN A 49 -17.889 -8.231 2.354 1.00 0.00 C ATOM 727 C GLN A 49 -18.126 -6.738 2.177 1.00 0.00 C ATOM 728 O GLN A 49 -18.474 -6.291 1.095 1.00 0.00 O ATOM 729 CB GLN A 49 -19.084 -8.875 3.073 1.00 0.00 C ATOM 730 CG GLN A 49 -20.438 -8.634 2.400 1.00 0.00 C ATOM 731 CD GLN A 49 -20.556 -9.273 1.030 1.00 0.00 C ATOM 732 OE1 GLN A 49 -20.226 -8.675 0.008 1.00 0.00 O ATOM 733 NE2 GLN A 49 -21.058 -10.469 0.997 1.00 0.00 N ATOM 0 H GLN A 49 -16.779 -9.009 3.948 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.791 -8.686 1.368 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -18.914 -9.949 3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -19.127 -8.493 4.093 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -21.228 -9.023 3.042 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -20.602 -7.560 2.307 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -21.321 -10.936 1.865 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -21.190 -10.942 0.103 1.00 0.00 H new ATOM 742 N ASP A 50 -17.907 -5.975 3.230 1.00 0.00 N ATOM 743 CA ASP A 50 -18.092 -4.527 3.160 1.00 0.00 C ATOM 744 C ASP A 50 -17.087 -3.891 2.205 1.00 0.00 C ATOM 745 O ASP A 50 -17.443 -3.021 1.404 1.00 0.00 O ATOM 746 CB ASP A 50 -18.014 -3.879 4.541 1.00 0.00 C ATOM 747 CG ASP A 50 -18.191 -2.382 4.474 1.00 0.00 C ATOM 748 OD1 ASP A 50 -19.329 -1.905 4.220 1.00 0.00 O ATOM 749 OD2 ASP A 50 -17.207 -1.645 4.677 1.00 0.00 O ATOM 0 H ASP A 50 -17.603 -6.323 4.139 1.00 0.00 H new ATOM 0 HA ASP A 50 -19.094 -4.348 2.770 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -18.782 -4.306 5.186 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -17.051 -4.110 4.996 1.00 0.00 H new ATOM 754 N MET A 51 -15.847 -4.368 2.255 1.00 0.00 N ATOM 755 CA MET A 51 -14.792 -3.880 1.367 1.00 0.00 C ATOM 756 C MET A 51 -15.165 -4.177 -0.081 1.00 0.00 C ATOM 757 O MET A 51 -14.996 -3.346 -0.969 1.00 0.00 O ATOM 758 CB MET A 51 -13.448 -4.545 1.694 1.00 0.00 C ATOM 759 CG MET A 51 -12.301 -4.009 0.863 1.00 0.00 C ATOM 760 SD MET A 51 -11.988 -2.265 1.183 1.00 0.00 S ATOM 761 CE MET A 51 -10.828 -1.912 -0.129 1.00 0.00 C ATOM 0 H MET A 51 -15.545 -5.095 2.903 1.00 0.00 H new ATOM 0 HA MET A 51 -14.691 -2.804 1.512 1.00 0.00 H new ATOM 0 HB2 MET A 51 -13.224 -4.397 2.750 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.533 -5.620 1.534 1.00 0.00 H new ATOM 0 HG2 MET A 51 -11.400 -4.584 1.077 1.00 0.00 H new ATOM 0 HG3 MET A 51 -12.524 -4.148 -0.195 1.00 0.00 H new ATOM 0 HE1 MET A 51 -10.528 -0.865 -0.078 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.949 -2.547 -0.018 1.00 0.00 H new ATOM 0 HE3 MET A 51 -11.298 -2.108 -1.093 1.00 0.00 H new ATOM 771 N ILE A 52 -15.682 -5.369 -0.292 1.00 0.00 N ATOM 772 CA ILE A 52 -16.149 -5.795 -1.590 1.00 0.00 C ATOM 773 C ILE A 52 -17.292 -4.907 -2.045 1.00 0.00 C ATOM 774 O ILE A 52 -17.260 -4.369 -3.130 1.00 0.00 O ATOM 775 CB ILE A 52 -16.631 -7.279 -1.560 1.00 0.00 C ATOM 776 CG1 ILE A 52 -15.456 -8.223 -1.275 1.00 0.00 C ATOM 777 CG2 ILE A 52 -17.338 -7.664 -2.858 1.00 0.00 C ATOM 778 CD1 ILE A 52 -15.843 -9.683 -1.139 1.00 0.00 C ATOM 0 H ILE A 52 -15.790 -6.073 0.439 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.315 -5.715 -2.288 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.355 -7.378 -0.751 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -14.726 -8.127 -2.078 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.964 -7.903 -0.357 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -17.660 -8.704 -2.802 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.207 -7.022 -3.003 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -16.652 -7.541 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -14.952 -10.278 -0.939 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -16.549 -9.797 -0.316 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -16.307 -10.024 -2.065 1.00 0.00 H new ATOM 790 N ASN A 53 -18.249 -4.716 -1.168 1.00 0.00 N ATOM 791 CA ASN A 53 -19.486 -3.988 -1.449 1.00 0.00 C ATOM 792 C ASN A 53 -19.272 -2.600 -2.043 1.00 0.00 C ATOM 793 O ASN A 53 -20.039 -2.188 -2.920 1.00 0.00 O ATOM 794 CB ASN A 53 -20.376 -3.903 -0.197 1.00 0.00 C ATOM 795 CG ASN A 53 -21.651 -3.096 -0.419 1.00 0.00 C ATOM 796 OD1 ASN A 53 -22.672 -3.632 -0.841 1.00 0.00 O ATOM 797 ND2 ASN A 53 -21.630 -1.825 -0.084 1.00 0.00 N ATOM 0 H ASN A 53 -18.198 -5.067 -0.212 1.00 0.00 H new ATOM 0 HA ASN A 53 -19.994 -4.571 -2.217 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -20.643 -4.911 0.120 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -19.806 -3.453 0.616 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -22.475 -1.260 -0.172 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -20.769 -1.403 0.264 1.00 0.00 H new ATOM 804 N GLU A 54 -18.241 -1.878 -1.603 1.00 0.00 N ATOM 805 CA GLU A 54 -18.026 -0.548 -2.148 1.00 0.00 C ATOM 806 C GLU A 54 -17.645 -0.600 -3.631 1.00 0.00 C ATOM 807 O GLU A 54 -17.955 0.317 -4.381 1.00 0.00 O ATOM 808 CB GLU A 54 -17.026 0.317 -1.343 1.00 0.00 C ATOM 809 CG GLU A 54 -15.600 -0.202 -1.282 1.00 0.00 C ATOM 810 CD GLU A 54 -14.636 0.834 -0.747 1.00 0.00 C ATOM 811 OE1 GLU A 54 -14.009 1.537 -1.553 1.00 0.00 O ATOM 812 OE2 GLU A 54 -14.504 0.983 0.479 1.00 0.00 O ATOM 0 H GLU A 54 -17.568 -2.180 -0.898 1.00 0.00 H new ATOM 0 HA GLU A 54 -18.988 -0.045 -2.054 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -17.010 1.317 -1.776 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -17.400 0.417 -0.324 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -15.565 -1.089 -0.649 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -15.284 -0.509 -2.279 1.00 0.00 H new ATOM 819 N VAL A 55 -17.016 -1.681 -4.069 1.00 0.00 N ATOM 820 CA VAL A 55 -16.634 -1.787 -5.469 1.00 0.00 C ATOM 821 C VAL A 55 -17.615 -2.687 -6.228 1.00 0.00 C ATOM 822 O VAL A 55 -17.751 -2.592 -7.446 1.00 0.00 O ATOM 823 CB VAL A 55 -15.166 -2.312 -5.647 1.00 0.00 C ATOM 824 CG1 VAL A 55 -14.212 -1.518 -4.805 1.00 0.00 C ATOM 825 CG2 VAL A 55 -15.007 -3.787 -5.332 1.00 0.00 C ATOM 0 H VAL A 55 -16.764 -2.481 -3.489 1.00 0.00 H new ATOM 0 HA VAL A 55 -16.673 -0.781 -5.888 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.933 -2.182 -6.704 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.200 -1.899 -4.944 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -14.249 -0.470 -5.103 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -14.492 -1.607 -3.755 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -13.967 -4.080 -5.477 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.295 -3.971 -4.297 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -15.644 -4.372 -5.996 1.00 0.00 H new ATOM 835 N ASP A 56 -18.316 -3.514 -5.482 1.00 0.00 N ATOM 836 CA ASP A 56 -19.214 -4.525 -6.016 1.00 0.00 C ATOM 837 C ASP A 56 -20.471 -3.897 -6.581 1.00 0.00 C ATOM 838 O ASP A 56 -21.300 -3.374 -5.843 1.00 0.00 O ATOM 839 CB ASP A 56 -19.599 -5.508 -4.912 1.00 0.00 C ATOM 840 CG ASP A 56 -20.176 -6.807 -5.428 1.00 0.00 C ATOM 841 OD1 ASP A 56 -20.357 -7.733 -4.627 1.00 0.00 O ATOM 842 OD2 ASP A 56 -20.443 -6.939 -6.659 1.00 0.00 O ATOM 0 H ASP A 56 -18.279 -3.505 -4.463 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.694 -5.047 -6.819 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.718 -5.726 -4.309 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -20.327 -5.034 -4.253 1.00 0.00 H new ATOM 847 N ALA A 57 -20.617 -3.966 -7.876 1.00 0.00 N ATOM 848 CA ALA A 57 -21.764 -3.407 -8.549 1.00 0.00 C ATOM 849 C ALA A 57 -22.901 -4.409 -8.587 1.00 0.00 C ATOM 850 O ALA A 57 -24.057 -4.044 -8.835 1.00 0.00 O ATOM 851 CB ALA A 57 -21.401 -2.976 -9.959 1.00 0.00 C ATOM 0 H ALA A 57 -19.943 -4.412 -8.499 1.00 0.00 H new ATOM 0 HA ALA A 57 -22.090 -2.530 -7.990 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -22.280 -2.557 -10.449 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -20.615 -2.222 -9.918 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -21.047 -3.839 -10.524 1.00 0.00 H new ATOM 857 N ASP A 58 -22.591 -5.672 -8.331 1.00 0.00 N ATOM 858 CA ASP A 58 -23.621 -6.714 -8.412 1.00 0.00 C ATOM 859 C ASP A 58 -24.136 -7.002 -7.032 1.00 0.00 C ATOM 860 O ASP A 58 -25.173 -7.648 -6.872 1.00 0.00 O ATOM 861 CB ASP A 58 -23.041 -8.053 -8.919 1.00 0.00 C ATOM 862 CG ASP A 58 -22.141 -7.966 -10.115 1.00 0.00 C ATOM 863 OD1 ASP A 58 -20.898 -7.996 -9.924 1.00 0.00 O ATOM 864 OD2 ASP A 58 -22.626 -7.904 -11.249 1.00 0.00 O ATOM 0 H ASP A 58 -21.661 -6.001 -8.071 1.00 0.00 H new ATOM 0 HA ASP A 58 -24.392 -6.348 -9.091 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.486 -8.518 -8.104 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.870 -8.718 -9.160 1.00 0.00 H new ATOM 869 N GLY A 59 -23.419 -6.490 -6.034 1.00 0.00 N ATOM 870 CA GLY A 59 -23.715 -6.789 -4.642 1.00 0.00 C ATOM 871 C GLY A 59 -23.678 -8.294 -4.391 1.00 0.00 C ATOM 872 O GLY A 59 -24.387 -8.810 -3.525 1.00 0.00 O ATOM 0 H GLY A 59 -22.626 -5.863 -6.169 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.992 -6.290 -3.997 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -24.698 -6.397 -4.382 1.00 0.00 H new ATOM 876 N ASN A 60 -22.821 -8.993 -5.128 1.00 0.00 N ATOM 877 CA ASN A 60 -22.810 -10.448 -5.108 1.00 0.00 C ATOM 878 C ASN A 60 -21.744 -11.008 -4.195 1.00 0.00 C ATOM 879 O ASN A 60 -21.653 -12.214 -4.012 1.00 0.00 O ATOM 880 CB ASN A 60 -22.704 -11.061 -6.530 1.00 0.00 C ATOM 881 CG ASN A 60 -21.364 -10.856 -7.265 1.00 0.00 C ATOM 882 OD1 ASN A 60 -20.634 -9.855 -7.077 1.00 0.00 O ATOM 883 ND2 ASN A 60 -21.049 -11.783 -8.120 1.00 0.00 N ATOM 0 H ASN A 60 -22.126 -8.574 -5.746 1.00 0.00 H new ATOM 0 HA ASN A 60 -23.776 -10.743 -4.697 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -22.893 -12.132 -6.456 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -23.499 -10.639 -7.145 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -20.187 -11.707 -8.660 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -21.664 -12.586 -8.251 1.00 0.00 H new ATOM 890 N GLY A 61 -20.924 -10.149 -3.647 1.00 0.00 N ATOM 891 CA GLY A 61 -19.941 -10.596 -2.694 1.00 0.00 C ATOM 892 C GLY A 61 -18.663 -11.036 -3.351 1.00 0.00 C ATOM 893 O GLY A 61 -17.932 -11.866 -2.815 1.00 0.00 O ATOM 0 H GLY A 61 -20.916 -9.148 -3.841 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -19.727 -9.790 -1.992 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -20.351 -11.423 -2.114 1.00 0.00 H new ATOM 897 N THR A 62 -18.412 -10.541 -4.539 1.00 0.00 N ATOM 898 CA THR A 62 -17.194 -10.866 -5.244 1.00 0.00 C ATOM 899 C THR A 62 -16.730 -9.625 -5.997 1.00 0.00 C ATOM 900 O THR A 62 -17.573 -8.888 -6.560 1.00 0.00 O ATOM 901 CB THR A 62 -17.430 -11.993 -6.267 1.00 0.00 C ATOM 902 OG1 THR A 62 -18.552 -12.792 -5.849 1.00 0.00 O ATOM 903 CG2 THR A 62 -16.224 -12.901 -6.321 1.00 0.00 C ATOM 0 H THR A 62 -19.037 -9.909 -5.040 1.00 0.00 H new ATOM 0 HA THR A 62 -16.448 -11.198 -4.522 1.00 0.00 H new ATOM 0 HB THR A 62 -17.613 -11.542 -7.243 1.00 0.00 H new ATOM 0 HG1 THR A 62 -18.704 -13.509 -6.500 1.00 0.00 H new ATOM 0 HG21 THR A 62 -16.399 -13.695 -7.047 1.00 0.00 H new ATOM 0 HG22 THR A 62 -15.348 -12.325 -6.618 1.00 0.00 H new ATOM 0 HG23 THR A 62 -16.054 -13.339 -5.337 1.00 0.00 H new ATOM 911 N ILE A 63 -15.441 -9.391 -6.000 1.00 0.00 N ATOM 912 CA ILE A 63 -14.859 -8.250 -6.697 1.00 0.00 C ATOM 913 C ILE A 63 -14.469 -8.698 -8.087 1.00 0.00 C ATOM 914 O ILE A 63 -13.583 -9.532 -8.254 1.00 0.00 O ATOM 915 CB ILE A 63 -13.592 -7.678 -5.973 1.00 0.00 C ATOM 916 CG1 ILE A 63 -13.918 -7.288 -4.525 1.00 0.00 C ATOM 917 CG2 ILE A 63 -13.041 -6.457 -6.733 1.00 0.00 C ATOM 918 CD1 ILE A 63 -12.715 -6.802 -3.727 1.00 0.00 C ATOM 0 H ILE A 63 -14.759 -9.980 -5.523 1.00 0.00 H new ATOM 0 HA ILE A 63 -15.603 -7.454 -6.720 1.00 0.00 H new ATOM 0 HB ILE A 63 -12.832 -8.459 -5.959 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -14.676 -6.505 -4.533 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -14.354 -8.149 -4.017 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -12.162 -6.073 -6.216 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -12.766 -6.752 -7.746 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -13.805 -5.680 -6.776 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -13.029 -6.546 -2.715 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.963 -7.590 -3.685 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -12.291 -5.921 -4.209 1.00 0.00 H new ATOM 930 N ASP A 64 -15.156 -8.193 -9.056 1.00 0.00 N ATOM 931 CA ASP A 64 -14.897 -8.528 -10.439 1.00 0.00 C ATOM 932 C ASP A 64 -13.811 -7.639 -10.968 1.00 0.00 C ATOM 933 O ASP A 64 -13.490 -6.615 -10.357 1.00 0.00 O ATOM 934 CB ASP A 64 -16.156 -8.341 -11.293 1.00 0.00 C ATOM 935 CG ASP A 64 -17.293 -9.268 -10.938 1.00 0.00 C ATOM 936 OD1 ASP A 64 -17.681 -10.084 -11.771 1.00 0.00 O ATOM 937 OD2 ASP A 64 -17.854 -9.168 -9.826 1.00 0.00 O ATOM 0 H ASP A 64 -15.920 -7.531 -8.923 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.592 -9.573 -10.490 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.498 -7.311 -11.193 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -15.895 -8.490 -12.341 1.00 0.00 H new ATOM 942 N PHE A 65 -13.269 -8.001 -12.108 1.00 0.00 N ATOM 943 CA PHE A 65 -12.214 -7.232 -12.750 1.00 0.00 C ATOM 944 C PHE A 65 -12.635 -5.757 -13.001 1.00 0.00 C ATOM 945 O PHE A 65 -11.922 -4.848 -12.582 1.00 0.00 O ATOM 946 CB PHE A 65 -11.734 -7.915 -14.039 1.00 0.00 C ATOM 947 CG PHE A 65 -10.629 -7.176 -14.723 1.00 0.00 C ATOM 948 CD1 PHE A 65 -9.379 -7.081 -14.139 1.00 0.00 C ATOM 949 CD2 PHE A 65 -10.845 -6.564 -15.947 1.00 0.00 C ATOM 950 CE1 PHE A 65 -8.368 -6.391 -14.756 1.00 0.00 C ATOM 951 CE2 PHE A 65 -9.836 -5.874 -16.570 1.00 0.00 C ATOM 952 CZ PHE A 65 -8.598 -5.786 -15.973 1.00 0.00 C ATOM 0 H PHE A 65 -13.544 -8.838 -12.622 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.371 -7.202 -12.060 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -11.396 -8.924 -13.803 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -12.575 -8.013 -14.725 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.197 -7.556 -13.186 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -11.816 -6.631 -16.415 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -7.396 -6.322 -14.291 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -10.012 -5.402 -17.525 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.804 -5.240 -16.461 1.00 0.00 H new ATOM 962 N PRO A 66 -13.796 -5.495 -13.682 1.00 0.00 N ATOM 963 CA PRO A 66 -14.319 -4.131 -13.879 1.00 0.00 C ATOM 964 C PRO A 66 -14.423 -3.347 -12.559 1.00 0.00 C ATOM 965 O PRO A 66 -14.113 -2.169 -12.502 1.00 0.00 O ATOM 966 CB PRO A 66 -15.730 -4.376 -14.459 1.00 0.00 C ATOM 967 CG PRO A 66 -15.989 -5.833 -14.261 1.00 0.00 C ATOM 968 CD PRO A 66 -14.652 -6.472 -14.363 1.00 0.00 C ATOM 0 HA PRO A 66 -13.669 -3.534 -14.519 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -16.477 -3.770 -13.946 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -15.773 -4.109 -15.515 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -16.447 -6.025 -13.291 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -16.671 -6.220 -15.018 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.627 -7.447 -13.875 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -14.351 -6.626 -15.399 1.00 0.00 H new ATOM 976 N GLU A 67 -14.797 -4.039 -11.500 1.00 0.00 N ATOM 977 CA GLU A 67 -14.990 -3.424 -10.193 1.00 0.00 C ATOM 978 C GLU A 67 -13.649 -3.105 -9.558 1.00 0.00 C ATOM 979 O GLU A 67 -13.491 -2.100 -8.852 1.00 0.00 O ATOM 980 CB GLU A 67 -15.787 -4.361 -9.315 1.00 0.00 C ATOM 981 CG GLU A 67 -17.092 -4.768 -9.953 1.00 0.00 C ATOM 982 CD GLU A 67 -17.867 -5.751 -9.142 1.00 0.00 C ATOM 983 OE1 GLU A 67 -17.284 -6.600 -8.465 1.00 0.00 O ATOM 984 OE2 GLU A 67 -19.103 -5.764 -9.209 1.00 0.00 O ATOM 0 H GLU A 67 -14.976 -5.043 -11.517 1.00 0.00 H new ATOM 0 HA GLU A 67 -15.539 -2.489 -10.308 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -15.194 -5.251 -9.105 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -15.987 -3.878 -8.359 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.702 -3.879 -10.113 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -16.890 -5.197 -10.934 1.00 0.00 H new ATOM 991 N PHE A 68 -12.679 -3.950 -9.836 1.00 0.00 N ATOM 992 CA PHE A 68 -11.338 -3.763 -9.356 1.00 0.00 C ATOM 993 C PHE A 68 -10.749 -2.534 -10.063 1.00 0.00 C ATOM 994 O PHE A 68 -10.019 -1.737 -9.457 1.00 0.00 O ATOM 995 CB PHE A 68 -10.505 -5.019 -9.650 1.00 0.00 C ATOM 996 CG PHE A 68 -9.259 -5.150 -8.822 1.00 0.00 C ATOM 997 CD1 PHE A 68 -8.135 -4.403 -9.098 1.00 0.00 C ATOM 998 CD2 PHE A 68 -9.222 -6.038 -7.756 1.00 0.00 C ATOM 999 CE1 PHE A 68 -7.002 -4.534 -8.333 1.00 0.00 C ATOM 1000 CE2 PHE A 68 -8.086 -6.173 -6.988 1.00 0.00 C ATOM 1001 CZ PHE A 68 -6.975 -5.419 -7.279 1.00 0.00 C ATOM 0 H PHE A 68 -12.805 -4.788 -10.404 1.00 0.00 H new ATOM 0 HA PHE A 68 -11.330 -3.602 -8.278 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.128 -5.899 -9.487 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -10.227 -5.016 -10.704 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -8.145 -3.707 -9.924 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -10.095 -6.631 -7.525 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.129 -3.940 -8.559 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -8.069 -6.868 -6.161 1.00 0.00 H new ATOM 0 HZ PHE A 68 -6.081 -5.521 -6.681 1.00 0.00 H new ATOM 1011 N LEU A 69 -11.107 -2.379 -11.340 1.00 0.00 N ATOM 1012 CA LEU A 69 -10.714 -1.215 -12.127 1.00 0.00 C ATOM 1013 C LEU A 69 -11.292 0.036 -11.498 1.00 0.00 C ATOM 1014 O LEU A 69 -10.579 1.015 -11.298 1.00 0.00 O ATOM 1015 CB LEU A 69 -11.193 -1.328 -13.582 1.00 0.00 C ATOM 1016 CG LEU A 69 -10.681 -2.526 -14.383 1.00 0.00 C ATOM 1017 CD1 LEU A 69 -11.255 -2.500 -15.789 1.00 0.00 C ATOM 1018 CD2 LEU A 69 -9.164 -2.532 -14.431 1.00 0.00 C ATOM 0 H LEU A 69 -11.674 -3.054 -11.852 1.00 0.00 H new ATOM 0 HA LEU A 69 -9.625 -1.164 -12.135 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.283 -1.361 -13.580 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.902 -0.418 -14.107 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.010 -3.439 -13.886 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.883 -3.358 -16.350 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.343 -2.543 -15.739 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.951 -1.580 -16.289 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -8.822 -3.393 -15.006 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.811 -1.616 -14.905 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.768 -2.592 -13.417 1.00 0.00 H new ATOM 1030 N THR A 70 -12.578 -0.024 -11.160 1.00 0.00 N ATOM 1031 CA THR A 70 -13.272 1.062 -10.494 1.00 0.00 C ATOM 1032 C THR A 70 -12.559 1.445 -9.181 1.00 0.00 C ATOM 1033 O THR A 70 -12.275 2.624 -8.935 1.00 0.00 O ATOM 1034 CB THR A 70 -14.746 0.655 -10.224 1.00 0.00 C ATOM 1035 OG1 THR A 70 -15.358 0.267 -11.472 1.00 0.00 O ATOM 1036 CG2 THR A 70 -15.539 1.807 -9.615 1.00 0.00 C ATOM 0 H THR A 70 -13.167 -0.836 -11.344 1.00 0.00 H new ATOM 0 HA THR A 70 -13.262 1.937 -11.144 1.00 0.00 H new ATOM 0 HB THR A 70 -14.752 -0.174 -9.516 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.046 -0.627 -11.725 1.00 0.00 H new ATOM 0 HG21 THR A 70 -16.566 1.488 -9.439 1.00 0.00 H new ATOM 0 HG22 THR A 70 -15.084 2.103 -8.670 1.00 0.00 H new ATOM 0 HG23 THR A 70 -15.535 2.654 -10.301 1.00 0.00 H new ATOM 1044 N MET A 71 -12.219 0.436 -8.387 1.00 0.00 N ATOM 1045 CA MET A 71 -11.518 0.618 -7.115 1.00 0.00 C ATOM 1046 C MET A 71 -10.194 1.348 -7.305 1.00 0.00 C ATOM 1047 O MET A 71 -9.859 2.260 -6.542 1.00 0.00 O ATOM 1048 CB MET A 71 -11.300 -0.743 -6.446 1.00 0.00 C ATOM 1049 CG MET A 71 -10.497 -0.716 -5.143 1.00 0.00 C ATOM 1050 SD MET A 71 -10.589 -2.279 -4.219 1.00 0.00 S ATOM 1051 CE MET A 71 -10.226 -3.484 -5.488 1.00 0.00 C ATOM 0 H MET A 71 -12.422 -0.539 -8.607 1.00 0.00 H new ATOM 0 HA MET A 71 -12.137 1.239 -6.467 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.274 -1.189 -6.243 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.791 -1.398 -7.153 1.00 0.00 H new ATOM 0 HG2 MET A 71 -9.454 -0.495 -5.370 1.00 0.00 H new ATOM 0 HG3 MET A 71 -10.864 0.094 -4.513 1.00 0.00 H new ATOM 0 HE1 MET A 71 -9.736 -4.348 -5.040 1.00 0.00 H new ATOM 0 HE2 MET A 71 -11.153 -3.800 -5.966 1.00 0.00 H new ATOM 0 HE3 MET A 71 -9.567 -3.040 -6.234 1.00 0.00 H new ATOM 1061 N MET A 72 -9.476 0.978 -8.338 1.00 0.00 N ATOM 1062 CA MET A 72 -8.189 1.578 -8.617 1.00 0.00 C ATOM 1063 C MET A 72 -8.314 2.964 -9.198 1.00 0.00 C ATOM 1064 O MET A 72 -7.637 3.873 -8.747 1.00 0.00 O ATOM 1065 CB MET A 72 -7.331 0.685 -9.492 1.00 0.00 C ATOM 1066 CG MET A 72 -6.862 -0.554 -8.772 1.00 0.00 C ATOM 1067 SD MET A 72 -5.867 -0.138 -7.329 1.00 0.00 S ATOM 1068 CE MET A 72 -5.643 -1.751 -6.617 1.00 0.00 C ATOM 0 H MET A 72 -9.761 0.260 -9.004 1.00 0.00 H new ATOM 0 HA MET A 72 -7.682 1.683 -7.658 1.00 0.00 H new ATOM 0 HB2 MET A 72 -7.899 0.394 -10.376 1.00 0.00 H new ATOM 0 HB3 MET A 72 -6.465 1.248 -9.841 1.00 0.00 H new ATOM 0 HG2 MET A 72 -7.724 -1.146 -8.463 1.00 0.00 H new ATOM 0 HG3 MET A 72 -6.278 -1.173 -9.453 1.00 0.00 H new ATOM 0 HE1 MET A 72 -5.044 -1.668 -5.710 1.00 0.00 H new ATOM 0 HE2 MET A 72 -6.615 -2.179 -6.372 1.00 0.00 H new ATOM 0 HE3 MET A 72 -5.132 -2.396 -7.332 1.00 0.00 H new ATOM 1078 N ALA A 73 -9.213 3.142 -10.159 1.00 0.00 N ATOM 1079 CA ALA A 73 -9.419 4.445 -10.792 1.00 0.00 C ATOM 1080 C ALA A 73 -9.828 5.484 -9.744 1.00 0.00 C ATOM 1081 O ALA A 73 -9.403 6.646 -9.800 1.00 0.00 O ATOM 1082 CB ALA A 73 -10.437 4.347 -11.935 1.00 0.00 C ATOM 0 H ALA A 73 -9.813 2.400 -10.519 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.479 4.773 -11.235 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.571 5.329 -12.388 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.073 3.647 -12.687 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.391 3.995 -11.543 1.00 0.00 H new ATOM 1088 N ARG A 74 -10.629 5.051 -8.779 1.00 0.00 N ATOM 1089 CA ARG A 74 -11.007 5.881 -7.645 1.00 0.00 C ATOM 1090 C ARG A 74 -9.789 6.229 -6.809 1.00 0.00 C ATOM 1091 O ARG A 74 -9.566 7.385 -6.482 1.00 0.00 O ATOM 1092 CB ARG A 74 -11.994 5.148 -6.756 1.00 0.00 C ATOM 1093 CG ARG A 74 -13.414 5.062 -7.267 1.00 0.00 C ATOM 1094 CD ARG A 74 -14.231 4.151 -6.366 1.00 0.00 C ATOM 1095 NE ARG A 74 -14.120 4.532 -4.941 1.00 0.00 N ATOM 1096 CZ ARG A 74 -14.142 3.674 -3.909 1.00 0.00 C ATOM 1097 NH1 ARG A 74 -14.458 2.406 -4.096 1.00 0.00 N ATOM 1098 NH2 ARG A 74 -13.908 4.097 -2.678 1.00 0.00 N ATOM 0 H ARG A 74 -11.034 4.115 -8.761 1.00 0.00 H new ATOM 0 HA ARG A 74 -11.461 6.790 -8.039 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.625 4.135 -6.597 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -12.009 5.639 -5.783 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.861 6.056 -7.296 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.420 4.680 -8.288 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -15.277 4.185 -6.669 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -13.896 3.121 -6.493 1.00 0.00 H new ATOM 0 HE ARG A 74 -14.019 5.524 -4.726 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -14.688 2.070 -5.031 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -14.472 1.762 -3.305 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -13.709 5.083 -2.507 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -13.927 3.438 -1.900 1.00 0.00 H new ATOM 1112 N LYS A 75 -8.978 5.218 -6.529 1.00 0.00 N ATOM 1113 CA LYS A 75 -7.817 5.340 -5.653 1.00 0.00 C ATOM 1114 C LYS A 75 -6.833 6.331 -6.254 1.00 0.00 C ATOM 1115 O LYS A 75 -6.445 7.311 -5.620 1.00 0.00 O ATOM 1116 CB LYS A 75 -7.153 3.955 -5.518 1.00 0.00 C ATOM 1117 CG LYS A 75 -5.994 3.872 -4.536 1.00 0.00 C ATOM 1118 CD LYS A 75 -5.309 2.557 -4.624 1.00 0.00 C ATOM 1119 CE LYS A 75 -4.208 2.416 -3.586 1.00 0.00 C ATOM 1120 NZ LYS A 75 -4.750 2.286 -2.222 1.00 0.00 N ATOM 0 H LYS A 75 -9.108 4.279 -6.907 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.123 5.697 -4.670 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.914 3.236 -5.215 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.796 3.646 -6.500 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -5.281 4.671 -4.742 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.362 4.026 -3.522 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -6.039 1.759 -4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.885 2.436 -5.621 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -3.599 1.542 -3.819 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.551 3.284 -3.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.333 3.017 -1.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -5.783 2.403 -2.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.517 1.346 -1.844 1.00 0.00 H new ATOM 1134 N MET A 76 -6.519 6.086 -7.502 1.00 0.00 N ATOM 1135 CA MET A 76 -5.570 6.853 -8.293 1.00 0.00 C ATOM 1136 C MET A 76 -5.923 8.343 -8.351 1.00 0.00 C ATOM 1137 O MET A 76 -5.054 9.209 -8.208 1.00 0.00 O ATOM 1138 CB MET A 76 -5.562 6.273 -9.708 1.00 0.00 C ATOM 1139 CG MET A 76 -4.632 6.959 -10.690 1.00 0.00 C ATOM 1140 SD MET A 76 -4.746 6.249 -12.348 1.00 0.00 S ATOM 1141 CE MET A 76 -4.276 4.546 -12.014 1.00 0.00 C ATOM 0 H MET A 76 -6.933 5.313 -8.024 1.00 0.00 H new ATOM 0 HA MET A 76 -4.589 6.780 -7.824 1.00 0.00 H new ATOM 0 HB2 MET A 76 -5.287 5.220 -9.649 1.00 0.00 H new ATOM 0 HB3 MET A 76 -6.576 6.315 -10.105 1.00 0.00 H new ATOM 0 HG2 MET A 76 -4.872 8.021 -10.734 1.00 0.00 H new ATOM 0 HG3 MET A 76 -3.606 6.879 -10.332 1.00 0.00 H new ATOM 0 HE1 MET A 76 -4.159 4.009 -12.956 1.00 0.00 H new ATOM 0 HE2 MET A 76 -3.333 4.529 -11.467 1.00 0.00 H new ATOM 0 HE3 MET A 76 -5.050 4.065 -11.416 1.00 0.00 H new ATOM 1222 N GLU A 82 0.520 12.252 -2.490 1.00 0.00 N ATOM 1223 CA GLU A 82 1.679 11.503 -1.955 1.00 0.00 C ATOM 1224 C GLU A 82 1.283 10.688 -0.739 1.00 0.00 C ATOM 1225 O GLU A 82 2.134 10.191 -0.039 1.00 0.00 O ATOM 1226 CB GLU A 82 2.840 12.433 -1.558 1.00 0.00 C ATOM 1227 CG GLU A 82 3.535 13.145 -2.692 1.00 0.00 C ATOM 1228 CD GLU A 82 4.524 14.161 -2.179 1.00 0.00 C ATOM 1229 OE1 GLU A 82 5.539 13.779 -1.536 1.00 0.00 O ATOM 1230 OE2 GLU A 82 4.303 15.374 -2.392 1.00 0.00 O ATOM 0 HA GLU A 82 2.012 10.845 -2.757 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.458 13.182 -0.865 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.581 11.845 -1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.050 12.418 -3.319 1.00 0.00 H new ATOM 0 HG3 GLU A 82 2.795 13.640 -3.321 1.00 0.00 H new ATOM 1237 N GLU A 83 0.002 10.490 -0.550 1.00 0.00 N ATOM 1238 CA GLU A 83 -0.499 9.872 0.648 1.00 0.00 C ATOM 1239 C GLU A 83 -0.145 8.412 0.691 1.00 0.00 C ATOM 1240 O GLU A 83 0.553 7.984 1.592 1.00 0.00 O ATOM 1241 CB GLU A 83 -1.988 10.119 0.797 1.00 0.00 C ATOM 1242 CG GLU A 83 -2.612 9.510 2.036 1.00 0.00 C ATOM 1243 CD GLU A 83 -4.036 9.937 2.210 1.00 0.00 C ATOM 1244 OE1 GLU A 83 -4.372 10.541 3.261 1.00 0.00 O ATOM 1245 OE2 GLU A 83 -4.858 9.703 1.283 1.00 0.00 O ATOM 0 H GLU A 83 -0.719 10.753 -1.221 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.014 10.334 1.508 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -2.164 11.195 0.810 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.497 9.723 -0.081 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.564 8.423 1.970 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.035 9.802 2.914 1.00 0.00 H new ATOM 1252 N GLU A 84 -0.540 7.673 -0.329 1.00 0.00 N ATOM 1253 CA GLU A 84 -0.231 6.243 -0.409 1.00 0.00 C ATOM 1254 C GLU A 84 1.277 6.043 -0.499 1.00 0.00 C ATOM 1255 O GLU A 84 1.830 5.050 -0.023 1.00 0.00 O ATOM 1256 CB GLU A 84 -0.906 5.623 -1.636 1.00 0.00 C ATOM 1257 CG GLU A 84 -2.419 5.738 -1.631 1.00 0.00 C ATOM 1258 CD GLU A 84 -3.048 5.036 -0.456 1.00 0.00 C ATOM 1259 OE1 GLU A 84 -3.400 3.843 -0.577 1.00 0.00 O ATOM 1260 OE2 GLU A 84 -3.215 5.660 0.608 1.00 0.00 O ATOM 0 H GLU A 84 -1.077 8.033 -1.118 1.00 0.00 H new ATOM 0 HA GLU A 84 -0.608 5.753 0.489 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.518 6.105 -2.534 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.632 4.570 -1.696 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.700 6.791 -1.614 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.815 5.318 -2.555 1.00 0.00 H new ATOM 1267 N ILE A 85 1.923 7.033 -1.065 1.00 0.00 N ATOM 1268 CA ILE A 85 3.347 7.023 -1.295 1.00 0.00 C ATOM 1269 C ILE A 85 4.083 7.159 0.036 1.00 0.00 C ATOM 1270 O ILE A 85 4.941 6.343 0.389 1.00 0.00 O ATOM 1271 CB ILE A 85 3.759 8.217 -2.193 1.00 0.00 C ATOM 1272 CG1 ILE A 85 2.816 8.366 -3.409 1.00 0.00 C ATOM 1273 CG2 ILE A 85 5.197 8.063 -2.649 1.00 0.00 C ATOM 1274 CD1 ILE A 85 2.726 7.155 -4.305 1.00 0.00 C ATOM 0 H ILE A 85 1.464 7.886 -1.385 1.00 0.00 H new ATOM 0 HA ILE A 85 3.606 6.084 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 85 3.674 9.126 -1.598 1.00 0.00 H new ATOM 0 HG12 ILE A 85 1.816 8.605 -3.046 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.150 9.215 -4.005 1.00 0.00 H new ATOM 0 HG21 ILE A 85 5.472 8.909 -3.279 1.00 0.00 H new ATOM 0 HG22 ILE A 85 5.853 8.030 -1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 85 5.301 7.139 -3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.040 7.361 -5.127 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.713 6.924 -4.705 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.359 6.304 -3.731 1.00 0.00 H new ATOM 1286 N ARG A 86 3.710 8.178 0.771 1.00 0.00 N ATOM 1287 CA ARG A 86 4.331 8.502 2.022 1.00 0.00 C ATOM 1288 C ARG A 86 3.958 7.488 3.061 1.00 0.00 C ATOM 1289 O ARG A 86 4.775 7.130 3.870 1.00 0.00 O ATOM 1290 CB ARG A 86 3.949 9.906 2.442 1.00 0.00 C ATOM 1291 CG ARG A 86 4.754 10.474 3.586 1.00 0.00 C ATOM 1292 CD ARG A 86 4.396 11.928 3.782 1.00 0.00 C ATOM 1293 NE ARG A 86 4.623 12.699 2.544 1.00 0.00 N ATOM 1294 CZ ARG A 86 4.167 13.923 2.301 1.00 0.00 C ATOM 1295 NH1 ARG A 86 3.441 14.560 3.212 1.00 0.00 N ATOM 1296 NH2 ARG A 86 4.429 14.507 1.129 1.00 0.00 N ATOM 0 H ARG A 86 2.955 8.812 0.509 1.00 0.00 H new ATOM 0 HA ARG A 86 5.415 8.473 1.908 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.053 10.567 1.582 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.896 9.911 2.722 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.554 9.913 4.499 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.820 10.376 3.379 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.351 12.012 4.081 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.994 12.348 4.591 1.00 0.00 H new ATOM 0 HE ARG A 86 5.177 12.254 1.812 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.231 14.110 4.103 1.00 0.00 H new ATOM 0 HH12 ARG A 86 3.093 15.500 3.021 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.977 14.013 0.425 1.00 0.00 H new ATOM 0 HH22 ARG A 86 4.081 15.447 0.938 1.00 0.00 H new ATOM 1310 N GLU A 87 2.731 6.997 3.003 1.00 0.00 N ATOM 1311 CA GLU A 87 2.283 5.932 3.883 1.00 0.00 C ATOM 1312 C GLU A 87 3.146 4.691 3.739 1.00 0.00 C ATOM 1313 O GLU A 87 3.438 4.014 4.731 1.00 0.00 O ATOM 1314 CB GLU A 87 0.828 5.593 3.615 1.00 0.00 C ATOM 1315 CG GLU A 87 -0.143 6.552 4.259 1.00 0.00 C ATOM 1316 CD GLU A 87 -0.089 6.440 5.746 1.00 0.00 C ATOM 1317 OE1 GLU A 87 0.358 7.378 6.426 1.00 0.00 O ATOM 1318 OE2 GLU A 87 -0.469 5.374 6.264 1.00 0.00 O ATOM 0 H GLU A 87 2.021 7.324 2.348 1.00 0.00 H new ATOM 0 HA GLU A 87 2.379 6.291 4.908 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.658 5.585 2.538 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.625 4.585 3.978 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.093 7.573 3.958 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.154 6.342 3.910 1.00 0.00 H new ATOM 1325 N ALA A 88 3.559 4.409 2.518 1.00 0.00 N ATOM 1326 CA ALA A 88 4.406 3.275 2.236 1.00 0.00 C ATOM 1327 C ALA A 88 5.812 3.496 2.789 1.00 0.00 C ATOM 1328 O ALA A 88 6.414 2.597 3.334 1.00 0.00 O ATOM 1329 CB ALA A 88 4.456 3.016 0.747 1.00 0.00 C ATOM 0 H ALA A 88 3.315 4.962 1.696 1.00 0.00 H new ATOM 0 HA ALA A 88 3.983 2.400 2.729 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.098 2.158 0.548 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.451 2.810 0.380 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.855 3.894 0.238 1.00 0.00 H new ATOM 1335 N PHE A 89 6.307 4.701 2.678 1.00 0.00 N ATOM 1336 CA PHE A 89 7.642 5.015 3.165 1.00 0.00 C ATOM 1337 C PHE A 89 7.650 5.022 4.705 1.00 0.00 C ATOM 1338 O PHE A 89 8.511 4.421 5.345 1.00 0.00 O ATOM 1339 CB PHE A 89 8.082 6.384 2.622 1.00 0.00 C ATOM 1340 CG PHE A 89 9.538 6.694 2.831 1.00 0.00 C ATOM 1341 CD1 PHE A 89 9.984 7.304 3.988 1.00 0.00 C ATOM 1342 CD2 PHE A 89 10.459 6.366 1.860 1.00 0.00 C ATOM 1343 CE1 PHE A 89 11.324 7.572 4.166 1.00 0.00 C ATOM 1344 CE2 PHE A 89 11.793 6.635 2.032 1.00 0.00 C ATOM 1345 CZ PHE A 89 12.227 7.235 3.182 1.00 0.00 C ATOM 0 H PHE A 89 5.813 5.487 2.256 1.00 0.00 H new ATOM 0 HA PHE A 89 8.342 4.255 2.816 1.00 0.00 H new ATOM 0 HB2 PHE A 89 7.863 6.426 1.555 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.485 7.160 3.100 1.00 0.00 H new ATOM 0 HD1 PHE A 89 9.277 7.573 4.759 1.00 0.00 H new ATOM 0 HD2 PHE A 89 10.125 5.890 0.950 1.00 0.00 H new ATOM 0 HE1 PHE A 89 11.665 8.045 5.075 1.00 0.00 H new ATOM 0 HE2 PHE A 89 12.501 6.373 1.259 1.00 0.00 H new ATOM 0 HZ PHE A 89 13.278 7.445 3.318 1.00 0.00 H new ATOM 1355 N ARG A 90 6.643 5.661 5.255 1.00 0.00 N ATOM 1356 CA ARG A 90 6.448 5.881 6.691 1.00 0.00 C ATOM 1357 C ARG A 90 6.243 4.574 7.445 1.00 0.00 C ATOM 1358 O ARG A 90 6.555 4.472 8.636 1.00 0.00 O ATOM 1359 CB ARG A 90 5.212 6.767 6.857 1.00 0.00 C ATOM 1360 CG ARG A 90 4.867 7.217 8.218 1.00 0.00 C ATOM 1361 CD ARG A 90 3.685 8.087 8.186 1.00 0.00 C ATOM 1362 NE ARG A 90 3.283 8.592 9.501 1.00 0.00 N ATOM 1363 CZ ARG A 90 2.130 9.231 9.744 1.00 0.00 C ATOM 1364 NH1 ARG A 90 1.276 9.487 8.756 1.00 0.00 N ATOM 1365 NH2 ARG A 90 1.840 9.622 10.965 1.00 0.00 N ATOM 0 H ARG A 90 5.894 6.066 4.694 1.00 0.00 H new ATOM 0 HA ARG A 90 7.339 6.353 7.105 1.00 0.00 H new ATOM 0 HB2 ARG A 90 5.349 7.652 6.236 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.355 6.225 6.456 1.00 0.00 H new ATOM 0 HG2 ARG A 90 4.674 6.354 8.855 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.709 7.753 8.655 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.887 8.933 7.529 1.00 0.00 H new ATOM 0 HD3 ARG A 90 2.852 7.536 7.749 1.00 0.00 H new ATOM 0 HE ARG A 90 3.922 8.448 10.283 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.496 9.196 7.803 1.00 0.00 H new ATOM 0 HH12 ARG A 90 0.401 9.974 8.951 1.00 0.00 H new ATOM 0 HH21 ARG A 90 2.492 9.439 11.728 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.963 10.108 11.150 1.00 0.00 H new ATOM 1379 N VAL A 91 5.708 3.586 6.772 1.00 0.00 N ATOM 1380 CA VAL A 91 5.463 2.323 7.413 1.00 0.00 C ATOM 1381 C VAL A 91 6.771 1.508 7.543 1.00 0.00 C ATOM 1382 O VAL A 91 6.890 0.635 8.415 1.00 0.00 O ATOM 1383 CB VAL A 91 4.338 1.526 6.710 1.00 0.00 C ATOM 1384 CG1 VAL A 91 4.736 1.040 5.339 1.00 0.00 C ATOM 1385 CG2 VAL A 91 3.838 0.409 7.580 1.00 0.00 C ATOM 0 H VAL A 91 5.437 3.632 5.790 1.00 0.00 H new ATOM 0 HA VAL A 91 5.105 2.525 8.423 1.00 0.00 H new ATOM 0 HB VAL A 91 3.511 2.219 6.553 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.908 0.488 4.894 1.00 0.00 H new ATOM 0 HG12 VAL A 91 4.983 1.894 4.708 1.00 0.00 H new ATOM 0 HG13 VAL A 91 5.605 0.387 5.422 1.00 0.00 H new ATOM 0 HG21 VAL A 91 3.048 -0.132 7.059 1.00 0.00 H new ATOM 0 HG22 VAL A 91 4.658 -0.273 7.804 1.00 0.00 H new ATOM 0 HG23 VAL A 91 3.444 0.820 8.509 1.00 0.00 H new ATOM 1395 N PHE A 92 7.752 1.815 6.695 1.00 0.00 N ATOM 1396 CA PHE A 92 9.063 1.194 6.812 1.00 0.00 C ATOM 1397 C PHE A 92 9.903 2.044 7.737 1.00 0.00 C ATOM 1398 O PHE A 92 10.382 1.585 8.769 1.00 0.00 O ATOM 1399 CB PHE A 92 9.787 1.072 5.459 1.00 0.00 C ATOM 1400 CG PHE A 92 9.092 0.237 4.424 1.00 0.00 C ATOM 1401 CD1 PHE A 92 8.705 -1.064 4.697 1.00 0.00 C ATOM 1402 CD2 PHE A 92 8.858 0.748 3.165 1.00 0.00 C ATOM 1403 CE1 PHE A 92 8.091 -1.833 3.733 1.00 0.00 C ATOM 1404 CE2 PHE A 92 8.242 -0.013 2.198 1.00 0.00 C ATOM 1405 CZ PHE A 92 7.858 -1.307 2.481 1.00 0.00 C ATOM 0 H PHE A 92 7.662 2.483 5.929 1.00 0.00 H new ATOM 0 HA PHE A 92 8.924 0.184 7.197 1.00 0.00 H new ATOM 0 HB2 PHE A 92 9.933 2.073 5.054 1.00 0.00 H new ATOM 0 HB3 PHE A 92 10.777 0.652 5.634 1.00 0.00 H new ATOM 0 HD1 PHE A 92 8.887 -1.481 5.677 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.162 1.758 2.935 1.00 0.00 H new ATOM 0 HE1 PHE A 92 7.793 -2.846 3.958 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.059 0.403 1.218 1.00 0.00 H new ATOM 0 HZ PHE A 92 7.376 -1.907 1.723 1.00 0.00 H new ATOM 1415 N ASP A 93 10.034 3.296 7.375 1.00 0.00 N ATOM 1416 CA ASP A 93 10.783 4.252 8.150 1.00 0.00 C ATOM 1417 C ASP A 93 9.849 4.943 9.126 1.00 0.00 C ATOM 1418 O ASP A 93 9.297 6.022 8.860 1.00 0.00 O ATOM 1419 CB ASP A 93 11.526 5.252 7.244 1.00 0.00 C ATOM 1420 CG ASP A 93 12.244 6.343 8.007 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.149 7.529 7.607 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.893 6.056 9.037 1.00 0.00 O ATOM 0 H ASP A 93 9.620 3.683 6.527 1.00 0.00 H new ATOM 0 HA ASP A 93 11.553 3.732 8.719 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.249 4.710 6.635 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.812 5.709 6.559 1.00 0.00 H new ATOM 1427 N LYS A 94 9.597 4.257 10.218 1.00 0.00 N ATOM 1428 CA LYS A 94 8.655 4.714 11.225 1.00 0.00 C ATOM 1429 C LYS A 94 9.215 5.783 12.136 1.00 0.00 C ATOM 1430 O LYS A 94 8.471 6.641 12.629 1.00 0.00 O ATOM 1431 CB LYS A 94 8.017 3.567 12.045 1.00 0.00 C ATOM 1432 CG LYS A 94 8.956 2.631 12.818 1.00 0.00 C ATOM 1433 CD LYS A 94 9.609 1.554 11.945 1.00 0.00 C ATOM 1434 CE LYS A 94 8.572 0.670 11.245 1.00 0.00 C ATOM 1435 NZ LYS A 94 7.605 0.077 12.189 1.00 0.00 N ATOM 0 H LYS A 94 10.038 3.364 10.437 1.00 0.00 H new ATOM 0 HA LYS A 94 7.855 5.174 10.646 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.324 4.012 12.760 1.00 0.00 H new ATOM 0 HB3 LYS A 94 7.424 2.958 11.363 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.738 3.225 13.292 1.00 0.00 H new ATOM 0 HG3 LYS A 94 8.395 2.147 13.617 1.00 0.00 H new ATOM 0 HD2 LYS A 94 10.243 2.030 11.197 1.00 0.00 H new ATOM 0 HD3 LYS A 94 10.257 0.932 12.562 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.035 1.263 10.504 1.00 0.00 H new ATOM 0 HE3 LYS A 94 9.084 -0.127 10.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 7.012 -0.615 11.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.118 -0.398 12.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.003 0.826 12.586 1.00 0.00 H new ATOM 1449 N ASP A 95 10.505 5.748 12.360 1.00 0.00 N ATOM 1450 CA ASP A 95 11.146 6.712 13.248 1.00 0.00 C ATOM 1451 C ASP A 95 11.371 8.041 12.527 1.00 0.00 C ATOM 1452 O ASP A 95 11.597 9.080 13.148 1.00 0.00 O ATOM 1453 CB ASP A 95 12.459 6.128 13.793 1.00 0.00 C ATOM 1454 CG ASP A 95 13.260 7.093 14.634 1.00 0.00 C ATOM 1455 OD1 ASP A 95 12.833 7.444 15.755 1.00 0.00 O ATOM 1456 OD2 ASP A 95 14.363 7.479 14.204 1.00 0.00 O ATOM 0 H ASP A 95 11.140 5.066 11.944 1.00 0.00 H new ATOM 0 HA ASP A 95 10.490 6.912 14.095 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.231 5.245 14.390 1.00 0.00 H new ATOM 0 HB3 ASP A 95 13.073 5.797 12.955 1.00 0.00 H new ATOM 1461 N GLY A 96 11.226 8.013 11.217 1.00 0.00 N ATOM 1462 CA GLY A 96 11.354 9.209 10.429 1.00 0.00 C ATOM 1463 C GLY A 96 12.791 9.626 10.266 1.00 0.00 C ATOM 1464 O GLY A 96 13.262 10.551 10.936 1.00 0.00 O ATOM 0 H GLY A 96 11.019 7.170 10.681 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.910 9.045 9.447 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.794 10.016 10.901 1.00 0.00 H new ATOM 1468 N ASN A 97 13.487 8.932 9.414 1.00 0.00 N ATOM 1469 CA ASN A 97 14.880 9.221 9.120 1.00 0.00 C ATOM 1470 C ASN A 97 15.007 9.763 7.709 1.00 0.00 C ATOM 1471 O ASN A 97 16.005 10.405 7.356 1.00 0.00 O ATOM 1472 CB ASN A 97 15.722 7.951 9.244 1.00 0.00 C ATOM 1473 CG ASN A 97 15.714 7.393 10.643 1.00 0.00 C ATOM 1474 OD1 ASN A 97 16.558 7.718 11.460 1.00 0.00 O ATOM 1475 ND2 ASN A 97 14.755 6.567 10.937 1.00 0.00 N ATOM 0 H ASN A 97 13.110 8.140 8.893 1.00 0.00 H new ATOM 0 HA ASN A 97 15.238 9.963 9.834 1.00 0.00 H new ATOM 0 HB2 ASN A 97 15.343 7.198 8.553 1.00 0.00 H new ATOM 0 HB3 ASN A 97 16.748 8.168 8.948 1.00 0.00 H new ATOM 0 HD21 ASN A 97 14.693 6.170 11.875 1.00 0.00 H new ATOM 0 HD22 ASN A 97 14.064 6.315 10.230 1.00 0.00 H new ATOM 1482 N GLY A 98 13.990 9.512 6.898 1.00 0.00 N ATOM 1483 CA GLY A 98 13.961 10.035 5.549 1.00 0.00 C ATOM 1484 C GLY A 98 14.689 9.153 4.560 1.00 0.00 C ATOM 1485 O GLY A 98 14.759 9.461 3.370 1.00 0.00 O ATOM 0 H GLY A 98 13.178 8.950 7.154 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.925 10.150 5.231 1.00 0.00 H new ATOM 0 HA3 GLY A 98 14.409 11.029 5.540 1.00 0.00 H new ATOM 1489 N TYR A 99 15.212 8.059 5.046 1.00 0.00 N ATOM 1490 CA TYR A 99 15.963 7.116 4.246 1.00 0.00 C ATOM 1491 C TYR A 99 15.621 5.731 4.686 1.00 0.00 C ATOM 1492 O TYR A 99 15.355 5.510 5.871 1.00 0.00 O ATOM 1493 CB TYR A 99 17.479 7.308 4.430 1.00 0.00 C ATOM 1494 CG TYR A 99 18.060 8.569 3.845 1.00 0.00 C ATOM 1495 CD1 TYR A 99 18.626 8.559 2.584 1.00 0.00 C ATOM 1496 CD2 TYR A 99 18.056 9.761 4.552 1.00 0.00 C ATOM 1497 CE1 TYR A 99 19.170 9.697 2.041 1.00 0.00 C ATOM 1498 CE2 TYR A 99 18.595 10.905 4.014 1.00 0.00 C ATOM 1499 CZ TYR A 99 19.151 10.873 2.762 1.00 0.00 C ATOM 1500 OH TYR A 99 19.693 12.026 2.229 1.00 0.00 O ATOM 0 H TYR A 99 15.129 7.789 6.026 1.00 0.00 H new ATOM 0 HA TYR A 99 15.707 7.280 3.199 1.00 0.00 H new ATOM 0 HB2 TYR A 99 17.701 7.290 5.497 1.00 0.00 H new ATOM 0 HB3 TYR A 99 17.990 6.455 3.984 1.00 0.00 H new ATOM 0 HD1 TYR A 99 18.641 7.641 2.016 1.00 0.00 H new ATOM 0 HD2 TYR A 99 17.623 9.791 5.541 1.00 0.00 H new ATOM 0 HE1 TYR A 99 19.610 9.671 1.055 1.00 0.00 H new ATOM 0 HE2 TYR A 99 18.580 11.827 4.577 1.00 0.00 H new ATOM 0 HH TYR A 99 19.594 12.761 2.870 1.00 0.00 H new ATOM 1510 N ILE A 100 15.595 4.809 3.762 1.00 0.00 N ATOM 1511 CA ILE A 100 15.398 3.428 4.102 1.00 0.00 C ATOM 1512 C ILE A 100 16.748 2.742 3.957 1.00 0.00 C ATOM 1513 O ILE A 100 17.311 2.683 2.854 1.00 0.00 O ATOM 1514 CB ILE A 100 14.385 2.693 3.179 1.00 0.00 C ATOM 1515 CG1 ILE A 100 13.286 3.644 2.665 1.00 0.00 C ATOM 1516 CG2 ILE A 100 13.762 1.523 3.943 1.00 0.00 C ATOM 1517 CD1 ILE A 100 12.235 2.984 1.790 1.00 0.00 C ATOM 0 H ILE A 100 15.708 4.991 2.765 1.00 0.00 H new ATOM 0 HA ILE A 100 14.991 3.386 5.112 1.00 0.00 H new ATOM 0 HB ILE A 100 14.923 2.320 2.307 1.00 0.00 H new ATOM 0 HG12 ILE A 100 12.791 4.102 3.521 1.00 0.00 H new ATOM 0 HG13 ILE A 100 13.756 4.449 2.100 1.00 0.00 H new ATOM 0 HG21 ILE A 100 13.051 1.005 3.299 1.00 0.00 H new ATOM 0 HG22 ILE A 100 14.546 0.830 4.249 1.00 0.00 H new ATOM 0 HG23 ILE A 100 13.245 1.899 4.826 1.00 0.00 H new ATOM 0 HD11 ILE A 100 11.504 3.729 1.475 1.00 0.00 H new ATOM 0 HD12 ILE A 100 12.713 2.551 0.911 1.00 0.00 H new ATOM 0 HD13 ILE A 100 11.733 2.198 2.354 1.00 0.00 H new ATOM 1529 N SER A 101 17.285 2.301 5.046 1.00 0.00 N ATOM 1530 CA SER A 101 18.549 1.621 5.057 1.00 0.00 C ATOM 1531 C SER A 101 18.293 0.112 5.046 1.00 0.00 C ATOM 1532 O SER A 101 17.215 -0.326 5.465 1.00 0.00 O ATOM 1533 CB SER A 101 19.302 2.028 6.317 1.00 0.00 C ATOM 1534 OG SER A 101 19.308 3.454 6.463 1.00 0.00 O ATOM 0 H SER A 101 16.858 2.401 5.967 1.00 0.00 H new ATOM 0 HA SER A 101 19.145 1.885 4.183 1.00 0.00 H new ATOM 0 HB2 SER A 101 18.836 1.570 7.189 1.00 0.00 H new ATOM 0 HB3 SER A 101 20.326 1.657 6.271 1.00 0.00 H new ATOM 0 HG SER A 101 19.795 3.697 7.278 1.00 0.00 H new ATOM 1540 N ALA A 102 19.260 -0.677 4.585 1.00 0.00 N ATOM 1541 CA ALA A 102 19.099 -2.134 4.504 1.00 0.00 C ATOM 1542 C ALA A 102 18.906 -2.734 5.873 1.00 0.00 C ATOM 1543 O ALA A 102 18.070 -3.602 6.046 1.00 0.00 O ATOM 1544 CB ALA A 102 20.265 -2.802 3.785 1.00 0.00 C ATOM 0 H ALA A 102 20.165 -0.336 4.261 1.00 0.00 H new ATOM 0 HA ALA A 102 18.202 -2.321 3.913 1.00 0.00 H new ATOM 0 HB1 ALA A 102 20.102 -3.879 3.750 1.00 0.00 H new ATOM 0 HB2 ALA A 102 20.338 -2.412 2.770 1.00 0.00 H new ATOM 0 HB3 ALA A 102 21.191 -2.593 4.321 1.00 0.00 H new ATOM 1550 N ALA A 103 19.647 -2.228 6.851 1.00 0.00 N ATOM 1551 CA ALA A 103 19.543 -2.690 8.226 1.00 0.00 C ATOM 1552 C ALA A 103 18.135 -2.465 8.761 1.00 0.00 C ATOM 1553 O ALA A 103 17.547 -3.360 9.379 1.00 0.00 O ATOM 1554 CB ALA A 103 20.567 -1.995 9.104 1.00 0.00 C ATOM 0 H ALA A 103 20.335 -1.488 6.712 1.00 0.00 H new ATOM 0 HA ALA A 103 19.749 -3.760 8.244 1.00 0.00 H new ATOM 0 HB1 ALA A 103 20.472 -2.355 10.128 1.00 0.00 H new ATOM 0 HB2 ALA A 103 21.570 -2.211 8.735 1.00 0.00 H new ATOM 0 HB3 ALA A 103 20.396 -0.919 9.080 1.00 0.00 H new ATOM 1560 N GLU A 104 17.587 -1.286 8.491 1.00 0.00 N ATOM 1561 CA GLU A 104 16.226 -0.961 8.891 1.00 0.00 C ATOM 1562 C GLU A 104 15.246 -1.835 8.161 1.00 0.00 C ATOM 1563 O GLU A 104 14.349 -2.413 8.760 1.00 0.00 O ATOM 1564 CB GLU A 104 15.853 0.462 8.534 1.00 0.00 C ATOM 1565 CG GLU A 104 14.377 0.732 8.801 1.00 0.00 C ATOM 1566 CD GLU A 104 14.097 1.064 10.259 1.00 0.00 C ATOM 1567 OE1 GLU A 104 14.271 2.226 10.661 1.00 0.00 O ATOM 1568 OE2 GLU A 104 13.735 0.146 11.046 1.00 0.00 O ATOM 0 H GLU A 104 18.069 -0.537 7.994 1.00 0.00 H new ATOM 0 HA GLU A 104 16.186 -1.107 9.970 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.462 1.156 9.113 1.00 0.00 H new ATOM 0 HB3 GLU A 104 16.074 0.645 7.482 1.00 0.00 H new ATOM 0 HG2 GLU A 104 14.043 1.559 8.174 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.794 -0.143 8.513 1.00 0.00 H new ATOM 1575 N LEU A 105 15.410 -1.897 6.862 1.00 0.00 N ATOM 1576 CA LEU A 105 14.487 -2.585 6.018 1.00 0.00 C ATOM 1577 C LEU A 105 14.450 -4.074 6.432 1.00 0.00 C ATOM 1578 O LEU A 105 13.394 -4.674 6.525 1.00 0.00 O ATOM 1579 CB LEU A 105 14.889 -2.372 4.528 1.00 0.00 C ATOM 1580 CG LEU A 105 13.914 -2.814 3.397 1.00 0.00 C ATOM 1581 CD1 LEU A 105 13.873 -4.316 3.208 1.00 0.00 C ATOM 1582 CD2 LEU A 105 12.516 -2.267 3.641 1.00 0.00 C ATOM 0 H LEU A 105 16.192 -1.468 6.367 1.00 0.00 H new ATOM 0 HA LEU A 105 13.477 -2.190 6.130 1.00 0.00 H new ATOM 0 HB2 LEU A 105 15.085 -1.308 4.392 1.00 0.00 H new ATOM 0 HB3 LEU A 105 15.833 -2.893 4.367 1.00 0.00 H new ATOM 0 HG LEU A 105 14.303 -2.391 2.471 1.00 0.00 H new ATOM 0 HD11 LEU A 105 13.177 -4.563 2.407 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.868 -4.677 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 105 13.545 -4.790 4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 105 11.854 -2.589 2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 105 12.140 -2.641 4.593 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.551 -1.178 3.667 1.00 0.00 H new ATOM 1594 N ARG A 106 15.624 -4.617 6.734 1.00 0.00 N ATOM 1595 CA ARG A 106 15.785 -5.987 7.223 1.00 0.00 C ATOM 1596 C ARG A 106 14.992 -6.132 8.527 1.00 0.00 C ATOM 1597 O ARG A 106 14.234 -7.088 8.707 1.00 0.00 O ATOM 1598 CB ARG A 106 17.296 -6.245 7.451 1.00 0.00 C ATOM 1599 CG ARG A 106 17.731 -7.695 7.671 1.00 0.00 C ATOM 1600 CD ARG A 106 17.390 -8.219 9.028 1.00 0.00 C ATOM 1601 NE ARG A 106 17.845 -9.591 9.201 1.00 0.00 N ATOM 1602 CZ ARG A 106 18.406 -10.078 10.304 1.00 0.00 C ATOM 1603 NH1 ARG A 106 18.543 -9.309 11.386 1.00 0.00 N ATOM 1604 NH2 ARG A 106 18.808 -11.336 10.333 1.00 0.00 N ATOM 0 H ARG A 106 16.506 -4.112 6.646 1.00 0.00 H new ATOM 0 HA ARG A 106 15.409 -6.717 6.506 1.00 0.00 H new ATOM 0 HB2 ARG A 106 17.839 -5.856 6.590 1.00 0.00 H new ATOM 0 HB3 ARG A 106 17.612 -5.662 8.316 1.00 0.00 H new ATOM 0 HG2 ARG A 106 17.260 -8.326 6.917 1.00 0.00 H new ATOM 0 HG3 ARG A 106 18.808 -7.770 7.521 1.00 0.00 H new ATOM 0 HD2 ARG A 106 17.845 -7.585 9.789 1.00 0.00 H new ATOM 0 HD3 ARG A 106 16.311 -8.171 9.177 1.00 0.00 H new ATOM 0 HE ARG A 106 17.724 -10.229 8.414 1.00 0.00 H new ATOM 0 HH11 ARG A 106 18.217 -8.343 11.370 1.00 0.00 H new ATOM 0 HH12 ARG A 106 18.974 -9.688 12.229 1.00 0.00 H new ATOM 0 HH21 ARG A 106 18.688 -11.929 9.512 1.00 0.00 H new ATOM 0 HH22 ARG A 106 19.239 -11.714 11.177 1.00 0.00 H new ATOM 1618 N HIS A 107 15.178 -5.156 9.405 1.00 0.00 N ATOM 1619 CA HIS A 107 14.478 -5.067 10.682 1.00 0.00 C ATOM 1620 C HIS A 107 12.957 -5.092 10.498 1.00 0.00 C ATOM 1621 O HIS A 107 12.269 -5.909 11.117 1.00 0.00 O ATOM 1622 CB HIS A 107 14.940 -3.787 11.450 1.00 0.00 C ATOM 1623 CG HIS A 107 14.023 -3.317 12.553 1.00 0.00 C ATOM 1624 ND1 HIS A 107 13.376 -2.098 12.516 1.00 0.00 N ATOM 1625 CD2 HIS A 107 13.630 -3.911 13.703 1.00 0.00 C ATOM 1626 CE1 HIS A 107 12.629 -1.970 13.583 1.00 0.00 C ATOM 1627 NE2 HIS A 107 12.760 -3.052 14.320 1.00 0.00 N ATOM 0 H HIS A 107 15.832 -4.389 9.248 1.00 0.00 H new ATOM 0 HA HIS A 107 14.735 -5.943 11.277 1.00 0.00 H new ATOM 0 HB2 HIS A 107 15.924 -3.978 11.878 1.00 0.00 H new ATOM 0 HB3 HIS A 107 15.057 -2.977 10.730 1.00 0.00 H new ATOM 0 HD1 HIS A 107 13.466 -1.405 11.773 1.00 0.00 H new ATOM 0 HD2 HIS A 107 13.943 -4.879 14.066 1.00 0.00 H new ATOM 0 HE1 HIS A 107 12.008 -1.118 13.819 1.00 0.00 H new ATOM 1636 N VAL A 108 12.438 -4.217 9.649 1.00 0.00 N ATOM 1637 CA VAL A 108 11.011 -4.139 9.459 1.00 0.00 C ATOM 1638 C VAL A 108 10.491 -5.419 8.813 1.00 0.00 C ATOM 1639 O VAL A 108 9.479 -5.918 9.220 1.00 0.00 O ATOM 1640 CB VAL A 108 10.538 -2.847 8.687 1.00 0.00 C ATOM 1641 CG1 VAL A 108 10.883 -2.876 7.209 1.00 0.00 C ATOM 1642 CG2 VAL A 108 9.045 -2.603 8.885 1.00 0.00 C ATOM 0 H VAL A 108 12.983 -3.561 9.090 1.00 0.00 H new ATOM 0 HA VAL A 108 10.568 -4.045 10.450 1.00 0.00 H new ATOM 0 HB VAL A 108 11.092 -2.015 9.122 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.531 -1.960 6.735 1.00 0.00 H new ATOM 0 HG12 VAL A 108 11.964 -2.955 7.089 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.402 -3.735 6.740 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.748 -1.706 8.342 1.00 0.00 H new ATOM 0 HG22 VAL A 108 8.484 -3.458 8.509 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.836 -2.470 9.946 1.00 0.00 H new ATOM 1652 N MET A 109 11.257 -5.993 7.881 1.00 0.00 N ATOM 1653 CA MET A 109 10.860 -7.231 7.204 1.00 0.00 C ATOM 1654 C MET A 109 10.691 -8.372 8.172 1.00 0.00 C ATOM 1655 O MET A 109 9.722 -9.137 8.072 1.00 0.00 O ATOM 1656 CB MET A 109 11.820 -7.598 6.085 1.00 0.00 C ATOM 1657 CG MET A 109 11.716 -6.626 4.958 1.00 0.00 C ATOM 1658 SD MET A 109 10.071 -6.616 4.246 1.00 0.00 S ATOM 1659 CE MET A 109 10.123 -5.077 3.378 1.00 0.00 C ATOM 0 H MET A 109 12.157 -5.620 7.578 1.00 0.00 H new ATOM 0 HA MET A 109 9.887 -7.041 6.751 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.841 -7.612 6.466 1.00 0.00 H new ATOM 0 HB3 MET A 109 11.600 -8.603 5.726 1.00 0.00 H new ATOM 0 HG2 MET A 109 11.965 -5.626 5.315 1.00 0.00 H new ATOM 0 HG3 MET A 109 12.445 -6.881 4.188 1.00 0.00 H new ATOM 0 HE1 MET A 109 9.107 -4.720 3.210 1.00 0.00 H new ATOM 0 HE2 MET A 109 10.672 -4.344 3.969 1.00 0.00 H new ATOM 0 HE3 MET A 109 10.622 -5.217 2.419 1.00 0.00 H new ATOM 1669 N THR A 110 11.599 -8.468 9.130 1.00 0.00 N ATOM 1670 CA THR A 110 11.505 -9.456 10.182 1.00 0.00 C ATOM 1671 C THR A 110 10.188 -9.271 10.955 1.00 0.00 C ATOM 1672 O THR A 110 9.484 -10.242 11.255 1.00 0.00 O ATOM 1673 CB THR A 110 12.698 -9.328 11.157 1.00 0.00 C ATOM 1674 OG1 THR A 110 13.933 -9.486 10.435 1.00 0.00 O ATOM 1675 CG2 THR A 110 12.613 -10.378 12.253 1.00 0.00 C ATOM 0 H THR A 110 12.418 -7.863 9.196 1.00 0.00 H new ATOM 0 HA THR A 110 11.527 -10.447 9.728 1.00 0.00 H new ATOM 0 HB THR A 110 12.664 -8.340 11.617 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.086 -8.698 9.873 1.00 0.00 H new ATOM 0 HG21 THR A 110 13.462 -10.269 12.928 1.00 0.00 H new ATOM 0 HG22 THR A 110 11.687 -10.246 12.812 1.00 0.00 H new ATOM 0 HG23 THR A 110 12.629 -11.372 11.806 1.00 0.00 H new ATOM 1683 N ASN A 111 9.842 -8.028 11.209 1.00 0.00 N ATOM 1684 CA ASN A 111 8.620 -7.678 11.933 1.00 0.00 C ATOM 1685 C ASN A 111 7.385 -7.862 11.062 1.00 0.00 C ATOM 1686 O ASN A 111 6.284 -8.050 11.567 1.00 0.00 O ATOM 1687 CB ASN A 111 8.669 -6.224 12.441 1.00 0.00 C ATOM 1688 CG ASN A 111 9.689 -5.973 13.540 1.00 0.00 C ATOM 1689 OD1 ASN A 111 10.717 -6.629 13.626 1.00 0.00 O ATOM 1690 ND2 ASN A 111 9.416 -5.008 14.376 1.00 0.00 N ATOM 0 H ASN A 111 10.397 -7.222 10.922 1.00 0.00 H new ATOM 0 HA ASN A 111 8.555 -8.353 12.786 1.00 0.00 H new ATOM 0 HB2 ASN A 111 8.890 -5.566 11.600 1.00 0.00 H new ATOM 0 HB3 ASN A 111 7.681 -5.948 12.810 1.00 0.00 H new ATOM 0 HD21 ASN A 111 10.069 -4.784 15.127 1.00 0.00 H new ATOM 0 HD22 ASN A 111 8.550 -4.478 14.278 1.00 0.00 H new ATOM 1697 N LEU A 112 7.568 -7.808 9.758 1.00 0.00 N ATOM 1698 CA LEU A 112 6.472 -7.944 8.815 1.00 0.00 C ATOM 1699 C LEU A 112 6.243 -9.397 8.494 1.00 0.00 C ATOM 1700 O LEU A 112 5.192 -9.776 8.004 1.00 0.00 O ATOM 1701 CB LEU A 112 6.783 -7.180 7.519 1.00 0.00 C ATOM 1702 CG LEU A 112 7.040 -5.682 7.669 1.00 0.00 C ATOM 1703 CD1 LEU A 112 7.445 -5.055 6.346 1.00 0.00 C ATOM 1704 CD2 LEU A 112 5.836 -4.982 8.266 1.00 0.00 C ATOM 0 H LEU A 112 8.479 -7.669 9.321 1.00 0.00 H new ATOM 0 HA LEU A 112 5.574 -7.527 9.270 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.659 -7.634 7.055 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.949 -7.318 6.830 1.00 0.00 H new ATOM 0 HG LEU A 112 7.875 -5.555 8.358 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.621 -3.989 6.487 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.358 -5.528 5.983 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.648 -5.198 5.616 1.00 0.00 H new ATOM 0 HD21 LEU A 112 6.045 -3.917 8.362 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.973 -5.125 7.616 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.623 -5.400 9.250 1.00 0.00 H new ATOM 1716 N GLY A 113 7.236 -10.203 8.750 1.00 0.00 N ATOM 1717 CA GLY A 113 7.134 -11.603 8.478 1.00 0.00 C ATOM 1718 C GLY A 113 7.443 -11.911 7.032 1.00 0.00 C ATOM 1719 O GLY A 113 6.810 -12.774 6.428 1.00 0.00 O ATOM 0 H GLY A 113 8.128 -9.909 9.149 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.822 -12.151 9.122 1.00 0.00 H new ATOM 0 HA3 GLY A 113 6.128 -11.949 8.718 1.00 0.00 H new ATOM 1723 N GLU A 114 8.367 -11.171 6.463 1.00 0.00 N ATOM 1724 CA GLU A 114 8.800 -11.407 5.117 1.00 0.00 C ATOM 1725 C GLU A 114 10.081 -12.197 5.156 1.00 0.00 C ATOM 1726 O GLU A 114 11.001 -11.870 5.910 1.00 0.00 O ATOM 1727 CB GLU A 114 8.990 -10.100 4.339 1.00 0.00 C ATOM 1728 CG GLU A 114 7.696 -9.382 3.980 1.00 0.00 C ATOM 1729 CD GLU A 114 6.815 -10.215 3.070 1.00 0.00 C ATOM 1730 OE1 GLU A 114 7.124 -10.343 1.872 1.00 0.00 O ATOM 1731 OE2 GLU A 114 5.804 -10.768 3.538 1.00 0.00 O ATOM 0 H GLU A 114 8.835 -10.391 6.925 1.00 0.00 H new ATOM 0 HA GLU A 114 8.029 -11.972 4.593 1.00 0.00 H new ATOM 0 HB2 GLU A 114 9.611 -9.427 4.931 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.537 -10.315 3.421 1.00 0.00 H new ATOM 0 HG2 GLU A 114 7.150 -9.142 4.892 1.00 0.00 H new ATOM 0 HG3 GLU A 114 7.930 -8.436 3.491 1.00 0.00 H new ATOM 1738 N LYS A 115 10.138 -13.214 4.362 1.00 0.00 N ATOM 1739 CA LYS A 115 11.270 -14.135 4.313 1.00 0.00 C ATOM 1740 C LYS A 115 12.383 -13.593 3.391 1.00 0.00 C ATOM 1741 O LYS A 115 12.956 -14.330 2.562 1.00 0.00 O ATOM 1742 CB LYS A 115 10.789 -15.520 3.826 1.00 0.00 C ATOM 1743 CG LYS A 115 10.119 -15.488 2.460 1.00 0.00 C ATOM 1744 CD LYS A 115 9.799 -16.868 1.933 1.00 0.00 C ATOM 1745 CE LYS A 115 9.289 -16.790 0.500 1.00 0.00 C ATOM 1746 NZ LYS A 115 10.288 -16.163 -0.410 1.00 0.00 N ATOM 0 H LYS A 115 9.392 -13.450 3.707 1.00 0.00 H new ATOM 0 HA LYS A 115 11.687 -14.232 5.315 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.641 -16.198 3.787 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.089 -15.929 4.555 1.00 0.00 H new ATOM 0 HG2 LYS A 115 9.199 -14.906 2.525 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.771 -14.976 1.752 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.690 -17.494 1.974 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.048 -17.340 2.567 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.052 -17.792 0.144 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.363 -16.215 0.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.053 -16.395 -1.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.272 -15.131 -0.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.237 -16.525 -0.186 1.00 0.00 H new ATOM 1760 N LEU A 116 12.704 -12.335 3.547 1.00 0.00 N ATOM 1761 CA LEU A 116 13.721 -11.722 2.737 1.00 0.00 C ATOM 1762 C LEU A 116 15.082 -11.953 3.356 1.00 0.00 C ATOM 1763 O LEU A 116 15.286 -11.710 4.549 1.00 0.00 O ATOM 1764 CB LEU A 116 13.479 -10.216 2.539 1.00 0.00 C ATOM 1765 CG LEU A 116 12.138 -9.796 1.911 1.00 0.00 C ATOM 1766 CD1 LEU A 116 12.139 -8.316 1.583 1.00 0.00 C ATOM 1767 CD2 LEU A 116 11.815 -10.611 0.675 1.00 0.00 C ATOM 0 H LEU A 116 12.273 -11.714 4.231 1.00 0.00 H new ATOM 0 HA LEU A 116 13.680 -12.188 1.753 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.564 -9.729 3.511 1.00 0.00 H new ATOM 0 HB3 LEU A 116 14.282 -9.824 1.915 1.00 0.00 H new ATOM 0 HG LEU A 116 11.360 -9.992 2.648 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.182 -8.041 1.140 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.295 -7.741 2.496 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.941 -8.100 0.877 1.00 0.00 H new ATOM 0 HD21 LEU A 116 10.861 -10.283 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.599 -10.471 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.752 -11.666 0.941 1.00 0.00 H new ATOM 1779 N THR A 117 15.991 -12.424 2.560 1.00 0.00 N ATOM 1780 CA THR A 117 17.338 -12.689 2.999 1.00 0.00 C ATOM 1781 C THR A 117 18.151 -11.382 3.063 1.00 0.00 C ATOM 1782 O THR A 117 17.705 -10.355 2.553 1.00 0.00 O ATOM 1783 CB THR A 117 18.009 -13.731 2.081 1.00 0.00 C ATOM 1784 OG1 THR A 117 17.844 -13.358 0.696 1.00 0.00 O ATOM 1785 CG2 THR A 117 17.409 -15.105 2.302 1.00 0.00 C ATOM 0 H THR A 117 15.824 -12.639 1.577 1.00 0.00 H new ATOM 0 HA THR A 117 17.305 -13.107 4.005 1.00 0.00 H new ATOM 0 HB THR A 117 19.071 -13.762 2.326 1.00 0.00 H new ATOM 0 HG1 THR A 117 16.889 -13.310 0.482 1.00 0.00 H new ATOM 0 HG21 THR A 117 17.897 -15.825 1.645 1.00 0.00 H new ATOM 0 HG22 THR A 117 17.556 -15.404 3.340 1.00 0.00 H new ATOM 0 HG23 THR A 117 16.342 -15.076 2.081 1.00 0.00 H new ATOM 1793 N ASP A 118 19.333 -11.416 3.669 1.00 0.00 N ATOM 1794 CA ASP A 118 20.145 -10.191 3.847 1.00 0.00 C ATOM 1795 C ASP A 118 20.551 -9.542 2.520 1.00 0.00 C ATOM 1796 O ASP A 118 20.334 -8.357 2.321 1.00 0.00 O ATOM 1797 CB ASP A 118 21.369 -10.448 4.715 1.00 0.00 C ATOM 1798 CG ASP A 118 22.281 -9.234 4.812 1.00 0.00 C ATOM 1799 OD1 ASP A 118 21.952 -8.281 5.550 1.00 0.00 O ATOM 1800 OD2 ASP A 118 23.357 -9.231 4.169 1.00 0.00 O ATOM 0 H ASP A 118 19.757 -12.263 4.046 1.00 0.00 H new ATOM 0 HA ASP A 118 19.499 -9.481 4.363 1.00 0.00 H new ATOM 0 HB2 ASP A 118 21.047 -10.737 5.715 1.00 0.00 H new ATOM 0 HB3 ASP A 118 21.930 -11.288 4.306 1.00 0.00 H new ATOM 1805 N GLU A 119 21.111 -10.325 1.613 1.00 0.00 N ATOM 1806 CA GLU A 119 21.515 -9.822 0.297 1.00 0.00 C ATOM 1807 C GLU A 119 20.293 -9.278 -0.445 1.00 0.00 C ATOM 1808 O GLU A 119 20.373 -8.301 -1.179 1.00 0.00 O ATOM 1809 CB GLU A 119 22.158 -10.923 -0.577 1.00 0.00 C ATOM 1810 CG GLU A 119 23.213 -11.799 0.092 1.00 0.00 C ATOM 1811 CD GLU A 119 22.600 -12.867 0.958 1.00 0.00 C ATOM 1812 OE1 GLU A 119 22.410 -12.637 2.161 1.00 0.00 O ATOM 1813 OE2 GLU A 119 22.260 -13.948 0.435 1.00 0.00 O ATOM 0 H GLU A 119 21.300 -11.317 1.759 1.00 0.00 H new ATOM 0 HA GLU A 119 22.253 -9.038 0.468 1.00 0.00 H new ATOM 0 HB2 GLU A 119 21.363 -11.570 -0.948 1.00 0.00 H new ATOM 0 HB3 GLU A 119 22.612 -10.446 -1.446 1.00 0.00 H new ATOM 0 HG2 GLU A 119 23.833 -12.266 -0.673 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.870 -11.175 0.698 1.00 0.00 H new ATOM 1820 N GLU A 120 19.167 -9.906 -0.186 1.00 0.00 N ATOM 1821 CA GLU A 120 17.909 -9.581 -0.806 1.00 0.00 C ATOM 1822 C GLU A 120 17.370 -8.243 -0.281 1.00 0.00 C ATOM 1823 O GLU A 120 16.926 -7.411 -1.060 1.00 0.00 O ATOM 1824 CB GLU A 120 16.954 -10.740 -0.556 1.00 0.00 C ATOM 1825 CG GLU A 120 15.569 -10.645 -1.143 1.00 0.00 C ATOM 1826 CD GLU A 120 14.807 -11.941 -0.934 1.00 0.00 C ATOM 1827 OE1 GLU A 120 15.223 -12.767 -0.063 1.00 0.00 O ATOM 1828 OE2 GLU A 120 13.780 -12.175 -1.636 1.00 0.00 O ATOM 0 H GLU A 120 19.104 -10.676 0.480 1.00 0.00 H new ATOM 0 HA GLU A 120 18.029 -9.449 -1.881 1.00 0.00 H new ATOM 0 HB2 GLU A 120 17.420 -11.647 -0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 120 16.854 -10.865 0.522 1.00 0.00 H new ATOM 0 HG2 GLU A 120 15.028 -9.820 -0.679 1.00 0.00 H new ATOM 0 HG3 GLU A 120 15.635 -10.424 -2.208 1.00 0.00 H new ATOM 1835 N VAL A 121 17.446 -8.013 1.036 1.00 0.00 N ATOM 1836 CA VAL A 121 17.003 -6.725 1.593 1.00 0.00 C ATOM 1837 C VAL A 121 17.960 -5.625 1.156 1.00 0.00 C ATOM 1838 O VAL A 121 17.557 -4.484 0.920 1.00 0.00 O ATOM 1839 CB VAL A 121 16.851 -6.715 3.158 1.00 0.00 C ATOM 1840 CG1 VAL A 121 15.927 -7.813 3.639 1.00 0.00 C ATOM 1841 CG2 VAL A 121 18.192 -6.764 3.886 1.00 0.00 C ATOM 0 H VAL A 121 17.800 -8.681 1.721 1.00 0.00 H new ATOM 0 HA VAL A 121 16.003 -6.549 1.197 1.00 0.00 H new ATOM 0 HB VAL A 121 16.394 -5.758 3.409 1.00 0.00 H new ATOM 0 HG11 VAL A 121 15.848 -7.772 4.725 1.00 0.00 H new ATOM 0 HG12 VAL A 121 14.939 -7.677 3.198 1.00 0.00 H new ATOM 0 HG13 VAL A 121 16.327 -8.782 3.340 1.00 0.00 H new ATOM 0 HG21 VAL A 121 18.022 -6.755 4.963 1.00 0.00 H new ATOM 0 HG22 VAL A 121 18.723 -7.675 3.610 1.00 0.00 H new ATOM 0 HG23 VAL A 121 18.790 -5.897 3.606 1.00 0.00 H new ATOM 1851 N ASP A 122 19.219 -5.999 1.011 1.00 0.00 N ATOM 1852 CA ASP A 122 20.258 -5.093 0.584 1.00 0.00 C ATOM 1853 C ASP A 122 20.036 -4.670 -0.849 1.00 0.00 C ATOM 1854 O ASP A 122 20.101 -3.484 -1.172 1.00 0.00 O ATOM 1855 CB ASP A 122 21.626 -5.745 0.736 1.00 0.00 C ATOM 1856 CG ASP A 122 22.744 -4.880 0.220 1.00 0.00 C ATOM 1857 OD1 ASP A 122 23.092 -3.891 0.871 1.00 0.00 O ATOM 1858 OD2 ASP A 122 23.315 -5.195 -0.843 1.00 0.00 O ATOM 0 H ASP A 122 19.546 -6.948 1.189 1.00 0.00 H new ATOM 0 HA ASP A 122 20.222 -4.206 1.216 1.00 0.00 H new ATOM 0 HB2 ASP A 122 21.802 -5.969 1.788 1.00 0.00 H new ATOM 0 HB3 ASP A 122 21.632 -6.695 0.202 1.00 0.00 H new ATOM 1863 N GLU A 123 19.731 -5.636 -1.694 1.00 0.00 N ATOM 1864 CA GLU A 123 19.495 -5.385 -3.095 1.00 0.00 C ATOM 1865 C GLU A 123 18.159 -4.669 -3.298 1.00 0.00 C ATOM 1866 O GLU A 123 18.028 -3.839 -4.197 1.00 0.00 O ATOM 1867 CB GLU A 123 19.600 -6.682 -3.888 1.00 0.00 C ATOM 1868 CG GLU A 123 19.559 -6.506 -5.388 1.00 0.00 C ATOM 1869 CD GLU A 123 20.031 -7.737 -6.098 1.00 0.00 C ATOM 1870 OE1 GLU A 123 19.229 -8.635 -6.386 1.00 0.00 O ATOM 1871 OE2 GLU A 123 21.247 -7.841 -6.370 1.00 0.00 O ATOM 0 H GLU A 123 19.641 -6.616 -1.424 1.00 0.00 H new ATOM 0 HA GLU A 123 20.266 -4.716 -3.477 1.00 0.00 H new ATOM 0 HB2 GLU A 123 20.530 -7.183 -3.619 1.00 0.00 H new ATOM 0 HB3 GLU A 123 18.785 -7.342 -3.590 1.00 0.00 H new ATOM 0 HG2 GLU A 123 18.541 -6.272 -5.700 1.00 0.00 H new ATOM 0 HG3 GLU A 123 20.182 -5.659 -5.673 1.00 0.00 H new ATOM 1878 N MET A 124 17.187 -4.973 -2.429 1.00 0.00 N ATOM 1879 CA MET A 124 15.896 -4.262 -2.393 1.00 0.00 C ATOM 1880 C MET A 124 16.164 -2.763 -2.278 1.00 0.00 C ATOM 1881 O MET A 124 15.644 -1.953 -3.050 1.00 0.00 O ATOM 1882 CB MET A 124 15.074 -4.722 -1.168 1.00 0.00 C ATOM 1883 CG MET A 124 13.758 -3.973 -0.964 1.00 0.00 C ATOM 1884 SD MET A 124 12.493 -4.379 -2.181 1.00 0.00 S ATOM 1885 CE MET A 124 12.030 -6.026 -1.672 1.00 0.00 C ATOM 0 H MET A 124 17.269 -5.714 -1.733 1.00 0.00 H new ATOM 0 HA MET A 124 15.336 -4.479 -3.303 1.00 0.00 H new ATOM 0 HB2 MET A 124 14.859 -5.786 -1.271 1.00 0.00 H new ATOM 0 HB3 MET A 124 15.685 -4.605 -0.273 1.00 0.00 H new ATOM 0 HG2 MET A 124 13.375 -4.195 0.032 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.952 -2.901 -0.999 1.00 0.00 H new ATOM 0 HE1 MET A 124 12.235 -6.728 -2.480 1.00 0.00 H new ATOM 0 HE2 MET A 124 12.605 -6.310 -0.791 1.00 0.00 H new ATOM 0 HE3 MET A 124 10.967 -6.048 -1.434 1.00 0.00 H new ATOM 1895 N ILE A 125 17.021 -2.420 -1.331 1.00 0.00 N ATOM 1896 CA ILE A 125 17.424 -1.052 -1.111 1.00 0.00 C ATOM 1897 C ILE A 125 18.240 -0.541 -2.287 1.00 0.00 C ATOM 1898 O ILE A 125 17.937 0.495 -2.825 1.00 0.00 O ATOM 1899 CB ILE A 125 18.246 -0.906 0.205 1.00 0.00 C ATOM 1900 CG1 ILE A 125 17.380 -1.247 1.429 1.00 0.00 C ATOM 1901 CG2 ILE A 125 18.874 0.485 0.347 1.00 0.00 C ATOM 1902 CD1 ILE A 125 16.161 -0.361 1.605 1.00 0.00 C ATOM 0 H ILE A 125 17.455 -3.088 -0.694 1.00 0.00 H new ATOM 0 HA ILE A 125 16.518 -0.454 -1.017 1.00 0.00 H new ATOM 0 HB ILE A 125 19.068 -1.620 0.152 1.00 0.00 H new ATOM 0 HG12 ILE A 125 17.051 -2.283 1.348 1.00 0.00 H new ATOM 0 HG13 ILE A 125 17.997 -1.177 2.325 1.00 0.00 H new ATOM 0 HG21 ILE A 125 19.436 0.537 1.279 1.00 0.00 H new ATOM 0 HG22 ILE A 125 19.545 0.669 -0.492 1.00 0.00 H new ATOM 0 HG23 ILE A 125 18.088 1.240 0.355 1.00 0.00 H new ATOM 0 HD11 ILE A 125 15.609 -0.673 2.492 1.00 0.00 H new ATOM 0 HD12 ILE A 125 16.478 0.675 1.721 1.00 0.00 H new ATOM 0 HD13 ILE A 125 15.518 -0.448 0.729 1.00 0.00 H new ATOM 1914 N ARG A 126 19.220 -1.322 -2.706 1.00 0.00 N ATOM 1915 CA ARG A 126 20.174 -0.941 -3.759 1.00 0.00 C ATOM 1916 C ARG A 126 19.470 -0.587 -5.085 1.00 0.00 C ATOM 1917 O ARG A 126 19.926 0.279 -5.819 1.00 0.00 O ATOM 1918 CB ARG A 126 21.146 -2.088 -4.004 1.00 0.00 C ATOM 1919 CG ARG A 126 22.445 -1.687 -4.686 1.00 0.00 C ATOM 1920 CD ARG A 126 23.233 -2.907 -5.131 1.00 0.00 C ATOM 1921 NE ARG A 126 23.319 -3.950 -4.095 1.00 0.00 N ATOM 1922 CZ ARG A 126 23.030 -5.248 -4.309 1.00 0.00 C ATOM 1923 NH1 ARG A 126 22.708 -5.671 -5.535 1.00 0.00 N ATOM 1924 NH2 ARG A 126 23.051 -6.105 -3.299 1.00 0.00 N ATOM 0 H ARG A 126 19.387 -2.254 -2.326 1.00 0.00 H new ATOM 0 HA ARG A 126 20.704 -0.053 -3.413 1.00 0.00 H new ATOM 0 HB2 ARG A 126 21.383 -2.556 -3.048 1.00 0.00 H new ATOM 0 HB3 ARG A 126 20.649 -2.843 -4.614 1.00 0.00 H new ATOM 0 HG2 ARG A 126 22.226 -1.058 -5.549 1.00 0.00 H new ATOM 0 HG3 ARG A 126 23.049 -1.091 -4.002 1.00 0.00 H new ATOM 0 HD2 ARG A 126 22.768 -3.327 -6.023 1.00 0.00 H new ATOM 0 HD3 ARG A 126 24.240 -2.599 -5.412 1.00 0.00 H new ATOM 0 HE ARG A 126 23.615 -3.673 -3.159 1.00 0.00 H new ATOM 0 HH11 ARG A 126 22.681 -5.010 -6.312 1.00 0.00 H new ATOM 0 HH12 ARG A 126 22.490 -6.655 -5.694 1.00 0.00 H new ATOM 0 HH21 ARG A 126 23.286 -5.782 -2.361 1.00 0.00 H new ATOM 0 HH22 ARG A 126 22.832 -7.088 -3.460 1.00 0.00 H new ATOM 1938 N GLU A 127 18.368 -1.258 -5.375 1.00 0.00 N ATOM 1939 CA GLU A 127 17.637 -1.020 -6.613 1.00 0.00 C ATOM 1940 C GLU A 127 16.698 0.197 -6.481 1.00 0.00 C ATOM 1941 O GLU A 127 16.340 0.837 -7.472 1.00 0.00 O ATOM 1942 CB GLU A 127 16.884 -2.301 -7.036 1.00 0.00 C ATOM 1943 CG GLU A 127 16.152 -2.223 -8.379 1.00 0.00 C ATOM 1944 CD GLU A 127 17.037 -1.746 -9.520 1.00 0.00 C ATOM 1945 OE1 GLU A 127 16.565 -0.948 -10.354 1.00 0.00 O ATOM 1946 OE2 GLU A 127 18.219 -2.113 -9.583 1.00 0.00 O ATOM 0 H GLU A 127 17.958 -1.972 -4.772 1.00 0.00 H new ATOM 0 HA GLU A 127 18.347 -0.777 -7.403 1.00 0.00 H new ATOM 0 HB2 GLU A 127 17.598 -3.124 -7.078 1.00 0.00 H new ATOM 0 HB3 GLU A 127 16.159 -2.548 -6.261 1.00 0.00 H new ATOM 0 HG2 GLU A 127 15.753 -3.207 -8.625 1.00 0.00 H new ATOM 0 HG3 GLU A 127 15.301 -1.549 -8.282 1.00 0.00 H new ATOM 1953 N ALA A 128 16.312 0.522 -5.263 1.00 0.00 N ATOM 1954 CA ALA A 128 15.475 1.692 -5.028 1.00 0.00 C ATOM 1955 C ALA A 128 16.362 2.926 -4.838 1.00 0.00 C ATOM 1956 O ALA A 128 15.940 4.060 -5.041 1.00 0.00 O ATOM 1957 CB ALA A 128 14.578 1.465 -3.826 1.00 0.00 C ATOM 0 H ALA A 128 16.560 -0.001 -4.423 1.00 0.00 H new ATOM 0 HA ALA A 128 14.832 1.860 -5.892 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.959 2.347 -3.662 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.939 0.601 -4.007 1.00 0.00 H new ATOM 0 HB3 ALA A 128 15.191 1.284 -2.943 1.00 0.00 H new ATOM 1963 N ASP A 129 17.577 2.656 -4.431 1.00 0.00 N ATOM 1964 CA ASP A 129 18.649 3.622 -4.252 1.00 0.00 C ATOM 1965 C ASP A 129 19.116 4.137 -5.618 1.00 0.00 C ATOM 1966 O ASP A 129 19.839 3.465 -6.346 1.00 0.00 O ATOM 1967 CB ASP A 129 19.782 2.923 -3.457 1.00 0.00 C ATOM 1968 CG ASP A 129 21.130 3.585 -3.498 1.00 0.00 C ATOM 1969 OD1 ASP A 129 21.329 4.595 -2.835 1.00 0.00 O ATOM 1970 OD2 ASP A 129 22.047 3.050 -4.145 1.00 0.00 O ATOM 0 H ASP A 129 17.868 1.706 -4.201 1.00 0.00 H new ATOM 0 HA ASP A 129 18.315 4.494 -3.690 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.471 2.845 -2.415 1.00 0.00 H new ATOM 0 HB3 ASP A 129 19.888 1.906 -3.835 1.00 0.00 H new ATOM 1975 N ILE A 130 18.643 5.303 -5.983 1.00 0.00 N ATOM 1976 CA ILE A 130 18.903 5.859 -7.294 1.00 0.00 C ATOM 1977 C ILE A 130 20.263 6.555 -7.381 1.00 0.00 C ATOM 1978 O ILE A 130 21.036 6.284 -8.306 1.00 0.00 O ATOM 1979 CB ILE A 130 17.755 6.805 -7.764 1.00 0.00 C ATOM 1980 CG1 ILE A 130 16.432 6.017 -7.822 1.00 0.00 C ATOM 1981 CG2 ILE A 130 18.075 7.418 -9.135 1.00 0.00 C ATOM 1982 CD1 ILE A 130 15.223 6.841 -8.215 1.00 0.00 C ATOM 0 H ILE A 130 18.068 5.895 -5.383 1.00 0.00 H new ATOM 0 HA ILE A 130 18.936 5.012 -7.979 1.00 0.00 H new ATOM 0 HB ILE A 130 17.658 7.622 -7.049 1.00 0.00 H new ATOM 0 HG12 ILE A 130 16.543 5.198 -8.532 1.00 0.00 H new ATOM 0 HG13 ILE A 130 16.248 5.569 -6.845 1.00 0.00 H new ATOM 0 HG21 ILE A 130 17.259 8.073 -9.440 1.00 0.00 H new ATOM 0 HG22 ILE A 130 18.998 7.994 -9.069 1.00 0.00 H new ATOM 0 HG23 ILE A 130 18.195 6.622 -9.870 1.00 0.00 H new ATOM 0 HD11 ILE A 130 14.338 6.205 -8.230 1.00 0.00 H new ATOM 0 HD12 ILE A 130 15.080 7.645 -7.493 1.00 0.00 H new ATOM 0 HD13 ILE A 130 15.380 7.267 -9.206 1.00 0.00 H new ATOM 1994 N ASP A 131 20.577 7.406 -6.410 1.00 0.00 N ATOM 1995 CA ASP A 131 21.842 8.187 -6.439 1.00 0.00 C ATOM 1996 C ASP A 131 23.044 7.296 -6.118 1.00 0.00 C ATOM 1997 O ASP A 131 24.202 7.678 -6.335 1.00 0.00 O ATOM 1998 CB ASP A 131 21.772 9.358 -5.428 1.00 0.00 C ATOM 1999 CG ASP A 131 22.948 10.328 -5.500 1.00 0.00 C ATOM 2000 OD1 ASP A 131 22.849 11.344 -6.240 1.00 0.00 O ATOM 2001 OD2 ASP A 131 23.980 10.116 -4.801 1.00 0.00 O ATOM 0 H ASP A 131 19.990 7.583 -5.595 1.00 0.00 H new ATOM 0 HA ASP A 131 21.968 8.588 -7.445 1.00 0.00 H new ATOM 0 HB2 ASP A 131 20.849 9.913 -5.597 1.00 0.00 H new ATOM 0 HB3 ASP A 131 21.717 8.948 -4.420 1.00 0.00 H new ATOM 2006 N GLY A 132 22.772 6.092 -5.666 1.00 0.00 N ATOM 2007 CA GLY A 132 23.828 5.174 -5.340 1.00 0.00 C ATOM 2008 C GLY A 132 24.513 5.598 -4.079 1.00 0.00 C ATOM 2009 O GLY A 132 25.738 5.771 -4.045 1.00 0.00 O ATOM 0 H GLY A 132 21.830 5.731 -5.518 1.00 0.00 H new ATOM 0 HA2 GLY A 132 23.422 4.169 -5.221 1.00 0.00 H new ATOM 0 HA3 GLY A 132 24.548 5.132 -6.157 1.00 0.00 H new ATOM 2013 N ASP A 133 23.734 5.814 -3.056 1.00 0.00 N ATOM 2014 CA ASP A 133 24.256 6.283 -1.786 1.00 0.00 C ATOM 2015 C ASP A 133 24.233 5.137 -0.790 1.00 0.00 C ATOM 2016 O ASP A 133 24.948 5.143 0.220 1.00 0.00 O ATOM 2017 CB ASP A 133 23.372 7.434 -1.275 1.00 0.00 C ATOM 2018 CG ASP A 133 23.928 8.154 -0.067 1.00 0.00 C ATOM 2019 OD1 ASP A 133 23.788 7.671 1.064 1.00 0.00 O ATOM 2020 OD2 ASP A 133 24.496 9.262 -0.233 1.00 0.00 O ATOM 0 H ASP A 133 22.724 5.673 -3.070 1.00 0.00 H new ATOM 0 HA ASP A 133 25.279 6.638 -1.908 1.00 0.00 H new ATOM 0 HB2 ASP A 133 23.232 8.155 -2.081 1.00 0.00 H new ATOM 0 HB3 ASP A 133 22.387 7.038 -1.027 1.00 0.00 H new ATOM 2025 N GLY A 134 23.460 4.128 -1.118 1.00 0.00 N ATOM 2026 CA GLY A 134 23.341 2.965 -0.282 1.00 0.00 C ATOM 2027 C GLY A 134 22.048 2.972 0.478 1.00 0.00 C ATOM 2028 O GLY A 134 21.679 1.983 1.094 1.00 0.00 O ATOM 0 H GLY A 134 22.899 4.094 -1.969 1.00 0.00 H new ATOM 0 HA2 GLY A 134 23.400 2.066 -0.895 1.00 0.00 H new ATOM 0 HA3 GLY A 134 24.176 2.930 0.417 1.00 0.00 H new ATOM 2032 N GLN A 135 21.352 4.078 0.417 1.00 0.00 N ATOM 2033 CA GLN A 135 20.107 4.254 1.112 1.00 0.00 C ATOM 2034 C GLN A 135 19.112 4.849 0.164 1.00 0.00 C ATOM 2035 O GLN A 135 19.449 5.755 -0.589 1.00 0.00 O ATOM 2036 CB GLN A 135 20.266 5.205 2.299 1.00 0.00 C ATOM 2037 CG GLN A 135 21.165 4.721 3.419 1.00 0.00 C ATOM 2038 CD GLN A 135 21.348 5.790 4.471 1.00 0.00 C ATOM 2039 OE1 GLN A 135 22.269 6.599 4.393 1.00 0.00 O ATOM 2040 NE2 GLN A 135 20.492 5.819 5.444 1.00 0.00 N ATOM 0 H GLN A 135 21.640 4.892 -0.125 1.00 0.00 H new ATOM 0 HA GLN A 135 19.776 3.283 1.481 1.00 0.00 H new ATOM 0 HB2 GLN A 135 20.656 6.154 1.930 1.00 0.00 H new ATOM 0 HB3 GLN A 135 19.278 5.406 2.713 1.00 0.00 H new ATOM 0 HG2 GLN A 135 20.736 3.828 3.874 1.00 0.00 H new ATOM 0 HG3 GLN A 135 22.136 4.436 3.013 1.00 0.00 H new ATOM 0 HE21 GLN A 135 19.738 5.133 5.481 1.00 0.00 H new ATOM 0 HE22 GLN A 135 20.572 6.528 6.173 1.00 0.00 H new ATOM 2049 N VAL A 136 17.914 4.352 0.197 1.00 0.00 N ATOM 2050 CA VAL A 136 16.865 4.891 -0.626 1.00 0.00 C ATOM 2051 C VAL A 136 16.156 6.034 0.094 1.00 0.00 C ATOM 2052 O VAL A 136 15.585 5.862 1.178 1.00 0.00 O ATOM 2053 CB VAL A 136 15.871 3.790 -1.156 1.00 0.00 C ATOM 2054 CG1 VAL A 136 15.550 2.790 -0.086 1.00 0.00 C ATOM 2055 CG2 VAL A 136 14.572 4.410 -1.631 1.00 0.00 C ATOM 0 H VAL A 136 17.633 3.569 0.787 1.00 0.00 H new ATOM 0 HA VAL A 136 17.329 5.302 -1.522 1.00 0.00 H new ATOM 0 HB VAL A 136 16.368 3.292 -1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 136 14.862 2.043 -0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.467 2.301 0.242 1.00 0.00 H new ATOM 0 HG13 VAL A 136 15.087 3.298 0.760 1.00 0.00 H new ATOM 0 HG21 VAL A 136 13.905 3.627 -1.991 1.00 0.00 H new ATOM 0 HG22 VAL A 136 14.097 4.939 -0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 136 14.778 5.111 -2.440 1.00 0.00 H new ATOM 2065 N ASN A 137 16.259 7.191 -0.486 1.00 0.00 N ATOM 2066 CA ASN A 137 15.660 8.408 0.029 1.00 0.00 C ATOM 2067 C ASN A 137 14.206 8.503 -0.428 1.00 0.00 C ATOM 2068 O ASN A 137 13.814 7.862 -1.407 1.00 0.00 O ATOM 2069 CB ASN A 137 16.474 9.621 -0.477 1.00 0.00 C ATOM 2070 CG ASN A 137 15.923 10.975 -0.072 1.00 0.00 C ATOM 2071 OD1 ASN A 137 15.338 11.137 0.995 1.00 0.00 O ATOM 2072 ND2 ASN A 137 16.084 11.939 -0.928 1.00 0.00 N ATOM 0 H ASN A 137 16.774 7.330 -1.355 1.00 0.00 H new ATOM 0 HA ASN A 137 15.674 8.399 1.119 1.00 0.00 H new ATOM 0 HB2 ASN A 137 17.495 9.535 -0.106 1.00 0.00 H new ATOM 0 HB3 ASN A 137 16.526 9.577 -1.565 1.00 0.00 H new ATOM 0 HD21 ASN A 137 15.719 12.869 -0.723 1.00 0.00 H new ATOM 0 HD22 ASN A 137 16.576 11.766 -1.805 1.00 0.00 H new ATOM 2079 N TYR A 138 13.424 9.302 0.276 1.00 0.00 N ATOM 2080 CA TYR A 138 12.016 9.509 -0.006 1.00 0.00 C ATOM 2081 C TYR A 138 11.798 9.957 -1.454 1.00 0.00 C ATOM 2082 O TYR A 138 10.980 9.379 -2.153 1.00 0.00 O ATOM 2083 CB TYR A 138 11.424 10.514 0.996 1.00 0.00 C ATOM 2084 CG TYR A 138 9.957 10.842 0.796 1.00 0.00 C ATOM 2085 CD1 TYR A 138 9.570 12.094 0.354 1.00 0.00 C ATOM 2086 CD2 TYR A 138 8.964 9.905 1.053 1.00 0.00 C ATOM 2087 CE1 TYR A 138 8.241 12.412 0.176 1.00 0.00 C ATOM 2088 CE2 TYR A 138 7.629 10.217 0.873 1.00 0.00 C ATOM 2089 CZ TYR A 138 7.276 11.476 0.434 1.00 0.00 C ATOM 2090 OH TYR A 138 5.943 11.802 0.257 1.00 0.00 O ATOM 0 H TYR A 138 13.759 9.837 1.078 1.00 0.00 H new ATOM 0 HA TYR A 138 11.493 8.560 0.112 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.557 10.119 2.003 1.00 0.00 H new ATOM 0 HB3 TYR A 138 11.997 11.439 0.939 1.00 0.00 H new ATOM 0 HD1 TYR A 138 10.325 12.838 0.144 1.00 0.00 H new ATOM 0 HD2 TYR A 138 9.239 8.919 1.398 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.961 13.397 -0.166 1.00 0.00 H new ATOM 0 HE2 TYR A 138 6.867 9.479 1.075 1.00 0.00 H new ATOM 0 HH TYR A 138 5.870 12.549 -0.373 1.00 0.00 H new ATOM 2100 N GLU A 139 12.585 10.929 -1.917 1.00 0.00 N ATOM 2101 CA GLU A 139 12.477 11.436 -3.283 1.00 0.00 C ATOM 2102 C GLU A 139 12.774 10.355 -4.334 1.00 0.00 C ATOM 2103 O GLU A 139 12.352 10.463 -5.471 1.00 0.00 O ATOM 2104 CB GLU A 139 13.386 12.645 -3.527 1.00 0.00 C ATOM 2105 CG GLU A 139 13.014 13.943 -2.808 1.00 0.00 C ATOM 2106 CD GLU A 139 13.287 13.921 -1.331 1.00 0.00 C ATOM 2107 OE1 GLU A 139 12.357 13.719 -0.549 1.00 0.00 O ATOM 2108 OE2 GLU A 139 14.457 14.114 -0.935 1.00 0.00 O ATOM 0 H GLU A 139 13.309 11.383 -1.360 1.00 0.00 H new ATOM 0 HA GLU A 139 11.439 11.751 -3.394 1.00 0.00 H new ATOM 0 HB2 GLU A 139 14.400 12.373 -3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.407 12.844 -4.598 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.568 14.767 -3.258 1.00 0.00 H new ATOM 0 HG3 GLU A 139 11.955 14.145 -2.969 1.00 0.00 H new ATOM 2115 N GLU A 140 13.488 9.332 -3.950 1.00 0.00 N ATOM 2116 CA GLU A 140 13.790 8.243 -4.854 1.00 0.00 C ATOM 2117 C GLU A 140 12.668 7.226 -4.781 1.00 0.00 C ATOM 2118 O GLU A 140 12.163 6.743 -5.796 1.00 0.00 O ATOM 2119 CB GLU A 140 15.110 7.598 -4.461 1.00 0.00 C ATOM 2120 CG GLU A 140 16.260 8.577 -4.415 1.00 0.00 C ATOM 2121 CD GLU A 140 17.533 7.953 -3.941 1.00 0.00 C ATOM 2122 OE1 GLU A 140 17.626 7.604 -2.765 1.00 0.00 O ATOM 2123 OE2 GLU A 140 18.493 7.868 -4.719 1.00 0.00 O ATOM 0 H GLU A 140 13.876 9.225 -3.013 1.00 0.00 H new ATOM 0 HA GLU A 140 13.878 8.618 -5.874 1.00 0.00 H new ATOM 0 HB2 GLU A 140 15.001 7.129 -3.483 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.345 6.805 -5.170 1.00 0.00 H new ATOM 0 HG2 GLU A 140 16.414 8.996 -5.409 1.00 0.00 H new ATOM 0 HG3 GLU A 140 16.000 9.406 -3.757 1.00 0.00 H new ATOM 2130 N PHE A 141 12.242 6.956 -3.564 1.00 0.00 N ATOM 2131 CA PHE A 141 11.205 5.993 -3.296 1.00 0.00 C ATOM 2132 C PHE A 141 9.859 6.420 -3.892 1.00 0.00 C ATOM 2133 O PHE A 141 9.100 5.575 -4.382 1.00 0.00 O ATOM 2134 CB PHE A 141 11.094 5.733 -1.794 1.00 0.00 C ATOM 2135 CG PHE A 141 10.077 4.695 -1.443 1.00 0.00 C ATOM 2136 CD1 PHE A 141 8.864 5.049 -0.880 1.00 0.00 C ATOM 2137 CD2 PHE A 141 10.335 3.358 -1.692 1.00 0.00 C ATOM 2138 CE1 PHE A 141 7.930 4.091 -0.569 1.00 0.00 C ATOM 2139 CE2 PHE A 141 9.406 2.397 -1.386 1.00 0.00 C ATOM 2140 CZ PHE A 141 8.200 2.765 -0.822 1.00 0.00 C ATOM 0 H PHE A 141 12.613 7.406 -2.727 1.00 0.00 H new ATOM 0 HA PHE A 141 11.482 5.060 -3.786 1.00 0.00 H new ATOM 0 HB2 PHE A 141 12.067 5.420 -1.414 1.00 0.00 H new ATOM 0 HB3 PHE A 141 10.839 6.665 -1.290 1.00 0.00 H new ATOM 0 HD1 PHE A 141 8.649 6.089 -0.683 1.00 0.00 H new ATOM 0 HD2 PHE A 141 11.278 3.069 -2.132 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.987 4.377 -0.127 1.00 0.00 H new ATOM 0 HE2 PHE A 141 9.616 1.357 -1.585 1.00 0.00 H new ATOM 0 HZ PHE A 141 7.467 2.010 -0.579 1.00 0.00 H new ATOM 2150 N VAL A 142 9.579 7.722 -3.889 1.00 0.00 N ATOM 2151 CA VAL A 142 8.331 8.232 -4.468 1.00 0.00 C ATOM 2152 C VAL A 142 8.215 7.844 -5.943 1.00 0.00 C ATOM 2153 O VAL A 142 7.162 7.464 -6.406 1.00 0.00 O ATOM 2154 CB VAL A 142 8.147 9.781 -4.297 1.00 0.00 C ATOM 2155 CG1 VAL A 142 8.061 10.169 -2.840 1.00 0.00 C ATOM 2156 CG2 VAL A 142 9.249 10.565 -4.980 1.00 0.00 C ATOM 0 H VAL A 142 10.190 8.439 -3.497 1.00 0.00 H new ATOM 0 HA VAL A 142 7.526 7.760 -3.904 1.00 0.00 H new ATOM 0 HB VAL A 142 7.204 10.036 -4.782 1.00 0.00 H new ATOM 0 HG11 VAL A 142 7.934 11.248 -2.758 1.00 0.00 H new ATOM 0 HG12 VAL A 142 7.210 9.667 -2.379 1.00 0.00 H new ATOM 0 HG13 VAL A 142 8.977 9.872 -2.330 1.00 0.00 H new ATOM 0 HG21 VAL A 142 9.080 11.632 -4.835 1.00 0.00 H new ATOM 0 HG22 VAL A 142 10.212 10.289 -4.551 1.00 0.00 H new ATOM 0 HG23 VAL A 142 9.249 10.339 -6.046 1.00 0.00 H new ATOM 2166 N GLN A 143 9.346 7.837 -6.623 1.00 0.00 N ATOM 2167 CA GLN A 143 9.421 7.527 -8.036 1.00 0.00 C ATOM 2168 C GLN A 143 9.269 6.033 -8.286 1.00 0.00 C ATOM 2169 O GLN A 143 8.919 5.608 -9.385 1.00 0.00 O ATOM 2170 CB GLN A 143 10.693 8.101 -8.665 1.00 0.00 C ATOM 2171 CG GLN A 143 10.805 9.616 -8.486 1.00 0.00 C ATOM 2172 CD GLN A 143 9.611 10.397 -9.059 1.00 0.00 C ATOM 2173 OE1 GLN A 143 9.224 11.441 -8.531 1.00 0.00 O ATOM 2174 NE2 GLN A 143 9.034 9.924 -10.140 1.00 0.00 N ATOM 0 H GLN A 143 10.251 8.050 -6.202 1.00 0.00 H new ATOM 0 HA GLN A 143 8.580 8.013 -8.531 1.00 0.00 H new ATOM 0 HB2 GLN A 143 11.564 7.621 -8.218 1.00 0.00 H new ATOM 0 HB3 GLN A 143 10.708 7.862 -9.728 1.00 0.00 H new ATOM 0 HG2 GLN A 143 10.899 9.841 -7.424 1.00 0.00 H new ATOM 0 HG3 GLN A 143 11.719 9.963 -8.967 1.00 0.00 H new ATOM 0 HE21 GLN A 143 9.371 9.058 -10.560 1.00 0.00 H new ATOM 0 HE22 GLN A 143 8.249 10.423 -10.559 1.00 0.00 H new ATOM 2183 N MET A 144 9.530 5.243 -7.253 1.00 0.00 N ATOM 2184 CA MET A 144 9.444 3.782 -7.344 1.00 0.00 C ATOM 2185 C MET A 144 7.988 3.421 -7.300 1.00 0.00 C ATOM 2186 O MET A 144 7.515 2.520 -7.979 1.00 0.00 O ATOM 2187 CB MET A 144 10.172 3.113 -6.160 1.00 0.00 C ATOM 2188 CG MET A 144 11.677 3.356 -6.111 1.00 0.00 C ATOM 2189 SD MET A 144 12.566 2.563 -7.464 1.00 0.00 S ATOM 2190 CE MET A 144 12.222 0.832 -7.127 1.00 0.00 C ATOM 0 H MET A 144 9.805 5.588 -6.333 1.00 0.00 H new ATOM 0 HA MET A 144 9.915 3.437 -8.264 1.00 0.00 H new ATOM 0 HB2 MET A 144 9.730 3.473 -5.231 1.00 0.00 H new ATOM 0 HB3 MET A 144 9.993 2.039 -6.203 1.00 0.00 H new ATOM 0 HG2 MET A 144 11.867 4.429 -6.139 1.00 0.00 H new ATOM 0 HG3 MET A 144 12.068 2.988 -5.162 1.00 0.00 H new ATOM 0 HE1 MET A 144 12.971 0.210 -7.617 1.00 0.00 H new ATOM 0 HE2 MET A 144 12.252 0.658 -6.051 1.00 0.00 H new ATOM 0 HE3 MET A 144 11.233 0.577 -7.508 1.00 0.00 H new ATOM 2200 N MET A 145 7.284 4.196 -6.521 1.00 0.00 N ATOM 2201 CA MET A 145 5.872 4.090 -6.347 1.00 0.00 C ATOM 2202 C MET A 145 5.138 4.616 -7.593 1.00 0.00 C ATOM 2203 O MET A 145 4.004 4.232 -7.875 1.00 0.00 O ATOM 2204 CB MET A 145 5.493 4.895 -5.114 1.00 0.00 C ATOM 2205 CG MET A 145 5.914 4.277 -3.777 1.00 0.00 C ATOM 2206 SD MET A 145 5.014 2.761 -3.332 1.00 0.00 S ATOM 2207 CE MET A 145 3.354 3.393 -2.998 1.00 0.00 C ATOM 0 H MET A 145 7.701 4.947 -5.971 1.00 0.00 H new ATOM 0 HA MET A 145 5.582 3.048 -6.214 1.00 0.00 H new ATOM 0 HB2 MET A 145 5.940 5.886 -5.195 1.00 0.00 H new ATOM 0 HB3 MET A 145 4.412 5.033 -5.108 1.00 0.00 H new ATOM 0 HG2 MET A 145 6.980 4.054 -3.814 1.00 0.00 H new ATOM 0 HG3 MET A 145 5.770 5.015 -2.988 1.00 0.00 H new ATOM 0 HE1 MET A 145 3.134 3.293 -1.935 1.00 0.00 H new ATOM 0 HE2 MET A 145 3.301 4.444 -3.283 1.00 0.00 H new ATOM 0 HE3 MET A 145 2.625 2.823 -3.574 1.00 0.00 H new ATOM 2385 N LYS B 82 9.869 -4.570 -8.131 1.00 0.00 N ATOM 2386 CA LYS B 82 8.500 -4.073 -8.041 1.00 0.00 C ATOM 2387 C LYS B 82 7.564 -5.211 -7.651 1.00 0.00 C ATOM 2388 O LYS B 82 6.597 -5.011 -6.926 1.00 0.00 O ATOM 2389 CB LYS B 82 8.082 -3.481 -9.379 1.00 0.00 C ATOM 2390 CG LYS B 82 6.651 -2.978 -9.451 1.00 0.00 C ATOM 2391 CD LYS B 82 6.377 -2.443 -10.829 1.00 0.00 C ATOM 2392 CE LYS B 82 4.951 -1.988 -11.004 1.00 0.00 C ATOM 2393 NZ LYS B 82 4.772 -1.382 -12.325 1.00 0.00 N ATOM 0 HA LYS B 82 8.445 -3.296 -7.279 1.00 0.00 H new ATOM 0 HB2 LYS B 82 8.752 -2.655 -9.616 1.00 0.00 H new ATOM 0 HB3 LYS B 82 8.223 -4.237 -10.151 1.00 0.00 H new ATOM 0 HG2 LYS B 82 5.958 -3.786 -9.219 1.00 0.00 H new ATOM 0 HG3 LYS B 82 6.491 -2.197 -8.708 1.00 0.00 H new ATOM 0 HD2 LYS B 82 7.048 -1.608 -11.030 1.00 0.00 H new ATOM 0 HD3 LYS B 82 6.600 -3.215 -11.565 1.00 0.00 H new ATOM 0 HE2 LYS B 82 4.275 -2.835 -10.890 1.00 0.00 H new ATOM 0 HE3 LYS B 82 4.694 -1.268 -10.227 1.00 0.00 H new ATOM 0 HZ1 LYS B 82 3.871 -1.702 -12.734 1.00 0.00 H new ATOM 0 HZ2 LYS B 82 4.762 -0.346 -12.233 1.00 0.00 H new ATOM 0 HZ3 LYS B 82 5.555 -1.667 -12.947 1.00 0.00 H new ATOM 2407 N GLU B 83 7.890 -6.410 -8.126 1.00 0.00 N ATOM 2408 CA GLU B 83 7.152 -7.624 -7.803 1.00 0.00 C ATOM 2409 C GLU B 83 7.209 -7.806 -6.306 1.00 0.00 C ATOM 2410 O GLU B 83 6.195 -7.974 -5.623 1.00 0.00 O ATOM 2411 CB GLU B 83 7.857 -8.802 -8.441 1.00 0.00 C ATOM 2412 CG GLU B 83 6.968 -10.000 -8.688 1.00 0.00 C ATOM 2413 CD GLU B 83 5.831 -9.652 -9.599 1.00 0.00 C ATOM 2414 OE1 GLU B 83 6.071 -9.383 -10.790 1.00 0.00 O ATOM 2415 OE2 GLU B 83 4.671 -9.612 -9.147 1.00 0.00 O ATOM 0 H GLU B 83 8.681 -6.566 -8.751 1.00 0.00 H new ATOM 0 HA GLU B 83 6.124 -7.557 -8.158 1.00 0.00 H new ATOM 0 HB2 GLU B 83 8.288 -8.482 -9.390 1.00 0.00 H new ATOM 0 HB3 GLU B 83 8.685 -9.105 -7.801 1.00 0.00 H new ATOM 0 HG2 GLU B 83 7.555 -10.807 -9.126 1.00 0.00 H new ATOM 0 HG3 GLU B 83 6.578 -10.368 -7.739 1.00 0.00 H new ATOM 2422 N ALA B 84 8.417 -7.736 -5.820 1.00 0.00 N ATOM 2423 CA ALA B 84 8.690 -7.837 -4.402 1.00 0.00 C ATOM 2424 C ALA B 84 8.048 -6.670 -3.623 1.00 0.00 C ATOM 2425 O ALA B 84 7.463 -6.882 -2.560 1.00 0.00 O ATOM 2426 CB ALA B 84 10.186 -7.923 -4.149 1.00 0.00 C ATOM 0 H ALA B 84 9.249 -7.607 -6.395 1.00 0.00 H new ATOM 0 HA ALA B 84 8.236 -8.757 -4.034 1.00 0.00 H new ATOM 0 HB1 ALA B 84 10.370 -7.998 -3.077 1.00 0.00 H new ATOM 0 HB2 ALA B 84 10.590 -8.803 -4.649 1.00 0.00 H new ATOM 0 HB3 ALA B 84 10.673 -7.029 -4.539 1.00 0.00 H new ATOM 2432 N TRP B 85 8.132 -5.448 -4.172 1.00 0.00 N ATOM 2433 CA TRP B 85 7.514 -4.267 -3.560 1.00 0.00 C ATOM 2434 C TRP B 85 6.009 -4.440 -3.377 1.00 0.00 C ATOM 2435 O TRP B 85 5.470 -4.009 -2.371 1.00 0.00 O ATOM 2436 CB TRP B 85 7.809 -2.949 -4.313 1.00 0.00 C ATOM 2437 CG TRP B 85 9.206 -2.386 -4.133 1.00 0.00 C ATOM 2438 CD1 TRP B 85 10.172 -2.250 -5.087 1.00 0.00 C ATOM 2439 CD2 TRP B 85 9.778 -1.867 -2.919 1.00 0.00 C ATOM 2440 NE1 TRP B 85 11.301 -1.687 -4.547 1.00 0.00 N ATOM 2441 CE2 TRP B 85 11.087 -1.444 -3.223 1.00 0.00 C ATOM 2442 CE3 TRP B 85 9.317 -1.723 -1.610 1.00 0.00 C ATOM 2443 CZ2 TRP B 85 11.932 -0.884 -2.268 1.00 0.00 C ATOM 2444 CZ3 TRP B 85 10.158 -1.168 -0.665 1.00 0.00 C ATOM 2445 CH2 TRP B 85 11.450 -0.755 -1.000 1.00 0.00 C ATOM 0 H TRP B 85 8.625 -5.254 -5.043 1.00 0.00 H new ATOM 0 HA TRP B 85 7.982 -4.184 -2.579 1.00 0.00 H new ATOM 0 HB2 TRP B 85 7.638 -3.114 -5.377 1.00 0.00 H new ATOM 0 HB3 TRP B 85 7.090 -2.197 -3.987 1.00 0.00 H new ATOM 0 HD1 TRP B 85 10.063 -2.544 -6.121 1.00 0.00 H new ATOM 0 HE1 TRP B 85 12.162 -1.483 -5.055 1.00 0.00 H new ATOM 0 HE3 TRP B 85 8.320 -2.040 -1.340 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 12.932 -0.564 -2.523 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.811 -1.051 0.351 1.00 0.00 H new ATOM 0 HH2 TRP B 85 12.081 -0.324 -0.237 1.00 0.00 H new ATOM 2456 N LYS B 86 5.339 -5.115 -4.336 1.00 0.00 N ATOM 2457 CA LYS B 86 3.883 -5.404 -4.241 1.00 0.00 C ATOM 2458 C LYS B 86 3.569 -6.073 -2.921 1.00 0.00 C ATOM 2459 O LYS B 86 2.506 -5.871 -2.335 1.00 0.00 O ATOM 2460 CB LYS B 86 3.420 -6.327 -5.371 1.00 0.00 C ATOM 2461 CG LYS B 86 3.574 -5.758 -6.761 1.00 0.00 C ATOM 2462 CD LYS B 86 3.297 -6.817 -7.812 1.00 0.00 C ATOM 2463 CE LYS B 86 3.665 -6.322 -9.195 1.00 0.00 C ATOM 2464 NZ LYS B 86 3.602 -7.398 -10.203 1.00 0.00 N ATOM 0 H LYS B 86 5.778 -5.471 -5.185 1.00 0.00 H new ATOM 0 HA LYS B 86 3.358 -4.452 -4.320 1.00 0.00 H new ATOM 0 HB2 LYS B 86 3.981 -7.259 -5.312 1.00 0.00 H new ATOM 0 HB3 LYS B 86 2.371 -6.576 -5.210 1.00 0.00 H new ATOM 0 HG2 LYS B 86 2.889 -4.920 -6.894 1.00 0.00 H new ATOM 0 HG3 LYS B 86 4.584 -5.368 -6.889 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.864 -7.719 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS B 86 2.242 -7.090 -7.789 1.00 0.00 H new ATOM 0 HE2 LYS B 86 2.990 -5.516 -9.483 1.00 0.00 H new ATOM 0 HE3 LYS B 86 4.671 -5.903 -9.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 4.372 -7.275 -10.891 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 3.702 -8.320 -9.733 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 2.687 -7.358 -10.696 1.00 0.00 H new ATOM 2478 N HIS B 87 4.495 -6.883 -2.473 1.00 0.00 N ATOM 2479 CA HIS B 87 4.376 -7.553 -1.210 1.00 0.00 C ATOM 2480 C HIS B 87 4.859 -6.675 -0.090 1.00 0.00 C ATOM 2481 O HIS B 87 4.121 -6.405 0.823 1.00 0.00 O ATOM 2482 CB HIS B 87 5.096 -8.894 -1.211 1.00 0.00 C ATOM 2483 CG HIS B 87 4.400 -9.917 -2.036 1.00 0.00 C ATOM 2484 ND1 HIS B 87 3.778 -11.006 -1.494 1.00 0.00 N ATOM 2485 CD2 HIS B 87 4.206 -9.998 -3.370 1.00 0.00 C ATOM 2486 CE1 HIS B 87 3.226 -11.709 -2.448 1.00 0.00 C ATOM 2487 NE2 HIS B 87 3.472 -11.120 -3.603 1.00 0.00 N ATOM 0 H HIS B 87 5.355 -7.095 -2.979 1.00 0.00 H new ATOM 0 HA HIS B 87 3.318 -7.758 -1.046 1.00 0.00 H new ATOM 0 HB2 HIS B 87 6.110 -8.757 -1.588 1.00 0.00 H new ATOM 0 HB3 HIS B 87 5.183 -9.256 -0.187 1.00 0.00 H new ATOM 0 HD2 HIS B 87 4.566 -9.302 -4.113 1.00 0.00 H new ATOM 0 HE1 HIS B 87 2.662 -12.620 -2.313 1.00 0.00 H new ATOM 0 HE2 HIS B 87 3.164 -11.450 -4.517 1.00 0.00 H new ATOM 2496 N ALA B 88 6.086 -6.186 -0.214 1.00 0.00 N ATOM 2497 CA ALA B 88 6.749 -5.363 0.810 1.00 0.00 C ATOM 2498 C ALA B 88 5.885 -4.184 1.274 1.00 0.00 C ATOM 2499 O ALA B 88 5.655 -4.010 2.475 1.00 0.00 O ATOM 2500 CB ALA B 88 8.085 -4.856 0.282 1.00 0.00 C ATOM 0 H ALA B 88 6.664 -6.348 -1.039 1.00 0.00 H new ATOM 0 HA ALA B 88 6.910 -6.000 1.679 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.570 -4.247 1.045 1.00 0.00 H new ATOM 0 HB2 ALA B 88 8.723 -5.704 0.034 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.918 -4.253 -0.611 1.00 0.00 H new ATOM 2506 N ILE B 89 5.389 -3.408 0.316 1.00 0.00 N ATOM 2507 CA ILE B 89 4.563 -2.235 0.597 1.00 0.00 C ATOM 2508 C ILE B 89 3.301 -2.663 1.322 1.00 0.00 C ATOM 2509 O ILE B 89 3.013 -2.216 2.421 1.00 0.00 O ATOM 2510 CB ILE B 89 4.134 -1.510 -0.729 1.00 0.00 C ATOM 2511 CG1 ILE B 89 5.349 -1.072 -1.566 1.00 0.00 C ATOM 2512 CG2 ILE B 89 3.214 -0.318 -0.452 1.00 0.00 C ATOM 2513 CD1 ILE B 89 6.260 -0.098 -0.885 1.00 0.00 C ATOM 0 H ILE B 89 5.547 -3.573 -0.678 1.00 0.00 H new ATOM 0 HA ILE B 89 5.154 -1.553 1.208 1.00 0.00 H new ATOM 0 HB ILE B 89 3.574 -2.240 -1.313 1.00 0.00 H new ATOM 0 HG12 ILE B 89 5.924 -1.957 -1.838 1.00 0.00 H new ATOM 0 HG13 ILE B 89 4.992 -0.626 -2.494 1.00 0.00 H new ATOM 0 HG21 ILE B 89 2.940 0.157 -1.394 1.00 0.00 H new ATOM 0 HG22 ILE B 89 2.314 -0.664 0.056 1.00 0.00 H new ATOM 0 HG23 ILE B 89 3.733 0.403 0.180 1.00 0.00 H new ATOM 0 HD11 ILE B 89 7.087 0.153 -1.550 1.00 0.00 H new ATOM 0 HD12 ILE B 89 5.705 0.807 -0.638 1.00 0.00 H new ATOM 0 HD13 ILE B 89 6.652 -0.544 0.029 1.00 0.00 H new ATOM 2525 N GLN B 90 2.622 -3.601 0.723 1.00 0.00 N ATOM 2526 CA GLN B 90 1.308 -4.036 1.140 1.00 0.00 C ATOM 2527 C GLN B 90 1.344 -4.789 2.484 1.00 0.00 C ATOM 2528 O GLN B 90 0.412 -4.680 3.286 1.00 0.00 O ATOM 2529 CB GLN B 90 0.750 -4.890 0.017 1.00 0.00 C ATOM 2530 CG GLN B 90 -0.729 -5.196 0.070 1.00 0.00 C ATOM 2531 CD GLN B 90 -1.203 -5.923 -1.186 1.00 0.00 C ATOM 2532 OE1 GLN B 90 -2.141 -6.698 -1.151 1.00 0.00 O ATOM 2533 NE2 GLN B 90 -0.541 -5.677 -2.309 1.00 0.00 N ATOM 0 H GLN B 90 2.973 -4.102 -0.093 1.00 0.00 H new ATOM 0 HA GLN B 90 0.662 -3.177 1.319 1.00 0.00 H new ATOM 0 HB2 GLN B 90 0.961 -4.390 -0.928 1.00 0.00 H new ATOM 0 HB3 GLN B 90 1.293 -5.835 0.006 1.00 0.00 H new ATOM 0 HG2 GLN B 90 -0.942 -5.808 0.946 1.00 0.00 H new ATOM 0 HG3 GLN B 90 -1.288 -4.268 0.186 1.00 0.00 H new ATOM 0 HE21 GLN B 90 0.241 -5.022 -2.307 1.00 0.00 H new ATOM 0 HE22 GLN B 90 -0.814 -6.143 -3.174 1.00 0.00 H new ATOM 2542 N LYS B 91 2.440 -5.502 2.729 1.00 0.00 N ATOM 2543 CA LYS B 91 2.638 -6.282 3.956 1.00 0.00 C ATOM 2544 C LYS B 91 2.775 -5.345 5.141 1.00 0.00 C ATOM 2545 O LYS B 91 2.269 -5.612 6.233 1.00 0.00 O ATOM 2546 CB LYS B 91 3.931 -7.123 3.852 1.00 0.00 C ATOM 2547 CG LYS B 91 4.093 -8.198 4.927 1.00 0.00 C ATOM 2548 CD LYS B 91 3.084 -9.298 4.705 1.00 0.00 C ATOM 2549 CE LYS B 91 3.153 -10.429 5.722 1.00 0.00 C ATOM 2550 NZ LYS B 91 4.452 -11.113 5.736 1.00 0.00 N ATOM 0 H LYS B 91 3.224 -5.558 2.079 1.00 0.00 H new ATOM 0 HA LYS B 91 1.778 -6.939 4.089 1.00 0.00 H new ATOM 0 HB2 LYS B 91 3.956 -7.603 2.874 1.00 0.00 H new ATOM 0 HB3 LYS B 91 4.788 -6.451 3.900 1.00 0.00 H new ATOM 0 HG2 LYS B 91 5.103 -8.607 4.896 1.00 0.00 H new ATOM 0 HG3 LYS B 91 3.956 -7.760 5.916 1.00 0.00 H new ATOM 0 HD2 LYS B 91 2.083 -8.866 4.727 1.00 0.00 H new ATOM 0 HD3 LYS B 91 3.230 -9.713 3.708 1.00 0.00 H new ATOM 0 HE2 LYS B 91 2.949 -10.029 6.715 1.00 0.00 H new ATOM 0 HE3 LYS B 91 2.369 -11.155 5.503 1.00 0.00 H new ATOM 0 HZ1 LYS B 91 4.304 -12.137 5.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 91 4.951 -10.929 4.842 1.00 0.00 H new ATOM 0 HZ3 LYS B 91 5.022 -10.759 6.530 1.00 0.00 H new ATOM 2564 N ALA B 92 3.469 -4.256 4.917 1.00 0.00 N ATOM 2565 CA ALA B 92 3.710 -3.288 5.948 1.00 0.00 C ATOM 2566 C ALA B 92 2.532 -2.358 6.095 1.00 0.00 C ATOM 2567 O ALA B 92 1.997 -2.178 7.195 1.00 0.00 O ATOM 2568 CB ALA B 92 4.969 -2.505 5.631 1.00 0.00 C ATOM 0 H ALA B 92 3.881 -4.020 4.014 1.00 0.00 H new ATOM 0 HA ALA B 92 3.845 -3.811 6.895 1.00 0.00 H new ATOM 0 HB1 ALA B 92 5.148 -1.771 6.417 1.00 0.00 H new ATOM 0 HB2 ALA B 92 5.817 -3.188 5.572 1.00 0.00 H new ATOM 0 HB3 ALA B 92 4.848 -1.993 4.676 1.00 0.00 H new ATOM 2574 N LYS B 93 2.115 -1.797 4.977 1.00 0.00 N ATOM 2575 CA LYS B 93 1.043 -0.833 4.924 1.00 0.00 C ATOM 2576 C LYS B 93 -0.281 -1.424 5.406 1.00 0.00 C ATOM 2577 O LYS B 93 -1.100 -0.694 5.980 1.00 0.00 O ATOM 2578 CB LYS B 93 0.955 -0.231 3.496 1.00 0.00 C ATOM 2579 CG LYS B 93 -0.232 0.677 3.197 1.00 0.00 C ATOM 2580 CD LYS B 93 -0.360 1.829 4.167 1.00 0.00 C ATOM 2581 CE LYS B 93 -1.539 2.696 3.788 1.00 0.00 C ATOM 2582 NZ LYS B 93 -1.944 3.589 4.899 1.00 0.00 N ATOM 0 H LYS B 93 2.522 -2.005 4.065 1.00 0.00 H new ATOM 0 HA LYS B 93 1.263 -0.020 5.616 1.00 0.00 H new ATOM 0 HB2 LYS B 93 1.868 0.334 3.310 1.00 0.00 H new ATOM 0 HB3 LYS B 93 0.939 -1.055 2.782 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -0.134 1.071 2.186 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -1.148 0.087 3.221 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -0.488 1.449 5.181 1.00 0.00 H new ATOM 0 HD3 LYS B 93 0.554 2.422 4.162 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -1.284 3.296 2.914 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -2.380 2.063 3.505 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -2.599 4.313 4.541 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -2.416 3.031 5.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -1.102 4.051 5.298 1.00 0.00 H new