USER MOD reduce.3.24.130724 H: found=0, std=0, add=664, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 665 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 21 THR OG1 : rot 180:sc= 0.822 USER MOD Set 1.2: A 70 THR OG1 : rot -112:sc= 0.754 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.257 K(o=-0.26,f=-0.82) USER MOD Single : A 13 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot -48:sc= -0.438 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 30:sc= -0.0622 USER MOD Single : A 30 MET CE :methyl -152:sc= -2.84 (180deg=-4.87!) USER MOD Single : A 41 GLN : amide:sc= 0.0368 X(o=0.037,f=0) USER MOD Single : A 43 ASN : amide:sc=-0.00535 K(o=-0.0053,f=-0.62) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.643 K(o=-0.64,f=-5.4!) USER MOD Single : A 47 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.36) USER MOD Single : A 49 SER OG : rot -88:sc= 1.23 USER MOD Single : A 51 CYS SG : rot 2:sc= -0.606 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -1.27 K(o=-1.3,f=-0.35) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 142:sc= 0.967 USER MOD Single : A 66 SER OG : rot 170:sc= -0.569 USER MOD Single : A 68 SER OG : rot 10:sc= 1.28 USER MOD Single : A 75 SER OG : rot -169:sc= 0.557 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 78 LYS NZ :NH3+ 168:sc= 1.28 (180deg=1.04) USER MOD Single : A 80 LYS NZ :NH3+ -119:sc= 1.4 (180deg=-0.243) USER MOD Single : A 81 MET CE :methyl -138:sc= 0 (180deg=-2.15!) USER MOD Single : A 82 MET CE :methyl -141:sc= -0.169 (180deg=-1.69!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 5 17.833 4.171 6.075 1.00 0.00 N ATOM 2 CA ILE A 5 18.140 4.944 4.872 1.00 0.00 C ATOM 3 C ILE A 5 16.889 5.175 4.013 1.00 0.00 C ATOM 4 O ILE A 5 16.876 6.040 3.136 1.00 0.00 O ATOM 5 CB ILE A 5 19.244 4.251 4.032 1.00 0.00 C ATOM 6 CG1 ILE A 5 19.665 5.128 2.847 1.00 0.00 C ATOM 7 CG2 ILE A 5 18.773 2.885 3.548 1.00 0.00 C ATOM 8 CD1 ILE A 5 20.791 4.541 2.022 1.00 0.00 C ATOM 0 HA ILE A 5 18.509 5.916 5.200 1.00 0.00 H new ATOM 0 HB ILE A 5 20.115 4.108 4.672 1.00 0.00 H new ATOM 0 HG12 ILE A 5 18.801 5.290 2.202 1.00 0.00 H new ATOM 0 HG13 ILE A 5 19.972 6.105 3.221 1.00 0.00 H new ATOM 0 HG21 ILE A 5 19.562 2.415 2.961 1.00 0.00 H new ATOM 0 HG22 ILE A 5 18.537 2.256 4.407 1.00 0.00 H new ATOM 0 HG23 ILE A 5 17.883 3.005 2.930 1.00 0.00 H new ATOM 0 HD11 ILE A 5 21.033 5.218 1.203 1.00 0.00 H new ATOM 0 HD12 ILE A 5 21.670 4.404 2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 5 20.481 3.578 1.617 1.00 0.00 H new ATOM 20 N SER A 6 15.835 4.409 4.299 1.00 0.00 N ATOM 21 CA SER A 6 14.568 4.503 3.575 1.00 0.00 C ATOM 22 C SER A 6 14.728 4.027 2.129 1.00 0.00 C ATOM 23 O SER A 6 15.824 3.646 1.715 1.00 0.00 O ATOM 24 CB SER A 6 14.023 5.938 3.618 1.00 0.00 C ATOM 25 OG SER A 6 13.891 6.398 4.955 1.00 0.00 O ATOM 0 H SER A 6 15.836 3.707 5.039 1.00 0.00 H new ATOM 0 HA SER A 6 13.848 3.849 4.068 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.691 6.600 3.067 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.054 5.977 3.120 1.00 0.00 H new ATOM 0 HG SER A 6 13.544 7.314 4.953 1.00 0.00 H new ATOM 31 N SER A 7 13.622 4.037 1.379 1.00 0.00 N ATOM 32 CA SER A 7 13.585 3.566 -0.008 1.00 0.00 C ATOM 33 C SER A 7 13.785 2.048 -0.056 1.00 0.00 C ATOM 34 O SER A 7 12.853 1.306 -0.350 1.00 0.00 O ATOM 35 CB SER A 7 14.640 4.291 -0.859 1.00 0.00 C ATOM 36 OG SER A 7 14.446 4.058 -2.246 1.00 0.00 O ATOM 0 H SER A 7 12.722 4.374 1.720 1.00 0.00 H new ATOM 0 HA SER A 7 12.606 3.796 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.595 5.362 -0.660 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.635 3.954 -0.569 1.00 0.00 H new ATOM 0 HG SER A 7 15.133 4.535 -2.757 1.00 0.00 H new ATOM 42 N GLN A 8 14.993 1.612 0.269 1.00 0.00 N ATOM 43 CA GLN A 8 15.364 0.199 0.300 1.00 0.00 C ATOM 44 C GLN A 8 14.927 -0.531 -0.981 1.00 0.00 C ATOM 45 O GLN A 8 14.756 0.087 -2.036 1.00 0.00 O ATOM 46 CB GLN A 8 14.740 -0.456 1.542 1.00 0.00 C ATOM 47 CG GLN A 8 15.550 -1.621 2.095 1.00 0.00 C ATOM 48 CD GLN A 8 16.931 -1.199 2.557 1.00 0.00 C ATOM 49 OE1 GLN A 8 17.131 -0.073 3.013 1.00 0.00 O ATOM 50 NE2 GLN A 8 17.892 -2.099 2.440 1.00 0.00 N ATOM 0 H GLN A 8 15.758 2.238 0.523 1.00 0.00 H new ATOM 0 HA GLN A 8 16.450 0.123 0.353 1.00 0.00 H new ATOM 0 HB2 GLN A 8 14.627 0.298 2.321 1.00 0.00 H new ATOM 0 HB3 GLN A 8 13.739 -0.808 1.292 1.00 0.00 H new ATOM 0 HG2 GLN A 8 15.012 -2.070 2.930 1.00 0.00 H new ATOM 0 HG3 GLN A 8 15.646 -2.389 1.328 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.683 -3.021 2.057 1.00 0.00 H new ATOM 0 HE22 GLN A 8 18.842 -1.872 2.733 1.00 0.00 H new ATOM 59 N LEU A 9 14.770 -1.844 -0.861 1.00 0.00 N ATOM 60 CA LEU A 9 14.322 -2.719 -1.938 1.00 0.00 C ATOM 61 C LEU A 9 14.406 -4.160 -1.450 1.00 0.00 C ATOM 62 O LEU A 9 13.496 -4.948 -1.665 1.00 0.00 O ATOM 63 CB LEU A 9 15.113 -2.518 -3.253 1.00 0.00 C ATOM 64 CG LEU A 9 16.602 -2.895 -3.255 1.00 0.00 C ATOM 65 CD1 LEU A 9 16.796 -4.368 -3.594 1.00 0.00 C ATOM 66 CD2 LEU A 9 17.357 -2.026 -4.245 1.00 0.00 C ATOM 0 H LEU A 9 14.955 -2.342 0.010 1.00 0.00 H new ATOM 0 HA LEU A 9 13.291 -2.464 -2.185 1.00 0.00 H new ATOM 0 HB2 LEU A 9 14.619 -3.097 -4.033 1.00 0.00 H new ATOM 0 HB3 LEU A 9 15.032 -1.468 -3.536 1.00 0.00 H new ATOM 0 HG LEU A 9 16.997 -2.724 -2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 9 17.860 -4.606 -3.588 1.00 0.00 H new ATOM 0 HD12 LEU A 9 16.283 -4.982 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 9 16.385 -4.571 -4.583 1.00 0.00 H new ATOM 0 HD21 LEU A 9 18.412 -2.300 -4.239 1.00 0.00 H new ATOM 0 HD22 LEU A 9 16.949 -2.174 -5.245 1.00 0.00 H new ATOM 0 HD23 LEU A 9 17.253 -0.978 -3.963 1.00 0.00 H new ATOM 78 N GLY A 10 15.488 -4.480 -0.750 1.00 0.00 N ATOM 79 CA GLY A 10 15.645 -5.807 -0.191 1.00 0.00 C ATOM 80 C GLY A 10 17.099 -6.217 -0.067 1.00 0.00 C ATOM 81 O GLY A 10 17.839 -6.174 -1.049 1.00 0.00 O ATOM 0 H GLY A 10 16.260 -3.842 -0.560 1.00 0.00 H new ATOM 0 HA2 GLY A 10 15.176 -5.841 0.792 1.00 0.00 H new ATOM 0 HA3 GLY A 10 15.120 -6.527 -0.819 1.00 0.00 H new ATOM 85 N PRO A 11 17.537 -6.628 1.134 1.00 0.00 N ATOM 86 CA PRO A 11 18.931 -7.020 1.384 1.00 0.00 C ATOM 87 C PRO A 11 19.270 -8.389 0.793 1.00 0.00 C ATOM 88 O PRO A 11 20.438 -8.768 0.698 1.00 0.00 O ATOM 89 CB PRO A 11 19.008 -7.063 2.909 1.00 0.00 C ATOM 90 CG PRO A 11 17.625 -7.402 3.341 1.00 0.00 C ATOM 91 CD PRO A 11 16.707 -6.743 2.348 1.00 0.00 C ATOM 0 HA PRO A 11 19.639 -6.333 0.922 1.00 0.00 H new ATOM 0 HB2 PRO A 11 19.725 -7.810 3.250 1.00 0.00 H new ATOM 0 HB3 PRO A 11 19.328 -6.105 3.318 1.00 0.00 H new ATOM 0 HG2 PRO A 11 17.474 -8.481 3.355 1.00 0.00 H new ATOM 0 HG3 PRO A 11 17.432 -7.040 4.351 1.00 0.00 H new ATOM 0 HD2 PRO A 11 15.814 -7.342 2.168 1.00 0.00 H new ATOM 0 HD3 PRO A 11 16.371 -5.767 2.698 1.00 0.00 H new ATOM 99 N ILE A 12 18.240 -9.131 0.411 1.00 0.00 N ATOM 100 CA ILE A 12 18.420 -10.447 -0.173 1.00 0.00 C ATOM 101 C ILE A 12 17.303 -10.694 -1.191 1.00 0.00 C ATOM 102 O ILE A 12 16.204 -10.155 -1.042 1.00 0.00 O ATOM 103 CB ILE A 12 18.443 -11.536 0.930 1.00 0.00 C ATOM 104 CG1 ILE A 12 19.116 -12.812 0.421 1.00 0.00 C ATOM 105 CG2 ILE A 12 17.040 -11.821 1.446 1.00 0.00 C ATOM 106 CD1 ILE A 12 19.337 -13.853 1.500 1.00 0.00 C ATOM 0 H ILE A 12 17.266 -8.839 0.497 1.00 0.00 H new ATOM 0 HA ILE A 12 19.380 -10.496 -0.687 1.00 0.00 H new ATOM 0 HB ILE A 12 19.032 -11.158 1.766 1.00 0.00 H new ATOM 0 HG12 ILE A 12 18.504 -13.245 -0.370 1.00 0.00 H new ATOM 0 HG13 ILE A 12 20.076 -12.553 -0.025 1.00 0.00 H new ATOM 0 HG21 ILE A 12 17.085 -12.589 2.219 1.00 0.00 H new ATOM 0 HG22 ILE A 12 16.614 -10.909 1.865 1.00 0.00 H new ATOM 0 HG23 ILE A 12 16.414 -12.170 0.625 1.00 0.00 H new ATOM 0 HD11 ILE A 12 19.818 -14.730 1.067 1.00 0.00 H new ATOM 0 HD12 ILE A 12 19.975 -13.438 2.281 1.00 0.00 H new ATOM 0 HD13 ILE A 12 18.378 -14.141 1.930 1.00 0.00 H new ATOM 118 N HIS A 13 17.591 -11.458 -2.242 1.00 0.00 N ATOM 119 CA HIS A 13 16.661 -11.589 -3.371 1.00 0.00 C ATOM 120 C HIS A 13 15.631 -12.740 -3.277 1.00 0.00 C ATOM 121 O HIS A 13 14.747 -12.802 -4.133 1.00 0.00 O ATOM 122 CB HIS A 13 17.426 -11.663 -4.692 1.00 0.00 C ATOM 123 CG HIS A 13 17.873 -10.317 -5.175 1.00 0.00 C ATOM 124 ND1 HIS A 13 17.172 -9.582 -6.105 1.00 0.00 N ATOM 125 CD2 HIS A 13 18.943 -9.561 -4.832 1.00 0.00 C ATOM 126 CE1 HIS A 13 17.792 -8.434 -6.313 1.00 0.00 C ATOM 127 NE2 HIS A 13 18.870 -8.394 -5.551 1.00 0.00 N ATOM 0 H HIS A 13 18.453 -11.994 -2.340 1.00 0.00 H new ATOM 0 HA HIS A 13 16.057 -10.683 -3.326 1.00 0.00 H new ATOM 0 HB2 HIS A 13 18.296 -12.308 -4.568 1.00 0.00 H new ATOM 0 HB3 HIS A 13 16.792 -12.125 -5.449 1.00 0.00 H new ATOM 0 HD2 HIS A 13 19.713 -9.827 -4.123 1.00 0.00 H new ATOM 0 HE1 HIS A 13 17.471 -7.658 -6.992 1.00 0.00 H new ATOM 0 HE2 HIS A 13 19.537 -7.624 -5.505 1.00 0.00 H new ATOM 136 N PRO A 14 15.736 -13.703 -2.322 1.00 0.00 N ATOM 137 CA PRO A 14 14.615 -14.575 -1.944 1.00 0.00 C ATOM 138 C PRO A 14 13.259 -13.847 -1.926 1.00 0.00 C ATOM 139 O PRO A 14 13.235 -12.628 -1.890 1.00 0.00 O ATOM 140 CB PRO A 14 14.984 -15.006 -0.523 1.00 0.00 C ATOM 141 CG PRO A 14 16.457 -14.793 -0.383 1.00 0.00 C ATOM 142 CD PRO A 14 16.952 -14.128 -1.638 1.00 0.00 C ATOM 0 HA PRO A 14 14.487 -15.391 -2.655 1.00 0.00 H new ATOM 0 HB2 PRO A 14 14.436 -14.420 0.215 1.00 0.00 H new ATOM 0 HB3 PRO A 14 14.726 -16.052 -0.356 1.00 0.00 H new ATOM 0 HG2 PRO A 14 16.671 -14.172 0.487 1.00 0.00 H new ATOM 0 HG3 PRO A 14 16.967 -15.744 -0.229 1.00 0.00 H new ATOM 0 HD2 PRO A 14 17.598 -13.280 -1.411 1.00 0.00 H new ATOM 0 HD3 PRO A 14 17.533 -14.817 -2.251 1.00 0.00 H new ATOM 150 N PRO A 15 12.129 -14.595 -1.918 1.00 0.00 N ATOM 151 CA PRO A 15 10.756 -14.058 -2.015 1.00 0.00 C ATOM 152 C PRO A 15 10.558 -12.617 -1.497 1.00 0.00 C ATOM 153 O PRO A 15 11.170 -12.197 -0.508 1.00 0.00 O ATOM 154 CB PRO A 15 9.985 -15.052 -1.158 1.00 0.00 C ATOM 155 CG PRO A 15 10.655 -16.363 -1.414 1.00 0.00 C ATOM 156 CD PRO A 15 12.090 -16.064 -1.799 1.00 0.00 C ATOM 0 HA PRO A 15 10.439 -13.968 -3.054 1.00 0.00 H new ATOM 0 HB2 PRO A 15 10.028 -14.783 -0.102 1.00 0.00 H new ATOM 0 HB3 PRO A 15 8.932 -15.083 -1.436 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.618 -16.994 -0.526 1.00 0.00 H new ATOM 0 HG3 PRO A 15 10.147 -16.905 -2.212 1.00 0.00 H new ATOM 0 HD2 PRO A 15 12.789 -16.422 -1.043 1.00 0.00 H new ATOM 0 HD3 PRO A 15 12.360 -16.548 -2.738 1.00 0.00 H new ATOM 164 N PRO A 16 9.644 -11.859 -2.146 1.00 0.00 N ATOM 165 CA PRO A 16 9.454 -10.411 -1.913 1.00 0.00 C ATOM 166 C PRO A 16 8.929 -10.063 -0.517 1.00 0.00 C ATOM 167 O PRO A 16 8.503 -8.931 -0.264 1.00 0.00 O ATOM 168 CB PRO A 16 8.434 -10.011 -2.974 1.00 0.00 C ATOM 169 CG PRO A 16 7.702 -11.262 -3.277 1.00 0.00 C ATOM 170 CD PRO A 16 8.708 -12.365 -3.163 1.00 0.00 C ATOM 0 HA PRO A 16 10.406 -9.883 -1.976 1.00 0.00 H new ATOM 0 HB2 PRO A 16 7.761 -9.237 -2.605 1.00 0.00 H new ATOM 0 HB3 PRO A 16 8.922 -9.612 -3.863 1.00 0.00 H new ATOM 0 HG2 PRO A 16 6.878 -11.411 -2.579 1.00 0.00 H new ATOM 0 HG3 PRO A 16 7.270 -11.229 -4.277 1.00 0.00 H new ATOM 0 HD2 PRO A 16 8.245 -13.302 -2.854 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.208 -12.554 -4.113 1.00 0.00 H new ATOM 178 N ARG A 17 8.962 -11.037 0.381 1.00 0.00 N ATOM 179 CA ARG A 17 8.715 -10.790 1.791 1.00 0.00 C ATOM 180 C ARG A 17 9.957 -10.171 2.424 1.00 0.00 C ATOM 181 O ARG A 17 10.008 -9.924 3.626 1.00 0.00 O ATOM 182 CB ARG A 17 8.290 -12.082 2.510 1.00 0.00 C ATOM 183 CG ARG A 17 8.985 -13.347 2.015 1.00 0.00 C ATOM 184 CD ARG A 17 10.440 -13.422 2.451 1.00 0.00 C ATOM 185 NE ARG A 17 10.576 -13.544 3.899 1.00 0.00 N ATOM 186 CZ ARG A 17 11.631 -14.080 4.508 1.00 0.00 C ATOM 187 NH1 ARG A 17 12.654 -14.540 3.795 1.00 0.00 N ATOM 188 NH2 ARG A 17 11.651 -14.168 5.829 1.00 0.00 N ATOM 0 H ARG A 17 9.159 -12.012 0.154 1.00 0.00 H new ATOM 0 HA ARG A 17 7.889 -10.086 1.894 1.00 0.00 H new ATOM 0 HB2 ARG A 17 8.487 -11.970 3.576 1.00 0.00 H new ATOM 0 HB3 ARG A 17 7.213 -12.207 2.396 1.00 0.00 H new ATOM 0 HG2 ARG A 17 8.452 -14.221 2.389 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.933 -13.384 0.927 1.00 0.00 H new ATOM 0 HD2 ARG A 17 10.918 -14.275 1.970 1.00 0.00 H new ATOM 0 HD3 ARG A 17 10.965 -12.529 2.112 1.00 0.00 H new ATOM 0 HE ARG A 17 9.814 -13.196 4.481 1.00 0.00 H new ATOM 0 HH11 ARG A 17 12.633 -14.483 2.777 1.00 0.00 H new ATOM 0 HH12 ARG A 17 13.461 -14.950 4.266 1.00 0.00 H new ATOM 0 HH21 ARG A 17 10.860 -13.826 6.375 1.00 0.00 H new ATOM 0 HH22 ARG A 17 12.457 -14.578 6.301 1.00 0.00 H new ATOM 202 N THR A 18 10.959 -9.932 1.584 1.00 0.00 N ATOM 203 CA THR A 18 12.149 -9.200 1.978 1.00 0.00 C ATOM 204 C THR A 18 12.877 -8.649 0.747 1.00 0.00 C ATOM 205 O THR A 18 13.571 -7.640 0.834 1.00 0.00 O ATOM 206 CB THR A 18 13.098 -10.074 2.828 1.00 0.00 C ATOM 207 OG1 THR A 18 14.270 -9.337 3.201 1.00 0.00 O ATOM 208 CG2 THR A 18 13.502 -11.339 2.081 1.00 0.00 C ATOM 0 H THR A 18 10.965 -10.242 0.612 1.00 0.00 H new ATOM 0 HA THR A 18 11.831 -8.361 2.597 1.00 0.00 H new ATOM 0 HB THR A 18 12.557 -10.362 3.729 1.00 0.00 H new ATOM 0 HG1 THR A 18 14.857 -9.907 3.740 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.170 -11.933 2.705 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.612 -11.922 1.845 1.00 0.00 H new ATOM 0 HG23 THR A 18 14.014 -11.068 1.158 1.00 0.00 H new ATOM 216 N SER A 19 12.687 -9.293 -0.412 1.00 0.00 N ATOM 217 CA SER A 19 13.288 -8.819 -1.661 1.00 0.00 C ATOM 218 C SER A 19 12.486 -7.669 -2.255 1.00 0.00 C ATOM 219 O SER A 19 12.764 -7.210 -3.363 1.00 0.00 O ATOM 220 CB SER A 19 13.389 -9.951 -2.683 1.00 0.00 C ATOM 221 OG SER A 19 14.166 -9.576 -3.809 1.00 0.00 O ATOM 0 H SER A 19 12.125 -10.139 -0.509 1.00 0.00 H new ATOM 0 HA SER A 19 14.291 -8.463 -1.424 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.832 -10.828 -2.211 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.389 -10.236 -3.010 1.00 0.00 H new ATOM 0 HG SER A 19 13.874 -8.698 -4.130 1.00 0.00 H new ATOM 227 N MET A 20 11.492 -7.205 -1.517 1.00 0.00 N ATOM 228 CA MET A 20 10.660 -6.112 -1.978 1.00 0.00 C ATOM 229 C MET A 20 10.247 -5.219 -0.831 1.00 0.00 C ATOM 230 O MET A 20 9.125 -4.723 -0.797 1.00 0.00 O ATOM 231 CB MET A 20 9.430 -6.645 -2.697 1.00 0.00 C ATOM 232 CG MET A 20 9.709 -7.033 -4.133 1.00 0.00 C ATOM 233 SD MET A 20 9.769 -5.608 -5.240 1.00 0.00 S ATOM 234 CE MET A 20 10.224 -6.392 -6.787 1.00 0.00 C ATOM 0 H MET A 20 11.243 -7.569 -0.597 1.00 0.00 H new ATOM 0 HA MET A 20 11.247 -5.517 -2.678 1.00 0.00 H new ATOM 0 HB2 MET A 20 9.049 -7.513 -2.159 1.00 0.00 H new ATOM 0 HB3 MET A 20 8.647 -5.887 -2.676 1.00 0.00 H new ATOM 0 HG2 MET A 20 10.658 -7.567 -4.183 1.00 0.00 H new ATOM 0 HG3 MET A 20 8.937 -7.722 -4.476 1.00 0.00 H new ATOM 0 HE1 MET A 20 10.300 -5.637 -7.569 1.00 0.00 H new ATOM 0 HE2 MET A 20 11.185 -6.893 -6.672 1.00 0.00 H new ATOM 0 HE3 MET A 20 9.464 -7.123 -7.062 1.00 0.00 H new ATOM 244 N THR A 21 11.154 -5.014 0.111 1.00 0.00 N ATOM 245 CA THR A 21 10.900 -4.071 1.171 1.00 0.00 C ATOM 246 C THR A 21 11.304 -2.684 0.705 1.00 0.00 C ATOM 247 O THR A 21 12.485 -2.398 0.515 1.00 0.00 O ATOM 248 CB THR A 21 11.658 -4.440 2.464 1.00 0.00 C ATOM 249 OG1 THR A 21 11.177 -5.694 2.962 1.00 0.00 O ATOM 250 CG2 THR A 21 11.484 -3.357 3.531 1.00 0.00 C ATOM 0 H THR A 21 12.058 -5.484 0.158 1.00 0.00 H new ATOM 0 HA THR A 21 9.836 -4.094 1.404 1.00 0.00 H new ATOM 0 HB THR A 21 12.720 -4.521 2.230 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.660 -5.927 3.782 1.00 0.00 H new ATOM 0 HG21 THR A 21 12.028 -3.642 4.431 1.00 0.00 H new ATOM 0 HG22 THR A 21 11.874 -2.411 3.156 1.00 0.00 H new ATOM 0 HG23 THR A 21 10.426 -3.245 3.767 1.00 0.00 H new ATOM 258 N GLU A 22 10.312 -1.832 0.537 1.00 0.00 N ATOM 259 CA GLU A 22 10.519 -0.490 0.034 1.00 0.00 C ATOM 260 C GLU A 22 9.965 0.506 1.029 1.00 0.00 C ATOM 261 O GLU A 22 8.778 0.470 1.349 1.00 0.00 O ATOM 262 CB GLU A 22 9.829 -0.341 -1.333 1.00 0.00 C ATOM 263 CG GLU A 22 9.945 1.040 -1.970 1.00 0.00 C ATOM 264 CD GLU A 22 9.908 0.969 -3.486 1.00 0.00 C ATOM 265 OE1 GLU A 22 10.952 0.635 -4.090 1.00 0.00 O ATOM 266 OE2 GLU A 22 8.844 1.224 -4.078 1.00 0.00 O ATOM 0 H GLU A 22 9.338 -2.052 0.746 1.00 0.00 H new ATOM 0 HA GLU A 22 11.584 -0.299 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 22 10.251 -1.076 -2.018 1.00 0.00 H new ATOM 0 HB3 GLU A 22 8.773 -0.583 -1.217 1.00 0.00 H new ATOM 0 HG2 GLU A 22 9.131 1.673 -1.616 1.00 0.00 H new ATOM 0 HG3 GLU A 22 10.875 1.510 -1.651 1.00 0.00 H new ATOM 273 N GLU A 23 10.817 1.373 1.548 1.00 0.00 N ATOM 274 CA GLU A 23 10.352 2.374 2.484 1.00 0.00 C ATOM 275 C GLU A 23 10.008 3.635 1.704 1.00 0.00 C ATOM 276 O GLU A 23 10.887 4.402 1.312 1.00 0.00 O ATOM 277 CB GLU A 23 11.421 2.658 3.543 1.00 0.00 C ATOM 278 CG GLU A 23 10.904 3.439 4.739 1.00 0.00 C ATOM 279 CD GLU A 23 10.173 2.567 5.741 1.00 0.00 C ATOM 280 OE1 GLU A 23 8.947 2.388 5.598 1.00 0.00 O ATOM 281 OE2 GLU A 23 10.824 2.063 6.682 1.00 0.00 O ATOM 0 H GLU A 23 11.815 1.403 1.341 1.00 0.00 H new ATOM 0 HA GLU A 23 9.466 2.014 3.006 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.836 1.712 3.890 1.00 0.00 H new ATOM 0 HB3 GLU A 23 12.237 3.214 3.082 1.00 0.00 H new ATOM 0 HG2 GLU A 23 11.741 3.931 5.235 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.233 4.225 4.391 1.00 0.00 H new ATOM 288 N TYR A 24 8.726 3.843 1.490 1.00 0.00 N ATOM 289 CA TYR A 24 8.261 4.884 0.595 1.00 0.00 C ATOM 290 C TYR A 24 8.001 6.171 1.357 1.00 0.00 C ATOM 291 O TYR A 24 7.435 6.153 2.448 1.00 0.00 O ATOM 292 CB TYR A 24 6.984 4.425 -0.111 1.00 0.00 C ATOM 293 CG TYR A 24 6.999 4.658 -1.600 1.00 0.00 C ATOM 294 CD1 TYR A 24 7.519 3.707 -2.468 1.00 0.00 C ATOM 295 CD2 TYR A 24 6.496 5.826 -2.139 1.00 0.00 C ATOM 296 CE1 TYR A 24 7.530 3.919 -3.833 1.00 0.00 C ATOM 297 CE2 TYR A 24 6.503 6.043 -3.499 1.00 0.00 C ATOM 298 CZ TYR A 24 7.022 5.091 -4.342 1.00 0.00 C ATOM 299 OH TYR A 24 7.030 5.314 -5.698 1.00 0.00 O ATOM 0 H TYR A 24 7.981 3.300 1.927 1.00 0.00 H new ATOM 0 HA TYR A 24 9.035 5.077 -0.148 1.00 0.00 H new ATOM 0 HB2 TYR A 24 6.835 3.362 0.080 1.00 0.00 H new ATOM 0 HB3 TYR A 24 6.132 4.949 0.321 1.00 0.00 H new ATOM 0 HD1 TYR A 24 7.921 2.787 -2.070 1.00 0.00 H new ATOM 0 HD2 TYR A 24 6.090 6.582 -1.483 1.00 0.00 H new ATOM 0 HE1 TYR A 24 7.935 3.169 -4.496 1.00 0.00 H new ATOM 0 HE2 TYR A 24 6.101 6.961 -3.902 1.00 0.00 H new ATOM 0 HH TYR A 24 6.960 4.458 -6.171 1.00 0.00 H new ATOM 309 N ARG A 25 8.428 7.284 0.787 1.00 0.00 N ATOM 310 CA ARG A 25 8.199 8.578 1.403 1.00 0.00 C ATOM 311 C ARG A 25 7.045 9.280 0.711 1.00 0.00 C ATOM 312 O ARG A 25 7.011 9.383 -0.516 1.00 0.00 O ATOM 313 CB ARG A 25 9.448 9.450 1.332 1.00 0.00 C ATOM 314 CG ARG A 25 10.733 8.725 1.691 1.00 0.00 C ATOM 315 CD ARG A 25 11.886 9.698 1.886 1.00 0.00 C ATOM 316 NE ARG A 25 11.781 10.874 1.021 1.00 0.00 N ATOM 317 CZ ARG A 25 12.800 11.383 0.333 1.00 0.00 C ATOM 318 NH1 ARG A 25 13.981 10.778 0.344 1.00 0.00 N ATOM 319 NH2 ARG A 25 12.635 12.489 -0.379 1.00 0.00 N ATOM 0 H ARG A 25 8.933 7.318 -0.098 1.00 0.00 H new ATOM 0 HA ARG A 25 7.954 8.416 2.453 1.00 0.00 H new ATOM 0 HB2 ARG A 25 9.540 9.852 0.323 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.323 10.300 2.003 1.00 0.00 H new ATOM 0 HG2 ARG A 25 10.584 8.148 2.604 1.00 0.00 H new ATOM 0 HG3 ARG A 25 10.984 8.015 0.903 1.00 0.00 H new ATOM 0 HD2 ARG A 25 11.914 10.019 2.927 1.00 0.00 H new ATOM 0 HD3 ARG A 25 12.827 9.186 1.685 1.00 0.00 H new ATOM 0 HE ARG A 25 10.872 11.331 0.941 1.00 0.00 H new ATOM 0 HH11 ARG A 25 14.110 9.920 0.881 1.00 0.00 H new ATOM 0 HH12 ARG A 25 14.760 11.171 -0.184 1.00 0.00 H new ATOM 0 HH21 ARG A 25 11.726 12.951 -0.400 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.417 12.878 -0.906 1.00 0.00 H new ATOM 333 N VAL A 26 6.101 9.749 1.498 1.00 0.00 N ATOM 334 CA VAL A 26 4.921 10.406 0.970 1.00 0.00 C ATOM 335 C VAL A 26 4.613 11.680 1.754 1.00 0.00 C ATOM 336 O VAL A 26 4.485 11.647 2.975 1.00 0.00 O ATOM 337 CB VAL A 26 3.706 9.442 0.987 1.00 0.00 C ATOM 338 CG1 VAL A 26 3.674 8.620 2.264 1.00 0.00 C ATOM 339 CG2 VAL A 26 2.404 10.202 0.819 1.00 0.00 C ATOM 0 H VAL A 26 6.127 9.687 2.516 1.00 0.00 H new ATOM 0 HA VAL A 26 5.120 10.686 -0.064 1.00 0.00 H new ATOM 0 HB VAL A 26 3.819 8.760 0.144 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.811 7.954 2.246 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.587 8.029 2.339 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.601 9.286 3.124 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.569 9.501 0.835 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.293 10.917 1.634 1.00 0.00 H new ATOM 0 HG23 VAL A 26 2.413 10.734 -0.132 1.00 0.00 H new ATOM 349 N PRO A 27 4.523 12.830 1.063 1.00 0.00 N ATOM 350 CA PRO A 27 4.200 14.113 1.697 1.00 0.00 C ATOM 351 C PRO A 27 2.887 14.047 2.467 1.00 0.00 C ATOM 352 O PRO A 27 1.939 13.412 2.012 1.00 0.00 O ATOM 353 CB PRO A 27 4.080 15.082 0.520 1.00 0.00 C ATOM 354 CG PRO A 27 4.879 14.456 -0.568 1.00 0.00 C ATOM 355 CD PRO A 27 4.734 12.971 -0.385 1.00 0.00 C ATOM 0 HA PRO A 27 4.954 14.410 2.426 1.00 0.00 H new ATOM 0 HB2 PRO A 27 3.040 15.215 0.221 1.00 0.00 H new ATOM 0 HB3 PRO A 27 4.466 16.068 0.778 1.00 0.00 H new ATOM 0 HG2 PRO A 27 4.515 14.766 -1.548 1.00 0.00 H new ATOM 0 HG3 PRO A 27 5.925 14.757 -0.507 1.00 0.00 H new ATOM 0 HD2 PRO A 27 3.893 12.575 -0.955 1.00 0.00 H new ATOM 0 HD3 PRO A 27 5.624 12.436 -0.716 1.00 0.00 H new ATOM 363 N ASP A 28 2.847 14.697 3.625 1.00 0.00 N ATOM 364 CA ASP A 28 1.739 14.558 4.580 1.00 0.00 C ATOM 365 C ASP A 28 0.360 14.682 3.913 1.00 0.00 C ATOM 366 O ASP A 28 -0.525 13.851 4.144 1.00 0.00 O ATOM 367 CB ASP A 28 1.891 15.598 5.693 1.00 0.00 C ATOM 368 CG ASP A 28 0.921 15.388 6.844 1.00 0.00 C ATOM 369 OD1 ASP A 28 -0.289 15.666 6.679 1.00 0.00 O ATOM 370 OD2 ASP A 28 1.371 14.939 7.922 1.00 0.00 O ATOM 0 H ASP A 28 3.579 15.337 3.934 1.00 0.00 H new ATOM 0 HA ASP A 28 1.791 13.553 5.000 1.00 0.00 H new ATOM 0 HB2 ASP A 28 2.911 15.565 6.075 1.00 0.00 H new ATOM 0 HB3 ASP A 28 1.739 16.593 5.275 1.00 0.00 H new ATOM 375 N GLY A 29 0.189 15.697 3.073 1.00 0.00 N ATOM 376 CA GLY A 29 -1.082 15.903 2.392 1.00 0.00 C ATOM 377 C GLY A 29 -1.422 14.777 1.434 1.00 0.00 C ATOM 378 O GLY A 29 -2.594 14.430 1.240 1.00 0.00 O ATOM 0 H GLY A 29 0.909 16.384 2.849 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -1.876 15.996 3.133 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.047 16.844 1.843 1.00 0.00 H new ATOM 382 N MET A 30 -0.396 14.171 0.862 1.00 0.00 N ATOM 383 CA MET A 30 -0.592 13.076 -0.073 1.00 0.00 C ATOM 384 C MET A 30 -0.904 11.805 0.695 1.00 0.00 C ATOM 385 O MET A 30 -1.379 10.828 0.129 1.00 0.00 O ATOM 386 CB MET A 30 0.639 12.869 -0.960 1.00 0.00 C ATOM 387 CG MET A 30 1.027 14.100 -1.760 1.00 0.00 C ATOM 388 SD MET A 30 -0.363 14.831 -2.646 1.00 0.00 S ATOM 389 CE MET A 30 -0.827 13.480 -3.724 1.00 0.00 C ATOM 0 H MET A 30 0.580 14.418 1.028 1.00 0.00 H new ATOM 0 HA MET A 30 -1.429 13.326 -0.724 1.00 0.00 H new ATOM 0 HB2 MET A 30 1.481 12.572 -0.335 1.00 0.00 H new ATOM 0 HB3 MET A 30 0.447 12.045 -1.647 1.00 0.00 H new ATOM 0 HG2 MET A 30 1.454 14.844 -1.087 1.00 0.00 H new ATOM 0 HG3 MET A 30 1.806 13.832 -2.474 1.00 0.00 H new ATOM 0 HE1 MET A 30 -1.286 13.878 -4.629 1.00 0.00 H new ATOM 0 HE2 MET A 30 0.060 12.905 -3.989 1.00 0.00 H new ATOM 0 HE3 MET A 30 -1.538 12.833 -3.211 1.00 0.00 H new ATOM 399 N VAL A 31 -0.640 11.833 1.994 1.00 0.00 N ATOM 400 CA VAL A 31 -1.039 10.748 2.875 1.00 0.00 C ATOM 401 C VAL A 31 -2.541 10.796 3.066 1.00 0.00 C ATOM 402 O VAL A 31 -3.212 9.768 3.068 1.00 0.00 O ATOM 403 CB VAL A 31 -0.355 10.835 4.249 1.00 0.00 C ATOM 404 CG1 VAL A 31 -0.605 9.571 5.058 1.00 0.00 C ATOM 405 CG2 VAL A 31 1.126 11.088 4.081 1.00 0.00 C ATOM 0 H VAL A 31 -0.151 12.597 2.460 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.733 9.811 2.410 1.00 0.00 H new ATOM 0 HB VAL A 31 -0.785 11.672 4.799 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -0.112 9.655 6.026 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -1.677 9.440 5.207 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -0.206 8.710 4.521 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.598 11.147 5.061 1.00 0.00 H new ATOM 0 HG22 VAL A 31 1.572 10.272 3.512 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.277 12.027 3.548 1.00 0.00 H new ATOM 415 N GLY A 32 -3.066 12.005 3.202 1.00 0.00 N ATOM 416 CA GLY A 32 -4.501 12.178 3.257 1.00 0.00 C ATOM 417 C GLY A 32 -5.166 11.669 1.996 1.00 0.00 C ATOM 418 O GLY A 32 -6.306 11.206 2.026 1.00 0.00 O ATOM 0 H GLY A 32 -2.525 12.866 3.275 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -4.900 11.647 4.121 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -4.737 13.233 3.394 1.00 0.00 H new ATOM 422 N LEU A 33 -4.448 11.741 0.883 1.00 0.00 N ATOM 423 CA LEU A 33 -4.967 11.236 -0.382 1.00 0.00 C ATOM 424 C LEU A 33 -4.670 9.747 -0.595 1.00 0.00 C ATOM 425 O LEU A 33 -5.387 9.081 -1.339 1.00 0.00 O ATOM 426 CB LEU A 33 -4.409 12.042 -1.554 1.00 0.00 C ATOM 427 CG LEU A 33 -4.857 13.501 -1.612 1.00 0.00 C ATOM 428 CD1 LEU A 33 -4.256 14.188 -2.825 1.00 0.00 C ATOM 429 CD2 LEU A 33 -6.374 13.591 -1.646 1.00 0.00 C ATOM 0 H LEU A 33 -3.511 12.141 0.829 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.050 11.351 -0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.320 12.015 -1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.701 11.552 -2.483 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.503 14.009 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.584 15.227 -2.854 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -3.168 14.152 -2.762 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.584 13.679 -3.731 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.676 14.638 -1.687 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.750 13.070 -2.527 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.786 13.130 -0.748 1.00 0.00 H new ATOM 441 N ILE A 34 -3.625 9.218 0.042 1.00 0.00 N ATOM 442 CA ILE A 34 -3.303 7.798 -0.106 1.00 0.00 C ATOM 443 C ILE A 34 -4.300 6.964 0.688 1.00 0.00 C ATOM 444 O ILE A 34 -4.565 5.801 0.371 1.00 0.00 O ATOM 445 CB ILE A 34 -1.848 7.456 0.324 1.00 0.00 C ATOM 446 CG1 ILE A 34 -1.463 6.059 -0.166 1.00 0.00 C ATOM 447 CG2 ILE A 34 -1.675 7.534 1.832 1.00 0.00 C ATOM 448 CD1 ILE A 34 -1.467 5.925 -1.673 1.00 0.00 C ATOM 0 H ILE A 34 -2.997 9.739 0.654 1.00 0.00 H new ATOM 0 HA ILE A 34 -3.375 7.559 -1.167 1.00 0.00 H new ATOM 0 HB ILE A 34 -1.191 8.196 -0.132 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.470 5.812 0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -2.155 5.331 0.257 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.646 7.289 2.093 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.905 8.543 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -2.350 6.826 2.313 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.185 4.909 -1.949 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -2.465 6.141 -2.055 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.754 6.629 -2.103 1.00 0.00 H new ATOM 460 N ILE A 35 -4.855 7.574 1.722 1.00 0.00 N ATOM 461 CA ILE A 35 -5.950 6.975 2.457 1.00 0.00 C ATOM 462 C ILE A 35 -7.277 7.355 1.818 1.00 0.00 C ATOM 463 O ILE A 35 -8.311 6.750 2.111 1.00 0.00 O ATOM 464 CB ILE A 35 -5.948 7.383 3.942 1.00 0.00 C ATOM 465 CG1 ILE A 35 -5.905 8.906 4.099 1.00 0.00 C ATOM 466 CG2 ILE A 35 -4.785 6.728 4.665 1.00 0.00 C ATOM 467 CD1 ILE A 35 -5.862 9.375 5.539 1.00 0.00 C ATOM 0 H ILE A 35 -4.562 8.487 2.070 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.816 5.894 2.414 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.877 7.034 4.393 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -5.029 9.291 3.576 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -6.781 9.336 3.613 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.795 7.025 5.714 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.876 5.644 4.594 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.848 7.044 4.208 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.833 10.464 5.566 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.750 9.022 6.063 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.972 8.976 6.025 1.00 0.00 H new ATOM 479 N GLY A 36 -7.224 8.374 0.955 1.00 0.00 N ATOM 480 CA GLY A 36 -8.369 8.785 0.153 1.00 0.00 C ATOM 481 C GLY A 36 -9.562 9.220 0.974 1.00 0.00 C ATOM 482 O GLY A 36 -9.741 10.403 1.260 1.00 0.00 O ATOM 0 H GLY A 36 -6.386 8.933 0.796 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.069 9.606 -0.499 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.665 7.958 -0.492 1.00 0.00 H new ATOM 486 N ARG A 37 -10.369 8.247 1.357 1.00 0.00 N ATOM 487 CA ARG A 37 -11.584 8.480 2.119 1.00 0.00 C ATOM 488 C ARG A 37 -11.278 8.656 3.604 1.00 0.00 C ATOM 489 O ARG A 37 -12.171 8.594 4.446 1.00 0.00 O ATOM 490 CB ARG A 37 -12.542 7.312 1.903 1.00 0.00 C ATOM 491 CG ARG A 37 -11.962 5.969 2.314 1.00 0.00 C ATOM 492 CD ARG A 37 -12.538 4.840 1.473 1.00 0.00 C ATOM 493 NE ARG A 37 -12.107 4.910 0.077 1.00 0.00 N ATOM 494 CZ ARG A 37 -12.019 3.855 -0.736 1.00 0.00 C ATOM 495 NH1 ARG A 37 -12.382 2.647 -0.315 1.00 0.00 N ATOM 496 NH2 ARG A 37 -11.589 4.015 -1.985 1.00 0.00 N ATOM 0 H ARG A 37 -10.198 7.264 1.146 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.049 9.402 1.770 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.456 7.493 2.469 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.821 7.271 0.850 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.878 5.990 2.206 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -12.174 5.786 3.367 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.234 3.883 1.897 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.627 4.877 1.517 1.00 0.00 H new ATOM 0 HE ARG A 37 -11.857 5.824 -0.300 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -12.731 2.522 0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -12.312 1.846 -0.942 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -11.327 4.942 -2.319 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -11.521 3.210 -2.608 1.00 0.00 H new ATOM 510 N GLY A 38 -10.006 8.861 3.912 1.00 0.00 N ATOM 511 CA GLY A 38 -9.607 9.147 5.272 1.00 0.00 C ATOM 512 C GLY A 38 -9.040 7.940 5.999 1.00 0.00 C ATOM 513 O GLY A 38 -8.936 7.944 7.226 1.00 0.00 O ATOM 0 H GLY A 38 -9.240 8.834 3.239 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.861 9.941 5.265 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -10.468 9.523 5.824 1.00 0.00 H new ATOM 517 N GLY A 39 -8.674 6.904 5.255 1.00 0.00 N ATOM 518 CA GLY A 39 -7.991 5.775 5.864 1.00 0.00 C ATOM 519 C GLY A 39 -8.295 4.456 5.188 1.00 0.00 C ATOM 520 O GLY A 39 -7.386 3.705 4.837 1.00 0.00 O ATOM 0 H GLY A 39 -8.835 6.823 4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -6.916 5.951 5.835 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.275 5.711 6.914 1.00 0.00 H new ATOM 524 N GLU A 40 -9.578 4.193 4.992 1.00 0.00 N ATOM 525 CA GLU A 40 -10.061 2.912 4.480 1.00 0.00 C ATOM 526 C GLU A 40 -9.356 2.470 3.195 1.00 0.00 C ATOM 527 O GLU A 40 -9.160 1.274 2.983 1.00 0.00 O ATOM 528 CB GLU A 40 -11.562 3.004 4.226 1.00 0.00 C ATOM 529 CG GLU A 40 -12.194 1.710 3.751 1.00 0.00 C ATOM 530 CD GLU A 40 -13.558 1.934 3.144 1.00 0.00 C ATOM 531 OE1 GLU A 40 -14.489 2.323 3.878 1.00 0.00 O ATOM 532 OE2 GLU A 40 -13.701 1.745 1.919 1.00 0.00 O ATOM 0 H GLU A 40 -10.321 4.865 5.184 1.00 0.00 H new ATOM 0 HA GLU A 40 -9.837 2.162 5.239 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -12.056 3.320 5.145 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -11.746 3.779 3.482 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -11.543 1.238 3.015 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -12.280 1.020 4.590 1.00 0.00 H new ATOM 539 N GLN A 41 -8.974 3.419 2.343 1.00 0.00 N ATOM 540 CA GLN A 41 -8.431 3.075 1.031 1.00 0.00 C ATOM 541 C GLN A 41 -7.164 2.239 1.149 1.00 0.00 C ATOM 542 O GLN A 41 -7.059 1.187 0.531 1.00 0.00 O ATOM 543 CB GLN A 41 -8.139 4.318 0.198 1.00 0.00 C ATOM 544 CG GLN A 41 -7.824 4.004 -1.253 1.00 0.00 C ATOM 545 CD GLN A 41 -7.429 5.231 -2.041 1.00 0.00 C ATOM 546 OE1 GLN A 41 -8.266 5.896 -2.649 1.00 0.00 O ATOM 547 NE2 GLN A 41 -6.149 5.546 -2.022 1.00 0.00 N ATOM 0 H GLN A 41 -9.029 4.419 2.534 1.00 0.00 H new ATOM 0 HA GLN A 41 -9.197 2.486 0.527 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -8.999 4.986 0.240 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.298 4.853 0.638 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.016 3.274 -1.296 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.695 3.543 -1.718 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.489 4.966 -1.504 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.819 6.370 -2.525 1.00 0.00 H new ATOM 556 N ILE A 42 -6.204 2.694 1.949 1.00 0.00 N ATOM 557 CA ILE A 42 -4.942 1.977 2.073 1.00 0.00 C ATOM 558 C ILE A 42 -5.169 0.598 2.676 1.00 0.00 C ATOM 559 O ILE A 42 -4.635 -0.389 2.180 1.00 0.00 O ATOM 560 CB ILE A 42 -3.886 2.757 2.893 1.00 0.00 C ATOM 561 CG1 ILE A 42 -2.566 1.982 2.948 1.00 0.00 C ATOM 562 CG2 ILE A 42 -4.378 3.066 4.300 1.00 0.00 C ATOM 563 CD1 ILE A 42 -1.911 1.798 1.595 1.00 0.00 C ATOM 0 H ILE A 42 -6.274 3.542 2.512 1.00 0.00 H new ATOM 0 HA ILE A 42 -4.542 1.869 1.065 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.717 3.707 2.386 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.875 2.506 3.608 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.748 1.002 3.390 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -3.608 3.614 4.843 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.283 3.671 4.244 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -4.596 2.134 4.822 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -0.982 1.241 1.713 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.583 1.247 0.937 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.696 2.774 1.159 1.00 0.00 H new ATOM 575 N ASN A 43 -6.000 0.533 3.713 1.00 0.00 N ATOM 576 CA ASN A 43 -6.302 -0.735 4.369 1.00 0.00 C ATOM 577 C ASN A 43 -6.973 -1.678 3.386 1.00 0.00 C ATOM 578 O ASN A 43 -6.732 -2.877 3.402 1.00 0.00 O ATOM 579 CB ASN A 43 -7.200 -0.532 5.597 1.00 0.00 C ATOM 580 CG ASN A 43 -6.615 0.460 6.593 1.00 0.00 C ATOM 581 OD1 ASN A 43 -5.398 0.578 6.725 1.00 0.00 O ATOM 582 ND2 ASN A 43 -7.470 1.186 7.301 1.00 0.00 N ATOM 0 H ASN A 43 -6.475 1.341 4.116 1.00 0.00 H new ATOM 0 HA ASN A 43 -5.362 -1.171 4.709 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.179 -0.180 5.272 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -7.354 -1.491 6.092 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -7.123 1.866 7.978 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -8.474 1.065 7.168 1.00 0.00 H new ATOM 589 N LYS A 44 -7.804 -1.116 2.519 1.00 0.00 N ATOM 590 CA LYS A 44 -8.444 -1.879 1.458 1.00 0.00 C ATOM 591 C LYS A 44 -7.398 -2.395 0.479 1.00 0.00 C ATOM 592 O LYS A 44 -7.330 -3.585 0.195 1.00 0.00 O ATOM 593 CB LYS A 44 -9.465 -1.005 0.712 1.00 0.00 C ATOM 594 CG LYS A 44 -10.059 -1.672 -0.523 1.00 0.00 C ATOM 595 CD LYS A 44 -10.797 -2.954 -0.173 1.00 0.00 C ATOM 596 CE LYS A 44 -11.135 -3.756 -1.420 1.00 0.00 C ATOM 597 NZ LYS A 44 -11.806 -5.041 -1.089 1.00 0.00 N ATOM 0 H LYS A 44 -8.052 -0.127 2.531 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.963 -2.726 1.906 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -10.272 -0.742 1.395 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -8.983 -0.074 0.414 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.744 -0.981 -1.015 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -9.263 -1.893 -1.235 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.183 -3.558 0.495 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.713 -2.713 0.366 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -11.783 -3.165 -2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -10.222 -3.957 -1.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -12.019 -5.557 -1.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -11.178 -5.617 -0.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -12.690 -4.849 -0.577 1.00 0.00 H new ATOM 611 N ILE A 45 -6.577 -1.479 -0.008 1.00 0.00 N ATOM 612 CA ILE A 45 -5.582 -1.771 -1.030 1.00 0.00 C ATOM 613 C ILE A 45 -4.580 -2.831 -0.569 1.00 0.00 C ATOM 614 O ILE A 45 -4.327 -3.807 -1.284 1.00 0.00 O ATOM 615 CB ILE A 45 -4.845 -0.470 -1.452 1.00 0.00 C ATOM 616 CG1 ILE A 45 -5.557 0.195 -2.638 1.00 0.00 C ATOM 617 CG2 ILE A 45 -3.382 -0.733 -1.794 1.00 0.00 C ATOM 618 CD1 ILE A 45 -7.033 0.459 -2.422 1.00 0.00 C ATOM 0 H ILE A 45 -6.581 -0.505 0.296 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.108 -2.178 -1.893 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.870 0.208 -0.599 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.061 1.140 -2.859 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -5.440 -0.439 -3.517 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.902 0.202 -2.084 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.873 -1.147 -0.923 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -3.323 -1.442 -2.620 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -7.452 0.930 -3.311 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -7.547 -0.483 -2.234 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -7.163 1.121 -1.565 1.00 0.00 H new ATOM 630 N GLN A 46 -4.032 -2.655 0.626 1.00 0.00 N ATOM 631 CA GLN A 46 -2.996 -3.551 1.116 1.00 0.00 C ATOM 632 C GLN A 46 -3.581 -4.905 1.515 1.00 0.00 C ATOM 633 O GLN A 46 -2.955 -5.945 1.310 1.00 0.00 O ATOM 634 CB GLN A 46 -2.213 -2.896 2.264 1.00 0.00 C ATOM 635 CG GLN A 46 -3.038 -2.503 3.473 1.00 0.00 C ATOM 636 CD GLN A 46 -3.038 -3.555 4.562 1.00 0.00 C ATOM 637 OE1 GLN A 46 -2.959 -4.754 4.307 1.00 0.00 O ATOM 638 NE2 GLN A 46 -3.095 -3.114 5.794 1.00 0.00 N ATOM 0 H GLN A 46 -4.286 -1.905 1.269 1.00 0.00 H new ATOM 0 HA GLN A 46 -2.291 -3.739 0.307 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.431 -3.584 2.587 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.715 -2.006 1.880 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -2.652 -1.568 3.880 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -4.065 -2.314 3.159 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -3.160 -2.112 5.975 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -3.074 -3.772 6.573 1.00 0.00 H new ATOM 647 N GLN A 47 -4.800 -4.894 2.039 1.00 0.00 N ATOM 648 CA GLN A 47 -5.444 -6.119 2.499 1.00 0.00 C ATOM 649 C GLN A 47 -5.964 -6.927 1.314 1.00 0.00 C ATOM 650 O GLN A 47 -5.872 -8.154 1.291 1.00 0.00 O ATOM 651 CB GLN A 47 -6.584 -5.771 3.455 1.00 0.00 C ATOM 652 CG GLN A 47 -7.191 -6.961 4.166 1.00 0.00 C ATOM 653 CD GLN A 47 -6.175 -7.733 4.984 1.00 0.00 C ATOM 654 OE1 GLN A 47 -5.529 -8.652 4.485 1.00 0.00 O ATOM 655 NE2 GLN A 47 -6.025 -7.367 6.247 1.00 0.00 N ATOM 0 H GLN A 47 -5.363 -4.051 2.156 1.00 0.00 H new ATOM 0 HA GLN A 47 -4.712 -6.729 3.028 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -6.214 -5.068 4.201 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -7.367 -5.259 2.896 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -7.993 -6.618 4.820 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -7.642 -7.628 3.431 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -6.580 -6.599 6.625 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.355 -7.853 6.843 1.00 0.00 H new ATOM 664 N ASP A 48 -6.505 -6.225 0.329 1.00 0.00 N ATOM 665 CA ASP A 48 -7.012 -6.851 -0.888 1.00 0.00 C ATOM 666 C ASP A 48 -5.893 -7.547 -1.648 1.00 0.00 C ATOM 667 O ASP A 48 -6.083 -8.631 -2.205 1.00 0.00 O ATOM 668 CB ASP A 48 -7.679 -5.798 -1.777 1.00 0.00 C ATOM 669 CG ASP A 48 -7.960 -6.301 -3.177 1.00 0.00 C ATOM 670 OD1 ASP A 48 -8.903 -7.095 -3.350 1.00 0.00 O ATOM 671 OD2 ASP A 48 -7.244 -5.887 -4.114 1.00 0.00 O ATOM 0 H ASP A 48 -6.606 -5.210 0.348 1.00 0.00 H new ATOM 0 HA ASP A 48 -7.750 -7.602 -0.607 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -8.614 -5.480 -1.316 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -7.037 -4.919 -1.834 1.00 0.00 H new ATOM 676 N SER A 49 -4.722 -6.933 -1.660 1.00 0.00 N ATOM 677 CA SER A 49 -3.581 -7.505 -2.345 1.00 0.00 C ATOM 678 C SER A 49 -2.913 -8.569 -1.479 1.00 0.00 C ATOM 679 O SER A 49 -2.584 -9.661 -1.951 1.00 0.00 O ATOM 680 CB SER A 49 -2.585 -6.403 -2.719 1.00 0.00 C ATOM 681 OG SER A 49 -2.262 -5.602 -1.594 1.00 0.00 O ATOM 0 H SER A 49 -4.539 -6.040 -1.203 1.00 0.00 H new ATOM 0 HA SER A 49 -3.926 -7.985 -3.261 1.00 0.00 H new ATOM 0 HB2 SER A 49 -1.677 -6.851 -3.123 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.008 -5.778 -3.505 1.00 0.00 H new ATOM 0 HG SER A 49 -2.904 -4.865 -1.522 1.00 0.00 H new ATOM 687 N GLY A 50 -2.750 -8.258 -0.200 1.00 0.00 N ATOM 688 CA GLY A 50 -2.090 -9.168 0.714 1.00 0.00 C ATOM 689 C GLY A 50 -0.722 -8.664 1.107 1.00 0.00 C ATOM 690 O GLY A 50 0.056 -9.375 1.744 1.00 0.00 O ATOM 0 H GLY A 50 -3.066 -7.385 0.223 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.702 -9.296 1.607 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -1.997 -10.149 0.248 1.00 0.00 H new ATOM 694 N CYS A 51 -0.426 -7.435 0.719 1.00 0.00 N ATOM 695 CA CYS A 51 0.851 -6.824 1.027 1.00 0.00 C ATOM 696 C CYS A 51 0.773 -6.091 2.352 1.00 0.00 C ATOM 697 O CYS A 51 -0.163 -5.337 2.603 1.00 0.00 O ATOM 698 CB CYS A 51 1.263 -5.864 -0.088 1.00 0.00 C ATOM 699 SG CYS A 51 2.808 -4.976 0.217 1.00 0.00 S ATOM 0 H CYS A 51 -1.060 -6.839 0.186 1.00 0.00 H new ATOM 0 HA CYS A 51 1.604 -7.608 1.105 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.360 -6.426 -1.017 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.465 -5.137 -0.237 1.00 0.00 H new ATOM 0 HG CYS A 51 3.312 -5.359 1.352 1.00 0.00 H new ATOM 705 N LYS A 52 1.762 -6.321 3.195 1.00 0.00 N ATOM 706 CA LYS A 52 1.820 -5.698 4.503 1.00 0.00 C ATOM 707 C LYS A 52 2.340 -4.273 4.386 1.00 0.00 C ATOM 708 O LYS A 52 3.518 -4.000 4.623 1.00 0.00 O ATOM 709 CB LYS A 52 2.714 -6.527 5.421 1.00 0.00 C ATOM 710 CG LYS A 52 2.210 -7.947 5.610 1.00 0.00 C ATOM 711 CD LYS A 52 3.286 -8.851 6.183 1.00 0.00 C ATOM 712 CE LYS A 52 4.437 -9.034 5.206 1.00 0.00 C ATOM 713 NZ LYS A 52 5.501 -9.905 5.772 1.00 0.00 N ATOM 0 H LYS A 52 2.545 -6.943 2.993 1.00 0.00 H new ATOM 0 HA LYS A 52 0.818 -5.657 4.929 1.00 0.00 H new ATOM 0 HB2 LYS A 52 3.722 -6.556 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 52 2.781 -6.038 6.393 1.00 0.00 H new ATOM 0 HG2 LYS A 52 1.347 -7.942 6.275 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.872 -8.344 4.653 1.00 0.00 H new ATOM 0 HD2 LYS A 52 3.661 -8.427 7.114 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.855 -9.822 6.426 1.00 0.00 H new ATOM 0 HE2 LYS A 52 4.063 -9.470 4.280 1.00 0.00 H new ATOM 0 HE3 LYS A 52 4.858 -8.061 4.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.270 -10.008 5.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 5.874 -9.476 6.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.104 -10.841 5.990 1.00 0.00 H new ATOM 727 N VAL A 53 1.451 -3.382 3.985 1.00 0.00 N ATOM 728 CA VAL A 53 1.782 -1.978 3.819 1.00 0.00 C ATOM 729 C VAL A 53 1.599 -1.240 5.135 1.00 0.00 C ATOM 730 O VAL A 53 0.478 -1.022 5.594 1.00 0.00 O ATOM 731 CB VAL A 53 0.911 -1.328 2.725 1.00 0.00 C ATOM 732 CG1 VAL A 53 1.302 0.120 2.495 1.00 0.00 C ATOM 733 CG2 VAL A 53 1.017 -2.114 1.432 1.00 0.00 C ATOM 0 H VAL A 53 0.481 -3.610 3.766 1.00 0.00 H new ATOM 0 HA VAL A 53 2.825 -1.910 3.510 1.00 0.00 H new ATOM 0 HB VAL A 53 -0.124 -1.345 3.067 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.669 0.549 1.718 1.00 0.00 H new ATOM 0 HG12 VAL A 53 1.173 0.683 3.420 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.345 0.170 2.182 1.00 0.00 H new ATOM 0 HG21 VAL A 53 0.397 -1.644 0.669 1.00 0.00 H new ATOM 0 HG22 VAL A 53 2.055 -2.128 1.099 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.675 -3.136 1.598 1.00 0.00 H new ATOM 743 N GLN A 54 2.710 -0.871 5.745 1.00 0.00 N ATOM 744 CA GLN A 54 2.690 -0.236 7.051 1.00 0.00 C ATOM 745 C GLN A 54 2.795 1.275 6.940 1.00 0.00 C ATOM 746 O GLN A 54 3.842 1.814 6.575 1.00 0.00 O ATOM 747 CB GLN A 54 3.818 -0.791 7.921 1.00 0.00 C ATOM 748 CG GLN A 54 3.465 -2.118 8.568 1.00 0.00 C ATOM 749 CD GLN A 54 2.482 -1.951 9.710 1.00 0.00 C ATOM 750 OE1 GLN A 54 2.878 -1.863 10.871 1.00 0.00 O ATOM 751 NE2 GLN A 54 1.202 -1.848 9.385 1.00 0.00 N ATOM 0 H GLN A 54 3.643 -1.001 5.355 1.00 0.00 H new ATOM 0 HA GLN A 54 1.733 -0.463 7.521 1.00 0.00 H new ATOM 0 HB2 GLN A 54 4.713 -0.916 7.311 1.00 0.00 H new ATOM 0 HB3 GLN A 54 4.061 -0.066 8.698 1.00 0.00 H new ATOM 0 HG2 GLN A 54 3.039 -2.785 7.818 1.00 0.00 H new ATOM 0 HG3 GLN A 54 4.373 -2.593 8.938 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.916 -1.927 8.409 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.503 -1.690 10.111 1.00 0.00 H new ATOM 760 N ILE A 55 1.699 1.952 7.253 1.00 0.00 N ATOM 761 CA ILE A 55 1.677 3.399 7.263 1.00 0.00 C ATOM 762 C ILE A 55 2.292 3.902 8.563 1.00 0.00 C ATOM 763 O ILE A 55 1.743 3.676 9.642 1.00 0.00 O ATOM 764 CB ILE A 55 0.237 3.955 7.128 1.00 0.00 C ATOM 765 CG1 ILE A 55 -0.430 3.456 5.840 1.00 0.00 C ATOM 766 CG2 ILE A 55 0.240 5.476 7.164 1.00 0.00 C ATOM 767 CD1 ILE A 55 0.259 3.905 4.570 1.00 0.00 C ATOM 0 H ILE A 55 0.812 1.515 7.504 1.00 0.00 H new ATOM 0 HA ILE A 55 2.253 3.750 6.407 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.341 3.588 7.976 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -0.460 2.367 5.858 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -1.463 3.803 5.821 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -0.781 5.844 7.068 1.00 0.00 H new ATOM 0 HG22 ILE A 55 0.661 5.817 8.110 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.843 5.858 6.340 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.276 3.509 3.707 1.00 0.00 H new ATOM 0 HD12 ILE A 55 0.265 4.994 4.525 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.284 3.536 4.562 1.00 0.00 H new ATOM 779 N SER A 56 3.440 4.550 8.464 1.00 0.00 N ATOM 780 CA SER A 56 4.124 5.063 9.640 1.00 0.00 C ATOM 781 C SER A 56 3.946 6.574 9.749 1.00 0.00 C ATOM 782 O SER A 56 4.632 7.338 9.059 1.00 0.00 O ATOM 783 CB SER A 56 5.610 4.708 9.579 1.00 0.00 C ATOM 784 OG SER A 56 5.788 3.311 9.394 1.00 0.00 O ATOM 0 H SER A 56 3.918 4.734 7.582 1.00 0.00 H new ATOM 0 HA SER A 56 3.686 4.601 10.525 1.00 0.00 H new ATOM 0 HB2 SER A 56 6.085 5.251 8.762 1.00 0.00 H new ATOM 0 HB3 SER A 56 6.102 5.023 10.499 1.00 0.00 H new ATOM 0 HG SER A 56 6.745 3.105 9.356 1.00 0.00 H new ATOM 790 N PRO A 57 2.996 7.019 10.602 1.00 0.00 N ATOM 791 CA PRO A 57 2.771 8.441 10.869 1.00 0.00 C ATOM 792 C PRO A 57 3.934 9.039 11.641 1.00 0.00 C ATOM 793 O PRO A 57 4.249 10.222 11.510 1.00 0.00 O ATOM 794 CB PRO A 57 1.493 8.462 11.711 1.00 0.00 C ATOM 795 CG PRO A 57 1.425 7.112 12.339 1.00 0.00 C ATOM 796 CD PRO A 57 2.074 6.162 11.371 1.00 0.00 C ATOM 0 HA PRO A 57 2.683 9.029 9.955 1.00 0.00 H new ATOM 0 HB2 PRO A 57 1.530 9.247 12.466 1.00 0.00 H new ATOM 0 HB3 PRO A 57 0.616 8.655 11.093 1.00 0.00 H new ATOM 0 HG2 PRO A 57 1.942 7.103 13.298 1.00 0.00 H new ATOM 0 HG3 PRO A 57 0.391 6.825 12.532 1.00 0.00 H new ATOM 0 HD2 PRO A 57 2.607 5.365 11.889 1.00 0.00 H new ATOM 0 HD3 PRO A 57 1.338 5.685 10.724 1.00 0.00 H new ATOM 804 N ASP A 58 4.564 8.203 12.450 1.00 0.00 N ATOM 805 CA ASP A 58 5.784 8.576 13.136 1.00 0.00 C ATOM 806 C ASP A 58 6.959 8.129 12.286 1.00 0.00 C ATOM 807 O ASP A 58 7.552 7.072 12.515 1.00 0.00 O ATOM 808 CB ASP A 58 5.843 7.931 14.524 1.00 0.00 C ATOM 809 CG ASP A 58 6.978 8.468 15.373 1.00 0.00 C ATOM 810 OD1 ASP A 58 6.942 9.667 15.726 1.00 0.00 O ATOM 811 OD2 ASP A 58 7.888 7.687 15.723 1.00 0.00 O ATOM 0 H ASP A 58 4.245 7.254 12.647 1.00 0.00 H new ATOM 0 HA ASP A 58 5.817 9.656 13.278 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.898 8.101 15.039 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.956 6.852 14.414 1.00 0.00 H new ATOM 816 N SER A 59 7.255 8.919 11.270 1.00 0.00 N ATOM 817 CA SER A 59 8.277 8.579 10.303 1.00 0.00 C ATOM 818 C SER A 59 9.661 8.724 10.924 1.00 0.00 C ATOM 819 O SER A 59 10.570 7.941 10.644 1.00 0.00 O ATOM 820 CB SER A 59 8.137 9.482 9.078 1.00 0.00 C ATOM 821 OG SER A 59 6.771 9.713 8.776 1.00 0.00 O ATOM 0 H SER A 59 6.794 9.812 11.094 1.00 0.00 H new ATOM 0 HA SER A 59 8.152 7.541 9.994 1.00 0.00 H new ATOM 0 HB2 SER A 59 8.639 10.432 9.262 1.00 0.00 H new ATOM 0 HB3 SER A 59 8.630 9.021 8.222 1.00 0.00 H new ATOM 0 HG SER A 59 6.654 10.640 8.480 1.00 0.00 H new ATOM 827 N GLY A 60 9.812 9.735 11.772 1.00 0.00 N ATOM 828 CA GLY A 60 11.049 9.911 12.505 1.00 0.00 C ATOM 829 C GLY A 60 12.129 10.583 11.683 1.00 0.00 C ATOM 830 O GLY A 60 12.494 11.732 11.938 1.00 0.00 O ATOM 0 H GLY A 60 9.097 10.437 11.964 1.00 0.00 H new ATOM 0 HA2 GLY A 60 10.855 10.506 13.398 1.00 0.00 H new ATOM 0 HA3 GLY A 60 11.408 8.938 12.842 1.00 0.00 H new ATOM 834 N GLY A 61 12.637 9.868 10.689 1.00 0.00 N ATOM 835 CA GLY A 61 13.695 10.397 9.851 1.00 0.00 C ATOM 836 C GLY A 61 13.163 11.294 8.758 1.00 0.00 C ATOM 837 O GLY A 61 13.929 11.897 8.007 1.00 0.00 O ATOM 0 H GLY A 61 12.333 8.925 10.447 1.00 0.00 H new ATOM 0 HA2 GLY A 61 14.399 10.956 10.467 1.00 0.00 H new ATOM 0 HA3 GLY A 61 14.249 9.572 9.404 1.00 0.00 H new ATOM 841 N LEU A 62 11.848 11.387 8.673 1.00 0.00 N ATOM 842 CA LEU A 62 11.204 12.149 7.618 1.00 0.00 C ATOM 843 C LEU A 62 10.229 13.157 8.216 1.00 0.00 C ATOM 844 O LEU A 62 9.601 12.888 9.239 1.00 0.00 O ATOM 845 CB LEU A 62 10.444 11.199 6.682 1.00 0.00 C ATOM 846 CG LEU A 62 11.260 10.036 6.111 1.00 0.00 C ATOM 847 CD1 LEU A 62 10.398 9.190 5.193 1.00 0.00 C ATOM 848 CD2 LEU A 62 12.491 10.544 5.377 1.00 0.00 C ATOM 0 H LEU A 62 11.202 10.942 9.325 1.00 0.00 H new ATOM 0 HA LEU A 62 11.969 12.683 7.055 1.00 0.00 H new ATOM 0 HB2 LEU A 62 9.592 10.789 7.224 1.00 0.00 H new ATOM 0 HB3 LEU A 62 10.044 11.780 5.851 1.00 0.00 H new ATOM 0 HG LEU A 62 11.598 9.414 6.940 1.00 0.00 H new ATOM 0 HD11 LEU A 62 10.991 8.367 4.794 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.553 8.790 5.754 1.00 0.00 H new ATOM 0 HD13 LEU A 62 10.030 9.804 4.371 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.053 9.698 4.981 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.184 11.192 4.556 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.120 11.107 6.067 1.00 0.00 H new ATOM 860 N PRO A 63 10.115 14.345 7.596 1.00 0.00 N ATOM 861 CA PRO A 63 9.094 15.333 7.959 1.00 0.00 C ATOM 862 C PRO A 63 7.762 14.954 7.336 1.00 0.00 C ATOM 863 O PRO A 63 6.695 15.393 7.757 1.00 0.00 O ATOM 864 CB PRO A 63 9.631 16.614 7.332 1.00 0.00 C ATOM 865 CG PRO A 63 10.333 16.140 6.111 1.00 0.00 C ATOM 866 CD PRO A 63 10.972 14.829 6.492 1.00 0.00 C ATOM 0 HA PRO A 63 8.922 15.416 9.032 1.00 0.00 H new ATOM 0 HB2 PRO A 63 8.827 17.308 7.088 1.00 0.00 H new ATOM 0 HB3 PRO A 63 10.309 17.137 8.007 1.00 0.00 H new ATOM 0 HG2 PRO A 63 9.635 16.010 5.284 1.00 0.00 H new ATOM 0 HG3 PRO A 63 11.083 16.861 5.785 1.00 0.00 H new ATOM 0 HD2 PRO A 63 10.986 14.130 5.656 1.00 0.00 H new ATOM 0 HD3 PRO A 63 12.005 14.963 6.813 1.00 0.00 H new ATOM 874 N GLU A 64 7.868 14.117 6.318 1.00 0.00 N ATOM 875 CA GLU A 64 6.732 13.589 5.604 1.00 0.00 C ATOM 876 C GLU A 64 6.352 12.244 6.202 1.00 0.00 C ATOM 877 O GLU A 64 6.754 11.924 7.319 1.00 0.00 O ATOM 878 CB GLU A 64 7.088 13.463 4.118 1.00 0.00 C ATOM 879 CG GLU A 64 8.434 12.792 3.875 1.00 0.00 C ATOM 880 CD GLU A 64 9.101 13.267 2.599 1.00 0.00 C ATOM 881 OE1 GLU A 64 9.436 14.466 2.514 1.00 0.00 O ATOM 882 OE2 GLU A 64 9.304 12.448 1.680 1.00 0.00 O ATOM 0 H GLU A 64 8.764 13.783 5.963 1.00 0.00 H new ATOM 0 HA GLU A 64 5.875 14.257 5.694 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.309 12.893 3.612 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.099 14.456 3.669 1.00 0.00 H new ATOM 0 HG2 GLU A 64 9.093 12.991 4.720 1.00 0.00 H new ATOM 0 HG3 GLU A 64 8.294 11.712 3.827 1.00 0.00 H new ATOM 889 N ARG A 65 5.596 11.459 5.470 1.00 0.00 N ATOM 890 CA ARG A 65 5.141 10.173 5.956 1.00 0.00 C ATOM 891 C ARG A 65 6.012 9.062 5.391 1.00 0.00 C ATOM 892 O ARG A 65 6.490 9.166 4.259 1.00 0.00 O ATOM 893 CB ARG A 65 3.693 9.956 5.541 1.00 0.00 C ATOM 894 CG ARG A 65 3.005 8.828 6.275 1.00 0.00 C ATOM 895 CD ARG A 65 2.804 9.201 7.724 1.00 0.00 C ATOM 896 NE ARG A 65 1.758 10.205 7.894 1.00 0.00 N ATOM 897 CZ ARG A 65 1.992 11.471 8.230 1.00 0.00 C ATOM 898 NH1 ARG A 65 3.226 11.866 8.527 1.00 0.00 N ATOM 899 NH2 ARG A 65 0.989 12.330 8.292 1.00 0.00 N ATOM 0 H ARG A 65 5.280 11.689 4.528 1.00 0.00 H new ATOM 0 HA ARG A 65 5.213 10.157 7.044 1.00 0.00 H new ATOM 0 HB2 ARG A 65 3.136 10.878 5.708 1.00 0.00 H new ATOM 0 HB3 ARG A 65 3.659 9.753 4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 65 2.043 8.614 5.809 1.00 0.00 H new ATOM 0 HG3 ARG A 65 3.603 7.919 6.204 1.00 0.00 H new ATOM 0 HD2 ARG A 65 2.546 8.309 8.295 1.00 0.00 H new ATOM 0 HD3 ARG A 65 3.740 9.581 8.133 1.00 0.00 H new ATOM 0 HE ARG A 65 0.790 9.919 7.746 1.00 0.00 H new ATOM 0 HH11 ARG A 65 3.996 11.198 8.498 1.00 0.00 H new ATOM 0 HH12 ARG A 65 3.403 12.837 8.784 1.00 0.00 H new ATOM 0 HH21 ARG A 65 0.040 12.021 8.083 1.00 0.00 H new ATOM 0 HH22 ARG A 65 1.165 13.301 8.549 1.00 0.00 H new ATOM 913 N SER A 66 6.227 8.007 6.163 1.00 0.00 N ATOM 914 CA SER A 66 6.989 6.876 5.670 1.00 0.00 C ATOM 915 C SER A 66 6.117 5.625 5.665 1.00 0.00 C ATOM 916 O SER A 66 5.385 5.358 6.617 1.00 0.00 O ATOM 917 CB SER A 66 8.256 6.681 6.506 1.00 0.00 C ATOM 918 OG SER A 66 7.947 6.419 7.864 1.00 0.00 O ATOM 0 H SER A 66 5.888 7.913 7.121 1.00 0.00 H new ATOM 0 HA SER A 66 7.302 7.071 4.644 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.839 5.855 6.098 1.00 0.00 H new ATOM 0 HB3 SER A 66 8.878 7.573 6.439 1.00 0.00 H new ATOM 0 HG SER A 66 8.759 6.141 8.337 1.00 0.00 H new ATOM 924 N VAL A 67 6.166 4.882 4.573 1.00 0.00 N ATOM 925 CA VAL A 67 5.322 3.708 4.408 1.00 0.00 C ATOM 926 C VAL A 67 6.156 2.500 4.010 1.00 0.00 C ATOM 927 O VAL A 67 6.849 2.530 2.997 1.00 0.00 O ATOM 928 CB VAL A 67 4.245 3.948 3.329 1.00 0.00 C ATOM 929 CG1 VAL A 67 3.340 2.737 3.195 1.00 0.00 C ATOM 930 CG2 VAL A 67 3.433 5.196 3.643 1.00 0.00 C ATOM 0 H VAL A 67 6.784 5.071 3.783 1.00 0.00 H new ATOM 0 HA VAL A 67 4.836 3.518 5.365 1.00 0.00 H new ATOM 0 HB VAL A 67 4.749 4.104 2.375 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.588 2.928 2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.934 1.868 2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.847 2.544 4.148 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.680 5.345 2.869 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.942 5.077 4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.095 6.062 3.677 1.00 0.00 H new ATOM 940 N SER A 68 6.086 1.437 4.799 1.00 0.00 N ATOM 941 CA SER A 68 6.828 0.227 4.487 1.00 0.00 C ATOM 942 C SER A 68 6.048 -0.669 3.544 1.00 0.00 C ATOM 943 O SER A 68 4.911 -1.058 3.823 1.00 0.00 O ATOM 944 CB SER A 68 7.165 -0.565 5.739 1.00 0.00 C ATOM 945 OG SER A 68 7.962 0.190 6.639 1.00 0.00 O ATOM 0 H SER A 68 5.528 1.389 5.652 1.00 0.00 H new ATOM 0 HA SER A 68 7.752 0.549 4.007 1.00 0.00 H new ATOM 0 HB2 SER A 68 6.244 -0.869 6.236 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.694 -1.477 5.462 1.00 0.00 H new ATOM 0 HG SER A 68 8.005 1.121 6.336 1.00 0.00 H new ATOM 951 N LEU A 69 6.673 -0.983 2.431 1.00 0.00 N ATOM 952 CA LEU A 69 6.113 -1.883 1.450 1.00 0.00 C ATOM 953 C LEU A 69 6.811 -3.235 1.503 1.00 0.00 C ATOM 954 O LEU A 69 8.009 -3.317 1.255 1.00 0.00 O ATOM 955 CB LEU A 69 6.298 -1.294 0.060 1.00 0.00 C ATOM 956 CG LEU A 69 5.316 -0.194 -0.366 1.00 0.00 C ATOM 957 CD1 LEU A 69 3.895 -0.728 -0.396 1.00 0.00 C ATOM 958 CD2 LEU A 69 5.406 1.024 0.540 1.00 0.00 C ATOM 0 H LEU A 69 7.592 -0.617 2.180 1.00 0.00 H new ATOM 0 HA LEU A 69 5.054 -2.017 1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.308 -0.890 -0.005 1.00 0.00 H new ATOM 0 HB3 LEU A 69 6.232 -2.106 -0.664 1.00 0.00 H new ATOM 0 HG LEU A 69 5.595 0.121 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.214 0.067 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.831 -1.552 -1.106 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.618 -1.082 0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.695 1.780 0.205 1.00 0.00 H new ATOM 0 HD22 LEU A 69 5.172 0.734 1.564 1.00 0.00 H new ATOM 0 HD23 LEU A 69 6.416 1.433 0.501 1.00 0.00 H new ATOM 970 N THR A 70 6.085 -4.279 1.880 1.00 0.00 N ATOM 971 CA THR A 70 6.598 -5.648 1.805 1.00 0.00 C ATOM 972 C THR A 70 5.442 -6.637 1.639 1.00 0.00 C ATOM 973 O THR A 70 4.385 -6.451 2.242 1.00 0.00 O ATOM 974 CB THR A 70 7.418 -6.021 3.056 1.00 0.00 C ATOM 975 OG1 THR A 70 8.462 -5.060 3.260 1.00 0.00 O ATOM 976 CG2 THR A 70 8.033 -7.402 2.903 1.00 0.00 C ATOM 0 H THR A 70 5.134 -4.207 2.243 1.00 0.00 H new ATOM 0 HA THR A 70 7.257 -5.702 0.939 1.00 0.00 H new ATOM 0 HB THR A 70 6.747 -6.025 3.915 1.00 0.00 H new ATOM 0 HG1 THR A 70 9.332 -5.485 3.107 1.00 0.00 H new ATOM 0 HG21 THR A 70 8.607 -7.646 3.797 1.00 0.00 H new ATOM 0 HG22 THR A 70 7.242 -8.140 2.768 1.00 0.00 H new ATOM 0 HG23 THR A 70 8.691 -7.413 2.034 1.00 0.00 H new ATOM 984 N GLY A 71 5.625 -7.682 0.832 1.00 0.00 N ATOM 985 CA GLY A 71 4.546 -8.634 0.627 1.00 0.00 C ATOM 986 C GLY A 71 4.912 -9.776 -0.298 1.00 0.00 C ATOM 987 O GLY A 71 5.973 -10.379 -0.164 1.00 0.00 O ATOM 0 H GLY A 71 6.487 -7.884 0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 71 4.244 -9.042 1.592 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.682 -8.109 0.218 1.00 0.00 H new ATOM 991 N ALA A 72 4.023 -10.068 -1.235 1.00 0.00 N ATOM 992 CA ALA A 72 4.203 -11.162 -2.173 1.00 0.00 C ATOM 993 C ALA A 72 4.348 -10.598 -3.587 1.00 0.00 C ATOM 994 O ALA A 72 4.049 -9.425 -3.796 1.00 0.00 O ATOM 995 CB ALA A 72 3.019 -12.117 -2.073 1.00 0.00 C ATOM 0 H ALA A 72 3.154 -9.550 -1.366 1.00 0.00 H new ATOM 0 HA ALA A 72 5.109 -11.719 -1.933 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.154 -12.938 -2.777 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.956 -12.514 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.099 -11.582 -2.311 1.00 0.00 H new ATOM 1001 N PRO A 73 4.801 -11.406 -4.575 1.00 0.00 N ATOM 1002 CA PRO A 73 5.124 -10.915 -5.925 1.00 0.00 C ATOM 1003 C PRO A 73 4.013 -10.065 -6.544 1.00 0.00 C ATOM 1004 O PRO A 73 4.280 -9.029 -7.156 1.00 0.00 O ATOM 1005 CB PRO A 73 5.346 -12.195 -6.747 1.00 0.00 C ATOM 1006 CG PRO A 73 4.887 -13.323 -5.881 1.00 0.00 C ATOM 1007 CD PRO A 73 5.036 -12.854 -4.466 1.00 0.00 C ATOM 0 HA PRO A 73 5.991 -10.255 -5.901 1.00 0.00 H new ATOM 0 HB2 PRO A 73 4.782 -12.163 -7.679 1.00 0.00 H new ATOM 0 HB3 PRO A 73 6.396 -12.310 -7.014 1.00 0.00 H new ATOM 0 HG2 PRO A 73 3.851 -13.583 -6.098 1.00 0.00 H new ATOM 0 HG3 PRO A 73 5.484 -14.218 -6.059 1.00 0.00 H new ATOM 0 HD2 PRO A 73 4.314 -13.332 -3.804 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.027 -13.074 -4.069 1.00 0.00 H new ATOM 1015 N GLU A 74 2.776 -10.498 -6.368 1.00 0.00 N ATOM 1016 CA GLU A 74 1.629 -9.780 -6.907 1.00 0.00 C ATOM 1017 C GLU A 74 1.195 -8.661 -5.963 1.00 0.00 C ATOM 1018 O GLU A 74 0.957 -7.530 -6.392 1.00 0.00 O ATOM 1019 CB GLU A 74 0.473 -10.763 -7.148 1.00 0.00 C ATOM 1020 CG GLU A 74 -0.852 -10.113 -7.520 1.00 0.00 C ATOM 1021 CD GLU A 74 -0.803 -9.362 -8.834 1.00 0.00 C ATOM 1022 OE1 GLU A 74 0.003 -9.730 -9.712 1.00 0.00 O ATOM 1023 OE2 GLU A 74 -1.605 -8.417 -9.009 1.00 0.00 O ATOM 0 H GLU A 74 2.538 -11.346 -5.854 1.00 0.00 H new ATOM 0 HA GLU A 74 1.913 -9.324 -7.855 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.760 -11.451 -7.943 1.00 0.00 H new ATOM 0 HB3 GLU A 74 0.328 -11.360 -6.247 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -1.622 -10.882 -7.578 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -1.147 -9.425 -6.727 1.00 0.00 H new ATOM 1030 N SER A 75 1.129 -8.974 -4.676 1.00 0.00 N ATOM 1031 CA SER A 75 0.589 -8.048 -3.693 1.00 0.00 C ATOM 1032 C SER A 75 1.472 -6.822 -3.547 1.00 0.00 C ATOM 1033 O SER A 75 0.990 -5.690 -3.558 1.00 0.00 O ATOM 1034 CB SER A 75 0.440 -8.747 -2.339 1.00 0.00 C ATOM 1035 OG SER A 75 1.664 -8.836 -1.636 1.00 0.00 O ATOM 0 H SER A 75 1.444 -9.864 -4.289 1.00 0.00 H new ATOM 0 HA SER A 75 -0.391 -7.721 -4.042 1.00 0.00 H new ATOM 0 HB2 SER A 75 -0.285 -8.205 -1.732 1.00 0.00 H new ATOM 0 HB3 SER A 75 0.040 -9.749 -2.494 1.00 0.00 H new ATOM 0 HG SER A 75 1.557 -9.435 -0.868 1.00 0.00 H new ATOM 1041 N VAL A 76 2.765 -7.060 -3.426 1.00 0.00 N ATOM 1042 CA VAL A 76 3.709 -5.997 -3.144 1.00 0.00 C ATOM 1043 C VAL A 76 3.820 -5.030 -4.316 1.00 0.00 C ATOM 1044 O VAL A 76 4.023 -3.834 -4.126 1.00 0.00 O ATOM 1045 CB VAL A 76 5.100 -6.557 -2.777 1.00 0.00 C ATOM 1046 CG1 VAL A 76 5.914 -6.932 -4.010 1.00 0.00 C ATOM 1047 CG2 VAL A 76 5.840 -5.566 -1.906 1.00 0.00 C ATOM 0 H VAL A 76 3.186 -7.984 -3.519 1.00 0.00 H new ATOM 0 HA VAL A 76 3.326 -5.450 -2.283 1.00 0.00 H new ATOM 0 HB VAL A 76 4.954 -7.479 -2.214 1.00 0.00 H new ATOM 0 HG11 VAL A 76 6.884 -7.321 -3.701 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.382 -7.694 -4.579 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.059 -6.049 -4.633 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.821 -5.967 -1.651 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.962 -4.627 -2.446 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.272 -5.389 -0.993 1.00 0.00 H new ATOM 1057 N GLN A 77 3.663 -5.546 -5.525 1.00 0.00 N ATOM 1058 CA GLN A 77 3.717 -4.705 -6.703 1.00 0.00 C ATOM 1059 C GLN A 77 2.437 -3.896 -6.808 1.00 0.00 C ATOM 1060 O GLN A 77 2.469 -2.705 -7.105 1.00 0.00 O ATOM 1061 CB GLN A 77 3.922 -5.542 -7.963 1.00 0.00 C ATOM 1062 CG GLN A 77 4.069 -4.701 -9.220 1.00 0.00 C ATOM 1063 CD GLN A 77 4.307 -5.536 -10.459 1.00 0.00 C ATOM 1064 OE1 GLN A 77 3.848 -6.674 -10.556 1.00 0.00 O ATOM 1065 NE2 GLN A 77 5.031 -4.982 -11.413 1.00 0.00 N ATOM 0 H GLN A 77 3.499 -6.535 -5.712 1.00 0.00 H new ATOM 0 HA GLN A 77 4.566 -4.027 -6.611 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.811 -6.160 -7.841 1.00 0.00 H new ATOM 0 HB3 GLN A 77 3.077 -6.220 -8.083 1.00 0.00 H new ATOM 0 HG2 GLN A 77 3.169 -4.102 -9.358 1.00 0.00 H new ATOM 0 HG3 GLN A 77 4.898 -4.005 -9.091 1.00 0.00 H new ATOM 0 HE21 GLN A 77 5.393 -4.036 -11.294 1.00 0.00 H new ATOM 0 HE22 GLN A 77 5.228 -5.500 -12.269 1.00 0.00 H new ATOM 1074 N LYS A 78 1.316 -4.557 -6.539 1.00 0.00 N ATOM 1075 CA LYS A 78 0.014 -3.909 -6.552 1.00 0.00 C ATOM 1076 C LYS A 78 -0.002 -2.754 -5.556 1.00 0.00 C ATOM 1077 O LYS A 78 -0.335 -1.624 -5.906 1.00 0.00 O ATOM 1078 CB LYS A 78 -1.073 -4.926 -6.197 1.00 0.00 C ATOM 1079 CG LYS A 78 -2.490 -4.434 -6.438 1.00 0.00 C ATOM 1080 CD LYS A 78 -3.198 -5.299 -7.466 1.00 0.00 C ATOM 1081 CE LYS A 78 -2.523 -5.210 -8.825 1.00 0.00 C ATOM 1082 NZ LYS A 78 -3.059 -6.220 -9.773 1.00 0.00 N ATOM 0 H LYS A 78 1.286 -5.550 -6.308 1.00 0.00 H new ATOM 0 HA LYS A 78 -0.181 -3.515 -7.550 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -0.911 -5.832 -6.780 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.969 -5.200 -5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.047 -4.446 -5.501 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.466 -3.400 -6.782 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.205 -6.335 -7.129 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.238 -4.985 -7.553 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.667 -4.211 -9.238 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.449 -5.355 -8.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.729 -6.002 -10.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -2.725 -7.166 -9.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.099 -6.200 -9.750 1.00 0.00 H new ATOM 1096 N ALA A 79 0.399 -3.051 -4.326 1.00 0.00 N ATOM 1097 CA ALA A 79 0.467 -2.054 -3.265 1.00 0.00 C ATOM 1098 C ALA A 79 1.316 -0.859 -3.691 1.00 0.00 C ATOM 1099 O ALA A 79 0.909 0.294 -3.537 1.00 0.00 O ATOM 1100 CB ALA A 79 1.040 -2.682 -2.003 1.00 0.00 C ATOM 0 H ALA A 79 0.685 -3.986 -4.037 1.00 0.00 H new ATOM 0 HA ALA A 79 -0.543 -1.696 -3.063 1.00 0.00 H new ATOM 0 HB1 ALA A 79 1.089 -1.932 -1.213 1.00 0.00 H new ATOM 0 HB2 ALA A 79 0.401 -3.505 -1.683 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.042 -3.059 -2.207 1.00 0.00 H new ATOM 1106 N LYS A 80 2.494 -1.142 -4.239 1.00 0.00 N ATOM 1107 CA LYS A 80 3.397 -0.089 -4.686 1.00 0.00 C ATOM 1108 C LYS A 80 2.826 0.669 -5.878 1.00 0.00 C ATOM 1109 O LYS A 80 3.215 1.806 -6.126 1.00 0.00 O ATOM 1110 CB LYS A 80 4.780 -0.648 -5.029 1.00 0.00 C ATOM 1111 CG LYS A 80 5.556 -1.135 -3.815 1.00 0.00 C ATOM 1112 CD LYS A 80 7.012 -1.416 -4.156 1.00 0.00 C ATOM 1113 CE LYS A 80 7.143 -2.494 -5.219 1.00 0.00 C ATOM 1114 NZ LYS A 80 8.554 -2.676 -5.653 1.00 0.00 N ATOM 0 H LYS A 80 2.844 -2.089 -4.384 1.00 0.00 H new ATOM 0 HA LYS A 80 3.505 0.610 -3.857 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.665 -1.473 -5.732 1.00 0.00 H new ATOM 0 HB3 LYS A 80 5.360 0.124 -5.535 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.505 -0.385 -3.025 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.092 -2.041 -3.425 1.00 0.00 H new ATOM 0 HD2 LYS A 80 7.487 -0.500 -4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 80 7.543 -1.726 -3.256 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.758 -3.437 -4.830 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.529 -2.231 -6.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.634 -2.468 -6.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.168 -2.029 -5.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 8.848 -3.658 -5.476 1.00 0.00 H new ATOM 1128 N MET A 81 1.910 0.047 -6.617 1.00 0.00 N ATOM 1129 CA MET A 81 1.247 0.729 -7.725 1.00 0.00 C ATOM 1130 C MET A 81 0.442 1.911 -7.206 1.00 0.00 C ATOM 1131 O MET A 81 0.534 3.013 -7.745 1.00 0.00 O ATOM 1132 CB MET A 81 0.335 -0.219 -8.514 1.00 0.00 C ATOM 1133 CG MET A 81 1.089 -1.226 -9.366 1.00 0.00 C ATOM 1134 SD MET A 81 -0.004 -2.308 -10.311 1.00 0.00 S ATOM 1135 CE MET A 81 1.194 -3.256 -11.248 1.00 0.00 C ATOM 0 H MET A 81 1.613 -0.918 -6.471 1.00 0.00 H new ATOM 0 HA MET A 81 2.022 1.086 -8.403 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.307 -0.756 -7.816 1.00 0.00 H new ATOM 0 HB3 MET A 81 -0.318 0.371 -9.157 1.00 0.00 H new ATOM 0 HG2 MET A 81 1.746 -0.693 -10.053 1.00 0.00 H new ATOM 0 HG3 MET A 81 1.726 -1.834 -8.723 1.00 0.00 H new ATOM 0 HE1 MET A 81 0.845 -3.371 -12.274 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.151 -2.735 -11.247 1.00 0.00 H new ATOM 0 HE3 MET A 81 1.316 -4.239 -10.794 1.00 0.00 H new ATOM 1145 N MET A 82 -0.345 1.680 -6.155 1.00 0.00 N ATOM 1146 CA MET A 82 -1.098 2.758 -5.518 1.00 0.00 C ATOM 1147 C MET A 82 -0.163 3.779 -4.875 1.00 0.00 C ATOM 1148 O MET A 82 -0.386 4.985 -4.974 1.00 0.00 O ATOM 1149 CB MET A 82 -2.070 2.216 -4.465 1.00 0.00 C ATOM 1150 CG MET A 82 -3.188 1.373 -5.045 1.00 0.00 C ATOM 1151 SD MET A 82 -2.811 -0.385 -5.066 1.00 0.00 S ATOM 1152 CE MET A 82 -4.252 -1.030 -5.910 1.00 0.00 C ATOM 0 H MET A 82 -0.477 0.762 -5.730 1.00 0.00 H new ATOM 0 HA MET A 82 -1.673 3.251 -6.302 1.00 0.00 H new ATOM 0 HB2 MET A 82 -1.513 1.619 -3.743 1.00 0.00 H new ATOM 0 HB3 MET A 82 -2.504 3.053 -3.919 1.00 0.00 H new ATOM 0 HG2 MET A 82 -4.096 1.536 -4.465 1.00 0.00 H new ATOM 0 HG3 MET A 82 -3.395 1.706 -6.062 1.00 0.00 H new ATOM 0 HE1 MET A 82 -4.551 -1.972 -5.451 1.00 0.00 H new ATOM 0 HE2 MET A 82 -5.070 -0.313 -5.834 1.00 0.00 H new ATOM 0 HE3 MET A 82 -4.014 -1.198 -6.960 1.00 0.00 H new ATOM 1162 N LEU A 83 0.883 3.289 -4.222 1.00 0.00 N ATOM 1163 CA LEU A 83 1.854 4.159 -3.560 1.00 0.00 C ATOM 1164 C LEU A 83 2.520 5.089 -4.563 1.00 0.00 C ATOM 1165 O LEU A 83 2.452 6.309 -4.428 1.00 0.00 O ATOM 1166 CB LEU A 83 2.917 3.334 -2.823 1.00 0.00 C ATOM 1167 CG LEU A 83 2.654 3.090 -1.332 1.00 0.00 C ATOM 1168 CD1 LEU A 83 2.596 4.411 -0.576 1.00 0.00 C ATOM 1169 CD2 LEU A 83 1.369 2.304 -1.125 1.00 0.00 C ATOM 0 H LEU A 83 1.083 2.293 -4.135 1.00 0.00 H new ATOM 0 HA LEU A 83 1.314 4.762 -2.830 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.009 2.368 -3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.878 3.839 -2.926 1.00 0.00 H new ATOM 0 HG LEU A 83 3.480 2.499 -0.938 1.00 0.00 H new ATOM 0 HD11 LEU A 83 2.409 4.218 0.480 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.545 4.935 -0.686 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.793 5.027 -0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.207 2.145 -0.059 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.530 2.862 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.447 1.340 -1.627 1.00 0.00 H new ATOM 1181 N ASP A 84 3.140 4.501 -5.579 1.00 0.00 N ATOM 1182 CA ASP A 84 3.823 5.266 -6.620 1.00 0.00 C ATOM 1183 C ASP A 84 2.863 6.248 -7.275 1.00 0.00 C ATOM 1184 O ASP A 84 3.224 7.382 -7.569 1.00 0.00 O ATOM 1185 CB ASP A 84 4.397 4.317 -7.679 1.00 0.00 C ATOM 1186 CG ASP A 84 5.110 5.045 -8.804 1.00 0.00 C ATOM 1187 OD1 ASP A 84 4.447 5.407 -9.801 1.00 0.00 O ATOM 1188 OD2 ASP A 84 6.340 5.240 -8.709 1.00 0.00 O ATOM 0 H ASP A 84 3.185 3.490 -5.706 1.00 0.00 H new ATOM 0 HA ASP A 84 4.638 5.825 -6.160 1.00 0.00 H new ATOM 0 HB2 ASP A 84 5.093 3.627 -7.202 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.589 3.716 -8.097 1.00 0.00 H new ATOM 1193 N ASP A 85 1.631 5.799 -7.466 1.00 0.00 N ATOM 1194 CA ASP A 85 0.600 6.588 -8.129 1.00 0.00 C ATOM 1195 C ASP A 85 0.379 7.926 -7.420 1.00 0.00 C ATOM 1196 O ASP A 85 0.429 8.993 -8.041 1.00 0.00 O ATOM 1197 CB ASP A 85 -0.702 5.783 -8.168 1.00 0.00 C ATOM 1198 CG ASP A 85 -1.737 6.377 -9.099 1.00 0.00 C ATOM 1199 OD1 ASP A 85 -1.703 6.058 -10.307 1.00 0.00 O ATOM 1200 OD2 ASP A 85 -2.600 7.146 -8.634 1.00 0.00 O ATOM 0 H ASP A 85 1.317 4.876 -7.166 1.00 0.00 H new ATOM 0 HA ASP A 85 0.927 6.807 -9.145 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.482 4.762 -8.482 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.117 5.725 -7.162 1.00 0.00 H new ATOM 1205 N ILE A 86 0.163 7.869 -6.113 1.00 0.00 N ATOM 1206 CA ILE A 86 -0.126 9.070 -5.337 1.00 0.00 C ATOM 1207 C ILE A 86 1.147 9.841 -5.001 1.00 0.00 C ATOM 1208 O ILE A 86 1.172 11.071 -5.082 1.00 0.00 O ATOM 1209 CB ILE A 86 -0.921 8.749 -4.042 1.00 0.00 C ATOM 1210 CG1 ILE A 86 -2.397 8.504 -4.372 1.00 0.00 C ATOM 1211 CG2 ILE A 86 -0.794 9.868 -3.014 1.00 0.00 C ATOM 1212 CD1 ILE A 86 -2.659 7.210 -5.110 1.00 0.00 C ATOM 0 H ILE A 86 0.182 7.007 -5.568 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.753 9.702 -5.966 1.00 0.00 H new ATOM 0 HB ILE A 86 -0.495 7.845 -3.608 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -2.970 8.503 -3.445 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.766 9.334 -4.974 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -1.363 9.608 -2.121 1.00 0.00 H new ATOM 0 HG22 ILE A 86 0.255 10.002 -2.749 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.183 10.795 -3.435 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -3.727 7.112 -5.305 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -2.116 7.214 -6.055 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.323 6.370 -4.502 1.00 0.00 H new ATOM 1224 N VAL A 87 2.206 9.134 -4.648 1.00 0.00 N ATOM 1225 CA VAL A 87 3.463 9.788 -4.320 1.00 0.00 C ATOM 1226 C VAL A 87 3.991 10.565 -5.525 1.00 0.00 C ATOM 1227 O VAL A 87 4.450 11.694 -5.393 1.00 0.00 O ATOM 1228 CB VAL A 87 4.526 8.779 -3.844 1.00 0.00 C ATOM 1229 CG1 VAL A 87 5.876 9.460 -3.655 1.00 0.00 C ATOM 1230 CG2 VAL A 87 4.094 8.111 -2.549 1.00 0.00 C ATOM 0 H VAL A 87 2.223 8.116 -4.581 1.00 0.00 H new ATOM 0 HA VAL A 87 3.264 10.480 -3.501 1.00 0.00 H new ATOM 0 HB VAL A 87 4.628 8.015 -4.614 1.00 0.00 H new ATOM 0 HG11 VAL A 87 6.609 8.727 -3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 87 6.202 9.891 -4.602 1.00 0.00 H new ATOM 0 HG13 VAL A 87 5.784 10.250 -2.909 1.00 0.00 H new ATOM 0 HG21 VAL A 87 4.860 7.403 -2.232 1.00 0.00 H new ATOM 0 HG22 VAL A 87 3.958 8.868 -1.777 1.00 0.00 H new ATOM 0 HG23 VAL A 87 3.154 7.582 -2.708 1.00 0.00 H new ATOM 1240 N SER A 88 3.894 9.970 -6.700 1.00 0.00 N ATOM 1241 CA SER A 88 4.362 10.613 -7.916 1.00 0.00 C ATOM 1242 C SER A 88 3.491 11.822 -8.263 1.00 0.00 C ATOM 1243 O SER A 88 4.005 12.866 -8.661 1.00 0.00 O ATOM 1244 CB SER A 88 4.369 9.603 -9.069 1.00 0.00 C ATOM 1245 OG SER A 88 4.916 10.151 -10.256 1.00 0.00 O ATOM 0 H SER A 88 3.495 9.042 -6.839 1.00 0.00 H new ATOM 0 HA SER A 88 5.379 10.970 -7.753 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.945 8.725 -8.777 1.00 0.00 H new ATOM 0 HB3 SER A 88 3.350 9.267 -9.262 1.00 0.00 H new ATOM 0 HG SER A 88 4.903 9.474 -10.965 1.00 0.00 H new ATOM 1251 N ARG A 89 2.175 11.694 -8.084 1.00 0.00 N ATOM 1252 CA ARG A 89 1.258 12.766 -8.464 1.00 0.00 C ATOM 1253 C ARG A 89 1.398 13.982 -7.540 1.00 0.00 C ATOM 1254 O ARG A 89 1.142 15.114 -7.953 1.00 0.00 O ATOM 1255 CB ARG A 89 -0.202 12.281 -8.474 1.00 0.00 C ATOM 1256 CG ARG A 89 -0.817 12.109 -7.091 1.00 0.00 C ATOM 1257 CD ARG A 89 -2.329 11.966 -7.155 1.00 0.00 C ATOM 1258 NE ARG A 89 -2.754 10.637 -7.595 1.00 0.00 N ATOM 1259 CZ ARG A 89 -4.020 10.212 -7.540 1.00 0.00 C ATOM 1260 NH1 ARG A 89 -4.986 11.029 -7.124 1.00 0.00 N ATOM 1261 NH2 ARG A 89 -4.323 8.976 -7.913 1.00 0.00 N ATOM 0 H ARG A 89 1.726 10.870 -7.684 1.00 0.00 H new ATOM 0 HA ARG A 89 1.530 13.069 -9.475 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -0.804 12.991 -9.040 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.252 11.329 -9.002 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.389 11.229 -6.611 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.560 12.967 -6.470 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -2.751 12.170 -6.171 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.732 12.715 -7.836 1.00 0.00 H new ATOM 0 HE ARG A 89 -2.047 10.001 -7.963 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -4.761 11.984 -6.845 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -5.951 10.700 -7.084 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -3.589 8.348 -8.242 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -5.290 8.653 -7.871 1.00 0.00 H new ATOM 1275 N GLY A 90 1.807 13.753 -6.298 1.00 0.00 N ATOM 1276 CA GLY A 90 1.886 14.844 -5.341 1.00 0.00 C ATOM 1277 C GLY A 90 3.288 15.096 -4.828 1.00 0.00 C ATOM 1278 O GLY A 90 3.477 15.841 -3.869 1.00 0.00 O ATOM 0 H GLY A 90 2.084 12.840 -5.937 1.00 0.00 H new ATOM 0 HA2 GLY A 90 1.509 15.754 -5.808 1.00 0.00 H new ATOM 0 HA3 GLY A 90 1.233 14.624 -4.497 1.00 0.00 H new ATOM 1282 N ARG A 91 4.269 14.468 -5.453 1.00 0.00 N ATOM 1283 CA ARG A 91 5.663 14.660 -5.075 1.00 0.00 C ATOM 1284 C ARG A 91 6.570 14.330 -6.249 1.00 0.00 C ATOM 1285 O ARG A 91 7.374 15.155 -6.681 1.00 0.00 O ATOM 1286 CB ARG A 91 6.020 13.795 -3.848 1.00 0.00 C ATOM 1287 CG ARG A 91 7.450 13.968 -3.348 1.00 0.00 C ATOM 1288 CD ARG A 91 8.431 13.083 -4.103 1.00 0.00 C ATOM 1289 NE ARG A 91 9.805 13.559 -3.979 1.00 0.00 N ATOM 1290 CZ ARG A 91 10.844 13.017 -4.606 1.00 0.00 C ATOM 1291 NH1 ARG A 91 10.675 11.952 -5.382 1.00 0.00 N ATOM 1292 NH2 ARG A 91 12.048 13.547 -4.455 1.00 0.00 N ATOM 0 H ARG A 91 4.128 13.819 -6.227 1.00 0.00 H new ATOM 0 HA ARG A 91 5.811 15.705 -4.803 1.00 0.00 H new ATOM 0 HB2 ARG A 91 5.333 14.036 -3.037 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.861 12.746 -4.100 1.00 0.00 H new ATOM 0 HG2 ARG A 91 7.747 15.011 -3.455 1.00 0.00 H new ATOM 0 HG3 ARG A 91 7.493 13.731 -2.285 1.00 0.00 H new ATOM 0 HD2 ARG A 91 8.365 12.063 -3.724 1.00 0.00 H new ATOM 0 HD3 ARG A 91 8.153 13.050 -5.156 1.00 0.00 H new ATOM 0 HE ARG A 91 9.979 14.360 -3.372 1.00 0.00 H new ATOM 0 HH11 ARG A 91 9.746 11.548 -5.498 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.475 11.539 -5.862 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.174 14.366 -3.860 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.850 13.136 -4.933 1.00 0.00 H new ATOM 1306 N GLY A 92 6.432 13.117 -6.755 1.00 0.00 N ATOM 1307 CA GLY A 92 7.253 12.668 -7.854 1.00 0.00 C ATOM 1308 C GLY A 92 8.134 11.513 -7.445 1.00 0.00 C ATOM 1309 O GLY A 92 7.927 10.914 -6.390 1.00 0.00 O ATOM 0 H GLY A 92 5.758 12.429 -6.419 1.00 0.00 H new ATOM 0 HA2 GLY A 92 6.617 12.366 -8.686 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.872 13.492 -8.209 1.00 0.00 H new ATOM 1313 N GLY A 93 9.129 11.216 -8.258 1.00 0.00 N ATOM 1314 CA GLY A 93 10.026 10.119 -7.972 1.00 0.00 C ATOM 1315 C GLY A 93 11.439 10.446 -8.388 1.00 0.00 C ATOM 1316 O GLY A 93 11.778 10.216 -9.565 1.00 0.00 O ATOM 1317 OXT GLY A 93 12.208 10.959 -7.548 1.00 0.00 O ATOM 0 H GLY A 93 9.335 11.720 -9.121 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.001 9.894 -6.906 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.688 9.224 -8.495 1.00 0.00 H new TER 1321 GLY A 93