USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 761 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 138 THR OG1 : rot -106:sc= 0.197! USER MOD Set 1.2: A 140 SER OG : rot -80:sc= -1.23 USER MOD Set 2.1: A 89 MET CE :methyl -136:sc= -1.11 (180deg=-1.42) USER MOD Set 2.2: A 137 HIS : no HE2:sc= -2.56 K(o=-3.7,f=-5.7) USER MOD Set 3.1: A 101 SER OG : rot -110:sc= -0.525 USER MOD Set 3.2: A 107 LYS NZ :NH3+ -175:sc= 0.00375 (180deg=0) USER MOD Set 4.1: A 56 TYR OH : rot -100:sc= -1.69! USER MOD Set 4.2: A 118 HIS : no HE2:sc= -6.09! C(o=-7.8!,f=-16!) USER MOD Set 5.1: A 51 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 55 ASN : amide:sc= -2.21 X(o=-2.2,f=-2.3) USER MOD Single : A 41 GLN : amide:sc= -0.328 X(o=-0.33,f=-0.066) USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00459 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.168 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -2.71 X(o=-2.7,f=-3.1!) USER MOD Single : A 85 SER OG : rot -100:sc= 0.778 USER MOD Single : A 86 ASN : amide:sc= -2.34 K(o=-2.3,f=-2.9!) USER MOD Single : A 87 ASN : amide:sc= -0.757 K(o=-0.76,f=-0.1) USER MOD Single : A 90 MET CE :methyl 167:sc= -6.85! (180deg=-7.87!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.286 USER MOD Single : A 93 HIS : no HD1:sc= -5.28! C(o=-5.3!,f=-7!) USER MOD Single : A 96 THR OG1 : rot 75:sc= 0.933 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -39:sc= 0.272 USER MOD Single : A 106 ASN : amide:sc= -3.74! C(o=-3.7!,f=-8.5!) USER MOD Single : A 110 TYR OH : rot 100:sc= -1.79 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 62:sc= 0.348 USER MOD Single : A 125 GLN : amide:sc= -0.919 K(o=-0.92,f=-0.023) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.39 X(o=-0.39,f=-0.02) USER MOD Single : A 131 ASN : amide:sc= -4.84! C(o=-4.8!,f=-13!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot -169:sc= -1.23 USER MOD Single : A 148 ASN : amide:sc= -4.07! C(o=-4.1!,f=-14!) USER MOD Single : A 150 HIS : no HD1:sc= -12.6! C(o=-13!,f=-13!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.685 -10.086 6.744 1.00 0.00 N ATOM 14 CA PHE A 37 7.692 -9.161 6.234 1.00 0.00 C ATOM 15 C PHE A 37 9.090 -9.545 6.716 1.00 0.00 C ATOM 16 O PHE A 37 10.024 -8.748 6.630 1.00 0.00 O ATOM 17 CB PHE A 37 7.369 -7.730 6.671 1.00 0.00 C ATOM 18 CG PHE A 37 5.912 -7.375 6.570 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.152 -7.798 5.489 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.303 -6.616 7.556 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.813 -7.469 5.396 1.00 0.00 C ATOM 22 CE2 PHE A 37 3.964 -6.285 7.468 1.00 0.00 C ATOM 23 CZ PHE A 37 3.218 -6.711 6.387 1.00 0.00 C ATOM 0 HA PHE A 37 7.676 -9.218 5.146 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.695 -7.593 7.702 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.945 -7.035 6.060 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.612 -8.391 4.712 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.881 -6.279 8.403 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.232 -7.804 4.550 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.501 -5.694 8.244 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.172 -6.453 6.316 1.00 0.00 H new ATOM 33 N ALA A 38 9.230 -10.767 7.225 1.00 0.00 N ATOM 34 CA ALA A 38 10.516 -11.245 7.719 1.00 0.00 C ATOM 35 C ALA A 38 11.453 -11.593 6.569 1.00 0.00 C ATOM 36 O ALA A 38 12.588 -11.120 6.512 1.00 0.00 O ATOM 37 CB ALA A 38 10.318 -12.450 8.626 1.00 0.00 C ATOM 0 H ALA A 38 8.469 -11.442 7.305 1.00 0.00 H new ATOM 0 HA ALA A 38 10.976 -10.442 8.295 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.286 -12.796 8.987 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.694 -12.168 9.474 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.832 -13.250 8.067 1.00 0.00 H new ATOM 43 N ASP A 39 10.967 -12.423 5.657 1.00 0.00 N ATOM 44 CA ASP A 39 11.755 -12.841 4.501 1.00 0.00 C ATOM 45 C ASP A 39 11.455 -11.974 3.279 1.00 0.00 C ATOM 46 O ASP A 39 11.947 -12.241 2.183 1.00 0.00 O ATOM 47 CB ASP A 39 11.476 -14.309 4.176 1.00 0.00 C ATOM 48 CG ASP A 39 11.552 -15.198 5.402 1.00 0.00 C ATOM 49 OD1 ASP A 39 10.496 -15.447 6.021 1.00 0.00 O ATOM 50 OD2 ASP A 39 12.667 -15.645 5.744 1.00 0.00 O ATOM 0 H ASP A 39 10.029 -12.822 5.693 1.00 0.00 H new ATOM 0 HA ASP A 39 12.808 -12.719 4.754 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.486 -14.397 3.728 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.194 -14.657 3.434 1.00 0.00 H new ATOM 55 N ALA A 40 10.643 -10.936 3.471 1.00 0.00 N ATOM 56 CA ALA A 40 10.281 -10.037 2.383 1.00 0.00 C ATOM 57 C ALA A 40 11.484 -9.225 1.914 1.00 0.00 C ATOM 58 O ALA A 40 12.249 -8.706 2.728 1.00 0.00 O ATOM 59 CB ALA A 40 9.158 -9.111 2.825 1.00 0.00 C ATOM 0 H ALA A 40 10.225 -10.699 4.371 1.00 0.00 H new ATOM 0 HA ALA A 40 9.937 -10.640 1.543 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.894 -8.443 2.006 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.287 -9.703 3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.487 -8.523 3.681 1.00 0.00 H new ATOM 65 N GLN A 41 11.646 -9.114 0.599 1.00 0.00 N ATOM 66 CA GLN A 41 12.754 -8.358 0.027 1.00 0.00 C ATOM 67 C GLN A 41 12.686 -6.900 0.460 1.00 0.00 C ATOM 68 O GLN A 41 11.670 -6.452 0.993 1.00 0.00 O ATOM 69 CB GLN A 41 12.738 -8.457 -1.499 1.00 0.00 C ATOM 70 CG GLN A 41 13.505 -9.653 -2.039 1.00 0.00 C ATOM 71 CD GLN A 41 14.332 -9.312 -3.264 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.259 -9.995 -4.286 1.00 0.00 O ATOM 73 NE2 GLN A 41 15.124 -8.251 -3.166 1.00 0.00 N ATOM 0 H GLN A 41 11.024 -9.538 -0.090 1.00 0.00 H new ATOM 0 HA GLN A 41 13.686 -8.786 0.394 1.00 0.00 H new ATOM 0 HB2 GLN A 41 11.704 -8.515 -1.840 1.00 0.00 H new ATOM 0 HB3 GLN A 41 13.162 -7.545 -1.918 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.160 -10.041 -1.260 1.00 0.00 H new ATOM 0 HG3 GLN A 41 12.802 -10.448 -2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 41 15.152 -7.714 -2.299 1.00 0.00 H new ATOM 0 HE22 GLN A 41 15.704 -7.973 -3.958 1.00 0.00 H new ATOM 82 N THR A 42 13.768 -6.162 0.239 1.00 0.00 N ATOM 83 CA THR A 42 13.809 -4.758 0.623 1.00 0.00 C ATOM 84 C THR A 42 14.708 -3.945 -0.305 1.00 0.00 C ATOM 85 O THR A 42 15.663 -4.463 -0.883 1.00 0.00 O ATOM 86 CB THR A 42 14.290 -4.616 2.071 1.00 0.00 C ATOM 87 OG1 THR A 42 14.598 -5.882 2.628 1.00 0.00 O ATOM 88 CG2 THR A 42 13.270 -3.956 2.975 1.00 0.00 C ATOM 0 H THR A 42 14.621 -6.509 -0.200 1.00 0.00 H new ATOM 0 HA THR A 42 12.796 -4.365 0.538 1.00 0.00 H new ATOM 0 HB THR A 42 15.176 -3.983 2.019 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.904 -5.767 3.552 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.671 -3.885 3.986 1.00 0.00 H new ATOM 0 HG22 THR A 42 13.047 -2.956 2.603 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.357 -4.551 2.988 1.00 0.00 H new ATOM 96 N ARG A 43 14.389 -2.661 -0.430 1.00 0.00 N ATOM 97 CA ARG A 43 15.151 -1.746 -1.271 1.00 0.00 C ATOM 98 C ARG A 43 14.776 -0.305 -0.941 1.00 0.00 C ATOM 99 O ARG A 43 13.768 -0.060 -0.284 1.00 0.00 O ATOM 100 CB ARG A 43 14.895 -2.033 -2.752 1.00 0.00 C ATOM 101 CG ARG A 43 13.462 -1.775 -3.185 1.00 0.00 C ATOM 102 CD ARG A 43 13.339 -1.719 -4.699 1.00 0.00 C ATOM 103 NE ARG A 43 13.662 -0.394 -5.227 1.00 0.00 N ATOM 104 CZ ARG A 43 14.639 -0.150 -6.100 1.00 0.00 C ATOM 105 NH1 ARG A 43 15.403 -1.136 -6.557 1.00 0.00 N ATOM 106 NH2 ARG A 43 14.852 1.088 -6.521 1.00 0.00 N ATOM 0 H ARG A 43 13.598 -2.227 0.047 1.00 0.00 H new ATOM 0 HA ARG A 43 16.213 -1.893 -1.073 1.00 0.00 H new ATOM 0 HB2 ARG A 43 15.563 -1.417 -3.353 1.00 0.00 H new ATOM 0 HB3 ARG A 43 15.147 -3.073 -2.960 1.00 0.00 H new ATOM 0 HG2 ARG A 43 12.816 -2.562 -2.795 1.00 0.00 H new ATOM 0 HG3 ARG A 43 13.115 -0.835 -2.756 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.004 -2.459 -5.144 1.00 0.00 H new ATOM 0 HD3 ARG A 43 12.324 -1.988 -4.990 1.00 0.00 H new ATOM 0 HE ARG A 43 13.102 0.396 -4.906 1.00 0.00 H new ATOM 0 HH11 ARG A 43 15.245 -2.093 -6.240 1.00 0.00 H new ATOM 0 HH12 ARG A 43 16.148 -0.937 -7.225 1.00 0.00 H new ATOM 0 HH21 ARG A 43 14.269 1.851 -6.177 1.00 0.00 H new ATOM 0 HH22 ARG A 43 15.599 1.278 -7.189 1.00 0.00 H new ATOM 120 N LYS A 44 15.591 0.647 -1.381 1.00 0.00 N ATOM 121 CA LYS A 44 15.322 2.051 -1.101 1.00 0.00 C ATOM 122 C LYS A 44 14.308 2.640 -2.073 1.00 0.00 C ATOM 123 O LYS A 44 14.332 2.361 -3.272 1.00 0.00 O ATOM 124 CB LYS A 44 16.616 2.862 -1.135 1.00 0.00 C ATOM 125 CG LYS A 44 16.928 3.526 0.192 1.00 0.00 C ATOM 126 CD LYS A 44 18.147 4.433 0.095 1.00 0.00 C ATOM 127 CE LYS A 44 19.263 3.970 1.018 1.00 0.00 C ATOM 128 NZ LYS A 44 19.866 2.687 0.562 1.00 0.00 N ATOM 0 H LYS A 44 16.435 0.474 -1.927 1.00 0.00 H new ATOM 0 HA LYS A 44 14.893 2.105 -0.101 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.442 2.208 -1.412 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.541 3.625 -1.909 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.066 4.108 0.519 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.102 2.762 0.949 1.00 0.00 H new ATOM 0 HD2 LYS A 44 18.508 4.450 -0.933 1.00 0.00 H new ATOM 0 HD3 LYS A 44 17.863 5.454 0.350 1.00 0.00 H new ATOM 0 HE2 LYS A 44 20.036 4.737 1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 44 18.871 3.848 2.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.622 2.406 1.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 19.135 1.948 0.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 20.263 2.809 -0.392 1.00 0.00 H new ATOM 142 N LEU A 45 13.416 3.459 -1.529 1.00 0.00 N ATOM 143 CA LEU A 45 12.373 4.110 -2.308 1.00 0.00 C ATOM 144 C LEU A 45 12.935 5.275 -3.116 1.00 0.00 C ATOM 145 O LEU A 45 13.794 6.017 -2.638 1.00 0.00 O ATOM 146 CB LEU A 45 11.275 4.614 -1.367 1.00 0.00 C ATOM 147 CG LEU A 45 9.937 4.971 -2.026 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.583 3.985 -3.129 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.831 5.015 -0.982 1.00 0.00 C ATOM 0 H LEU A 45 13.396 3.690 -0.536 1.00 0.00 H new ATOM 0 HA LEU A 45 11.958 3.383 -3.006 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.093 3.850 -0.611 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.647 5.496 -0.846 1.00 0.00 H new ATOM 0 HG LEU A 45 10.038 5.958 -2.478 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.629 4.266 -3.576 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.360 3.999 -3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.506 2.982 -2.709 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.887 5.270 -1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.743 4.040 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.070 5.768 -0.230 1.00 0.00 H new ATOM 161 N THR A 46 12.440 5.436 -4.338 1.00 0.00 N ATOM 162 CA THR A 46 12.887 6.517 -5.208 1.00 0.00 C ATOM 163 C THR A 46 12.165 7.816 -4.859 1.00 0.00 C ATOM 164 O THR A 46 11.051 7.793 -4.334 1.00 0.00 O ATOM 165 CB THR A 46 12.634 6.161 -6.673 1.00 0.00 C ATOM 166 OG1 THR A 46 11.259 6.287 -6.989 1.00 0.00 O ATOM 167 CG2 THR A 46 13.062 4.755 -7.033 1.00 0.00 C ATOM 0 H THR A 46 11.729 4.831 -4.749 1.00 0.00 H new ATOM 0 HA THR A 46 13.957 6.657 -5.057 1.00 0.00 H new ATOM 0 HB THR A 46 13.238 6.863 -7.248 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.117 6.056 -7.931 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.854 4.570 -8.087 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.130 4.642 -6.849 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.511 4.039 -6.423 1.00 0.00 H new ATOM 175 N PRO A 47 12.786 8.971 -5.150 1.00 0.00 N ATOM 176 CA PRO A 47 12.189 10.278 -4.866 1.00 0.00 C ATOM 177 C PRO A 47 10.869 10.473 -5.600 1.00 0.00 C ATOM 178 O PRO A 47 9.953 11.121 -5.093 1.00 0.00 O ATOM 179 CB PRO A 47 13.238 11.280 -5.364 1.00 0.00 C ATOM 180 CG PRO A 47 14.106 10.504 -6.296 1.00 0.00 C ATOM 181 CD PRO A 47 14.110 9.095 -5.780 1.00 0.00 C ATOM 0 HA PRO A 47 11.951 10.395 -3.809 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.768 12.122 -5.872 1.00 0.00 H new ATOM 0 HB3 PRO A 47 13.816 11.689 -4.536 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.720 10.546 -7.315 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.116 10.913 -6.321 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.244 8.371 -6.584 1.00 0.00 H new ATOM 0 HD3 PRO A 47 14.915 8.929 -5.064 1.00 0.00 H new ATOM 189 N GLU A 48 10.775 9.901 -6.796 1.00 0.00 N ATOM 190 CA GLU A 48 9.561 10.005 -7.596 1.00 0.00 C ATOM 191 C GLU A 48 8.456 9.145 -6.999 1.00 0.00 C ATOM 192 O GLU A 48 7.287 9.532 -6.991 1.00 0.00 O ATOM 193 CB GLU A 48 9.836 9.581 -9.039 1.00 0.00 C ATOM 194 CG GLU A 48 10.460 10.678 -9.888 1.00 0.00 C ATOM 195 CD GLU A 48 9.841 10.767 -11.270 1.00 0.00 C ATOM 196 OE1 GLU A 48 8.614 10.982 -11.358 1.00 0.00 O ATOM 197 OE2 GLU A 48 10.585 10.623 -12.263 1.00 0.00 O ATOM 0 H GLU A 48 11.523 9.362 -7.231 1.00 0.00 H new ATOM 0 HA GLU A 48 9.235 11.045 -7.593 1.00 0.00 H new ATOM 0 HB2 GLU A 48 10.499 8.716 -9.034 1.00 0.00 H new ATOM 0 HB3 GLU A 48 8.901 9.264 -9.500 1.00 0.00 H new ATOM 0 HG2 GLU A 48 10.345 11.636 -9.380 1.00 0.00 H new ATOM 0 HG3 GLU A 48 11.530 10.494 -9.984 1.00 0.00 H new ATOM 204 N GLU A 49 8.835 7.975 -6.493 1.00 0.00 N ATOM 205 CA GLU A 49 7.878 7.059 -5.886 1.00 0.00 C ATOM 206 C GLU A 49 7.363 7.617 -4.565 1.00 0.00 C ATOM 207 O GLU A 49 6.193 7.445 -4.220 1.00 0.00 O ATOM 208 CB GLU A 49 8.522 5.690 -5.660 1.00 0.00 C ATOM 209 CG GLU A 49 8.530 4.811 -6.898 1.00 0.00 C ATOM 210 CD GLU A 49 9.557 3.698 -6.816 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.602 3.902 -6.164 1.00 0.00 O ATOM 212 OE2 GLU A 49 9.316 2.622 -7.404 1.00 0.00 O ATOM 0 H GLU A 49 9.798 7.640 -6.492 1.00 0.00 H new ATOM 0 HA GLU A 49 7.035 6.945 -6.568 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.547 5.832 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.989 5.174 -4.862 1.00 0.00 H new ATOM 0 HG2 GLU A 49 7.540 4.377 -7.038 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.735 5.426 -7.774 1.00 0.00 H new ATOM 219 N ARG A 50 8.242 8.291 -3.831 1.00 0.00 N ATOM 220 CA ARG A 50 7.874 8.878 -2.548 1.00 0.00 C ATOM 221 C ARG A 50 6.959 10.080 -2.752 1.00 0.00 C ATOM 222 O ARG A 50 5.986 10.268 -2.019 1.00 0.00 O ATOM 223 CB ARG A 50 9.129 9.295 -1.778 1.00 0.00 C ATOM 224 CG ARG A 50 8.876 9.570 -0.303 1.00 0.00 C ATOM 225 CD ARG A 50 9.600 8.572 0.588 1.00 0.00 C ATOM 226 NE ARG A 50 11.050 8.622 0.407 1.00 0.00 N ATOM 227 CZ ARG A 50 11.813 9.637 0.806 1.00 0.00 C ATOM 228 NH1 ARG A 50 11.271 10.683 1.420 1.00 0.00 N ATOM 229 NH2 ARG A 50 13.122 9.605 0.596 1.00 0.00 N ATOM 0 H ARG A 50 9.213 8.444 -4.102 1.00 0.00 H new ATOM 0 HA ARG A 50 7.337 8.129 -1.967 1.00 0.00 H new ATOM 0 HB2 ARG A 50 9.879 8.509 -1.869 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.547 10.190 -2.239 1.00 0.00 H new ATOM 0 HG2 ARG A 50 9.205 10.580 -0.060 1.00 0.00 H new ATOM 0 HG3 ARG A 50 7.805 9.526 -0.103 1.00 0.00 H new ATOM 0 HD2 ARG A 50 9.358 8.776 1.631 1.00 0.00 H new ATOM 0 HD3 ARG A 50 9.243 7.566 0.369 1.00 0.00 H new ATOM 0 HE ARG A 50 11.504 7.832 -0.052 1.00 0.00 H new ATOM 0 HH11 ARG A 50 10.265 10.711 1.588 1.00 0.00 H new ATOM 0 HH12 ARG A 50 11.861 11.458 1.724 1.00 0.00 H new ATOM 0 HH21 ARG A 50 13.544 8.803 0.129 1.00 0.00 H new ATOM 0 HH22 ARG A 50 13.707 10.383 0.902 1.00 0.00 H new ATOM 243 N SER A 51 7.277 10.888 -3.756 1.00 0.00 N ATOM 244 CA SER A 51 6.486 12.073 -4.064 1.00 0.00 C ATOM 245 C SER A 51 5.092 11.687 -4.544 1.00 0.00 C ATOM 246 O SER A 51 4.100 12.326 -4.192 1.00 0.00 O ATOM 247 CB SER A 51 7.189 12.919 -5.128 1.00 0.00 C ATOM 248 OG SER A 51 6.341 13.952 -5.599 1.00 0.00 O ATOM 0 H SER A 51 8.078 10.744 -4.371 1.00 0.00 H new ATOM 0 HA SER A 51 6.386 12.660 -3.151 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.098 13.352 -4.711 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.491 12.284 -5.961 1.00 0.00 H new ATOM 0 HG SER A 51 6.813 14.479 -6.277 1.00 0.00 H new ATOM 254 N ALA A 52 5.021 10.635 -5.349 1.00 0.00 N ATOM 255 CA ALA A 52 3.745 10.167 -5.871 1.00 0.00 C ATOM 256 C ALA A 52 2.881 9.602 -4.755 1.00 0.00 C ATOM 257 O ALA A 52 1.693 9.899 -4.668 1.00 0.00 O ATOM 258 CB ALA A 52 3.960 9.127 -6.954 1.00 0.00 C ATOM 0 H ALA A 52 5.829 10.092 -5.653 1.00 0.00 H new ATOM 0 HA ALA A 52 3.224 11.019 -6.309 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.995 8.790 -7.331 1.00 0.00 H new ATOM 0 HB2 ALA A 52 4.536 9.565 -7.770 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.505 8.278 -6.540 1.00 0.00 H new ATOM 264 N VAL A 53 3.489 8.792 -3.900 1.00 0.00 N ATOM 265 CA VAL A 53 2.778 8.190 -2.780 1.00 0.00 C ATOM 266 C VAL A 53 2.177 9.268 -1.889 1.00 0.00 C ATOM 267 O VAL A 53 1.028 9.166 -1.461 1.00 0.00 O ATOM 268 CB VAL A 53 3.708 7.286 -1.944 1.00 0.00 C ATOM 269 CG1 VAL A 53 2.994 6.762 -0.707 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.225 6.136 -2.792 1.00 0.00 C ATOM 0 H VAL A 53 4.475 8.536 -3.960 1.00 0.00 H new ATOM 0 HA VAL A 53 1.978 7.575 -3.192 1.00 0.00 H new ATOM 0 HB VAL A 53 4.557 7.884 -1.611 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.673 6.128 -0.136 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.675 7.601 -0.088 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.122 6.181 -1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.880 5.506 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.384 5.544 -3.154 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.782 6.532 -3.641 1.00 0.00 H new ATOM 280 N GLU A 54 2.959 10.307 -1.622 1.00 0.00 N ATOM 281 CA GLU A 54 2.495 11.407 -0.791 1.00 0.00 C ATOM 282 C GLU A 54 1.377 12.169 -1.498 1.00 0.00 C ATOM 283 O GLU A 54 0.437 12.646 -0.863 1.00 0.00 O ATOM 284 CB GLU A 54 3.661 12.341 -0.431 1.00 0.00 C ATOM 285 CG GLU A 54 4.062 13.312 -1.533 1.00 0.00 C ATOM 286 CD GLU A 54 4.763 14.542 -0.994 1.00 0.00 C ATOM 287 OE1 GLU A 54 5.968 14.448 -0.676 1.00 0.00 O ATOM 288 OE2 GLU A 54 4.108 15.601 -0.889 1.00 0.00 O ATOM 0 H GLU A 54 3.913 10.409 -1.968 1.00 0.00 H new ATOM 0 HA GLU A 54 2.094 11.000 0.137 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.390 12.912 0.457 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.527 11.734 -0.168 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.718 12.804 -2.240 1.00 0.00 H new ATOM 0 HG3 GLU A 54 3.173 13.617 -2.086 1.00 0.00 H new ATOM 295 N ASN A 55 1.480 12.263 -2.821 1.00 0.00 N ATOM 296 CA ASN A 55 0.471 12.949 -3.622 1.00 0.00 C ATOM 297 C ASN A 55 -0.805 12.116 -3.685 1.00 0.00 C ATOM 298 O ASN A 55 -1.915 12.651 -3.690 1.00 0.00 O ATOM 299 CB ASN A 55 0.997 13.200 -5.039 1.00 0.00 C ATOM 300 CG ASN A 55 2.212 14.106 -5.055 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.344 15.002 -4.221 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.107 13.876 -6.009 1.00 0.00 N ATOM 0 H ASN A 55 2.252 11.873 -3.361 1.00 0.00 H new ATOM 0 HA ASN A 55 0.248 13.907 -3.153 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.252 12.247 -5.502 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.207 13.646 -5.643 1.00 0.00 H new ATOM 0 HD21 ASN A 55 3.945 14.453 -6.072 1.00 0.00 H new ATOM 0 HD22 ASN A 55 2.956 13.122 -6.679 1.00 0.00 H new ATOM 309 N TYR A 56 -0.627 10.802 -3.727 1.00 0.00 N ATOM 310 CA TYR A 56 -1.741 9.865 -3.785 1.00 0.00 C ATOM 311 C TYR A 56 -2.461 9.813 -2.439 1.00 0.00 C ATOM 312 O TYR A 56 -3.687 9.906 -2.374 1.00 0.00 O ATOM 313 CB TYR A 56 -1.217 8.478 -4.195 1.00 0.00 C ATOM 314 CG TYR A 56 -1.991 7.309 -3.625 1.00 0.00 C ATOM 315 CD1 TYR A 56 -3.321 7.101 -3.965 1.00 0.00 C ATOM 316 CD2 TYR A 56 -1.390 6.415 -2.746 1.00 0.00 C ATOM 317 CE1 TYR A 56 -4.031 6.038 -3.444 1.00 0.00 C ATOM 318 CE2 TYR A 56 -2.093 5.350 -2.222 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.412 5.166 -2.574 1.00 0.00 C ATOM 320 OH TYR A 56 -4.113 4.109 -2.049 1.00 0.00 O ATOM 0 H TYR A 56 0.291 10.357 -3.722 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.463 10.198 -4.531 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -1.230 8.408 -5.283 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.176 8.392 -3.883 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.808 7.782 -4.648 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -0.356 6.557 -2.469 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -5.066 5.890 -3.716 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -1.612 4.665 -1.540 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.410 4.332 -1.142 1.00 0.00 H new ATOM 330 N LEU A 57 -1.687 9.676 -1.368 1.00 0.00 N ATOM 331 CA LEU A 57 -2.245 9.626 -0.023 1.00 0.00 C ATOM 332 C LEU A 57 -2.837 10.978 0.360 1.00 0.00 C ATOM 333 O LEU A 57 -3.843 11.051 1.065 1.00 0.00 O ATOM 334 CB LEU A 57 -1.162 9.234 0.981 1.00 0.00 C ATOM 335 CG LEU A 57 -0.508 7.876 0.734 1.00 0.00 C ATOM 336 CD1 LEU A 57 0.920 7.869 1.258 1.00 0.00 C ATOM 337 CD2 LEU A 57 -1.326 6.770 1.384 1.00 0.00 C ATOM 0 H LEU A 57 -0.671 9.598 -1.406 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.037 8.878 -0.006 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.386 10.000 0.972 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.598 9.233 1.980 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.477 7.695 -0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.370 6.894 1.074 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.499 8.639 0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.915 8.070 2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.848 5.808 1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.386 6.945 2.458 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.330 6.763 0.960 1.00 0.00 H new ATOM 349 N GLU A 58 -2.200 12.049 -0.109 1.00 0.00 N ATOM 350 CA GLU A 58 -2.661 13.403 0.183 1.00 0.00 C ATOM 351 C GLU A 58 -4.025 13.653 -0.444 1.00 0.00 C ATOM 352 O GLU A 58 -4.949 14.120 0.220 1.00 0.00 O ATOM 353 CB GLU A 58 -1.654 14.434 -0.329 1.00 0.00 C ATOM 354 CG GLU A 58 -0.523 14.718 0.646 1.00 0.00 C ATOM 355 CD GLU A 58 -0.657 16.071 1.319 1.00 0.00 C ATOM 356 OE1 GLU A 58 -1.726 16.338 1.904 1.00 0.00 O ATOM 357 OE2 GLU A 58 0.308 16.861 1.260 1.00 0.00 O ATOM 0 H GLU A 58 -1.364 12.005 -0.692 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.750 13.505 1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.231 14.080 -1.269 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.178 15.365 -0.545 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.501 13.938 1.408 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.428 14.673 0.116 1.00 0.00 H new ATOM 364 N SER A 59 -4.145 13.325 -1.722 1.00 0.00 N ATOM 365 CA SER A 59 -5.402 13.498 -2.438 1.00 0.00 C ATOM 366 C SER A 59 -6.461 12.565 -1.864 1.00 0.00 C ATOM 367 O SER A 59 -7.651 12.882 -1.852 1.00 0.00 O ATOM 368 CB SER A 59 -5.212 13.221 -3.929 1.00 0.00 C ATOM 369 OG SER A 59 -4.637 14.337 -4.586 1.00 0.00 O ATOM 0 H SER A 59 -3.388 12.938 -2.285 1.00 0.00 H new ATOM 0 HA SER A 59 -5.732 14.530 -2.317 1.00 0.00 H new ATOM 0 HB2 SER A 59 -4.573 12.348 -4.061 1.00 0.00 H new ATOM 0 HB3 SER A 59 -6.174 12.983 -4.383 1.00 0.00 H new ATOM 0 HG SER A 59 -4.524 14.134 -5.538 1.00 0.00 H new ATOM 623 N SER A 78 -5.454 7.259 6.212 1.00 0.00 N ATOM 624 CA SER A 78 -4.229 7.900 5.749 1.00 0.00 C ATOM 625 C SER A 78 -3.056 7.548 6.657 1.00 0.00 C ATOM 626 O SER A 78 -3.212 7.411 7.869 1.00 0.00 O ATOM 627 CB SER A 78 -4.406 9.417 5.694 1.00 0.00 C ATOM 628 OG SER A 78 -3.154 10.075 5.605 1.00 0.00 O ATOM 0 HA SER A 78 -4.016 7.532 4.746 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.022 9.683 4.835 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.936 9.757 6.584 1.00 0.00 H new ATOM 0 HG SER A 78 -3.296 11.044 5.570 1.00 0.00 H new ATOM 634 N LEU A 79 -1.883 7.400 6.055 1.00 0.00 N ATOM 635 CA LEU A 79 -0.675 7.058 6.805 1.00 0.00 C ATOM 636 C LEU A 79 0.371 8.165 6.708 1.00 0.00 C ATOM 637 O LEU A 79 0.543 8.782 5.657 1.00 0.00 O ATOM 638 CB LEU A 79 -0.086 5.740 6.295 1.00 0.00 C ATOM 639 CG LEU A 79 -0.324 5.444 4.815 1.00 0.00 C ATOM 640 CD1 LEU A 79 0.654 6.223 3.947 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.209 3.953 4.553 1.00 0.00 C ATOM 0 H LEU A 79 -1.739 7.511 5.051 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.956 6.945 7.852 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.988 5.747 6.478 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.504 4.923 6.883 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.333 5.763 4.554 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.468 5.998 2.897 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.521 7.291 4.118 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.674 5.938 4.203 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.381 3.755 3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.788 3.611 4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.952 3.421 5.147 1.00 0.00 H new ATOM 653 N ALA A 80 1.070 8.406 7.816 1.00 0.00 N ATOM 654 CA ALA A 80 2.106 9.430 7.865 1.00 0.00 C ATOM 655 C ALA A 80 3.456 8.850 7.463 1.00 0.00 C ATOM 656 O ALA A 80 3.857 7.793 7.949 1.00 0.00 O ATOM 657 CB ALA A 80 2.182 10.041 9.256 1.00 0.00 C ATOM 0 H ALA A 80 0.935 7.903 8.693 1.00 0.00 H new ATOM 0 HA ALA A 80 1.846 10.215 7.155 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.960 10.804 9.276 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.223 10.494 9.507 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.417 9.263 9.983 1.00 0.00 H new ATOM 663 N LEU A 81 4.152 9.540 6.567 1.00 0.00 N ATOM 664 CA LEU A 81 5.450 9.080 6.089 1.00 0.00 C ATOM 665 C LEU A 81 6.497 9.082 7.201 1.00 0.00 C ATOM 666 O LEU A 81 6.672 10.077 7.905 1.00 0.00 O ATOM 667 CB LEU A 81 5.923 9.950 4.928 1.00 0.00 C ATOM 668 CG LEU A 81 5.315 9.600 3.568 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.351 8.099 3.323 1.00 0.00 C ATOM 670 CD2 LEU A 81 3.890 10.125 3.472 1.00 0.00 C ATOM 0 H LEU A 81 3.839 10.420 6.157 1.00 0.00 H new ATOM 0 HA LEU A 81 5.328 8.052 5.747 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.692 10.991 5.156 1.00 0.00 H new ATOM 0 HB3 LEU A 81 7.008 9.873 4.855 1.00 0.00 H new ATOM 0 HG LEU A 81 5.915 10.080 2.795 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.913 7.879 2.350 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.384 7.752 3.343 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.782 7.590 4.101 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.472 9.868 2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.283 9.675 4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.893 11.209 3.591 1.00 0.00 H new ATOM 682 N ASN A 82 7.192 7.957 7.339 1.00 0.00 N ATOM 683 CA ASN A 82 8.233 7.808 8.352 1.00 0.00 C ATOM 684 C ASN A 82 9.559 7.428 7.702 1.00 0.00 C ATOM 685 O ASN A 82 9.653 7.319 6.480 1.00 0.00 O ATOM 686 CB ASN A 82 7.840 6.745 9.378 1.00 0.00 C ATOM 687 CG ASN A 82 7.062 7.324 10.542 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.578 8.454 10.480 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.941 6.551 11.615 1.00 0.00 N ATOM 0 H ASN A 82 7.052 7.130 6.758 1.00 0.00 H new ATOM 0 HA ASN A 82 8.347 8.765 8.862 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.240 5.977 8.890 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.739 6.256 9.753 1.00 0.00 H new ATOM 0 HD21 ASN A 82 6.431 6.888 12.431 1.00 0.00 H new ATOM 0 HD22 ASN A 82 7.359 5.620 11.623 1.00 0.00 H new ATOM 696 N ALA A 83 10.581 7.231 8.525 1.00 0.00 N ATOM 697 CA ALA A 83 11.900 6.866 8.021 1.00 0.00 C ATOM 698 C ALA A 83 11.858 5.545 7.260 1.00 0.00 C ATOM 699 O ALA A 83 12.601 5.354 6.298 1.00 0.00 O ATOM 700 CB ALA A 83 12.907 6.791 9.156 1.00 0.00 C ATOM 0 H ALA A 83 10.523 7.317 9.540 1.00 0.00 H new ATOM 0 HA ALA A 83 12.215 7.645 7.326 1.00 0.00 H new ATOM 0 HB1 ALA A 83 13.884 6.517 8.758 1.00 0.00 H new ATOM 0 HB2 ALA A 83 12.974 7.762 9.647 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.586 6.040 9.878 1.00 0.00 H new ATOM 706 N GLU A 84 10.980 4.638 7.682 1.00 0.00 N ATOM 707 CA GLU A 84 10.849 3.353 7.017 1.00 0.00 C ATOM 708 C GLU A 84 10.242 3.541 5.633 1.00 0.00 C ATOM 709 O GLU A 84 10.409 2.700 4.752 1.00 0.00 O ATOM 710 CB GLU A 84 9.991 2.400 7.851 1.00 0.00 C ATOM 711 CG GLU A 84 10.573 1.000 7.963 1.00 0.00 C ATOM 712 CD GLU A 84 10.416 0.199 6.685 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.613 0.610 5.822 1.00 0.00 O ATOM 714 OE2 GLU A 84 11.099 -0.838 6.547 1.00 0.00 O ATOM 0 H GLU A 84 10.354 4.772 8.476 1.00 0.00 H new ATOM 0 HA GLU A 84 11.841 2.914 6.910 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.869 2.815 8.851 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.997 2.337 7.408 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.631 1.070 8.216 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.084 0.471 8.781 1.00 0.00 H new ATOM 721 N SER A 85 9.552 4.668 5.446 1.00 0.00 N ATOM 722 CA SER A 85 8.931 4.989 4.166 1.00 0.00 C ATOM 723 C SER A 85 9.977 5.033 3.055 1.00 0.00 C ATOM 724 O SER A 85 9.640 4.979 1.873 1.00 0.00 O ATOM 725 CB SER A 85 8.204 6.331 4.249 1.00 0.00 C ATOM 726 OG SER A 85 7.289 6.348 5.331 1.00 0.00 O ATOM 0 H SER A 85 9.411 5.373 6.169 1.00 0.00 H new ATOM 0 HA SER A 85 8.208 4.207 3.934 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.930 7.135 4.370 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.673 6.519 3.316 1.00 0.00 H new ATOM 0 HG SER A 85 6.383 6.184 4.996 1.00 0.00 H new ATOM 732 N ASN A 86 11.247 5.121 3.439 1.00 0.00 N ATOM 733 CA ASN A 86 12.333 5.155 2.473 1.00 0.00 C ATOM 734 C ASN A 86 12.803 3.743 2.144 1.00 0.00 C ATOM 735 O ASN A 86 13.548 3.534 1.189 1.00 0.00 O ATOM 736 CB ASN A 86 13.504 5.974 3.008 1.00 0.00 C ATOM 737 CG ASN A 86 13.060 7.289 3.616 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.312 7.317 4.592 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.524 8.387 3.037 1.00 0.00 N ATOM 0 H ASN A 86 11.546 5.170 4.413 1.00 0.00 H new ATOM 0 HA ASN A 86 11.959 5.625 1.564 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.038 5.392 3.759 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.207 6.170 2.198 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.263 9.304 3.399 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.142 8.315 2.229 1.00 0.00 H new ATOM 746 N ASN A 87 12.363 2.774 2.940 1.00 0.00 N ATOM 747 CA ASN A 87 12.736 1.385 2.724 1.00 0.00 C ATOM 748 C ASN A 87 11.519 0.572 2.306 1.00 0.00 C ATOM 749 O ASN A 87 10.651 0.274 3.125 1.00 0.00 O ATOM 750 CB ASN A 87 13.341 0.792 3.999 1.00 0.00 C ATOM 751 CG ASN A 87 14.242 1.767 4.731 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.195 2.299 4.162 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.941 2.006 6.002 1.00 0.00 N ATOM 0 H ASN A 87 11.748 2.927 3.739 1.00 0.00 H new ATOM 0 HA ASN A 87 13.480 1.347 1.928 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.537 0.477 4.665 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.911 -0.101 3.744 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.510 2.654 6.548 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.141 1.542 6.433 1.00 0.00 H new ATOM 760 N VAL A 88 11.463 0.216 1.028 1.00 0.00 N ATOM 761 CA VAL A 88 10.347 -0.560 0.503 1.00 0.00 C ATOM 762 C VAL A 88 10.523 -2.046 0.789 1.00 0.00 C ATOM 763 O VAL A 88 11.629 -2.578 0.719 1.00 0.00 O ATOM 764 CB VAL A 88 10.182 -0.356 -1.015 1.00 0.00 C ATOM 765 CG1 VAL A 88 8.927 -1.057 -1.516 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.141 1.126 -1.355 1.00 0.00 C ATOM 0 H VAL A 88 12.176 0.452 0.338 1.00 0.00 H new ATOM 0 HA VAL A 88 9.451 -0.201 1.009 1.00 0.00 H new ATOM 0 HB VAL A 88 11.044 -0.798 -1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.828 -0.901 -2.590 1.00 0.00 H new ATOM 0 HG12 VAL A 88 8.999 -2.125 -1.309 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.054 -0.647 -1.008 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.024 1.249 -2.432 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.300 1.594 -0.843 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.069 1.599 -1.034 1.00 0.00 H new ATOM 776 N MET A 89 9.414 -2.704 1.109 1.00 0.00 N ATOM 777 CA MET A 89 9.418 -4.131 1.410 1.00 0.00 C ATOM 778 C MET A 89 8.628 -4.901 0.353 1.00 0.00 C ATOM 779 O MET A 89 7.482 -4.566 0.058 1.00 0.00 O ATOM 780 CB MET A 89 8.831 -4.375 2.804 1.00 0.00 C ATOM 781 CG MET A 89 9.878 -4.713 3.853 1.00 0.00 C ATOM 782 SD MET A 89 10.544 -3.249 4.667 1.00 0.00 S ATOM 783 CE MET A 89 10.455 -3.746 6.385 1.00 0.00 C ATOM 0 H MET A 89 8.494 -2.268 1.167 1.00 0.00 H new ATOM 0 HA MET A 89 10.447 -4.490 1.397 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.285 -3.486 3.120 1.00 0.00 H new ATOM 0 HB3 MET A 89 8.109 -5.189 2.748 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.437 -5.371 4.602 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.692 -5.265 3.383 1.00 0.00 H new ATOM 0 HE1 MET A 89 10.065 -2.922 6.982 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.795 -4.608 6.481 1.00 0.00 H new ATOM 0 HE3 MET A 89 11.451 -4.011 6.739 1.00 0.00 H new ATOM 793 N MET A 90 9.252 -5.928 -0.219 1.00 0.00 N ATOM 794 CA MET A 90 8.608 -6.737 -1.252 1.00 0.00 C ATOM 795 C MET A 90 8.193 -8.095 -0.697 1.00 0.00 C ATOM 796 O MET A 90 8.996 -8.791 -0.077 1.00 0.00 O ATOM 797 CB MET A 90 9.539 -6.943 -2.460 1.00 0.00 C ATOM 798 CG MET A 90 10.720 -5.979 -2.533 1.00 0.00 C ATOM 799 SD MET A 90 10.602 -4.833 -3.919 1.00 0.00 S ATOM 800 CE MET A 90 10.475 -3.278 -3.044 1.00 0.00 C ATOM 0 H MET A 90 10.201 -6.220 0.014 1.00 0.00 H new ATOM 0 HA MET A 90 7.720 -6.196 -1.580 1.00 0.00 H new ATOM 0 HB2 MET A 90 9.922 -7.963 -2.435 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.952 -6.845 -3.373 1.00 0.00 H new ATOM 0 HG2 MET A 90 10.779 -5.413 -1.603 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.645 -6.550 -2.617 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.626 -2.454 -3.742 1.00 0.00 H new ATOM 0 HE2 MET A 90 9.487 -3.194 -2.592 1.00 0.00 H new ATOM 0 HE3 MET A 90 11.235 -3.236 -2.264 1.00 0.00 H new ATOM 810 N LEU A 91 6.937 -8.471 -0.920 1.00 0.00 N ATOM 811 CA LEU A 91 6.437 -9.751 -0.427 1.00 0.00 C ATOM 812 C LEU A 91 5.247 -10.251 -1.228 1.00 0.00 C ATOM 813 O LEU A 91 4.377 -9.475 -1.620 1.00 0.00 O ATOM 814 CB LEU A 91 6.007 -9.621 1.034 1.00 0.00 C ATOM 815 CG LEU A 91 4.868 -8.626 1.273 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.750 -9.273 2.076 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.381 -7.380 1.977 1.00 0.00 C ATOM 0 H LEU A 91 6.253 -7.915 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 91 7.253 -10.466 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.699 -10.601 1.398 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.869 -9.317 1.628 1.00 0.00 H new ATOM 0 HG LEU A 91 4.466 -8.329 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.950 -8.549 2.235 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.359 -10.131 1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.138 -9.603 3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.555 -6.687 2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.813 -7.657 2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.143 -6.902 1.361 1.00 0.00 H new ATOM 829 N THR A 92 5.184 -11.563 -1.412 1.00 0.00 N ATOM 830 CA THR A 92 4.059 -12.174 -2.097 1.00 0.00 C ATOM 831 C THR A 92 3.027 -12.518 -1.037 1.00 0.00 C ATOM 832 O THR A 92 3.284 -13.346 -0.163 1.00 0.00 O ATOM 833 CB THR A 92 4.494 -13.431 -2.853 1.00 0.00 C ATOM 834 OG1 THR A 92 3.391 -14.028 -3.511 1.00 0.00 O ATOM 835 CG2 THR A 92 5.118 -14.480 -1.960 1.00 0.00 C ATOM 0 H THR A 92 5.897 -12.220 -1.097 1.00 0.00 H new ATOM 0 HA THR A 92 3.644 -11.488 -2.836 1.00 0.00 H new ATOM 0 HB THR A 92 5.244 -13.093 -3.568 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.690 -14.829 -3.990 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.404 -15.345 -2.559 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.002 -14.066 -1.476 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.398 -14.786 -1.201 1.00 0.00 H new ATOM 843 N HIS A 93 1.886 -11.845 -1.069 1.00 0.00 N ATOM 844 CA HIS A 93 0.873 -12.066 -0.048 1.00 0.00 C ATOM 845 C HIS A 93 -0.514 -11.636 -0.511 1.00 0.00 C ATOM 846 O HIS A 93 -0.656 -10.755 -1.358 1.00 0.00 O ATOM 847 CB HIS A 93 1.277 -11.275 1.199 1.00 0.00 C ATOM 848 CG HIS A 93 1.121 -12.021 2.484 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.098 -12.433 2.977 1.00 0.00 N ATOM 850 CD2 HIS A 93 2.046 -12.406 3.395 1.00 0.00 C ATOM 851 CE1 HIS A 93 0.081 -13.038 4.136 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.373 -13.038 4.412 1.00 0.00 N ATOM 0 H HIS A 93 1.641 -11.153 -1.777 1.00 0.00 H new ATOM 0 HA HIS A 93 0.817 -13.133 0.166 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.317 -10.967 1.097 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.678 -10.366 1.247 1.00 0.00 H new ATOM 0 HD2 HIS A 93 3.112 -12.246 3.333 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.697 -13.461 4.754 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.801 -13.442 5.245 1.00 0.00 H new ATOM 861 N ALA A 94 -1.537 -12.257 0.071 1.00 0.00 N ATOM 862 CA ALA A 94 -2.918 -11.935 -0.258 1.00 0.00 C ATOM 863 C ALA A 94 -3.351 -10.670 0.473 1.00 0.00 C ATOM 864 O ALA A 94 -3.171 -10.549 1.684 1.00 0.00 O ATOM 865 CB ALA A 94 -3.834 -13.094 0.102 1.00 0.00 C ATOM 0 H ALA A 94 -1.432 -12.988 0.775 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.989 -11.760 -1.332 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.863 -12.837 -0.150 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.535 -13.981 -0.456 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.762 -13.296 1.171 1.00 0.00 H new ATOM 871 N ILE A 95 -3.911 -9.722 -0.270 1.00 0.00 N ATOM 872 CA ILE A 95 -4.352 -8.462 0.314 1.00 0.00 C ATOM 873 C ILE A 95 -5.827 -8.500 0.689 1.00 0.00 C ATOM 874 O ILE A 95 -6.687 -8.756 -0.155 1.00 0.00 O ATOM 875 CB ILE A 95 -4.112 -7.283 -0.648 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.756 -7.429 -1.340 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.188 -5.963 0.104 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.586 -7.439 -0.380 1.00 0.00 C ATOM 0 H ILE A 95 -4.070 -9.802 -1.274 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.760 -8.318 1.218 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.891 -7.291 -1.410 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.750 -8.353 -1.918 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.628 -6.610 -2.048 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.016 -5.139 -0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.174 -5.858 0.556 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.428 -5.945 0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.657 -7.545 -0.940 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.567 -6.504 0.180 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.690 -8.275 0.312 1.00 0.00 H new ATOM 890 N THR A 96 -6.114 -8.228 1.957 1.00 0.00 N ATOM 891 CA THR A 96 -7.487 -8.216 2.443 1.00 0.00 C ATOM 892 C THR A 96 -8.069 -6.813 2.315 1.00 0.00 C ATOM 893 O THR A 96 -7.335 -5.827 2.335 1.00 0.00 O ATOM 894 CB THR A 96 -7.547 -8.684 3.901 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.300 -9.215 4.311 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.600 -9.743 4.143 1.00 0.00 C ATOM 0 H THR A 96 -5.413 -8.013 2.666 1.00 0.00 H new ATOM 0 HA THR A 96 -8.078 -8.904 1.838 1.00 0.00 H new ATOM 0 HB THR A 96 -7.805 -7.797 4.480 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.665 -8.483 4.458 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.591 -10.031 5.194 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.582 -9.346 3.884 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.387 -10.616 3.526 1.00 0.00 H new ATOM 904 N ARG A 97 -9.386 -6.725 2.170 1.00 0.00 N ATOM 905 CA ARG A 97 -10.043 -5.431 2.026 1.00 0.00 C ATOM 906 C ARG A 97 -11.083 -5.205 3.116 1.00 0.00 C ATOM 907 O ARG A 97 -12.129 -5.854 3.139 1.00 0.00 O ATOM 908 CB ARG A 97 -10.700 -5.324 0.649 1.00 0.00 C ATOM 909 CG ARG A 97 -10.707 -3.912 0.086 1.00 0.00 C ATOM 910 CD ARG A 97 -11.128 -3.896 -1.375 1.00 0.00 C ATOM 911 NE ARG A 97 -11.421 -2.544 -1.847 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.128 -2.279 -2.943 1.00 0.00 C ATOM 913 NH1 ARG A 97 -12.613 -3.268 -3.684 1.00 0.00 N ATOM 914 NH2 ARG A 97 -12.350 -1.022 -3.301 1.00 0.00 N ATOM 0 H ARG A 97 -10.016 -7.527 2.149 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.280 -4.659 2.125 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.177 -5.981 -0.046 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -11.726 -5.684 0.716 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.387 -3.290 0.668 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.713 -3.475 0.184 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.335 -4.329 -1.985 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.009 -4.524 -1.505 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.063 -1.758 -1.305 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.445 -4.237 -3.414 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.154 -3.059 -4.523 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -11.979 -0.258 -2.736 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -12.892 -0.819 -4.141 1.00 0.00 H new ATOM 928 N TYR A 98 -10.793 -4.264 4.007 1.00 0.00 N ATOM 929 CA TYR A 98 -11.704 -3.927 5.092 1.00 0.00 C ATOM 930 C TYR A 98 -12.314 -2.550 4.854 1.00 0.00 C ATOM 931 O TYR A 98 -11.693 -1.528 5.143 1.00 0.00 O ATOM 932 CB TYR A 98 -10.967 -3.945 6.433 1.00 0.00 C ATOM 933 CG TYR A 98 -10.851 -5.322 7.045 1.00 0.00 C ATOM 934 CD1 TYR A 98 -10.009 -6.279 6.494 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.583 -5.664 8.176 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.900 -7.540 7.051 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.478 -6.922 8.739 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.636 -7.855 8.173 1.00 0.00 C ATOM 939 OH TYR A 98 -10.530 -9.108 8.732 1.00 0.00 O ATOM 0 H TYR A 98 -9.930 -3.720 3.998 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.501 -4.670 5.120 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.967 -3.534 6.293 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.487 -3.289 7.132 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.430 -6.034 5.616 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.244 -4.936 8.622 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -9.242 -8.274 6.609 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.053 -7.173 9.618 1.00 0.00 H new ATOM 0 HH TYR A 98 -11.113 -9.166 9.517 1.00 0.00 H new ATOM 949 N GLY A 99 -13.527 -2.530 4.315 1.00 0.00 N ATOM 950 CA GLY A 99 -14.190 -1.270 4.036 1.00 0.00 C ATOM 951 C GLY A 99 -15.050 -0.790 5.182 1.00 0.00 C ATOM 952 O GLY A 99 -15.684 -1.588 5.871 1.00 0.00 O ATOM 0 H GLY A 99 -14.063 -3.362 4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.439 -0.513 3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.809 -1.381 3.146 1.00 0.00 H new ATOM 956 N ILE A 100 -15.073 0.523 5.381 1.00 0.00 N ATOM 957 CA ILE A 100 -15.868 1.112 6.450 1.00 0.00 C ATOM 958 C ILE A 100 -16.424 2.474 6.055 1.00 0.00 C ATOM 959 O ILE A 100 -17.591 2.774 6.303 1.00 0.00 O ATOM 960 CB ILE A 100 -15.064 1.262 7.757 1.00 0.00 C ATOM 961 CG1 ILE A 100 -13.697 1.894 7.482 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.903 -0.089 8.439 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.708 3.405 7.545 1.00 0.00 C ATOM 0 H ILE A 100 -14.553 1.196 4.819 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.694 0.422 6.621 1.00 0.00 H new ATOM 0 HB ILE A 100 -15.615 1.923 8.426 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.977 1.513 8.206 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -13.353 1.582 6.496 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -14.333 0.034 9.360 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.886 -0.498 8.672 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -14.374 -0.772 7.774 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.707 3.785 7.340 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -14.403 3.795 6.802 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -14.022 3.725 8.539 1.00 0.00 H new ATOM 975 N SER A 101 -15.581 3.297 5.444 1.00 0.00 N ATOM 976 CA SER A 101 -15.985 4.632 5.016 1.00 0.00 C ATOM 977 C SER A 101 -17.313 4.592 4.268 1.00 0.00 C ATOM 978 O SER A 101 -18.077 5.558 4.288 1.00 0.00 O ATOM 979 CB SER A 101 -14.907 5.248 4.126 1.00 0.00 C ATOM 980 OG SER A 101 -14.741 6.628 4.404 1.00 0.00 O ATOM 0 H SER A 101 -14.611 3.063 5.233 1.00 0.00 H new ATOM 0 HA SER A 101 -16.112 5.247 5.907 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.962 4.727 4.281 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.177 5.115 3.078 1.00 0.00 H new ATOM 0 HG SER A 101 -15.078 7.156 3.651 1.00 0.00 H new ATOM 986 N THR A 102 -17.580 3.470 3.608 1.00 0.00 N ATOM 987 CA THR A 102 -18.812 3.306 2.848 1.00 0.00 C ATOM 988 C THR A 102 -19.041 1.841 2.487 1.00 0.00 C ATOM 989 O THR A 102 -18.137 1.014 2.606 1.00 0.00 O ATOM 990 CB THR A 102 -18.750 4.146 1.573 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.308 5.461 1.857 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.079 4.254 0.858 1.00 0.00 C ATOM 0 H THR A 102 -16.959 2.661 3.585 1.00 0.00 H new ATOM 0 HA THR A 102 -19.643 3.642 3.468 1.00 0.00 H new ATOM 0 HB THR A 102 -18.048 3.625 0.922 1.00 0.00 H new ATOM 0 HG1 THR A 102 -18.701 5.763 2.702 1.00 0.00 H new ATOM 0 HG21 THR A 102 -19.962 4.864 -0.038 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.423 3.259 0.577 1.00 0.00 H new ATOM 0 HG23 THR A 102 -20.811 4.718 1.519 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.253 1.529 2.038 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.596 0.166 1.652 1.00 0.00 C ATOM 1002 C ASP A 103 -20.543 -0.003 0.135 1.00 0.00 C ATOM 1003 O ASP A 103 -21.136 -0.931 -0.416 1.00 0.00 O ATOM 1004 CB ASP A 103 -21.989 -0.198 2.167 1.00 0.00 C ATOM 1005 CG ASP A 103 -21.956 -0.787 3.562 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -21.725 -0.023 4.524 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -22.159 -2.013 3.695 1.00 0.00 O ATOM 0 H ASP A 103 -21.013 2.201 1.933 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.863 -0.505 2.100 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.617 0.693 2.167 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.450 -0.913 1.485 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.826 0.895 -0.535 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.691 0.842 -1.987 1.00 0.00 C ATOM 1014 C ASP A 104 -18.219 0.856 -2.384 1.00 0.00 C ATOM 1015 O ASP A 104 -17.434 1.619 -1.826 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.422 2.023 -2.632 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.492 1.576 -3.609 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -21.198 1.507 -4.821 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -22.623 1.294 -3.161 1.00 0.00 O ATOM 0 H ASP A 104 -19.329 1.669 -0.094 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.140 -0.085 -2.343 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.878 2.634 -1.853 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -19.700 2.654 -3.151 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.820 0.007 -3.352 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.433 -0.083 -3.819 1.00 0.00 C ATOM 1026 C PRO A 105 -15.711 1.259 -3.861 1.00 0.00 C ATOM 1027 O PRO A 105 -15.699 1.937 -4.888 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.606 -0.650 -5.220 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.761 -1.579 -5.081 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.691 -0.943 -4.075 1.00 0.00 C ATOM 0 HA PRO A 105 -15.814 -0.684 -3.153 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.808 0.135 -5.948 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.710 -1.172 -5.555 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.262 -1.724 -6.038 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.432 -2.561 -4.742 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.522 -0.434 -4.563 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -19.122 -1.684 -3.402 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.095 1.629 -2.740 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.356 2.882 -2.661 1.00 0.00 C ATOM 1040 C ASN A 106 -13.344 2.872 -1.515 1.00 0.00 C ATOM 1041 O ASN A 106 -13.049 1.823 -0.942 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.311 4.076 -2.541 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.256 3.970 -1.363 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -15.961 3.308 -0.369 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -17.403 4.629 -1.475 1.00 0.00 N ATOM 0 H ASN A 106 -15.094 1.081 -1.880 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.794 2.988 -3.589 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -14.727 4.992 -2.448 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.893 4.161 -3.459 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.084 4.599 -0.716 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.603 5.165 -2.320 1.00 0.00 H new ATOM 1052 N LYS A 107 -12.795 4.048 -1.214 1.00 0.00 N ATOM 1053 CA LYS A 107 -11.784 4.205 -0.166 1.00 0.00 C ATOM 1054 C LYS A 107 -12.076 3.343 1.063 1.00 0.00 C ATOM 1055 O LYS A 107 -13.019 3.590 1.812 1.00 0.00 O ATOM 1056 CB LYS A 107 -11.654 5.696 0.201 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.414 5.986 1.678 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.692 6.441 2.367 1.00 0.00 C ATOM 1059 CE LYS A 107 -13.158 7.793 1.848 1.00 0.00 C ATOM 1060 NZ LYS A 107 -13.047 8.859 2.882 1.00 0.00 N ATOM 0 H LYS A 107 -13.037 4.918 -1.688 1.00 0.00 H new ATOM 0 HA LYS A 107 -10.830 3.850 -0.556 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -10.833 6.124 -0.374 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -12.563 6.210 -0.110 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.032 5.091 2.169 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.649 6.756 1.780 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -13.475 5.700 2.208 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -12.524 6.502 3.442 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.565 8.070 0.977 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -14.194 7.716 1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -13.453 9.743 2.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -13.565 8.569 3.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -12.046 9.010 3.119 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.235 2.329 1.241 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.335 1.386 2.348 1.00 0.00 C ATOM 1076 C TRP A 108 -9.935 1.008 2.835 1.00 0.00 C ATOM 1077 O TRP A 108 -8.936 1.452 2.270 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.075 0.135 1.897 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.518 0.377 1.582 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.351 1.302 2.144 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.296 -0.334 0.628 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.602 1.204 1.584 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.594 0.199 0.657 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.013 -1.373 -0.246 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.611 -0.280 -0.158 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.020 -1.852 -1.061 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.309 -1.306 -1.009 1.00 0.00 C ATOM 0 H TRP A 108 -10.455 2.137 0.612 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.886 1.853 3.164 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.582 -0.271 1.014 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.004 -0.622 2.678 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.069 2.005 2.913 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.405 1.786 1.821 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.022 -1.800 -0.289 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.604 0.143 -0.121 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -14.811 -2.659 -1.748 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.079 -1.703 -1.654 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.862 0.189 3.880 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.571 -0.238 4.423 1.00 0.00 C ATOM 1100 C ARG A 109 -8.199 -1.613 3.890 1.00 0.00 C ATOM 1101 O ARG A 109 -9.072 -2.411 3.552 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.629 -0.315 5.949 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.343 0.996 6.659 1.00 0.00 C ATOM 1104 CD ARG A 109 -9.607 1.820 6.867 1.00 0.00 C ATOM 1105 NE ARG A 109 -10.788 0.982 7.061 1.00 0.00 N ATOM 1106 CZ ARG A 109 -10.963 0.180 8.109 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.072 0.153 9.092 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -12.039 -0.590 8.177 1.00 0.00 N ATOM 0 H ARG A 109 -10.674 -0.191 4.367 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.825 0.495 4.117 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.618 -0.665 6.245 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -7.912 -1.062 6.290 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.880 0.792 7.625 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.625 1.574 6.077 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -9.477 2.468 7.734 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -9.762 2.468 6.005 1.00 0.00 H new ATOM 0 HE ARG A 109 -11.521 1.013 6.352 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -9.246 0.750 9.048 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.213 -0.464 9.892 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -12.731 -0.567 7.428 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -12.176 -1.206 8.979 1.00 0.00 H new ATOM 1122 N TYR A 110 -6.901 -1.898 3.833 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.437 -3.190 3.358 1.00 0.00 C ATOM 1124 C TYR A 110 -5.628 -3.877 4.444 1.00 0.00 C ATOM 1125 O TYR A 110 -5.219 -3.237 5.412 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.619 -3.029 2.081 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.477 -2.764 0.867 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.004 -1.500 0.630 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -6.766 -3.777 -0.037 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -7.795 -1.254 -0.476 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -7.555 -3.537 -1.148 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.066 -2.275 -1.362 1.00 0.00 C ATOM 1133 OH TYR A 110 -8.852 -2.033 -2.465 1.00 0.00 O ATOM 0 H TYR A 110 -6.159 -1.254 4.109 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.299 -3.814 3.122 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -4.913 -2.208 2.208 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.031 -3.932 1.915 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.792 -0.698 1.321 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.369 -4.767 0.129 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.199 -0.267 -0.646 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -7.769 -4.335 -1.844 1.00 0.00 H new ATOM 0 HH TYR A 110 -8.282 -1.908 -3.252 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.423 -5.180 4.309 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.687 -5.922 5.322 1.00 0.00 C ATOM 1145 C TYR A 111 -3.764 -6.971 4.720 1.00 0.00 C ATOM 1146 O TYR A 111 -4.175 -7.784 3.892 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.663 -6.592 6.289 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.156 -5.670 7.381 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -6.985 -4.592 7.087 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -5.784 -5.870 8.704 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -7.431 -3.741 8.080 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -6.228 -5.026 9.704 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.051 -3.963 9.388 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.493 -3.119 10.381 1.00 0.00 O ATOM 0 H TYR A 111 -5.750 -5.738 3.520 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.063 -5.205 5.855 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.518 -6.968 5.728 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.177 -7.455 6.744 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -7.285 -4.417 6.064 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -5.138 -6.698 8.955 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -8.073 -2.908 7.834 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -5.933 -5.197 10.729 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.136 -3.415 11.244 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.517 -6.956 5.172 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.518 -7.910 4.723 1.00 0.00 C ATOM 1166 C LEU A 112 -1.262 -8.923 5.830 1.00 0.00 C ATOM 1167 O LEU A 112 -0.612 -8.610 6.828 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.223 -7.183 4.361 1.00 0.00 C ATOM 1169 CG LEU A 112 0.702 -7.931 3.404 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.882 -9.376 3.845 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.159 -7.864 1.987 1.00 0.00 C ATOM 0 H LEU A 112 -2.173 -6.284 5.858 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.882 -8.428 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.478 -6.222 3.915 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.325 -6.973 5.280 1.00 0.00 H new ATOM 0 HG LEU A 112 1.680 -7.450 3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.545 -9.889 3.148 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.317 -9.400 4.844 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.087 -9.876 3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.828 -8.401 1.315 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.831 -8.320 1.955 1.00 0.00 H new ATOM 0 HD23 LEU A 112 0.089 -6.823 1.673 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.797 -10.129 5.670 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.639 -11.161 6.683 1.00 0.00 C ATOM 1185 C ASP A 113 -2.368 -10.734 7.965 1.00 0.00 C ATOM 1186 O ASP A 113 -3.563 -10.438 7.925 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.149 -11.426 6.939 1.00 0.00 C ATOM 1188 CG ASP A 113 0.093 -12.745 7.647 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.946 -13.524 7.174 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.572 -12.999 8.673 1.00 0.00 O ATOM 0 H ASP A 113 -2.340 -10.413 4.854 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.082 -12.093 6.334 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.386 -11.424 5.989 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.263 -10.614 7.539 1.00 0.00 H new ATOM 1195 N SER A 114 -1.662 -10.684 9.094 1.00 0.00 N ATOM 1196 CA SER A 114 -2.271 -10.273 10.352 1.00 0.00 C ATOM 1197 C SER A 114 -1.995 -8.797 10.636 1.00 0.00 C ATOM 1198 O SER A 114 -2.110 -8.347 11.775 1.00 0.00 O ATOM 1199 CB SER A 114 -1.745 -11.133 11.503 1.00 0.00 C ATOM 1200 OG SER A 114 -2.033 -12.504 11.289 1.00 0.00 O ATOM 0 H SER A 114 -0.672 -10.922 9.160 1.00 0.00 H new ATOM 0 HA SER A 114 -3.349 -10.412 10.267 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.668 -10.996 11.601 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.195 -10.806 12.440 1.00 0.00 H new ATOM 0 HG SER A 114 -1.586 -12.809 10.472 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.620 -8.048 9.599 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.320 -6.629 9.754 1.00 0.00 C ATOM 1208 C VAL A 115 -2.173 -5.771 8.825 1.00 0.00 C ATOM 1209 O VAL A 115 -2.632 -6.234 7.781 1.00 0.00 O ATOM 1210 CB VAL A 115 0.167 -6.340 9.478 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.507 -4.898 9.821 1.00 0.00 C ATOM 1212 CG2 VAL A 115 1.051 -7.302 10.257 1.00 0.00 C ATOM 0 H VAL A 115 -1.518 -8.400 8.647 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.552 -6.372 10.787 1.00 0.00 H new ATOM 0 HB VAL A 115 0.354 -6.489 8.414 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.562 -4.715 9.619 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.101 -4.227 9.214 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.303 -4.717 10.876 1.00 0.00 H new ATOM 0 HG21 VAL A 115 2.098 -7.083 10.050 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.861 -7.188 11.324 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.828 -8.326 9.956 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.374 -4.514 9.213 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.165 -3.582 8.418 1.00 0.00 C ATOM 1224 C GLU A 116 -2.273 -2.795 7.463 1.00 0.00 C ATOM 1225 O GLU A 116 -1.222 -2.290 7.856 1.00 0.00 O ATOM 1226 CB GLU A 116 -3.925 -2.618 9.332 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.025 -1.828 10.269 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.027 -2.378 11.681 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -1.936 -2.482 12.280 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -4.120 -2.705 12.190 1.00 0.00 O ATOM 0 H GLU A 116 -1.999 -4.118 10.075 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.881 -4.157 7.832 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.495 -1.922 8.717 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.644 -3.184 9.924 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.006 -1.837 9.881 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.350 -0.788 10.288 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.696 -2.694 6.207 1.00 0.00 N ATOM 1238 CA VAL A 117 -1.926 -1.971 5.203 1.00 0.00 C ATOM 1239 C VAL A 117 -2.818 -1.104 4.318 1.00 0.00 C ATOM 1240 O VAL A 117 -4.053 -1.184 4.371 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.116 -2.929 4.311 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.046 -3.640 5.125 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.037 -3.933 3.631 1.00 0.00 C ATOM 0 H VAL A 117 -3.565 -3.102 5.862 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.240 -1.327 5.753 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.620 -2.344 3.536 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.516 -4.313 4.478 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.631 -2.904 5.558 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.517 -4.214 5.923 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.447 -4.602 3.005 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.563 -4.515 4.388 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -2.761 -3.402 3.013 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.170 -0.267 3.516 1.00 0.00 N ATOM 1254 CA HIS A 118 -2.868 0.643 2.617 1.00 0.00 C ATOM 1255 C HIS A 118 -2.725 0.215 1.162 1.00 0.00 C ATOM 1256 O HIS A 118 -1.631 0.256 0.598 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.304 2.050 2.784 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.026 3.105 2.002 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -3.803 4.075 2.596 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.071 3.358 0.668 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.289 4.875 1.665 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -3.863 4.461 0.490 1.00 0.00 N ATOM 0 H HIS A 118 -1.153 -0.200 3.471 1.00 0.00 H new ATOM 0 HA HIS A 118 -3.927 0.624 2.874 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.332 2.316 3.841 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.256 2.046 2.484 1.00 0.00 H new ATOM 0 HD1 HIS A 118 -3.976 4.162 3.598 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.575 2.794 -0.108 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -4.929 5.727 1.838 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.838 -0.167 0.549 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.833 -0.567 -0.849 1.00 0.00 C ATOM 1273 C LEU A 119 -4.726 0.358 -1.663 1.00 0.00 C ATOM 1274 O LEU A 119 -5.910 0.509 -1.363 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.294 -2.009 -1.022 1.00 0.00 C ATOM 1276 CG LEU A 119 -3.688 -2.702 -2.239 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -2.710 -3.786 -1.816 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -4.771 -3.275 -3.136 1.00 0.00 C ATOM 0 H LEU A 119 -4.753 -0.208 0.998 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.807 -0.494 -1.209 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.036 -2.574 -0.126 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.380 -2.027 -1.108 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.139 -1.953 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -2.292 -4.265 -2.702 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.906 -3.342 -1.230 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.230 -4.530 -1.213 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.311 -3.763 -3.995 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.359 -4.003 -2.577 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.421 -2.471 -3.480 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.175 0.999 -2.703 1.00 0.00 N ATOM 1291 CA PRO A 120 -4.939 1.915 -3.546 1.00 0.00 C ATOM 1292 C PRO A 120 -6.161 1.246 -4.168 1.00 0.00 C ATOM 1293 O PRO A 120 -6.087 0.117 -4.655 1.00 0.00 O ATOM 1294 CB PRO A 120 -3.942 2.346 -4.627 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.841 1.347 -4.568 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.774 0.892 -3.140 1.00 0.00 C ATOM 0 HA PRO A 120 -5.337 2.753 -2.974 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.410 2.358 -5.611 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.570 3.353 -4.439 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.038 0.509 -5.236 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.895 1.789 -4.882 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.400 -0.129 -3.057 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.114 1.523 -2.544 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.312 1.939 -4.142 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.583 1.431 -4.685 1.00 0.00 C ATOM 1306 C PRO A 121 -8.494 0.887 -6.114 1.00 0.00 C ATOM 1307 O PRO A 121 -9.439 0.260 -6.592 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.506 2.661 -4.652 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.615 3.826 -4.378 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.487 3.279 -3.561 1.00 0.00 C ATOM 0 HA PRO A 121 -8.929 0.579 -4.099 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.030 2.783 -5.600 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.267 2.559 -3.878 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.250 4.268 -5.305 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.147 4.610 -3.839 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.585 3.885 -3.653 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.735 3.235 -2.500 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.386 1.133 -6.807 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.250 0.657 -8.186 1.00 0.00 C ATOM 1320 C PHE A 122 -6.670 -0.754 -8.264 1.00 0.00 C ATOM 1321 O PHE A 122 -6.643 -1.352 -9.339 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.409 1.614 -9.049 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.610 2.636 -8.286 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.239 3.626 -7.546 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.224 2.611 -8.323 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.501 4.569 -6.857 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.482 3.552 -7.635 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.121 4.532 -6.901 1.00 0.00 C ATOM 0 H PHE A 122 -6.582 1.648 -6.448 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.263 0.629 -8.586 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.725 1.022 -9.657 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -7.074 2.137 -9.736 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.318 3.660 -7.508 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.719 1.848 -8.896 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.003 5.335 -6.284 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.403 3.521 -7.671 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.543 5.268 -6.362 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.208 -1.292 -7.140 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.639 -2.633 -7.135 1.00 0.00 C ATOM 1340 C TRP A 123 -6.620 -3.663 -6.580 1.00 0.00 C ATOM 1341 O TRP A 123 -6.349 -4.863 -6.614 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.358 -2.642 -6.319 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.285 -1.774 -6.888 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.224 -1.226 -8.137 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.121 -1.351 -6.204 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.077 -0.468 -8.257 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.387 -0.532 -7.074 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.637 -1.586 -4.927 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.186 0.057 -6.693 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.452 -1.006 -4.551 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.260 -0.192 -5.427 1.00 0.00 C ATOM 0 H TRP A 123 -6.216 -0.827 -6.232 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.421 -2.909 -8.167 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.581 -2.313 -5.304 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.988 -3.665 -6.249 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.962 -1.365 -8.914 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.791 0.052 -9.086 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.183 -2.215 -4.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.371 0.686 -7.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.065 -1.184 -3.559 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.187 0.253 -5.097 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.761 -3.199 -6.075 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.770 -4.100 -5.525 1.00 0.00 C ATOM 1364 C GLU A 124 -9.075 -5.229 -6.506 1.00 0.00 C ATOM 1365 O GLU A 124 -9.465 -6.326 -6.106 1.00 0.00 O ATOM 1366 CB GLU A 124 -10.053 -3.333 -5.193 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.491 -2.372 -6.286 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.726 -2.851 -7.024 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.730 -4.013 -7.483 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -12.688 -2.064 -7.144 1.00 0.00 O ATOM 0 H GLU A 124 -8.009 -2.210 -6.035 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.373 -4.533 -4.607 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.855 -4.047 -5.007 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.903 -2.774 -4.269 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.691 -1.395 -5.847 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.676 -2.241 -6.997 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.888 -4.949 -7.792 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.133 -5.935 -8.836 1.00 0.00 C ATOM 1379 C GLN A 125 -7.838 -6.640 -9.230 1.00 0.00 C ATOM 1380 O GLN A 125 -7.857 -7.780 -9.693 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.753 -5.263 -10.062 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.972 -4.055 -10.555 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.757 -2.763 -10.438 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.697 -2.525 -11.195 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.374 -1.921 -9.485 1.00 0.00 N ATOM 0 H GLN A 125 -8.567 -4.044 -8.136 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.828 -6.679 -8.446 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.824 -5.993 -10.869 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.770 -4.954 -9.821 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.048 -3.967 -9.983 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.689 -4.211 -11.596 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.589 -2.159 -8.879 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.865 -1.036 -9.359 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.713 -5.952 -9.045 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.410 -6.515 -9.382 1.00 0.00 C ATOM 1396 C TYR A 126 -4.909 -7.462 -8.291 1.00 0.00 C ATOM 1397 O TYR A 126 -3.903 -8.148 -8.471 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.383 -5.402 -9.601 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.857 -4.285 -10.512 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.183 -3.072 -10.555 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -5.973 -4.442 -11.329 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.603 -2.049 -11.382 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.399 -3.423 -12.159 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.712 -2.229 -12.182 1.00 0.00 C ATOM 1405 OH TYR A 126 -6.133 -1.212 -13.007 1.00 0.00 O ATOM 0 H TYR A 126 -6.679 -5.006 -8.664 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.532 -7.083 -10.304 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.114 -4.977 -8.634 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.477 -5.838 -10.021 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.314 -2.926 -9.930 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.515 -5.376 -11.314 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -4.066 -1.112 -11.402 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.267 -3.562 -12.787 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.927 -1.501 -13.504 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.606 -7.489 -7.157 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.212 -8.345 -6.043 1.00 0.00 C ATOM 1417 C ILE A 127 -5.901 -9.706 -6.099 1.00 0.00 C ATOM 1418 O ILE A 127 -7.111 -9.811 -5.897 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.532 -7.682 -4.689 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -6.988 -7.210 -4.656 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.585 -6.520 -4.432 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.717 -7.589 -3.385 1.00 0.00 C ATOM 0 H ILE A 127 -6.442 -6.930 -6.987 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.136 -8.490 -6.134 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.393 -8.420 -3.899 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -7.013 -6.126 -4.770 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.518 -7.633 -5.509 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.823 -6.062 -3.472 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.558 -6.885 -4.415 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.694 -5.780 -5.224 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -8.743 -7.223 -3.431 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.724 -8.674 -3.279 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.211 -7.144 -2.529 1.00 0.00 H new ATOM 1434 N ASN A 128 -5.116 -10.746 -6.359 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.637 -12.109 -6.426 1.00 0.00 C ATOM 1436 C ASN A 128 -5.284 -12.876 -5.152 1.00 0.00 C ATOM 1437 O ASN A 128 -4.832 -12.284 -4.171 1.00 0.00 O ATOM 1438 CB ASN A 128 -5.075 -12.837 -7.647 1.00 0.00 C ATOM 1439 CG ASN A 128 -5.196 -12.016 -8.916 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -6.091 -12.240 -9.732 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -4.293 -11.058 -9.090 1.00 0.00 N ATOM 0 H ASN A 128 -4.113 -10.672 -6.528 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.722 -12.058 -6.518 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -4.026 -13.078 -7.472 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.602 -13.782 -7.777 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.324 -10.473 -9.925 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.568 -10.907 -8.388 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.485 -14.195 -5.168 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.176 -15.030 -4.006 1.00 0.00 C ATOM 1450 C ASP A 129 -3.785 -14.702 -3.468 1.00 0.00 C ATOM 1451 O ASP A 129 -3.624 -14.336 -2.304 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.259 -16.512 -4.377 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.899 -17.346 -3.285 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -5.188 -18.173 -2.675 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -7.111 -17.172 -3.038 1.00 0.00 O ATOM 0 H ASP A 129 -5.858 -14.706 -5.968 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.910 -14.821 -3.228 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.832 -16.622 -5.297 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.257 -16.890 -4.579 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.789 -14.807 -4.340 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.412 -14.492 -3.981 1.00 0.00 C ATOM 1462 C GLU A 130 -0.892 -13.420 -4.925 1.00 0.00 C ATOM 1463 O GLU A 130 -0.983 -13.569 -6.145 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.533 -15.743 -4.060 1.00 0.00 C ATOM 1465 CG GLU A 130 0.488 -15.842 -2.938 1.00 0.00 C ATOM 1466 CD GLU A 130 1.013 -17.252 -2.751 1.00 0.00 C ATOM 1467 OE1 GLU A 130 1.147 -17.686 -1.589 1.00 0.00 O ATOM 1468 OE2 GLU A 130 1.290 -17.923 -3.769 1.00 0.00 O ATOM 0 H GLU A 130 -2.911 -15.110 -5.306 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.380 -14.126 -2.955 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.171 -16.627 -4.039 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.011 -15.750 -5.017 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.322 -15.173 -3.150 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.034 -15.501 -2.008 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.380 -12.323 -4.376 1.00 0.00 N ATOM 1476 CA ASN A 131 0.102 -11.232 -5.215 1.00 0.00 C ATOM 1477 C ASN A 131 1.425 -10.667 -4.735 1.00 0.00 C ATOM 1478 O ASN A 131 1.718 -10.644 -3.540 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.928 -10.099 -5.266 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.337 -10.563 -4.952 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.776 -11.613 -5.421 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.054 -9.781 -4.153 1.00 0.00 N ATOM 0 H ASN A 131 -0.289 -12.167 -3.372 1.00 0.00 H new ATOM 0 HA ASN A 131 0.253 -11.653 -6.209 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.641 -9.323 -4.557 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.913 -9.647 -6.258 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.008 -10.043 -3.906 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.650 -8.919 -3.787 1.00 0.00 H new ATOM 1489 N THR A 132 2.196 -10.167 -5.690 1.00 0.00 N ATOM 1490 CA THR A 132 3.473 -9.542 -5.394 1.00 0.00 C ATOM 1491 C THR A 132 3.213 -8.110 -4.957 1.00 0.00 C ATOM 1492 O THR A 132 2.799 -7.271 -5.763 1.00 0.00 O ATOM 1493 CB THR A 132 4.386 -9.567 -6.621 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.124 -10.708 -7.419 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.858 -9.579 -6.271 1.00 0.00 C ATOM 0 H THR A 132 1.956 -10.183 -6.681 1.00 0.00 H new ATOM 0 HA THR A 132 3.976 -10.091 -4.598 1.00 0.00 H new ATOM 0 HB THR A 132 4.166 -8.648 -7.163 1.00 0.00 H new ATOM 0 HG1 THR A 132 4.717 -10.705 -8.199 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.450 -9.597 -7.186 1.00 0.00 H new ATOM 0 HG22 THR A 132 6.103 -8.685 -5.698 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.083 -10.464 -5.676 1.00 0.00 H new ATOM 1503 N VAL A 133 3.408 -7.845 -3.672 1.00 0.00 N ATOM 1504 CA VAL A 133 3.147 -6.519 -3.126 1.00 0.00 C ATOM 1505 C VAL A 133 4.399 -5.865 -2.560 1.00 0.00 C ATOM 1506 O VAL A 133 5.146 -6.471 -1.791 1.00 0.00 O ATOM 1507 CB VAL A 133 2.065 -6.560 -2.021 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.764 -5.959 -2.528 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.839 -7.981 -1.520 1.00 0.00 C ATOM 0 H VAL A 133 3.744 -8.526 -2.991 1.00 0.00 H new ATOM 0 HA VAL A 133 2.790 -5.922 -3.965 1.00 0.00 H new ATOM 0 HB VAL A 133 2.421 -5.963 -1.181 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.014 -5.996 -1.738 1.00 0.00 H new ATOM 0 HG12 VAL A 133 0.932 -4.923 -2.821 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.412 -6.527 -3.389 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.073 -7.976 -0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.513 -8.611 -2.348 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.769 -8.374 -1.109 1.00 0.00 H new ATOM 1519 N GLU A 134 4.591 -4.603 -2.924 1.00 0.00 N ATOM 1520 CA GLU A 134 5.714 -3.820 -2.442 1.00 0.00 C ATOM 1521 C GLU A 134 5.183 -2.632 -1.658 1.00 0.00 C ATOM 1522 O GLU A 134 4.492 -1.773 -2.210 1.00 0.00 O ATOM 1523 CB GLU A 134 6.587 -3.339 -3.597 1.00 0.00 C ATOM 1524 CG GLU A 134 7.010 -4.449 -4.545 1.00 0.00 C ATOM 1525 CD GLU A 134 7.177 -3.966 -5.972 1.00 0.00 C ATOM 1526 OE1 GLU A 134 6.492 -4.506 -6.866 1.00 0.00 O ATOM 1527 OE2 GLU A 134 7.993 -3.046 -6.196 1.00 0.00 O ATOM 0 H GLU A 134 3.973 -4.098 -3.559 1.00 0.00 H new ATOM 0 HA GLU A 134 6.332 -4.446 -1.799 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.044 -2.580 -4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.478 -2.859 -3.192 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.950 -4.879 -4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 134 6.267 -5.246 -4.520 1.00 0.00 H new ATOM 1534 N LEU A 135 5.473 -2.604 -0.367 1.00 0.00 N ATOM 1535 CA LEU A 135 4.979 -1.531 0.487 1.00 0.00 C ATOM 1536 C LEU A 135 6.062 -0.951 1.386 1.00 0.00 C ATOM 1537 O LEU A 135 7.015 -1.633 1.760 1.00 0.00 O ATOM 1538 CB LEU A 135 3.828 -2.049 1.353 1.00 0.00 C ATOM 1539 CG LEU A 135 4.071 -3.414 2.003 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.956 -3.275 3.233 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.750 -4.075 2.364 1.00 0.00 C ATOM 0 H LEU A 135 6.042 -3.303 0.111 1.00 0.00 H new ATOM 0 HA LEU A 135 4.635 -0.732 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.627 -1.320 2.138 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.930 -2.111 0.738 1.00 0.00 H new ATOM 0 HG LEU A 135 4.588 -4.049 1.283 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.116 -4.257 3.679 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.916 -2.847 2.944 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.471 -2.621 3.958 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.942 -5.044 2.825 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.206 -3.442 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.154 -4.214 1.462 1.00 0.00 H new ATOM 1553 N ILE A 136 5.876 0.311 1.758 1.00 0.00 N ATOM 1554 CA ILE A 136 6.796 1.003 2.650 1.00 0.00 C ATOM 1555 C ILE A 136 6.086 1.255 3.974 1.00 0.00 C ATOM 1556 O ILE A 136 4.937 1.677 3.985 1.00 0.00 O ATOM 1557 CB ILE A 136 7.315 2.345 2.070 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.826 2.585 0.634 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.833 2.365 2.102 1.00 0.00 C ATOM 1560 CD1 ILE A 136 6.376 4.007 0.383 1.00 0.00 C ATOM 0 H ILE A 136 5.087 0.880 1.451 1.00 0.00 H new ATOM 0 HA ILE A 136 7.671 0.367 2.784 1.00 0.00 H new ATOM 0 HB ILE A 136 6.916 3.146 2.692 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.628 2.337 -0.061 1.00 0.00 H new ATOM 0 HG13 ILE A 136 5.999 1.907 0.421 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.193 3.309 1.694 1.00 0.00 H new ATOM 0 HG22 ILE A 136 9.177 2.260 3.131 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.220 1.540 1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 136 6.044 4.106 -0.650 1.00 0.00 H new ATOM 0 HD12 ILE A 136 5.553 4.252 1.054 1.00 0.00 H new ATOM 0 HD13 ILE A 136 7.207 4.689 0.564 1.00 0.00 H new ATOM 1572 N HIS A 137 6.749 0.964 5.083 1.00 0.00 N ATOM 1573 CA HIS A 137 6.129 1.125 6.392 1.00 0.00 C ATOM 1574 C HIS A 137 6.079 2.583 6.836 1.00 0.00 C ATOM 1575 O HIS A 137 7.108 3.229 7.021 1.00 0.00 O ATOM 1576 CB HIS A 137 6.858 0.254 7.413 1.00 0.00 C ATOM 1577 CG HIS A 137 7.009 -1.167 6.951 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.325 -2.226 7.513 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.749 -1.695 5.946 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.640 -3.341 6.871 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.501 -3.043 5.920 1.00 0.00 N ATOM 0 H HIS A 137 7.708 0.618 5.105 1.00 0.00 H new ATOM 0 HA HIS A 137 5.092 0.797 6.319 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.844 0.676 7.608 1.00 0.00 H new ATOM 0 HB3 HIS A 137 6.312 0.270 8.356 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.678 -2.160 8.299 1.00 0.00 H new ATOM 0 HD2 HIS A 137 8.412 -1.154 5.287 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.256 -4.326 7.090 1.00 0.00 H new ATOM 1590 N THR A 138 4.858 3.091 7.002 1.00 0.00 N ATOM 1591 CA THR A 138 4.647 4.472 7.424 1.00 0.00 C ATOM 1592 C THR A 138 4.621 4.569 8.947 1.00 0.00 C ATOM 1593 O THR A 138 5.076 3.662 9.644 1.00 0.00 O ATOM 1594 CB THR A 138 3.324 4.995 6.859 1.00 0.00 C ATOM 1595 OG1 THR A 138 2.239 4.558 7.657 1.00 0.00 O ATOM 1596 CG2 THR A 138 3.048 4.555 5.439 1.00 0.00 C ATOM 0 H THR A 138 3.999 2.563 6.850 1.00 0.00 H new ATOM 0 HA THR A 138 5.471 5.077 7.044 1.00 0.00 H new ATOM 0 HB THR A 138 3.421 6.081 6.866 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.748 3.853 7.184 1.00 0.00 H new ATOM 0 HG21 THR A 138 2.093 4.965 5.110 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.843 4.915 4.786 1.00 0.00 H new ATOM 0 HG23 THR A 138 3.009 3.467 5.396 1.00 0.00 H new ATOM 1604 N ASP A 139 4.059 5.662 9.460 1.00 0.00 N ATOM 1605 CA ASP A 139 3.947 5.855 10.900 1.00 0.00 C ATOM 1606 C ASP A 139 2.771 5.047 11.440 1.00 0.00 C ATOM 1607 O ASP A 139 2.652 4.824 12.644 1.00 0.00 O ATOM 1608 CB ASP A 139 3.762 7.337 11.228 1.00 0.00 C ATOM 1609 CG ASP A 139 4.087 7.655 12.674 1.00 0.00 C ATOM 1610 OD1 ASP A 139 5.012 8.460 12.912 1.00 0.00 O ATOM 1611 OD2 ASP A 139 3.418 7.097 13.569 1.00 0.00 O ATOM 0 H ASP A 139 3.676 6.424 8.900 1.00 0.00 H new ATOM 0 HA ASP A 139 4.866 5.509 11.373 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.400 7.933 10.576 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.732 7.627 11.018 1.00 0.00 H new ATOM 1616 N SER A 140 1.906 4.609 10.527 1.00 0.00 N ATOM 1617 CA SER A 140 0.734 3.821 10.880 1.00 0.00 C ATOM 1618 C SER A 140 0.857 2.409 10.322 1.00 0.00 C ATOM 1619 O SER A 140 1.074 1.449 11.062 1.00 0.00 O ATOM 1620 CB SER A 140 -0.529 4.490 10.332 1.00 0.00 C ATOM 1621 OG SER A 140 -0.218 5.371 9.262 1.00 0.00 O ATOM 0 H SER A 140 2.000 4.791 9.528 1.00 0.00 H new ATOM 0 HA SER A 140 0.666 3.763 11.966 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.228 3.728 9.988 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.027 5.042 11.129 1.00 0.00 H new ATOM 0 HG SER A 140 0.112 6.220 9.623 1.00 0.00 H new ATOM 1627 N LEU A 141 0.724 2.300 9.008 1.00 0.00 N ATOM 1628 CA LEU A 141 0.823 1.018 8.324 1.00 0.00 C ATOM 1629 C LEU A 141 1.617 1.165 7.029 1.00 0.00 C ATOM 1630 O LEU A 141 1.920 2.278 6.598 1.00 0.00 O ATOM 1631 CB LEU A 141 -0.572 0.462 8.026 1.00 0.00 C ATOM 1632 CG LEU A 141 -1.618 1.503 7.614 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -1.766 1.542 6.102 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -2.958 1.204 8.273 1.00 0.00 C ATOM 0 H LEU A 141 0.546 3.091 8.389 1.00 0.00 H new ATOM 0 HA LEU A 141 1.346 0.319 8.977 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.488 -0.278 7.231 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -0.933 -0.061 8.911 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.279 2.482 7.952 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.513 2.287 5.829 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.810 1.804 5.649 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -2.082 0.563 5.742 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -3.688 1.954 7.969 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.302 0.216 7.966 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.844 1.228 9.357 1.00 0.00 H new ATOM 1646 N PRO A 142 1.995 0.041 6.404 1.00 0.00 N ATOM 1647 CA PRO A 142 2.775 0.048 5.169 1.00 0.00 C ATOM 1648 C PRO A 142 1.947 0.399 3.939 1.00 0.00 C ATOM 1649 O PRO A 142 0.926 -0.231 3.655 1.00 0.00 O ATOM 1650 CB PRO A 142 3.303 -1.390 5.056 1.00 0.00 C ATOM 1651 CG PRO A 142 2.946 -2.049 6.345 1.00 0.00 C ATOM 1652 CD PRO A 142 1.735 -1.325 6.857 1.00 0.00 C ATOM 0 HA PRO A 142 3.557 0.806 5.207 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.850 -1.909 4.211 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.381 -1.401 4.895 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.734 -3.108 6.197 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.769 -1.985 7.057 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.811 -1.726 6.440 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.649 -1.387 7.942 1.00 0.00 H new ATOM 1660 N LEU A 143 2.416 1.395 3.200 1.00 0.00 N ATOM 1661 CA LEU A 143 1.755 1.830 1.975 1.00 0.00 C ATOM 1662 C LEU A 143 2.230 0.984 0.807 1.00 0.00 C ATOM 1663 O LEU A 143 3.418 0.967 0.487 1.00 0.00 O ATOM 1664 CB LEU A 143 2.057 3.303 1.691 1.00 0.00 C ATOM 1665 CG LEU A 143 1.139 3.980 0.666 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.370 3.441 -0.739 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.310 3.803 1.053 1.00 0.00 C ATOM 0 H LEU A 143 3.259 1.922 3.429 1.00 0.00 H new ATOM 0 HA LEU A 143 0.679 1.710 2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.995 3.856 2.629 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.086 3.384 1.340 1.00 0.00 H new ATOM 0 HG LEU A 143 1.382 5.042 0.664 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.701 3.945 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.404 3.622 -1.033 1.00 0.00 H new ATOM 0 HD13 LEU A 143 1.170 2.370 -0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.946 4.290 0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.549 2.740 1.093 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.483 4.251 2.032 1.00 0.00 H new ATOM 1679 N VAL A 144 1.305 0.289 0.169 1.00 0.00 N ATOM 1680 CA VAL A 144 1.644 -0.554 -0.967 1.00 0.00 C ATOM 1681 C VAL A 144 1.882 0.301 -2.210 1.00 0.00 C ATOM 1682 O VAL A 144 0.942 0.688 -2.903 1.00 0.00 O ATOM 1683 CB VAL A 144 0.544 -1.599 -1.241 1.00 0.00 C ATOM 1684 CG1 VAL A 144 1.053 -2.672 -2.189 1.00 0.00 C ATOM 1685 CG2 VAL A 144 0.056 -2.221 0.062 1.00 0.00 C ATOM 0 H VAL A 144 0.315 0.291 0.416 1.00 0.00 H new ATOM 0 HA VAL A 144 2.561 -1.090 -0.723 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.298 -1.094 -1.714 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.263 -3.401 -2.371 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.348 -2.213 -3.133 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.913 -3.172 -1.744 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.720 -2.956 -0.154 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.889 -2.711 0.566 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.351 -1.442 0.707 1.00 0.00 H new ATOM 1695 N ILE A 145 3.153 0.615 -2.461 1.00 0.00 N ATOM 1696 CA ILE A 145 3.535 1.452 -3.595 1.00 0.00 C ATOM 1697 C ILE A 145 3.464 0.706 -4.925 1.00 0.00 C ATOM 1698 O ILE A 145 3.355 1.328 -5.982 1.00 0.00 O ATOM 1699 CB ILE A 145 4.957 2.019 -3.420 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.972 0.885 -3.247 1.00 0.00 C ATOM 1701 CG2 ILE A 145 5.004 2.966 -2.230 1.00 0.00 C ATOM 1702 CD1 ILE A 145 7.183 1.019 -4.144 1.00 0.00 C ATOM 0 H ILE A 145 3.938 0.300 -1.891 1.00 0.00 H new ATOM 0 HA ILE A 145 2.812 2.268 -3.617 1.00 0.00 H new ATOM 0 HB ILE A 145 5.221 2.578 -4.318 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.300 0.857 -2.208 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.481 -0.066 -3.452 1.00 0.00 H new ATOM 0 HG21 ILE A 145 6.014 3.359 -2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.310 3.790 -2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.722 2.428 -1.325 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.860 0.183 -3.969 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.865 1.017 -5.187 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.698 1.954 -3.923 1.00 0.00 H new ATOM 1714 N SER A 146 3.529 -0.621 -4.880 1.00 0.00 N ATOM 1715 CA SER A 146 3.473 -1.413 -6.106 1.00 0.00 C ATOM 1716 C SER A 146 2.715 -2.721 -5.896 1.00 0.00 C ATOM 1717 O SER A 146 2.565 -3.193 -4.769 1.00 0.00 O ATOM 1718 CB SER A 146 4.885 -1.703 -6.619 1.00 0.00 C ATOM 1719 OG SER A 146 5.864 -1.064 -5.816 1.00 0.00 O ATOM 0 H SER A 146 3.619 -1.165 -4.022 1.00 0.00 H new ATOM 0 HA SER A 146 2.934 -0.828 -6.851 1.00 0.00 H new ATOM 0 HB2 SER A 146 5.060 -2.779 -6.623 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.977 -1.362 -7.650 1.00 0.00 H new ATOM 0 HG SER A 146 6.737 -1.119 -6.259 1.00 0.00 H new ATOM 1725 N LEU A 147 2.248 -3.304 -6.999 1.00 0.00 N ATOM 1726 CA LEU A 147 1.515 -4.560 -6.954 1.00 0.00 C ATOM 1727 C LEU A 147 1.796 -5.372 -8.211 1.00 0.00 C ATOM 1728 O LEU A 147 2.214 -4.824 -9.230 1.00 0.00 O ATOM 1729 CB LEU A 147 0.013 -4.300 -6.821 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.747 -5.317 -5.964 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -1.093 -4.723 -4.609 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -2.007 -5.780 -6.677 1.00 0.00 C ATOM 0 H LEU A 147 2.367 -2.921 -7.937 1.00 0.00 H new ATOM 0 HA LEU A 147 1.847 -5.126 -6.083 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.132 -3.307 -6.394 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.428 -4.286 -7.818 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.101 -6.181 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.633 -5.461 -4.015 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -0.177 -4.440 -4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.718 -3.841 -4.747 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.534 -6.502 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.654 -4.923 -6.866 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.738 -6.247 -7.624 1.00 0.00 H new ATOM 1744 N ASN A 148 1.581 -6.678 -8.130 1.00 0.00 N ATOM 1745 CA ASN A 148 1.828 -7.568 -9.264 1.00 0.00 C ATOM 1746 C ASN A 148 1.299 -6.998 -10.582 1.00 0.00 C ATOM 1747 O ASN A 148 0.117 -7.125 -10.891 1.00 0.00 O ATOM 1748 CB ASN A 148 1.158 -8.916 -9.010 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.262 -8.755 -8.497 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.501 -8.052 -7.515 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -1.214 -9.392 -9.168 1.00 0.00 N ATOM 0 H ASN A 148 1.236 -7.148 -7.293 1.00 0.00 H new ATOM 0 HA ASN A 148 2.908 -7.679 -9.355 1.00 0.00 H new ATOM 0 HB2 ASN A 148 1.147 -9.496 -9.933 1.00 0.00 H new ATOM 0 HB3 ASN A 148 1.744 -9.482 -8.285 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -2.187 -9.309 -8.875 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.972 -9.965 -9.977 1.00 0.00 H new ATOM 1758 N GLY A 149 2.197 -6.419 -11.376 1.00 0.00 N ATOM 1759 CA GLY A 149 1.814 -5.887 -12.676 1.00 0.00 C ATOM 1760 C GLY A 149 1.142 -4.524 -12.624 1.00 0.00 C ATOM 1761 O GLY A 149 0.421 -4.156 -13.551 1.00 0.00 O ATOM 0 H GLY A 149 3.184 -6.308 -11.143 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.703 -5.816 -13.302 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.139 -6.593 -13.159 1.00 0.00 H new ATOM 1765 N HIS A 150 1.380 -3.765 -11.561 1.00 0.00 N ATOM 1766 CA HIS A 150 0.789 -2.433 -11.434 1.00 0.00 C ATOM 1767 C HIS A 150 1.602 -1.568 -10.487 1.00 0.00 C ATOM 1768 O HIS A 150 2.420 -2.071 -9.715 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.658 -2.512 -10.941 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.426 -3.654 -11.519 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.260 -3.534 -12.611 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.475 -4.950 -11.150 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.789 -4.713 -12.887 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.328 -5.590 -12.016 1.00 0.00 N ATOM 0 H HIS A 150 1.973 -4.043 -10.779 1.00 0.00 H new ATOM 0 HA HIS A 150 0.796 -1.980 -12.425 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.658 -2.598 -9.854 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.168 -1.581 -11.187 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.942 -5.401 -10.326 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.481 -4.923 -13.689 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.566 -6.581 -11.990 1.00 0.00 H new ATOM 1783 N THR A 151 1.376 -0.262 -10.552 1.00 0.00 N ATOM 1784 CA THR A 151 2.095 0.672 -9.701 1.00 0.00 C ATOM 1785 C THR A 151 1.210 1.842 -9.289 1.00 0.00 C ATOM 1786 O THR A 151 0.257 2.193 -9.986 1.00 0.00 O ATOM 1787 CB THR A 151 3.340 1.183 -10.418 1.00 0.00 C ATOM 1788 OG1 THR A 151 3.005 2.200 -11.345 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.081 0.097 -11.170 1.00 0.00 C ATOM 0 H THR A 151 0.702 0.172 -11.184 1.00 0.00 H new ATOM 0 HA THR A 151 2.393 0.142 -8.797 1.00 0.00 H new ATOM 0 HB THR A 151 3.990 1.568 -9.633 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.818 2.515 -11.793 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.957 0.525 -11.658 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.397 -0.678 -10.472 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.423 -0.339 -11.922 1.00 0.00 H new ATOM 1797 N LEU A 152 1.531 2.433 -8.144 1.00 0.00 N ATOM 1798 CA LEU A 152 0.771 3.558 -7.618 1.00 0.00 C ATOM 1799 C LEU A 152 0.897 4.778 -8.520 1.00 0.00 C ATOM 1800 O LEU A 152 -0.073 5.502 -8.743 1.00 0.00 O ATOM 1801 CB LEU A 152 1.252 3.892 -6.206 1.00 0.00 C ATOM 1802 CG LEU A 152 0.312 3.453 -5.085 1.00 0.00 C ATOM 1803 CD1 LEU A 152 0.892 3.813 -3.727 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.055 4.086 -5.270 1.00 0.00 C ATOM 0 H LEU A 152 2.317 2.149 -7.560 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.281 3.275 -7.584 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.224 3.424 -6.049 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.401 4.969 -6.134 1.00 0.00 H new ATOM 0 HG LEU A 152 0.201 2.370 -5.128 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.207 3.492 -2.942 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.852 3.314 -3.598 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.033 4.892 -3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.716 3.766 -4.465 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.959 5.172 -5.250 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.473 3.776 -6.228 1.00 0.00 H new