USER MOD reduce.3.24.130724 H: found=0, std=0, add=759, rem=0, adj=25 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 -108:sc= 0.542! USER MOD Set 1.2: A 140 SER OG : rot -100:sc= -0.521 USER MOD Set 2.1: A 101 SER OG : rot -39:sc= 1.1 USER MOD Set 2.2: A 107 LYS NZ :NH3+ -161:sc= 1.23 (180deg=0) USER MOD Set 3.1: A 89 MET CE :methyl -134:sc= -3.54 (180deg=-1.27) USER MOD Set 3.2: A 137 HIS : no HE2:sc= -4.99 X(o=-8.5,f=-8.7!) USER MOD Set 4.1: A 56 TYR OH : rot -90:sc= -2.35 USER MOD Set 4.2: A 118 HIS : no HD1:sc= -8.57! C(o=-11!,f=-11!) USER MOD Single : A 41 GLN : amide:sc= -0.0748 X(o=-0.075,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0817 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 160:sc= -2.12 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -2.31 X(o=-2.3,f=-2.3) USER MOD Single : A 59 SER OG : rot 96:sc= 0.138 USER MOD Single : A 78 SER OG : rot -27:sc= 0.381 USER MOD Single : A 82 ASN : amide:sc= -0.95 K(o=-0.95,f=-1.5!) USER MOD Single : A 85 SER OG : rot -11:sc= -0.0918 USER MOD Single : A 86 ASN : amide:sc= -1.74 K(o=-1.7,f=-3.8!) USER MOD Single : A 87 ASN : amide:sc= -0.263 X(o=-0.26,f=-0.00021) USER MOD Single : A 90 MET CE :methyl 163:sc= -10.7! (180deg=-13!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.2 USER MOD Single : A 93 HIS : no HD1:sc= -5.21! C(o=-5.2!,f=-6.9!) USER MOD Single : A 96 THR OG1 : rot 83:sc= 1.07 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -28:sc= 0.396 USER MOD Single : A 106 ASN : amide:sc= -0.59 K(o=-0.59,f=-1.5) USER MOD Single : A 110 TYR OH : rot 180:sc= -1.74 USER MOD Single : A 111 TYR OH : rot 30:sc= -1.67 USER MOD Single : A 114 SER OG : rot -49:sc= 0.0344 USER MOD Single : A 125 GLN : amide:sc= 0.397 X(o=0.4,f=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.024) USER MOD Single : A 131 ASN : amide:sc= -5.79! C(o=-5.8!,f=-13!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot 180:sc= -3.26 USER MOD Single : A 148 ASN : amide:sc= -2.98! C(o=-3!,f=-12!) USER MOD Single : A 150 HIS : no HD1:sc= -12.3! C(o=-12!,f=-12!) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 13 N PHE A 37 6.358 -10.275 6.952 1.00 0.00 N ATOM 14 CA PHE A 37 7.453 -9.539 6.327 1.00 0.00 C ATOM 15 C PHE A 37 8.802 -10.032 6.840 1.00 0.00 C ATOM 16 O PHE A 37 9.769 -9.272 6.901 1.00 0.00 O ATOM 17 CB PHE A 37 7.311 -8.039 6.594 1.00 0.00 C ATOM 18 CG PHE A 37 5.896 -7.539 6.515 1.00 0.00 C ATOM 19 CD1 PHE A 37 5.072 -7.908 5.463 1.00 0.00 C ATOM 20 CD2 PHE A 37 5.389 -6.698 7.493 1.00 0.00 C ATOM 21 CE1 PHE A 37 3.771 -7.449 5.389 1.00 0.00 C ATOM 22 CE2 PHE A 37 4.089 -6.235 7.424 1.00 0.00 C ATOM 23 CZ PHE A 37 3.278 -6.611 6.370 1.00 0.00 C ATOM 0 HA PHE A 37 7.405 -9.714 5.252 1.00 0.00 H new ATOM 0 HB2 PHE A 37 7.710 -7.816 7.584 1.00 0.00 H new ATOM 0 HB3 PHE A 37 7.920 -7.492 5.874 1.00 0.00 H new ATOM 0 HD1 PHE A 37 5.452 -8.562 4.692 1.00 0.00 H new ATOM 0 HD2 PHE A 37 6.018 -6.401 8.319 1.00 0.00 H new ATOM 0 HE1 PHE A 37 3.140 -7.745 4.564 1.00 0.00 H new ATOM 0 HE2 PHE A 37 3.707 -5.580 8.193 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.261 -6.251 6.314 1.00 0.00 H new ATOM 33 N ALA A 38 8.862 -11.307 7.212 1.00 0.00 N ATOM 34 CA ALA A 38 10.093 -11.899 7.722 1.00 0.00 C ATOM 35 C ALA A 38 11.088 -12.157 6.597 1.00 0.00 C ATOM 36 O ALA A 38 12.276 -11.860 6.723 1.00 0.00 O ATOM 37 CB ALA A 38 9.789 -13.190 8.467 1.00 0.00 C ATOM 0 H ALA A 38 8.071 -11.950 7.170 1.00 0.00 H new ATOM 0 HA ALA A 38 10.546 -11.190 8.415 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.717 -13.621 8.842 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.123 -12.979 9.304 1.00 0.00 H new ATOM 0 HB3 ALA A 38 9.309 -13.896 7.790 1.00 0.00 H new ATOM 43 N ASP A 39 10.593 -12.713 5.499 1.00 0.00 N ATOM 44 CA ASP A 39 11.435 -13.015 4.346 1.00 0.00 C ATOM 45 C ASP A 39 11.186 -12.032 3.202 1.00 0.00 C ATOM 46 O ASP A 39 11.713 -12.203 2.103 1.00 0.00 O ATOM 47 CB ASP A 39 11.177 -14.444 3.866 1.00 0.00 C ATOM 48 CG ASP A 39 12.417 -15.090 3.278 1.00 0.00 C ATOM 49 OD1 ASP A 39 13.471 -15.072 3.949 1.00 0.00 O ATOM 50 OD2 ASP A 39 12.335 -15.612 2.147 1.00 0.00 O ATOM 0 H ASP A 39 9.612 -12.965 5.381 1.00 0.00 H new ATOM 0 HA ASP A 39 12.475 -12.918 4.657 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.819 -15.046 4.701 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.385 -14.435 3.117 1.00 0.00 H new ATOM 55 N ALA A 40 10.383 -11.005 3.464 1.00 0.00 N ATOM 56 CA ALA A 40 10.070 -10.002 2.455 1.00 0.00 C ATOM 57 C ALA A 40 11.315 -9.218 2.053 1.00 0.00 C ATOM 58 O ALA A 40 12.065 -8.746 2.907 1.00 0.00 O ATOM 59 CB ALA A 40 8.994 -9.059 2.971 1.00 0.00 C ATOM 0 H ALA A 40 9.938 -10.847 4.368 1.00 0.00 H new ATOM 0 HA ALA A 40 9.697 -10.516 1.569 1.00 0.00 H new ATOM 0 HB1 ALA A 40 8.768 -8.313 2.209 1.00 0.00 H new ATOM 0 HB2 ALA A 40 8.093 -9.627 3.202 1.00 0.00 H new ATOM 0 HB3 ALA A 40 9.349 -8.560 3.873 1.00 0.00 H new ATOM 65 N GLN A 41 11.528 -9.079 0.747 1.00 0.00 N ATOM 66 CA GLN A 41 12.680 -8.347 0.236 1.00 0.00 C ATOM 67 C GLN A 41 12.624 -6.889 0.675 1.00 0.00 C ATOM 68 O GLN A 41 11.642 -6.453 1.275 1.00 0.00 O ATOM 69 CB GLN A 41 12.735 -8.435 -1.291 1.00 0.00 C ATOM 70 CG GLN A 41 14.130 -8.699 -1.835 1.00 0.00 C ATOM 71 CD GLN A 41 14.241 -8.411 -3.319 1.00 0.00 C ATOM 72 OE1 GLN A 41 14.567 -9.295 -4.112 1.00 0.00 O ATOM 73 NE2 GLN A 41 13.970 -7.169 -3.703 1.00 0.00 N ATOM 0 H GLN A 41 10.918 -9.464 0.026 1.00 0.00 H new ATOM 0 HA GLN A 41 13.583 -8.800 0.646 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.067 -9.229 -1.625 1.00 0.00 H new ATOM 0 HB3 GLN A 41 12.359 -7.503 -1.714 1.00 0.00 H new ATOM 0 HG2 GLN A 41 14.849 -8.084 -1.294 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.397 -9.739 -1.650 1.00 0.00 H new ATOM 0 HE21 GLN A 41 13.704 -6.468 -3.012 1.00 0.00 H new ATOM 0 HE22 GLN A 41 14.028 -6.916 -4.689 1.00 0.00 H new ATOM 82 N THR A 42 13.680 -6.138 0.380 1.00 0.00 N ATOM 83 CA THR A 42 13.730 -4.732 0.757 1.00 0.00 C ATOM 84 C THR A 42 14.671 -3.940 -0.147 1.00 0.00 C ATOM 85 O THR A 42 15.670 -4.464 -0.640 1.00 0.00 O ATOM 86 CB THR A 42 14.168 -4.589 2.219 1.00 0.00 C ATOM 87 OG1 THR A 42 14.426 -5.858 2.795 1.00 0.00 O ATOM 88 CG2 THR A 42 13.141 -3.893 3.085 1.00 0.00 C ATOM 0 H THR A 42 14.505 -6.476 -0.115 1.00 0.00 H new ATOM 0 HA THR A 42 12.726 -4.324 0.638 1.00 0.00 H new ATOM 0 HB THR A 42 15.071 -3.979 2.190 1.00 0.00 H new ATOM 0 HG1 THR A 42 14.705 -5.743 3.727 1.00 0.00 H new ATOM 0 HG21 THR A 42 13.513 -3.824 4.107 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.958 -2.891 2.698 1.00 0.00 H new ATOM 0 HG23 THR A 42 12.211 -4.462 3.075 1.00 0.00 H new ATOM 96 N ARG A 43 14.340 -2.669 -0.346 1.00 0.00 N ATOM 97 CA ARG A 43 15.144 -1.778 -1.174 1.00 0.00 C ATOM 98 C ARG A 43 14.806 -0.324 -0.855 1.00 0.00 C ATOM 99 O ARG A 43 13.794 -0.047 -0.213 1.00 0.00 O ATOM 100 CB ARG A 43 14.916 -2.072 -2.663 1.00 0.00 C ATOM 101 CG ARG A 43 13.683 -1.399 -3.251 1.00 0.00 C ATOM 102 CD ARG A 43 13.264 -2.047 -4.560 1.00 0.00 C ATOM 103 NE ARG A 43 12.626 -1.094 -5.464 1.00 0.00 N ATOM 104 CZ ARG A 43 12.497 -1.286 -6.775 1.00 0.00 C ATOM 105 NH1 ARG A 43 12.959 -2.396 -7.339 1.00 0.00 N ATOM 106 NH2 ARG A 43 11.905 -0.367 -7.525 1.00 0.00 N ATOM 0 H ARG A 43 13.513 -2.230 0.059 1.00 0.00 H new ATOM 0 HA ARG A 43 16.198 -1.949 -0.953 1.00 0.00 H new ATOM 0 HB2 ARG A 43 15.794 -1.751 -3.224 1.00 0.00 H new ATOM 0 HB3 ARG A 43 14.828 -3.150 -2.800 1.00 0.00 H new ATOM 0 HG2 ARG A 43 12.861 -1.455 -2.537 1.00 0.00 H new ATOM 0 HG3 ARG A 43 13.889 -0.342 -3.417 1.00 0.00 H new ATOM 0 HD2 ARG A 43 14.139 -2.478 -5.047 1.00 0.00 H new ATOM 0 HD3 ARG A 43 12.576 -2.867 -4.354 1.00 0.00 H new ATOM 0 HE ARG A 43 12.257 -0.230 -5.067 1.00 0.00 H new ATOM 0 HH11 ARG A 43 13.415 -3.107 -6.767 1.00 0.00 H new ATOM 0 HH12 ARG A 43 12.857 -2.538 -8.344 1.00 0.00 H new ATOM 0 HH21 ARG A 43 11.548 0.488 -7.098 1.00 0.00 H new ATOM 0 HH22 ARG A 43 11.806 -0.515 -8.529 1.00 0.00 H new ATOM 120 N LYS A 44 15.651 0.601 -1.291 1.00 0.00 N ATOM 121 CA LYS A 44 15.418 2.013 -1.027 1.00 0.00 C ATOM 122 C LYS A 44 14.434 2.613 -2.021 1.00 0.00 C ATOM 123 O LYS A 44 14.479 2.327 -3.218 1.00 0.00 O ATOM 124 CB LYS A 44 16.733 2.788 -1.055 1.00 0.00 C ATOM 125 CG LYS A 44 17.048 3.459 0.266 1.00 0.00 C ATOM 126 CD LYS A 44 18.197 4.445 0.136 1.00 0.00 C ATOM 127 CE LYS A 44 18.366 5.279 1.396 1.00 0.00 C ATOM 128 NZ LYS A 44 17.869 6.671 1.212 1.00 0.00 N ATOM 0 H LYS A 44 16.497 0.401 -1.825 1.00 0.00 H new ATOM 0 HA LYS A 44 14.981 2.093 -0.032 1.00 0.00 H new ATOM 0 HB2 LYS A 44 17.545 2.108 -1.314 1.00 0.00 H new ATOM 0 HB3 LYS A 44 16.687 3.544 -1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 44 16.162 3.979 0.630 1.00 0.00 H new ATOM 0 HG3 LYS A 44 17.301 2.701 1.008 1.00 0.00 H new ATOM 0 HD2 LYS A 44 19.120 3.903 -0.069 1.00 0.00 H new ATOM 0 HD3 LYS A 44 18.018 5.103 -0.715 1.00 0.00 H new ATOM 0 HE2 LYS A 44 17.828 4.807 2.218 1.00 0.00 H new ATOM 0 HE3 LYS A 44 19.419 5.304 1.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 18.002 7.207 2.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 18.399 7.130 0.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.858 6.649 0.970 1.00 0.00 H new ATOM 142 N LEU A 45 13.542 3.447 -1.502 1.00 0.00 N ATOM 143 CA LEU A 45 12.530 4.106 -2.315 1.00 0.00 C ATOM 144 C LEU A 45 13.138 5.243 -3.130 1.00 0.00 C ATOM 145 O LEU A 45 13.942 6.025 -2.619 1.00 0.00 O ATOM 146 CB LEU A 45 11.416 4.645 -1.413 1.00 0.00 C ATOM 147 CG LEU A 45 10.111 5.033 -2.120 1.00 0.00 C ATOM 148 CD1 LEU A 45 9.776 4.048 -3.231 1.00 0.00 C ATOM 149 CD2 LEU A 45 8.971 5.108 -1.117 1.00 0.00 C ATOM 0 H LEU A 45 13.500 3.684 -0.511 1.00 0.00 H new ATOM 0 HA LEU A 45 12.115 3.376 -3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 45 11.188 3.891 -0.660 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.794 5.520 -0.884 1.00 0.00 H new ATOM 0 HG LEU A 45 10.249 6.016 -2.571 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.846 4.348 -3.715 1.00 0.00 H new ATOM 0 HD12 LEU A 45 10.581 4.040 -3.966 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.660 3.050 -2.809 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.051 5.384 -1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.842 4.137 -0.640 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.202 5.857 -0.359 1.00 0.00 H new ATOM 161 N THR A 46 12.749 5.333 -4.397 1.00 0.00 N ATOM 162 CA THR A 46 13.254 6.377 -5.279 1.00 0.00 C ATOM 163 C THR A 46 12.537 7.698 -5.019 1.00 0.00 C ATOM 164 O THR A 46 11.398 7.713 -4.553 1.00 0.00 O ATOM 165 CB THR A 46 13.077 5.968 -6.743 1.00 0.00 C ATOM 166 OG1 THR A 46 11.722 6.099 -7.138 1.00 0.00 O ATOM 167 CG2 THR A 46 13.504 4.544 -7.025 1.00 0.00 C ATOM 0 H THR A 46 12.085 4.695 -4.836 1.00 0.00 H new ATOM 0 HA THR A 46 14.316 6.511 -5.073 1.00 0.00 H new ATOM 0 HB THR A 46 13.721 6.639 -7.311 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.670 6.150 -8.115 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.352 4.321 -8.081 1.00 0.00 H new ATOM 0 HG22 THR A 46 14.559 4.425 -6.777 1.00 0.00 H new ATOM 0 HG23 THR A 46 12.910 3.859 -6.420 1.00 0.00 H new ATOM 175 N PRO A 47 13.194 8.831 -5.321 1.00 0.00 N ATOM 176 CA PRO A 47 12.607 10.159 -5.118 1.00 0.00 C ATOM 177 C PRO A 47 11.337 10.354 -5.937 1.00 0.00 C ATOM 178 O PRO A 47 10.392 11.003 -5.489 1.00 0.00 O ATOM 179 CB PRO A 47 13.706 11.122 -5.588 1.00 0.00 C ATOM 180 CG PRO A 47 14.603 10.299 -6.448 1.00 0.00 C ATOM 181 CD PRO A 47 14.552 8.909 -5.885 1.00 0.00 C ATOM 0 HA PRO A 47 12.309 10.318 -4.082 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.285 11.959 -6.145 1.00 0.00 H new ATOM 0 HB3 PRO A 47 14.249 11.543 -4.742 1.00 0.00 H new ATOM 0 HG2 PRO A 47 14.269 10.312 -7.486 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.621 10.688 -6.435 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.713 8.155 -6.656 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.315 8.754 -5.123 1.00 0.00 H new ATOM 189 N GLU A 48 11.319 9.782 -7.136 1.00 0.00 N ATOM 190 CA GLU A 48 10.160 9.887 -8.012 1.00 0.00 C ATOM 191 C GLU A 48 8.994 9.081 -7.453 1.00 0.00 C ATOM 192 O GLU A 48 7.851 9.538 -7.454 1.00 0.00 O ATOM 193 CB GLU A 48 10.508 9.399 -9.419 1.00 0.00 C ATOM 194 CG GLU A 48 9.670 10.044 -10.511 1.00 0.00 C ATOM 195 CD GLU A 48 8.224 9.590 -10.482 1.00 0.00 C ATOM 196 OE1 GLU A 48 7.987 8.374 -10.331 1.00 0.00 O ATOM 197 OE2 GLU A 48 7.329 10.451 -10.610 1.00 0.00 O ATOM 0 H GLU A 48 12.093 9.242 -7.522 1.00 0.00 H new ATOM 0 HA GLU A 48 9.866 10.935 -8.067 1.00 0.00 H new ATOM 0 HB2 GLU A 48 11.561 9.600 -9.614 1.00 0.00 H new ATOM 0 HB3 GLU A 48 10.377 8.318 -9.462 1.00 0.00 H new ATOM 0 HG2 GLU A 48 9.709 11.128 -10.401 1.00 0.00 H new ATOM 0 HG3 GLU A 48 10.102 9.807 -11.483 1.00 0.00 H new ATOM 204 N GLU A 49 9.293 7.880 -6.968 1.00 0.00 N ATOM 205 CA GLU A 49 8.271 7.012 -6.398 1.00 0.00 C ATOM 206 C GLU A 49 7.779 7.570 -5.068 1.00 0.00 C ATOM 207 O GLU A 49 6.604 7.436 -4.722 1.00 0.00 O ATOM 208 CB GLU A 49 8.823 5.599 -6.200 1.00 0.00 C ATOM 209 CG GLU A 49 9.177 4.897 -7.500 1.00 0.00 C ATOM 210 CD GLU A 49 10.220 3.811 -7.311 1.00 0.00 C ATOM 211 OE1 GLU A 49 10.947 3.858 -6.296 1.00 0.00 O ATOM 212 OE2 GLU A 49 10.308 2.916 -8.178 1.00 0.00 O ATOM 0 H GLU A 49 10.234 7.487 -6.959 1.00 0.00 H new ATOM 0 HA GLU A 49 7.431 6.969 -7.092 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.711 5.650 -5.571 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.086 5.002 -5.663 1.00 0.00 H new ATOM 0 HG2 GLU A 49 8.276 4.459 -7.929 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.547 5.631 -8.216 1.00 0.00 H new ATOM 219 N ARG A 50 8.686 8.200 -4.328 1.00 0.00 N ATOM 220 CA ARG A 50 8.347 8.786 -3.036 1.00 0.00 C ATOM 221 C ARG A 50 7.468 10.017 -3.221 1.00 0.00 C ATOM 222 O ARG A 50 6.550 10.263 -2.436 1.00 0.00 O ATOM 223 CB ARG A 50 9.621 9.156 -2.274 1.00 0.00 C ATOM 224 CG ARG A 50 9.607 8.725 -0.815 1.00 0.00 C ATOM 225 CD ARG A 50 10.660 9.466 -0.007 1.00 0.00 C ATOM 226 NE ARG A 50 11.978 8.842 -0.122 1.00 0.00 N ATOM 227 CZ ARG A 50 13.127 9.502 0.013 1.00 0.00 C ATOM 228 NH1 ARG A 50 13.130 10.801 0.287 1.00 0.00 N ATOM 229 NH2 ARG A 50 14.278 8.857 -0.122 1.00 0.00 N ATOM 0 H ARG A 50 9.662 8.318 -4.601 1.00 0.00 H new ATOM 0 HA ARG A 50 7.791 8.049 -2.457 1.00 0.00 H new ATOM 0 HB2 ARG A 50 10.477 8.699 -2.771 1.00 0.00 H new ATOM 0 HB3 ARG A 50 9.763 10.236 -2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 50 8.621 8.911 -0.389 1.00 0.00 H new ATOM 0 HG3 ARG A 50 9.785 7.652 -0.750 1.00 0.00 H new ATOM 0 HD2 ARG A 50 10.717 10.500 -0.348 1.00 0.00 H new ATOM 0 HD3 ARG A 50 10.361 9.492 1.041 1.00 0.00 H new ATOM 0 HE ARG A 50 12.020 7.842 -0.317 1.00 0.00 H new ATOM 0 HH11 ARG A 50 12.248 11.301 0.396 1.00 0.00 H new ATOM 0 HH12 ARG A 50 14.014 11.299 0.389 1.00 0.00 H new ATOM 0 HH21 ARG A 50 14.282 7.858 -0.329 1.00 0.00 H new ATOM 0 HH22 ARG A 50 15.159 9.360 -0.019 1.00 0.00 H new ATOM 243 N SER A 51 7.753 10.785 -4.267 1.00 0.00 N ATOM 244 CA SER A 51 6.990 11.992 -4.560 1.00 0.00 C ATOM 245 C SER A 51 5.600 11.640 -5.080 1.00 0.00 C ATOM 246 O SER A 51 4.616 12.303 -4.752 1.00 0.00 O ATOM 247 CB SER A 51 7.728 12.853 -5.586 1.00 0.00 C ATOM 248 OG SER A 51 7.479 14.231 -5.370 1.00 0.00 O ATOM 0 H SER A 51 8.507 10.593 -4.926 1.00 0.00 H new ATOM 0 HA SER A 51 6.882 12.558 -3.635 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.799 12.660 -5.524 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.412 12.577 -6.592 1.00 0.00 H new ATOM 0 HG SER A 51 7.964 14.760 -6.038 1.00 0.00 H new ATOM 254 N ALA A 52 5.527 10.587 -5.887 1.00 0.00 N ATOM 255 CA ALA A 52 4.256 10.144 -6.446 1.00 0.00 C ATOM 256 C ALA A 52 3.335 9.656 -5.342 1.00 0.00 C ATOM 257 O ALA A 52 2.182 10.078 -5.243 1.00 0.00 O ATOM 258 CB ALA A 52 4.482 9.050 -7.479 1.00 0.00 C ATOM 0 H ALA A 52 6.331 10.026 -6.168 1.00 0.00 H new ATOM 0 HA ALA A 52 3.780 10.990 -6.942 1.00 0.00 H new ATOM 0 HB1 ALA A 52 3.523 8.731 -7.886 1.00 0.00 H new ATOM 0 HB2 ALA A 52 5.109 9.434 -8.284 1.00 0.00 H new ATOM 0 HB3 ALA A 52 4.977 8.201 -7.007 1.00 0.00 H new ATOM 264 N VAL A 53 3.862 8.778 -4.500 1.00 0.00 N ATOM 265 CA VAL A 53 3.102 8.243 -3.382 1.00 0.00 C ATOM 266 C VAL A 53 2.590 9.381 -2.514 1.00 0.00 C ATOM 267 O VAL A 53 1.393 9.501 -2.267 1.00 0.00 O ATOM 268 CB VAL A 53 3.963 7.292 -2.528 1.00 0.00 C ATOM 269 CG1 VAL A 53 3.185 6.794 -1.318 1.00 0.00 C ATOM 270 CG2 VAL A 53 4.456 6.125 -3.368 1.00 0.00 C ATOM 0 H VAL A 53 4.815 8.421 -4.571 1.00 0.00 H new ATOM 0 HA VAL A 53 2.261 7.679 -3.784 1.00 0.00 H new ATOM 0 HB VAL A 53 4.829 7.847 -2.166 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.814 6.125 -0.731 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.886 7.643 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 53 2.297 6.257 -1.652 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.063 5.463 -2.750 1.00 0.00 H new ATOM 0 HG22 VAL A 53 3.602 5.573 -3.761 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.057 6.501 -4.196 1.00 0.00 H new ATOM 280 N GLU A 54 3.513 10.226 -2.072 1.00 0.00 N ATOM 281 CA GLU A 54 3.170 11.375 -1.241 1.00 0.00 C ATOM 282 C GLU A 54 2.035 12.176 -1.867 1.00 0.00 C ATOM 283 O GLU A 54 1.131 12.640 -1.173 1.00 0.00 O ATOM 284 CB GLU A 54 4.393 12.271 -1.041 1.00 0.00 C ATOM 285 CG GLU A 54 5.224 11.908 0.178 1.00 0.00 C ATOM 286 CD GLU A 54 6.519 12.693 0.257 1.00 0.00 C ATOM 287 OE1 GLU A 54 7.483 12.186 0.868 1.00 0.00 O ATOM 288 OE2 GLU A 54 6.569 13.812 -0.293 1.00 0.00 O ATOM 0 H GLU A 54 4.509 10.137 -2.276 1.00 0.00 H new ATOM 0 HA GLU A 54 2.839 11.005 -0.271 1.00 0.00 H new ATOM 0 HB2 GLU A 54 5.023 12.214 -1.929 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.063 13.306 -0.950 1.00 0.00 H new ATOM 0 HG2 GLU A 54 4.638 12.089 1.079 1.00 0.00 H new ATOM 0 HG3 GLU A 54 5.451 10.842 0.154 1.00 0.00 H new ATOM 295 N ASN A 55 2.088 12.331 -3.185 1.00 0.00 N ATOM 296 CA ASN A 55 1.061 13.071 -3.904 1.00 0.00 C ATOM 297 C ASN A 55 -0.265 12.321 -3.866 1.00 0.00 C ATOM 298 O ASN A 55 -1.336 12.930 -3.871 1.00 0.00 O ATOM 299 CB ASN A 55 1.486 13.302 -5.355 1.00 0.00 C ATOM 300 CG ASN A 55 2.736 14.153 -5.463 1.00 0.00 C ATOM 301 OD1 ASN A 55 2.976 15.033 -4.637 1.00 0.00 O ATOM 302 ND2 ASN A 55 3.539 13.894 -6.488 1.00 0.00 N ATOM 0 H ASN A 55 2.830 11.955 -3.775 1.00 0.00 H new ATOM 0 HA ASN A 55 0.932 14.037 -3.415 1.00 0.00 H new ATOM 0 HB2 ASN A 55 1.662 12.340 -5.837 1.00 0.00 H new ATOM 0 HB3 ASN A 55 0.673 13.785 -5.896 1.00 0.00 H new ATOM 0 HD21 ASN A 55 4.395 14.434 -6.615 1.00 0.00 H new ATOM 0 HD22 ASN A 55 3.300 13.155 -7.149 1.00 0.00 H new ATOM 309 N TYR A 56 -0.186 10.994 -3.830 1.00 0.00 N ATOM 310 CA TYR A 56 -1.373 10.160 -3.796 1.00 0.00 C ATOM 311 C TYR A 56 -1.996 10.149 -2.398 1.00 0.00 C ATOM 312 O TYR A 56 -3.205 10.333 -2.251 1.00 0.00 O ATOM 313 CB TYR A 56 -1.019 8.738 -4.241 1.00 0.00 C ATOM 314 CG TYR A 56 -2.050 7.709 -3.855 1.00 0.00 C ATOM 315 CD1 TYR A 56 -3.277 7.658 -4.496 1.00 0.00 C ATOM 316 CD2 TYR A 56 -1.797 6.801 -2.839 1.00 0.00 C ATOM 317 CE1 TYR A 56 -4.229 6.728 -4.133 1.00 0.00 C ATOM 318 CE2 TYR A 56 -2.740 5.866 -2.472 1.00 0.00 C ATOM 319 CZ TYR A 56 -3.956 5.833 -3.120 1.00 0.00 C ATOM 320 OH TYR A 56 -4.903 4.905 -2.754 1.00 0.00 O ATOM 0 H TYR A 56 0.693 10.476 -3.824 1.00 0.00 H new ATOM 0 HA TYR A 56 -2.110 10.574 -4.484 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -0.894 8.726 -5.324 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.059 8.459 -3.806 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.491 8.356 -5.291 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -0.846 6.827 -2.327 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -5.183 6.701 -4.639 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -2.527 5.163 -1.681 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.471 5.278 -2.048 1.00 0.00 H new ATOM 330 N LEU A 57 -1.170 9.939 -1.377 1.00 0.00 N ATOM 331 CA LEU A 57 -1.659 9.912 -0.001 1.00 0.00 C ATOM 332 C LEU A 57 -2.251 11.265 0.376 1.00 0.00 C ATOM 333 O LEU A 57 -3.313 11.345 0.993 1.00 0.00 O ATOM 334 CB LEU A 57 -0.530 9.564 0.975 1.00 0.00 C ATOM 335 CG LEU A 57 0.442 8.481 0.503 1.00 0.00 C ATOM 336 CD1 LEU A 57 1.417 8.120 1.612 1.00 0.00 C ATOM 337 CD2 LEU A 57 -0.317 7.248 0.040 1.00 0.00 C ATOM 0 H LEU A 57 -0.166 9.786 -1.474 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.431 9.145 0.064 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.038 10.471 1.184 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.975 9.242 1.917 1.00 0.00 H new ATOM 0 HG LEU A 57 1.010 8.873 -0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.101 7.348 1.258 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.985 9.005 1.899 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.865 7.748 2.475 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.391 6.488 -0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.911 6.855 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.976 7.515 -0.786 1.00 0.00 H new ATOM 349 N GLU A 58 -1.549 12.329 -0.004 1.00 0.00 N ATOM 350 CA GLU A 58 -1.995 13.688 0.289 1.00 0.00 C ATOM 351 C GLU A 58 -3.290 13.997 -0.448 1.00 0.00 C ATOM 352 O GLU A 58 -4.258 14.470 0.147 1.00 0.00 O ATOM 353 CB GLU A 58 -0.916 14.700 -0.101 1.00 0.00 C ATOM 354 CG GLU A 58 -0.892 15.935 0.785 1.00 0.00 C ATOM 355 CD GLU A 58 -1.734 17.067 0.230 1.00 0.00 C ATOM 356 OE1 GLU A 58 -2.380 17.773 1.031 1.00 0.00 O ATOM 357 OE2 GLU A 58 -1.747 17.246 -1.006 1.00 0.00 O ATOM 0 H GLU A 58 -0.668 12.276 -0.516 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.177 13.764 1.361 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.059 14.214 -0.059 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.075 15.008 -1.135 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.254 15.672 1.779 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.137 16.275 0.900 1.00 0.00 H new ATOM 364 N SER A 59 -3.305 13.708 -1.742 1.00 0.00 N ATOM 365 CA SER A 59 -4.491 13.938 -2.556 1.00 0.00 C ATOM 366 C SER A 59 -5.633 13.049 -2.076 1.00 0.00 C ATOM 367 O SER A 59 -6.808 13.371 -2.254 1.00 0.00 O ATOM 368 CB SER A 59 -4.192 13.655 -4.030 1.00 0.00 C ATOM 369 OG SER A 59 -3.528 14.752 -4.635 1.00 0.00 O ATOM 0 H SER A 59 -2.512 13.315 -2.250 1.00 0.00 H new ATOM 0 HA SER A 59 -4.785 14.983 -2.455 1.00 0.00 H new ATOM 0 HB2 SER A 59 -3.575 12.761 -4.114 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.122 13.451 -4.561 1.00 0.00 H new ATOM 0 HG SER A 59 -2.561 14.595 -4.624 1.00 0.00 H new ATOM 623 N SER A 78 -5.599 7.765 6.100 1.00 0.00 N ATOM 624 CA SER A 78 -4.329 8.321 5.654 1.00 0.00 C ATOM 625 C SER A 78 -3.213 7.978 6.636 1.00 0.00 C ATOM 626 O SER A 78 -3.374 8.121 7.848 1.00 0.00 O ATOM 627 CB SER A 78 -4.439 9.838 5.492 1.00 0.00 C ATOM 628 OG SER A 78 -5.223 10.406 6.527 1.00 0.00 O ATOM 0 HA SER A 78 -4.086 7.880 4.687 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.443 10.281 5.501 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.883 10.072 4.525 1.00 0.00 H new ATOM 0 HG SER A 78 -5.858 9.738 6.860 1.00 0.00 H new ATOM 634 N LEU A 79 -2.089 7.516 6.103 1.00 0.00 N ATOM 635 CA LEU A 79 -0.946 7.141 6.931 1.00 0.00 C ATOM 636 C LEU A 79 0.150 8.202 6.865 1.00 0.00 C ATOM 637 O LEU A 79 0.346 8.842 5.831 1.00 0.00 O ATOM 638 CB LEU A 79 -0.382 5.772 6.507 1.00 0.00 C ATOM 639 CG LEU A 79 -0.728 5.307 5.089 1.00 0.00 C ATOM 640 CD1 LEU A 79 -2.223 5.064 4.956 1.00 0.00 C ATOM 641 CD2 LEU A 79 -0.239 6.310 4.050 1.00 0.00 C ATOM 0 H LEU A 79 -1.943 7.391 5.101 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.296 7.068 7.961 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.703 5.805 6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.741 5.021 7.211 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.214 4.364 4.905 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.449 4.734 3.942 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.531 4.295 5.665 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.762 5.988 5.166 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.498 5.956 3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.712 7.276 4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.843 6.417 4.128 1.00 0.00 H new ATOM 653 N ALA A 80 0.863 8.382 7.974 1.00 0.00 N ATOM 654 CA ALA A 80 1.940 9.363 8.039 1.00 0.00 C ATOM 655 C ALA A 80 3.279 8.722 7.690 1.00 0.00 C ATOM 656 O ALA A 80 3.651 7.695 8.255 1.00 0.00 O ATOM 657 CB ALA A 80 1.999 9.992 9.424 1.00 0.00 C ATOM 0 H ALA A 80 0.714 7.861 8.838 1.00 0.00 H new ATOM 0 HA ALA A 80 1.735 10.145 7.307 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.808 10.722 9.458 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.053 10.488 9.639 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.179 9.216 10.168 1.00 0.00 H new ATOM 663 N LEU A 81 3.995 9.331 6.753 1.00 0.00 N ATOM 664 CA LEU A 81 5.287 8.812 6.321 1.00 0.00 C ATOM 665 C LEU A 81 6.360 9.012 7.387 1.00 0.00 C ATOM 666 O LEU A 81 6.347 9.997 8.127 1.00 0.00 O ATOM 667 CB LEU A 81 5.717 9.482 5.016 1.00 0.00 C ATOM 668 CG LEU A 81 4.916 9.064 3.782 1.00 0.00 C ATOM 669 CD1 LEU A 81 5.205 9.997 2.617 1.00 0.00 C ATOM 670 CD2 LEU A 81 5.229 7.624 3.405 1.00 0.00 C ATOM 0 H LEU A 81 3.703 10.185 6.278 1.00 0.00 H new ATOM 0 HA LEU A 81 5.173 7.740 6.157 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.635 10.562 5.135 1.00 0.00 H new ATOM 0 HB3 LEU A 81 6.770 9.260 4.840 1.00 0.00 H new ATOM 0 HG LEU A 81 3.855 9.133 4.021 1.00 0.00 H new ATOM 0 HD11 LEU A 81 4.626 9.684 1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.929 11.016 2.889 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.268 9.961 2.377 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.650 7.344 2.525 1.00 0.00 H new ATOM 0 HD22 LEU A 81 6.292 7.528 3.185 1.00 0.00 H new ATOM 0 HD23 LEU A 81 4.969 6.966 4.234 1.00 0.00 H new ATOM 682 N ASN A 82 7.292 8.067 7.451 1.00 0.00 N ATOM 683 CA ASN A 82 8.388 8.119 8.412 1.00 0.00 C ATOM 684 C ASN A 82 9.696 7.707 7.744 1.00 0.00 C ATOM 685 O ASN A 82 9.724 7.416 6.549 1.00 0.00 O ATOM 686 CB ASN A 82 8.098 7.204 9.602 1.00 0.00 C ATOM 687 CG ASN A 82 7.033 7.768 10.521 1.00 0.00 C ATOM 688 OD1 ASN A 82 6.664 8.938 10.419 1.00 0.00 O ATOM 689 ND2 ASN A 82 6.532 6.935 11.427 1.00 0.00 N ATOM 0 H ASN A 82 7.310 7.249 6.843 1.00 0.00 H new ATOM 0 HA ASN A 82 8.483 9.143 8.773 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.778 6.228 9.237 1.00 0.00 H new ATOM 0 HB3 ASN A 82 9.016 7.047 10.168 1.00 0.00 H new ATOM 0 HD21 ASN A 82 5.812 7.258 12.073 1.00 0.00 H new ATOM 0 HD22 ASN A 82 6.867 5.973 11.476 1.00 0.00 H new ATOM 696 N ALA A 83 10.778 7.681 8.517 1.00 0.00 N ATOM 697 CA ALA A 83 12.081 7.299 7.982 1.00 0.00 C ATOM 698 C ALA A 83 12.003 5.963 7.248 1.00 0.00 C ATOM 699 O ALA A 83 12.740 5.726 6.292 1.00 0.00 O ATOM 700 CB ALA A 83 13.116 7.233 9.094 1.00 0.00 C ATOM 0 H ALA A 83 10.779 7.918 9.509 1.00 0.00 H new ATOM 0 HA ALA A 83 12.387 8.062 7.266 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.081 6.947 8.676 1.00 0.00 H new ATOM 0 HB2 ALA A 83 13.202 8.210 9.570 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.808 6.495 9.835 1.00 0.00 H new ATOM 706 N GLU A 84 11.096 5.099 7.695 1.00 0.00 N ATOM 707 CA GLU A 84 10.912 3.795 7.072 1.00 0.00 C ATOM 708 C GLU A 84 10.317 3.950 5.675 1.00 0.00 C ATOM 709 O GLU A 84 10.428 3.054 4.838 1.00 0.00 O ATOM 710 CB GLU A 84 10.008 2.913 7.934 1.00 0.00 C ATOM 711 CG GLU A 84 10.422 1.452 7.954 1.00 0.00 C ATOM 712 CD GLU A 84 10.146 0.750 6.638 1.00 0.00 C ATOM 713 OE1 GLU A 84 9.130 1.080 5.991 1.00 0.00 O ATOM 714 OE2 GLU A 84 10.947 -0.128 6.254 1.00 0.00 O ATOM 0 H GLU A 84 10.478 5.280 8.486 1.00 0.00 H new ATOM 0 HA GLU A 84 11.887 3.316 6.985 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.008 3.296 8.955 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.985 2.987 7.566 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.485 1.383 8.183 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.890 0.938 8.754 1.00 0.00 H new ATOM 721 N SER A 85 9.692 5.101 5.429 1.00 0.00 N ATOM 722 CA SER A 85 9.086 5.386 4.133 1.00 0.00 C ATOM 723 C SER A 85 10.122 5.307 3.012 1.00 0.00 C ATOM 724 O SER A 85 9.768 5.213 1.837 1.00 0.00 O ATOM 725 CB SER A 85 8.438 6.771 4.146 1.00 0.00 C ATOM 726 OG SER A 85 7.458 6.868 5.165 1.00 0.00 O ATOM 0 H SER A 85 9.593 5.851 6.113 1.00 0.00 H new ATOM 0 HA SER A 85 8.321 4.633 3.946 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.203 7.532 4.300 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.980 6.970 3.177 1.00 0.00 H new ATOM 0 HG SER A 85 7.277 5.977 5.530 1.00 0.00 H new ATOM 732 N ASN A 86 11.400 5.341 3.380 1.00 0.00 N ATOM 733 CA ASN A 86 12.476 5.269 2.401 1.00 0.00 C ATOM 734 C ASN A 86 12.893 3.822 2.144 1.00 0.00 C ATOM 735 O ASN A 86 13.672 3.549 1.233 1.00 0.00 O ATOM 736 CB ASN A 86 13.685 6.075 2.875 1.00 0.00 C ATOM 737 CG ASN A 86 13.294 7.419 3.454 1.00 0.00 C ATOM 738 OD1 ASN A 86 12.500 7.501 4.390 1.00 0.00 O ATOM 739 ND2 ASN A 86 13.855 8.484 2.896 1.00 0.00 N ATOM 0 H ASN A 86 11.713 5.418 4.348 1.00 0.00 H new ATOM 0 HA ASN A 86 12.103 5.693 1.469 1.00 0.00 H new ATOM 0 HB2 ASN A 86 14.227 5.502 3.628 1.00 0.00 H new ATOM 0 HB3 ASN A 86 14.367 6.228 2.038 1.00 0.00 H new ATOM 0 HD21 ASN A 86 13.633 9.418 3.242 1.00 0.00 H new ATOM 0 HD22 ASN A 86 14.509 8.369 2.121 1.00 0.00 H new ATOM 746 N ASN A 87 12.374 2.897 2.946 1.00 0.00 N ATOM 747 CA ASN A 87 12.704 1.487 2.785 1.00 0.00 C ATOM 748 C ASN A 87 11.482 0.695 2.337 1.00 0.00 C ATOM 749 O ASN A 87 10.575 0.437 3.127 1.00 0.00 O ATOM 750 CB ASN A 87 13.231 0.912 4.102 1.00 0.00 C ATOM 751 CG ASN A 87 14.191 1.848 4.807 1.00 0.00 C ATOM 752 OD1 ASN A 87 15.145 2.348 4.210 1.00 0.00 O ATOM 753 ND2 ASN A 87 13.942 2.088 6.089 1.00 0.00 N ATOM 0 H ASN A 87 11.727 3.098 3.709 1.00 0.00 H new ATOM 0 HA ASN A 87 13.477 1.405 2.021 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.390 0.696 4.762 1.00 0.00 H new ATOM 0 HB3 ASN A 87 13.733 -0.035 3.905 1.00 0.00 H new ATOM 0 HD21 ASN A 87 14.553 2.709 6.620 1.00 0.00 H new ATOM 0 HD22 ASN A 87 13.140 1.652 6.543 1.00 0.00 H new ATOM 760 N VAL A 88 11.470 0.302 1.069 1.00 0.00 N ATOM 761 CA VAL A 88 10.359 -0.467 0.518 1.00 0.00 C ATOM 762 C VAL A 88 10.492 -1.948 0.856 1.00 0.00 C ATOM 763 O VAL A 88 11.595 -2.490 0.898 1.00 0.00 O ATOM 764 CB VAL A 88 10.262 -0.305 -1.012 1.00 0.00 C ATOM 765 CG1 VAL A 88 9.027 -1.013 -1.548 1.00 0.00 C ATOM 766 CG2 VAL A 88 10.245 1.167 -1.392 1.00 0.00 C ATOM 0 H VAL A 88 12.216 0.503 0.403 1.00 0.00 H new ATOM 0 HA VAL A 88 9.450 -0.074 0.973 1.00 0.00 H new ATOM 0 HB VAL A 88 11.141 -0.765 -1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.976 -0.887 -2.630 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.084 -2.075 -1.308 1.00 0.00 H new ATOM 0 HG13 VAL A 88 8.135 -0.585 -1.091 1.00 0.00 H new ATOM 0 HG21 VAL A 88 10.176 1.262 -2.476 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.385 1.652 -0.930 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.161 1.643 -1.043 1.00 0.00 H new ATOM 776 N MET A 89 9.354 -2.590 1.098 1.00 0.00 N ATOM 777 CA MET A 89 9.323 -4.007 1.438 1.00 0.00 C ATOM 778 C MET A 89 8.568 -4.800 0.372 1.00 0.00 C ATOM 779 O MET A 89 7.434 -4.469 0.030 1.00 0.00 O ATOM 780 CB MET A 89 8.666 -4.201 2.808 1.00 0.00 C ATOM 781 CG MET A 89 9.658 -4.480 3.926 1.00 0.00 C ATOM 782 SD MET A 89 10.459 -2.982 4.531 1.00 0.00 S ATOM 783 CE MET A 89 10.064 -3.068 6.275 1.00 0.00 C ATOM 0 H MET A 89 8.436 -2.147 1.064 1.00 0.00 H new ATOM 0 HA MET A 89 10.347 -4.378 1.479 1.00 0.00 H new ATOM 0 HB2 MET A 89 8.093 -3.307 3.057 1.00 0.00 H new ATOM 0 HB3 MET A 89 7.958 -5.027 2.748 1.00 0.00 H new ATOM 0 HG2 MET A 89 9.141 -4.970 4.751 1.00 0.00 H new ATOM 0 HG3 MET A 89 10.418 -5.175 3.568 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.716 -2.094 6.618 1.00 0.00 H new ATOM 0 HE2 MET A 89 9.282 -3.810 6.435 1.00 0.00 H new ATOM 0 HE3 MET A 89 10.954 -3.353 6.836 1.00 0.00 H new ATOM 793 N MET A 90 9.207 -5.843 -0.152 1.00 0.00 N ATOM 794 CA MET A 90 8.595 -6.678 -1.185 1.00 0.00 C ATOM 795 C MET A 90 8.174 -8.028 -0.615 1.00 0.00 C ATOM 796 O MET A 90 8.952 -8.691 0.069 1.00 0.00 O ATOM 797 CB MET A 90 9.564 -6.898 -2.354 1.00 0.00 C ATOM 798 CG MET A 90 10.618 -5.813 -2.503 1.00 0.00 C ATOM 799 SD MET A 90 9.955 -4.292 -3.206 1.00 0.00 S ATOM 800 CE MET A 90 11.005 -3.074 -2.419 1.00 0.00 C ATOM 0 H MET A 90 10.147 -6.131 0.120 1.00 0.00 H new ATOM 0 HA MET A 90 7.711 -6.155 -1.549 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.063 -7.858 -2.222 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.991 -6.962 -3.279 1.00 0.00 H new ATOM 0 HG2 MET A 90 11.053 -5.598 -1.527 1.00 0.00 H new ATOM 0 HG3 MET A 90 11.425 -6.180 -3.137 1.00 0.00 H new ATOM 0 HE1 MET A 90 10.935 -2.130 -2.959 1.00 0.00 H new ATOM 0 HE2 MET A 90 10.682 -2.927 -1.388 1.00 0.00 H new ATOM 0 HE3 MET A 90 12.038 -3.423 -2.429 1.00 0.00 H new ATOM 810 N LEU A 91 6.939 -8.431 -0.899 1.00 0.00 N ATOM 811 CA LEU A 91 6.427 -9.706 -0.406 1.00 0.00 C ATOM 812 C LEU A 91 5.254 -10.208 -1.233 1.00 0.00 C ATOM 813 O LEU A 91 4.421 -9.427 -1.688 1.00 0.00 O ATOM 814 CB LEU A 91 5.964 -9.571 1.047 1.00 0.00 C ATOM 815 CG LEU A 91 4.835 -8.559 1.265 1.00 0.00 C ATOM 816 CD1 LEU A 91 3.690 -9.191 2.042 1.00 0.00 C ATOM 817 CD2 LEU A 91 5.353 -7.323 1.985 1.00 0.00 C ATOM 0 H LEU A 91 6.278 -7.898 -1.464 1.00 0.00 H new ATOM 0 HA LEU A 91 7.246 -10.421 -0.482 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.633 -10.547 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.817 -9.282 1.661 1.00 0.00 H new ATOM 0 HG LEU A 91 4.458 -8.253 0.289 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.899 -8.456 2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.298 -10.042 1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.052 -9.529 3.013 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.535 -6.617 2.130 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.760 -7.611 2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.135 -6.855 1.387 1.00 0.00 H new ATOM 829 N THR A 92 5.162 -11.525 -1.366 1.00 0.00 N ATOM 830 CA THR A 92 4.047 -12.135 -2.068 1.00 0.00 C ATOM 831 C THR A 92 2.986 -12.448 -1.028 1.00 0.00 C ATOM 832 O THR A 92 3.211 -13.264 -0.133 1.00 0.00 O ATOM 833 CB THR A 92 4.487 -13.411 -2.790 1.00 0.00 C ATOM 834 OG1 THR A 92 3.373 -14.070 -3.365 1.00 0.00 O ATOM 835 CG2 THR A 92 5.189 -14.399 -1.885 1.00 0.00 C ATOM 0 H THR A 92 5.845 -12.187 -0.997 1.00 0.00 H new ATOM 0 HA THR A 92 3.658 -11.458 -2.829 1.00 0.00 H new ATOM 0 HB THR A 92 5.190 -13.083 -3.555 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.674 -14.882 -3.823 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.474 -15.280 -2.460 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.082 -13.936 -1.464 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.518 -14.694 -1.078 1.00 0.00 H new ATOM 843 N HIS A 93 1.854 -11.763 -1.100 1.00 0.00 N ATOM 844 CA HIS A 93 0.813 -11.954 -0.103 1.00 0.00 C ATOM 845 C HIS A 93 -0.554 -11.504 -0.606 1.00 0.00 C ATOM 846 O HIS A 93 -0.658 -10.619 -1.455 1.00 0.00 O ATOM 847 CB HIS A 93 1.201 -11.160 1.147 1.00 0.00 C ATOM 848 CG HIS A 93 1.015 -11.899 2.433 1.00 0.00 C ATOM 849 ND1 HIS A 93 -0.213 -12.324 2.891 1.00 0.00 N ATOM 850 CD2 HIS A 93 1.916 -12.271 3.371 1.00 0.00 C ATOM 851 CE1 HIS A 93 -0.061 -12.926 4.057 1.00 0.00 C ATOM 852 NE2 HIS A 93 1.222 -12.909 4.370 1.00 0.00 N ATOM 0 H HIS A 93 1.635 -11.081 -1.826 1.00 0.00 H new ATOM 0 HA HIS A 93 0.731 -13.018 0.121 1.00 0.00 H new ATOM 0 HB2 HIS A 93 2.246 -10.861 1.062 1.00 0.00 H new ATOM 0 HB3 HIS A 93 0.609 -10.245 1.179 1.00 0.00 H new ATOM 0 HD2 HIS A 93 2.982 -12.099 3.340 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.851 -13.358 4.653 1.00 0.00 H new ATOM 0 HE2 HIS A 93 1.631 -13.305 5.216 1.00 0.00 H new ATOM 861 N ALA A 94 -1.601 -12.114 -0.058 1.00 0.00 N ATOM 862 CA ALA A 94 -2.969 -11.774 -0.429 1.00 0.00 C ATOM 863 C ALA A 94 -3.461 -10.585 0.387 1.00 0.00 C ATOM 864 O ALA A 94 -3.391 -10.593 1.615 1.00 0.00 O ATOM 865 CB ALA A 94 -3.885 -12.971 -0.226 1.00 0.00 C ATOM 0 H ALA A 94 -1.527 -12.848 0.646 1.00 0.00 H new ATOM 0 HA ALA A 94 -2.984 -11.500 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -4.903 -12.702 -0.507 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.544 -13.799 -0.847 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -3.865 -13.271 0.822 1.00 0.00 H new ATOM 871 N ILE A 95 -3.948 -9.560 -0.300 1.00 0.00 N ATOM 872 CA ILE A 95 -4.439 -8.360 0.367 1.00 0.00 C ATOM 873 C ILE A 95 -5.916 -8.487 0.726 1.00 0.00 C ATOM 874 O ILE A 95 -6.742 -8.841 -0.115 1.00 0.00 O ATOM 875 CB ILE A 95 -4.245 -7.106 -0.507 1.00 0.00 C ATOM 876 CG1 ILE A 95 -2.899 -7.163 -1.235 1.00 0.00 C ATOM 877 CG2 ILE A 95 -4.343 -5.849 0.346 1.00 0.00 C ATOM 878 CD1 ILE A 95 -1.706 -7.087 -0.309 1.00 0.00 C ATOM 0 H ILE A 95 -4.014 -9.535 -1.318 1.00 0.00 H new ATOM 0 HA ILE A 95 -3.854 -8.253 1.280 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.036 -7.077 -1.256 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -2.845 -8.088 -1.809 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.847 -6.341 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.204 -4.970 -0.284 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.324 -5.805 0.818 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -3.571 -5.870 1.115 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.788 -7.133 -0.894 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.736 -6.150 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.734 -7.924 0.389 1.00 0.00 H new ATOM 890 N THR A 96 -6.242 -8.185 1.980 1.00 0.00 N ATOM 891 CA THR A 96 -7.620 -8.254 2.448 1.00 0.00 C ATOM 892 C THR A 96 -8.291 -6.891 2.327 1.00 0.00 C ATOM 893 O THR A 96 -7.626 -5.857 2.371 1.00 0.00 O ATOM 894 CB THR A 96 -7.672 -8.740 3.898 1.00 0.00 C ATOM 895 OG1 THR A 96 -6.427 -9.290 4.291 1.00 0.00 O ATOM 896 CG2 THR A 96 -8.733 -9.793 4.137 1.00 0.00 C ATOM 0 H THR A 96 -5.570 -7.891 2.689 1.00 0.00 H new ATOM 0 HA THR A 96 -8.159 -8.967 1.823 1.00 0.00 H new ATOM 0 HB THR A 96 -7.916 -7.857 4.488 1.00 0.00 H new ATOM 0 HG1 THR A 96 -5.824 -8.569 4.567 1.00 0.00 H new ATOM 0 HG21 THR A 96 -8.717 -10.095 5.184 1.00 0.00 H new ATOM 0 HG22 THR A 96 -9.713 -9.384 3.892 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.534 -10.660 3.507 1.00 0.00 H new ATOM 904 N ARG A 97 -9.609 -6.894 2.168 1.00 0.00 N ATOM 905 CA ARG A 97 -10.366 -5.655 2.034 1.00 0.00 C ATOM 906 C ARG A 97 -11.316 -5.464 3.211 1.00 0.00 C ATOM 907 O ARG A 97 -12.285 -6.206 3.368 1.00 0.00 O ATOM 908 CB ARG A 97 -11.154 -5.658 0.721 1.00 0.00 C ATOM 909 CG ARG A 97 -10.982 -4.390 -0.102 1.00 0.00 C ATOM 910 CD ARG A 97 -10.894 -4.697 -1.590 1.00 0.00 C ATOM 911 NE ARG A 97 -12.153 -4.436 -2.282 1.00 0.00 N ATOM 912 CZ ARG A 97 -12.537 -3.230 -2.695 1.00 0.00 C ATOM 913 NH1 ARG A 97 -11.772 -2.168 -2.467 1.00 0.00 N ATOM 914 NH2 ARG A 97 -13.688 -3.084 -3.335 1.00 0.00 N ATOM 0 H ARG A 97 -10.176 -7.741 2.129 1.00 0.00 H new ATOM 0 HA ARG A 97 -9.659 -4.825 2.027 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -10.841 -6.514 0.122 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -12.212 -5.795 0.944 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -11.821 -3.719 0.083 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.080 -3.868 0.217 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.104 -4.094 -2.038 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.615 -5.742 -1.728 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.775 -5.224 -2.460 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -10.886 -2.274 -1.973 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.071 -1.246 -2.786 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -14.280 -3.896 -3.511 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.982 -2.160 -3.651 1.00 0.00 H new ATOM 928 N TYR A 98 -11.032 -4.461 4.035 1.00 0.00 N ATOM 929 CA TYR A 98 -11.861 -4.168 5.196 1.00 0.00 C ATOM 930 C TYR A 98 -12.581 -2.834 5.027 1.00 0.00 C ATOM 931 O TYR A 98 -12.006 -1.773 5.273 1.00 0.00 O ATOM 932 CB TYR A 98 -11.007 -4.137 6.466 1.00 0.00 C ATOM 933 CG TYR A 98 -10.664 -5.510 6.999 1.00 0.00 C ATOM 934 CD1 TYR A 98 -9.691 -6.291 6.389 1.00 0.00 C ATOM 935 CD2 TYR A 98 -11.313 -6.024 8.114 1.00 0.00 C ATOM 936 CE1 TYR A 98 -9.376 -7.546 6.874 1.00 0.00 C ATOM 937 CE2 TYR A 98 -11.002 -7.277 8.607 1.00 0.00 C ATOM 938 CZ TYR A 98 -10.034 -8.034 7.983 1.00 0.00 C ATOM 939 OH TYR A 98 -9.722 -9.282 8.470 1.00 0.00 O ATOM 0 H TYR A 98 -10.233 -3.837 3.919 1.00 0.00 H new ATOM 0 HA TYR A 98 -12.607 -4.958 5.285 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.084 -3.596 6.260 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -11.538 -3.579 7.237 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -9.172 -5.911 5.521 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -12.074 -5.434 8.604 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -8.618 -8.142 6.387 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.515 -7.661 9.477 1.00 0.00 H new ATOM 0 HH TYR A 98 -10.275 -9.474 9.256 1.00 0.00 H new ATOM 949 N GLY A 99 -13.843 -2.891 4.610 1.00 0.00 N ATOM 950 CA GLY A 99 -14.614 -1.676 4.420 1.00 0.00 C ATOM 951 C GLY A 99 -15.137 -1.105 5.723 1.00 0.00 C ATOM 952 O GLY A 99 -15.806 -1.798 6.490 1.00 0.00 O ATOM 0 H GLY A 99 -14.344 -3.755 4.401 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -13.993 -0.930 3.925 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.453 -1.883 3.756 1.00 0.00 H new ATOM 956 N ILE A 100 -14.823 0.163 5.976 1.00 0.00 N ATOM 957 CA ILE A 100 -15.260 0.830 7.202 1.00 0.00 C ATOM 958 C ILE A 100 -15.839 2.216 6.920 1.00 0.00 C ATOM 959 O ILE A 100 -16.137 2.969 7.848 1.00 0.00 O ATOM 960 CB ILE A 100 -14.103 0.981 8.217 1.00 0.00 C ATOM 961 CG1 ILE A 100 -12.967 0.011 7.896 1.00 0.00 C ATOM 962 CG2 ILE A 100 -14.603 0.749 9.635 1.00 0.00 C ATOM 963 CD1 ILE A 100 -13.352 -1.441 8.067 1.00 0.00 C ATOM 0 H ILE A 100 -14.269 0.749 5.351 1.00 0.00 H new ATOM 0 HA ILE A 100 -16.036 0.193 7.627 1.00 0.00 H new ATOM 0 HB ILE A 100 -13.720 1.999 8.142 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -12.639 0.174 6.869 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -12.117 0.232 8.541 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -13.775 0.859 10.335 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -15.378 1.478 9.871 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -15.015 -0.257 9.716 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -12.499 -2.075 7.823 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -13.652 -1.619 9.100 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -14.182 -1.678 7.402 1.00 0.00 H new ATOM 975 N SER A 101 -15.990 2.556 5.644 1.00 0.00 N ATOM 976 CA SER A 101 -16.524 3.859 5.262 1.00 0.00 C ATOM 977 C SER A 101 -17.831 3.721 4.490 1.00 0.00 C ATOM 978 O SER A 101 -18.672 4.619 4.512 1.00 0.00 O ATOM 979 CB SER A 101 -15.506 4.613 4.407 1.00 0.00 C ATOM 980 OG SER A 101 -15.652 6.014 4.556 1.00 0.00 O ATOM 0 H SER A 101 -15.751 1.950 4.859 1.00 0.00 H new ATOM 0 HA SER A 101 -16.723 4.417 6.177 1.00 0.00 H new ATOM 0 HB2 SER A 101 -14.497 4.317 4.693 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.634 4.340 3.359 1.00 0.00 H new ATOM 0 HG SER A 101 -16.604 6.240 4.609 1.00 0.00 H new ATOM 986 N THR A 102 -17.990 2.600 3.799 1.00 0.00 N ATOM 987 CA THR A 102 -19.188 2.356 3.008 1.00 0.00 C ATOM 988 C THR A 102 -19.302 0.883 2.632 1.00 0.00 C ATOM 989 O THR A 102 -18.332 0.130 2.730 1.00 0.00 O ATOM 990 CB THR A 102 -19.153 3.213 1.741 1.00 0.00 C ATOM 991 OG1 THR A 102 -18.907 4.571 2.061 1.00 0.00 O ATOM 992 CG2 THR A 102 -20.434 3.157 0.939 1.00 0.00 C ATOM 0 H THR A 102 -17.304 1.845 3.770 1.00 0.00 H new ATOM 0 HA THR A 102 -20.058 2.625 3.608 1.00 0.00 H new ATOM 0 HB THR A 102 -18.348 2.795 1.136 1.00 0.00 H new ATOM 0 HG1 THR A 102 -19.250 4.763 2.959 1.00 0.00 H new ATOM 0 HG21 THR A 102 -20.338 3.788 0.055 1.00 0.00 H new ATOM 0 HG22 THR A 102 -20.626 2.129 0.632 1.00 0.00 H new ATOM 0 HG23 THR A 102 -21.262 3.514 1.551 1.00 0.00 H new ATOM 1000 N ASP A 103 -20.491 0.478 2.199 1.00 0.00 N ATOM 1001 CA ASP A 103 -20.728 -0.905 1.803 1.00 0.00 C ATOM 1002 C ASP A 103 -20.650 -1.062 0.287 1.00 0.00 C ATOM 1003 O ASP A 103 -21.209 -2.001 -0.279 1.00 0.00 O ATOM 1004 CB ASP A 103 -22.094 -1.370 2.303 1.00 0.00 C ATOM 1005 CG ASP A 103 -22.102 -1.648 3.793 1.00 0.00 C ATOM 1006 OD1 ASP A 103 -22.583 -2.729 4.193 1.00 0.00 O ATOM 1007 OD2 ASP A 103 -21.629 -0.784 4.560 1.00 0.00 O ATOM 0 H ASP A 103 -21.305 1.087 2.113 1.00 0.00 H new ATOM 0 HA ASP A 103 -19.951 -1.523 2.253 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -22.840 -0.608 2.075 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -22.386 -2.273 1.766 1.00 0.00 H new ATOM 1012 N ASP A 104 -19.948 -0.139 -0.364 1.00 0.00 N ATOM 1013 CA ASP A 104 -19.791 -0.177 -1.813 1.00 0.00 C ATOM 1014 C ASP A 104 -18.326 0.020 -2.191 1.00 0.00 C ATOM 1015 O ASP A 104 -17.666 0.910 -1.658 1.00 0.00 O ATOM 1016 CB ASP A 104 -20.651 0.904 -2.472 1.00 0.00 C ATOM 1017 CG ASP A 104 -21.818 0.323 -3.246 1.00 0.00 C ATOM 1018 OD1 ASP A 104 -22.970 0.718 -2.970 1.00 0.00 O ATOM 1019 OD2 ASP A 104 -21.580 -0.527 -4.130 1.00 0.00 O ATOM 0 H ASP A 104 -19.479 0.645 0.090 1.00 0.00 H new ATOM 0 HA ASP A 104 -20.120 -1.153 -2.170 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -21.028 1.581 -1.706 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -20.032 1.497 -3.145 1.00 0.00 H new ATOM 1024 N PRO A 105 -17.797 -0.808 -3.118 1.00 0.00 N ATOM 1025 CA PRO A 105 -16.405 -0.729 -3.567 1.00 0.00 C ATOM 1026 C PRO A 105 -15.856 0.693 -3.576 1.00 0.00 C ATOM 1027 O PRO A 105 -15.919 1.391 -4.588 1.00 0.00 O ATOM 1028 CB PRO A 105 -16.499 -1.290 -4.978 1.00 0.00 C ATOM 1029 CG PRO A 105 -17.540 -2.352 -4.871 1.00 0.00 C ATOM 1030 CD PRO A 105 -18.518 -1.892 -3.813 1.00 0.00 C ATOM 0 HA PRO A 105 -15.721 -1.265 -2.909 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -16.785 -0.521 -5.696 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -15.544 -1.698 -5.311 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -18.043 -2.499 -5.827 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -17.093 -3.307 -4.596 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -19.448 -1.535 -4.255 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -18.780 -2.701 -3.131 1.00 0.00 H new ATOM 1038 N ASN A 106 -15.322 1.112 -2.434 1.00 0.00 N ATOM 1039 CA ASN A 106 -14.765 2.450 -2.297 1.00 0.00 C ATOM 1040 C ASN A 106 -13.662 2.491 -1.239 1.00 0.00 C ATOM 1041 O ASN A 106 -13.234 1.456 -0.728 1.00 0.00 O ATOM 1042 CB ASN A 106 -15.872 3.447 -1.945 1.00 0.00 C ATOM 1043 CG ASN A 106 -16.830 3.673 -3.097 1.00 0.00 C ATOM 1044 OD1 ASN A 106 -16.517 4.388 -4.049 1.00 0.00 O ATOM 1045 ND2 ASN A 106 -18.007 3.064 -3.015 1.00 0.00 N ATOM 0 H ASN A 106 -15.264 0.543 -1.590 1.00 0.00 H new ATOM 0 HA ASN A 106 -14.321 2.728 -3.253 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -16.426 3.081 -1.081 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.423 4.398 -1.657 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.694 3.180 -3.760 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -18.224 2.480 -2.207 1.00 0.00 H new ATOM 1052 N LYS A 107 -13.202 3.701 -0.928 1.00 0.00 N ATOM 1053 CA LYS A 107 -12.141 3.911 0.055 1.00 0.00 C ATOM 1054 C LYS A 107 -12.337 3.052 1.305 1.00 0.00 C ATOM 1055 O LYS A 107 -13.263 3.269 2.082 1.00 0.00 O ATOM 1056 CB LYS A 107 -12.076 5.398 0.433 1.00 0.00 C ATOM 1057 CG LYS A 107 -11.371 5.686 1.755 1.00 0.00 C ATOM 1058 CD LYS A 107 -12.212 6.580 2.655 1.00 0.00 C ATOM 1059 CE LYS A 107 -12.334 6.001 4.056 1.00 0.00 C ATOM 1060 NZ LYS A 107 -13.135 6.880 4.953 1.00 0.00 N ATOM 0 H LYS A 107 -13.553 4.561 -1.349 1.00 0.00 H new ATOM 0 HA LYS A 107 -11.198 3.606 -0.399 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -11.564 5.940 -0.362 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -13.091 5.791 0.484 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -11.160 4.747 2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -10.411 6.165 1.560 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -11.763 7.572 2.708 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -13.205 6.703 2.223 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -12.799 5.017 4.003 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -11.339 5.861 4.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -12.935 6.638 5.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -12.882 7.874 4.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -14.148 6.742 4.760 1.00 0.00 H new ATOM 1074 N TRP A 108 -11.434 2.093 1.488 1.00 0.00 N ATOM 1075 CA TRP A 108 -11.462 1.194 2.635 1.00 0.00 C ATOM 1076 C TRP A 108 -10.047 0.848 3.079 1.00 0.00 C ATOM 1077 O TRP A 108 -9.068 1.271 2.464 1.00 0.00 O ATOM 1078 CB TRP A 108 -12.207 -0.095 2.315 1.00 0.00 C ATOM 1079 CG TRP A 108 -13.649 0.104 1.976 1.00 0.00 C ATOM 1080 CD1 TRP A 108 -14.511 1.004 2.531 1.00 0.00 C ATOM 1081 CD2 TRP A 108 -14.404 -0.637 1.020 1.00 0.00 C ATOM 1082 NE1 TRP A 108 -15.753 0.870 1.972 1.00 0.00 N ATOM 1083 CE2 TRP A 108 -15.715 -0.134 1.044 1.00 0.00 C ATOM 1084 CE3 TRP A 108 -14.095 -1.676 0.147 1.00 0.00 C ATOM 1085 CZ2 TRP A 108 -16.720 -0.641 0.226 1.00 0.00 C ATOM 1086 CZ3 TRP A 108 -15.091 -2.178 -0.667 1.00 0.00 C ATOM 1087 CH2 TRP A 108 -16.392 -1.661 -0.622 1.00 0.00 C ATOM 0 H TRP A 108 -10.662 1.918 0.844 1.00 0.00 H new ATOM 0 HA TRP A 108 -11.985 1.714 3.438 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.713 -0.590 1.479 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -12.135 -0.766 3.171 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -14.251 1.718 3.299 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -16.573 1.428 2.209 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -13.095 -2.082 0.107 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -17.723 -0.243 0.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -14.863 -2.983 -1.350 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -17.150 -2.076 -1.270 1.00 0.00 H new ATOM 1098 N ARG A 109 -9.952 0.071 4.148 1.00 0.00 N ATOM 1099 CA ARG A 109 -8.665 -0.348 4.686 1.00 0.00 C ATOM 1100 C ARG A 109 -8.328 -1.747 4.199 1.00 0.00 C ATOM 1101 O ARG A 109 -9.201 -2.610 4.119 1.00 0.00 O ATOM 1102 CB ARG A 109 -8.726 -0.365 6.211 1.00 0.00 C ATOM 1103 CG ARG A 109 -8.009 0.788 6.882 1.00 0.00 C ATOM 1104 CD ARG A 109 -8.866 1.415 7.971 1.00 0.00 C ATOM 1105 NE ARG A 109 -8.709 0.734 9.254 1.00 0.00 N ATOM 1106 CZ ARG A 109 -9.370 -0.371 9.600 1.00 0.00 C ATOM 1107 NH1 ARG A 109 -10.258 -0.916 8.776 1.00 0.00 N ATOM 1108 NH2 ARG A 109 -9.150 -0.926 10.783 1.00 0.00 N ATOM 0 H ARG A 109 -10.757 -0.285 4.664 1.00 0.00 H new ATOM 0 HA ARG A 109 -7.901 0.353 4.350 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -9.771 -0.355 6.520 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -8.296 -1.301 6.569 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.072 0.435 7.312 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -7.754 1.542 6.138 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -8.597 2.465 8.083 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -9.913 1.384 7.670 1.00 0.00 H new ATOM 0 HE ARG A 109 -8.052 1.129 9.927 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -10.440 -0.489 7.868 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -10.758 -1.761 9.052 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -8.477 -0.508 11.425 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -9.654 -1.771 11.051 1.00 0.00 H new ATOM 1122 N TYR A 110 -7.059 -1.980 3.885 1.00 0.00 N ATOM 1123 CA TYR A 110 -6.638 -3.289 3.425 1.00 0.00 C ATOM 1124 C TYR A 110 -5.817 -3.967 4.501 1.00 0.00 C ATOM 1125 O TYR A 110 -5.391 -3.320 5.455 1.00 0.00 O ATOM 1126 CB TYR A 110 -5.854 -3.173 2.125 1.00 0.00 C ATOM 1127 CG TYR A 110 -6.740 -2.878 0.941 1.00 0.00 C ATOM 1128 CD1 TYR A 110 -7.111 -3.886 0.060 1.00 0.00 C ATOM 1129 CD2 TYR A 110 -7.206 -1.592 0.702 1.00 0.00 C ATOM 1130 CE1 TYR A 110 -7.922 -3.618 -1.025 1.00 0.00 C ATOM 1131 CE2 TYR A 110 -8.018 -1.317 -0.380 1.00 0.00 C ATOM 1132 CZ TYR A 110 -8.373 -2.332 -1.241 1.00 0.00 C ATOM 1133 OH TYR A 110 -9.182 -2.062 -2.319 1.00 0.00 O ATOM 0 H TYR A 110 -6.314 -1.285 3.941 1.00 0.00 H new ATOM 0 HA TYR A 110 -7.519 -3.899 3.225 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -5.109 -2.383 2.223 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -5.312 -4.102 1.947 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.760 -4.894 0.226 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -6.928 -0.793 1.374 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -8.202 -4.412 -1.702 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -8.373 -0.311 -0.551 1.00 0.00 H new ATOM 0 HH TYR A 110 -9.411 -1.109 -2.325 1.00 0.00 H new ATOM 1143 N TYR A 111 -5.623 -5.271 4.378 1.00 0.00 N ATOM 1144 CA TYR A 111 -4.874 -5.994 5.391 1.00 0.00 C ATOM 1145 C TYR A 111 -3.937 -7.036 4.797 1.00 0.00 C ATOM 1146 O TYR A 111 -4.358 -7.934 4.067 1.00 0.00 O ATOM 1147 CB TYR A 111 -5.841 -6.652 6.373 1.00 0.00 C ATOM 1148 CG TYR A 111 -6.378 -5.692 7.412 1.00 0.00 C ATOM 1149 CD1 TYR A 111 -5.997 -5.802 8.743 1.00 0.00 C ATOM 1150 CD2 TYR A 111 -7.259 -4.671 7.061 1.00 0.00 C ATOM 1151 CE1 TYR A 111 -6.478 -4.923 9.696 1.00 0.00 C ATOM 1152 CE2 TYR A 111 -7.743 -3.786 8.008 1.00 0.00 C ATOM 1153 CZ TYR A 111 -7.347 -3.917 9.324 1.00 0.00 C ATOM 1154 OH TYR A 111 -7.824 -3.043 10.272 1.00 0.00 O ATOM 0 H TYR A 111 -5.966 -5.840 3.604 1.00 0.00 H new ATOM 0 HA TYR A 111 -4.249 -5.269 5.913 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -6.675 -7.082 5.819 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -5.334 -7.476 6.876 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -5.315 -6.586 9.038 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -7.569 -4.569 6.032 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -6.175 -5.023 10.728 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -8.425 -2.999 7.720 1.00 0.00 H new ATOM 0 HH TYR A 111 -7.158 -2.936 10.983 1.00 0.00 H new ATOM 1164 N LEU A 112 -2.665 -6.916 5.152 1.00 0.00 N ATOM 1165 CA LEU A 112 -1.641 -7.846 4.706 1.00 0.00 C ATOM 1166 C LEU A 112 -1.386 -8.864 5.807 1.00 0.00 C ATOM 1167 O LEU A 112 -0.718 -8.564 6.798 1.00 0.00 O ATOM 1168 CB LEU A 112 -0.350 -7.093 4.374 1.00 0.00 C ATOM 1169 CG LEU A 112 0.597 -7.808 3.409 1.00 0.00 C ATOM 1170 CD1 LEU A 112 0.783 -9.262 3.815 1.00 0.00 C ATOM 1171 CD2 LEU A 112 0.070 -7.710 1.987 1.00 0.00 C ATOM 0 H LEU A 112 -2.316 -6.172 5.756 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.980 -8.358 3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.613 -6.125 3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.185 -6.897 5.303 1.00 0.00 H new ATOM 0 HG LEU A 112 1.570 -7.319 3.453 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.460 -9.751 3.115 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.204 -9.308 4.819 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.181 -9.770 3.802 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.753 -8.223 1.310 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -0.914 -8.175 1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.007 -6.662 1.699 1.00 0.00 H new ATOM 1183 N ASP A 113 -1.944 -10.058 5.654 1.00 0.00 N ATOM 1184 CA ASP A 113 -1.790 -11.093 6.664 1.00 0.00 C ATOM 1185 C ASP A 113 -2.524 -10.664 7.944 1.00 0.00 C ATOM 1186 O ASP A 113 -3.723 -10.386 7.902 1.00 0.00 O ATOM 1187 CB ASP A 113 -0.302 -11.360 6.925 1.00 0.00 C ATOM 1188 CG ASP A 113 -0.063 -12.675 7.642 1.00 0.00 C ATOM 1189 OD1 ASP A 113 0.699 -13.510 7.112 1.00 0.00 O ATOM 1190 OD2 ASP A 113 -0.638 -12.869 8.734 1.00 0.00 O ATOM 0 H ASP A 113 -2.503 -10.331 4.846 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.231 -12.025 6.312 1.00 0.00 H new ATOM 0 HB2 ASP A 113 0.234 -11.365 5.976 1.00 0.00 H new ATOM 0 HB3 ASP A 113 0.111 -10.545 7.520 1.00 0.00 H new ATOM 1195 N SER A 114 -1.818 -10.592 9.072 1.00 0.00 N ATOM 1196 CA SER A 114 -2.430 -10.177 10.328 1.00 0.00 C ATOM 1197 C SER A 114 -2.173 -8.694 10.600 1.00 0.00 C ATOM 1198 O SER A 114 -2.340 -8.227 11.726 1.00 0.00 O ATOM 1199 CB SER A 114 -1.892 -11.020 11.484 1.00 0.00 C ATOM 1200 OG SER A 114 -2.807 -11.046 12.566 1.00 0.00 O ATOM 0 H SER A 114 -0.825 -10.815 9.139 1.00 0.00 H new ATOM 0 HA SER A 114 -3.506 -10.330 10.245 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.703 -12.037 11.139 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.938 -10.615 11.820 1.00 0.00 H new ATOM 0 HG SER A 114 -3.087 -10.131 12.780 1.00 0.00 H new ATOM 1206 N VAL A 115 -1.756 -7.958 9.570 1.00 0.00 N ATOM 1207 CA VAL A 115 -1.467 -6.535 9.717 1.00 0.00 C ATOM 1208 C VAL A 115 -2.305 -5.693 8.759 1.00 0.00 C ATOM 1209 O VAL A 115 -2.742 -6.175 7.717 1.00 0.00 O ATOM 1210 CB VAL A 115 0.026 -6.239 9.471 1.00 0.00 C ATOM 1211 CG1 VAL A 115 0.340 -4.781 9.766 1.00 0.00 C ATOM 1212 CG2 VAL A 115 0.899 -7.160 10.309 1.00 0.00 C ATOM 0 H VAL A 115 -1.612 -8.324 8.629 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.722 -6.268 10.742 1.00 0.00 H new ATOM 0 HB VAL A 115 0.244 -6.427 8.420 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.399 -4.593 9.586 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.258 -4.141 9.116 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.104 -4.562 10.807 1.00 0.00 H new ATOM 0 HG21 VAL A 115 1.949 -6.936 10.122 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.679 -7.008 11.366 1.00 0.00 H new ATOM 0 HG23 VAL A 115 0.696 -8.197 10.041 1.00 0.00 H new ATOM 1222 N GLU A 116 -2.522 -4.433 9.122 1.00 0.00 N ATOM 1223 CA GLU A 116 -3.304 -3.521 8.293 1.00 0.00 C ATOM 1224 C GLU A 116 -2.398 -2.750 7.336 1.00 0.00 C ATOM 1225 O GLU A 116 -1.298 -2.339 7.708 1.00 0.00 O ATOM 1226 CB GLU A 116 -4.087 -2.544 9.172 1.00 0.00 C ATOM 1227 CG GLU A 116 -3.208 -1.724 10.101 1.00 0.00 C ATOM 1228 CD GLU A 116 -3.128 -2.312 11.497 1.00 0.00 C ATOM 1229 OE1 GLU A 116 -4.155 -2.829 11.983 1.00 0.00 O ATOM 1230 OE2 GLU A 116 -2.036 -2.257 12.102 1.00 0.00 O ATOM 0 H GLU A 116 -2.168 -4.020 9.985 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.007 -4.112 7.706 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -4.655 -1.868 8.533 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.809 -3.102 9.768 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -2.204 -1.657 9.681 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -3.597 -0.708 10.160 1.00 0.00 H new ATOM 1237 N VAL A 117 -2.862 -2.560 6.105 1.00 0.00 N ATOM 1238 CA VAL A 117 -2.089 -1.842 5.098 1.00 0.00 C ATOM 1239 C VAL A 117 -2.976 -0.963 4.219 1.00 0.00 C ATOM 1240 O VAL A 117 -4.211 -1.052 4.254 1.00 0.00 O ATOM 1241 CB VAL A 117 -1.303 -2.812 4.196 1.00 0.00 C ATOM 1242 CG1 VAL A 117 -0.175 -3.474 4.970 1.00 0.00 C ATOM 1243 CG2 VAL A 117 -2.234 -3.856 3.598 1.00 0.00 C ATOM 0 H VAL A 117 -3.770 -2.893 5.781 1.00 0.00 H new ATOM 0 HA VAL A 117 -1.392 -1.207 5.645 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.861 -2.240 3.380 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.366 -4.155 4.313 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.507 -2.710 5.343 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.589 -4.032 5.810 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.662 -4.533 2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -2.707 -4.423 4.399 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -3.001 -3.361 3.002 1.00 0.00 H new ATOM 1253 N HIS A 118 -2.321 -0.108 3.439 1.00 0.00 N ATOM 1254 CA HIS A 118 -3.009 0.815 2.545 1.00 0.00 C ATOM 1255 C HIS A 118 -2.839 0.414 1.081 1.00 0.00 C ATOM 1256 O HIS A 118 -1.821 0.718 0.457 1.00 0.00 O ATOM 1257 CB HIS A 118 -2.459 2.224 2.758 1.00 0.00 C ATOM 1258 CG HIS A 118 -3.164 3.289 1.972 1.00 0.00 C ATOM 1259 ND1 HIS A 118 -3.984 4.232 2.553 1.00 0.00 N ATOM 1260 CD2 HIS A 118 -3.153 3.575 0.645 1.00 0.00 C ATOM 1261 CE1 HIS A 118 -4.445 5.047 1.620 1.00 0.00 C ATOM 1262 NE2 HIS A 118 -3.957 4.667 0.455 1.00 0.00 N ATOM 0 H HIS A 118 -1.304 -0.036 3.409 1.00 0.00 H new ATOM 0 HA HIS A 118 -4.074 0.785 2.777 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -2.523 2.469 3.818 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -1.402 2.233 2.492 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.610 3.040 -0.120 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -5.109 5.883 1.784 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -4.148 5.114 -0.442 1.00 0.00 H new ATOM 1271 N LEU A 119 -3.851 -0.251 0.534 1.00 0.00 N ATOM 1272 CA LEU A 119 -3.830 -0.675 -0.863 1.00 0.00 C ATOM 1273 C LEU A 119 -4.749 0.224 -1.689 1.00 0.00 C ATOM 1274 O LEU A 119 -5.965 0.220 -1.493 1.00 0.00 O ATOM 1275 CB LEU A 119 -4.274 -2.132 -0.983 1.00 0.00 C ATOM 1276 CG LEU A 119 -4.193 -2.711 -2.389 1.00 0.00 C ATOM 1277 CD1 LEU A 119 -4.060 -4.224 -2.343 1.00 0.00 C ATOM 1278 CD2 LEU A 119 -5.408 -2.300 -3.195 1.00 0.00 C ATOM 0 H LEU A 119 -4.699 -0.509 1.038 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.812 -0.591 -1.242 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.660 -2.740 -0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -5.302 -2.214 -0.630 1.00 0.00 H new ATOM 0 HG LEU A 119 -3.304 -2.312 -2.877 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -4.004 -4.615 -3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.154 -4.493 -1.800 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -4.926 -4.650 -1.837 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.338 -2.720 -4.198 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.310 -2.671 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -5.451 -1.213 -3.259 1.00 0.00 H new ATOM 1290 N PRO A 120 -4.187 1.027 -2.612 1.00 0.00 N ATOM 1291 CA PRO A 120 -4.973 1.941 -3.441 1.00 0.00 C ATOM 1292 C PRO A 120 -6.167 1.258 -4.108 1.00 0.00 C ATOM 1293 O PRO A 120 -6.067 0.130 -4.584 1.00 0.00 O ATOM 1294 CB PRO A 120 -3.977 2.449 -4.494 1.00 0.00 C ATOM 1295 CG PRO A 120 -2.747 1.623 -4.326 1.00 0.00 C ATOM 1296 CD PRO A 120 -2.754 1.124 -2.912 1.00 0.00 C ATOM 0 HA PRO A 120 -5.410 2.740 -2.842 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.384 2.343 -5.500 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -3.760 3.507 -4.348 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -2.740 0.791 -5.030 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -1.853 2.215 -4.523 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.255 0.159 -2.820 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.245 1.812 -2.237 1.00 0.00 H new ATOM 1304 N PRO A 121 -7.324 1.941 -4.140 1.00 0.00 N ATOM 1305 CA PRO A 121 -8.565 1.413 -4.732 1.00 0.00 C ATOM 1306 C PRO A 121 -8.424 0.901 -6.169 1.00 0.00 C ATOM 1307 O PRO A 121 -9.341 0.263 -6.686 1.00 0.00 O ATOM 1308 CB PRO A 121 -9.519 2.618 -4.700 1.00 0.00 C ATOM 1309 CG PRO A 121 -8.659 3.803 -4.425 1.00 0.00 C ATOM 1310 CD PRO A 121 -7.532 3.287 -3.585 1.00 0.00 C ATOM 0 HA PRO A 121 -8.904 0.540 -4.175 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -10.045 2.727 -5.649 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -10.278 2.497 -3.927 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.290 4.244 -5.351 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.216 4.580 -3.902 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -6.640 3.907 -3.675 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -7.793 3.256 -2.527 1.00 0.00 H new ATOM 1318 N PHE A 122 -7.303 1.184 -6.824 1.00 0.00 N ATOM 1319 CA PHE A 122 -7.118 0.742 -8.210 1.00 0.00 C ATOM 1320 C PHE A 122 -6.495 -0.651 -8.308 1.00 0.00 C ATOM 1321 O PHE A 122 -6.319 -1.171 -9.410 1.00 0.00 O ATOM 1322 CB PHE A 122 -6.286 1.745 -9.028 1.00 0.00 C ATOM 1323 CG PHE A 122 -5.543 2.772 -8.218 1.00 0.00 C ATOM 1324 CD1 PHE A 122 -6.227 3.734 -7.489 1.00 0.00 C ATOM 1325 CD2 PHE A 122 -4.158 2.782 -8.197 1.00 0.00 C ATOM 1326 CE1 PHE A 122 -5.542 4.683 -6.755 1.00 0.00 C ATOM 1327 CE2 PHE A 122 -3.468 3.728 -7.463 1.00 0.00 C ATOM 1328 CZ PHE A 122 -4.161 4.679 -6.741 1.00 0.00 C ATOM 0 H PHE A 122 -6.520 1.707 -6.431 1.00 0.00 H new ATOM 0 HA PHE A 122 -8.120 0.690 -8.636 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.566 1.190 -9.630 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -6.949 2.263 -9.721 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -7.307 3.741 -7.495 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -3.611 2.041 -8.761 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.086 5.427 -6.193 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -2.388 3.723 -7.454 1.00 0.00 H new ATOM 0 HZ PHE A 122 -3.624 5.419 -6.166 1.00 0.00 H new ATOM 1338 N TRP A 123 -6.163 -1.264 -7.174 1.00 0.00 N ATOM 1339 CA TRP A 123 -5.569 -2.597 -7.193 1.00 0.00 C ATOM 1340 C TRP A 123 -6.527 -3.652 -6.645 1.00 0.00 C ATOM 1341 O TRP A 123 -6.244 -4.847 -6.715 1.00 0.00 O ATOM 1342 CB TRP A 123 -4.273 -2.605 -6.393 1.00 0.00 C ATOM 1343 CG TRP A 123 -3.250 -1.652 -6.914 1.00 0.00 C ATOM 1344 CD1 TRP A 123 -3.186 -1.100 -8.159 1.00 0.00 C ATOM 1345 CD2 TRP A 123 -2.144 -1.137 -6.186 1.00 0.00 C ATOM 1346 NE1 TRP A 123 -2.099 -0.257 -8.242 1.00 0.00 N ATOM 1347 CE2 TRP A 123 -1.445 -0.266 -7.037 1.00 0.00 C ATOM 1348 CE3 TRP A 123 -1.684 -1.329 -4.889 1.00 0.00 C ATOM 1349 CZ2 TRP A 123 -0.304 0.413 -6.621 1.00 0.00 C ATOM 1350 CZ3 TRP A 123 -0.559 -0.657 -4.480 1.00 0.00 C ATOM 1351 CH2 TRP A 123 0.119 0.203 -5.340 1.00 0.00 C ATOM 0 H TRP A 123 -6.293 -0.866 -6.244 1.00 0.00 H new ATOM 0 HA TRP A 123 -5.356 -2.848 -8.232 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -4.494 -2.358 -5.355 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -3.857 -3.612 -6.399 1.00 0.00 H new ATOM 0 HD1 TRP A 123 -3.883 -1.294 -8.961 1.00 0.00 H new ATOM 0 HE1 TRP A 123 -1.826 0.283 -9.063 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.202 -1.995 -4.215 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 0.226 1.080 -7.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -0.193 -0.798 -3.474 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.001 0.716 -4.985 1.00 0.00 H new ATOM 1362 N GLU A 124 -7.665 -3.213 -6.106 1.00 0.00 N ATOM 1363 CA GLU A 124 -8.651 -4.142 -5.561 1.00 0.00 C ATOM 1364 C GLU A 124 -8.975 -5.238 -6.574 1.00 0.00 C ATOM 1365 O GLU A 124 -9.353 -6.349 -6.204 1.00 0.00 O ATOM 1366 CB GLU A 124 -9.930 -3.402 -5.164 1.00 0.00 C ATOM 1367 CG GLU A 124 -10.472 -2.483 -6.246 1.00 0.00 C ATOM 1368 CD GLU A 124 -11.492 -3.168 -7.135 1.00 0.00 C ATOM 1369 OE1 GLU A 124 -11.330 -3.118 -8.373 1.00 0.00 O ATOM 1370 OE2 GLU A 124 -12.455 -3.752 -6.593 1.00 0.00 O ATOM 0 H GLU A 124 -7.924 -2.229 -6.036 1.00 0.00 H new ATOM 0 HA GLU A 124 -8.224 -4.603 -4.670 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.696 -4.133 -4.906 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.734 -2.815 -4.267 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.929 -1.610 -5.781 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.646 -2.122 -6.858 1.00 0.00 H new ATOM 1377 N GLN A 125 -8.815 -4.913 -7.854 1.00 0.00 N ATOM 1378 CA GLN A 125 -9.078 -5.865 -8.925 1.00 0.00 C ATOM 1379 C GLN A 125 -7.791 -6.565 -9.351 1.00 0.00 C ATOM 1380 O GLN A 125 -7.820 -7.695 -9.839 1.00 0.00 O ATOM 1381 CB GLN A 125 -9.708 -5.154 -10.123 1.00 0.00 C ATOM 1382 CG GLN A 125 -8.820 -4.078 -10.728 1.00 0.00 C ATOM 1383 CD GLN A 125 -9.575 -2.798 -11.026 1.00 0.00 C ATOM 1384 OE1 GLN A 125 -10.599 -2.812 -11.709 1.00 0.00 O ATOM 1385 NE2 GLN A 125 -9.070 -1.680 -10.516 1.00 0.00 N ATOM 0 H GLN A 125 -8.504 -3.996 -8.173 1.00 0.00 H new ATOM 0 HA GLN A 125 -9.775 -6.616 -8.552 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.944 -5.892 -10.890 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -10.651 -4.703 -9.813 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.001 -3.861 -10.043 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -8.374 -4.455 -11.648 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -8.219 -1.714 -9.955 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.534 -0.787 -10.685 1.00 0.00 H new ATOM 1394 N TYR A 126 -6.661 -5.886 -9.162 1.00 0.00 N ATOM 1395 CA TYR A 126 -5.364 -6.447 -9.525 1.00 0.00 C ATOM 1396 C TYR A 126 -4.864 -7.427 -8.465 1.00 0.00 C ATOM 1397 O TYR A 126 -3.908 -8.167 -8.697 1.00 0.00 O ATOM 1398 CB TYR A 126 -4.332 -5.333 -9.718 1.00 0.00 C ATOM 1399 CG TYR A 126 -4.795 -4.208 -10.623 1.00 0.00 C ATOM 1400 CD1 TYR A 126 -4.146 -2.982 -10.614 1.00 0.00 C ATOM 1401 CD2 TYR A 126 -5.875 -4.371 -11.484 1.00 0.00 C ATOM 1402 CE1 TYR A 126 -4.557 -1.949 -11.435 1.00 0.00 C ATOM 1403 CE2 TYR A 126 -6.292 -3.343 -12.309 1.00 0.00 C ATOM 1404 CZ TYR A 126 -5.630 -2.134 -12.280 1.00 0.00 C ATOM 1405 OH TYR A 126 -6.042 -1.109 -13.099 1.00 0.00 O ATOM 0 H TYR A 126 -6.619 -4.949 -8.761 1.00 0.00 H new ATOM 0 HA TYR A 126 -5.493 -6.988 -10.463 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.075 -4.918 -8.743 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.420 -5.765 -10.131 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -3.305 -2.832 -9.954 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.397 -5.316 -11.509 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -4.040 -1.001 -11.415 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -7.132 -3.486 -12.973 1.00 0.00 H new ATOM 0 HH TYR A 126 -6.810 -1.404 -13.632 1.00 0.00 H new ATOM 1415 N ILE A 127 -5.507 -7.421 -7.299 1.00 0.00 N ATOM 1416 CA ILE A 127 -5.111 -8.304 -6.208 1.00 0.00 C ATOM 1417 C ILE A 127 -5.788 -9.667 -6.304 1.00 0.00 C ATOM 1418 O ILE A 127 -6.997 -9.789 -6.111 1.00 0.00 O ATOM 1419 CB ILE A 127 -5.441 -7.683 -4.837 1.00 0.00 C ATOM 1420 CG1 ILE A 127 -6.897 -7.217 -4.794 1.00 0.00 C ATOM 1421 CG2 ILE A 127 -4.499 -6.526 -4.539 1.00 0.00 C ATOM 1422 CD1 ILE A 127 -7.623 -7.623 -3.531 1.00 0.00 C ATOM 0 H ILE A 127 -6.301 -6.817 -7.087 1.00 0.00 H new ATOM 0 HA ILE A 127 -4.033 -8.437 -6.299 1.00 0.00 H new ATOM 0 HB ILE A 127 -5.304 -8.446 -4.070 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -6.926 -6.131 -4.887 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.426 -7.625 -5.655 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -4.745 -6.098 -3.567 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -3.471 -6.888 -4.527 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.606 -5.762 -5.309 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -8.650 -7.259 -3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.626 -8.710 -3.446 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -7.117 -7.193 -2.666 1.00 0.00 H new ATOM 1434 N ASN A 128 -4.990 -10.692 -6.589 1.00 0.00 N ATOM 1435 CA ASN A 128 -5.498 -12.057 -6.694 1.00 0.00 C ATOM 1436 C ASN A 128 -5.170 -12.846 -5.428 1.00 0.00 C ATOM 1437 O ASN A 128 -4.749 -12.269 -4.425 1.00 0.00 O ATOM 1438 CB ASN A 128 -4.899 -12.756 -7.917 1.00 0.00 C ATOM 1439 CG ASN A 128 -4.978 -11.903 -9.167 1.00 0.00 C ATOM 1440 OD1 ASN A 128 -5.856 -12.092 -10.009 1.00 0.00 O ATOM 1441 ND2 ASN A 128 -4.056 -10.955 -9.296 1.00 0.00 N ATOM 0 H ASN A 128 -3.987 -10.603 -6.752 1.00 0.00 H new ATOM 0 HA ASN A 128 -6.581 -12.013 -6.810 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -3.857 -13.005 -7.716 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.424 -13.696 -8.088 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -4.058 -10.350 -10.117 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -3.346 -10.833 -8.574 1.00 0.00 H new ATOM 1448 N ASP A 129 -5.358 -14.166 -5.475 1.00 0.00 N ATOM 1449 CA ASP A 129 -5.070 -15.024 -4.321 1.00 0.00 C ATOM 1450 C ASP A 129 -3.711 -14.674 -3.722 1.00 0.00 C ATOM 1451 O ASP A 129 -3.604 -14.334 -2.545 1.00 0.00 O ATOM 1452 CB ASP A 129 -5.099 -16.497 -4.732 1.00 0.00 C ATOM 1453 CG ASP A 129 -5.693 -17.385 -3.657 1.00 0.00 C ATOM 1454 OD1 ASP A 129 -6.259 -18.443 -4.006 1.00 0.00 O ATOM 1455 OD2 ASP A 129 -5.593 -17.025 -2.465 1.00 0.00 O ATOM 0 H ASP A 129 -5.706 -14.664 -6.294 1.00 0.00 H new ATOM 0 HA ASP A 129 -5.838 -14.855 -3.567 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -5.678 -16.604 -5.649 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.085 -16.829 -4.955 1.00 0.00 H new ATOM 1460 N GLU A 130 -2.682 -14.730 -4.557 1.00 0.00 N ATOM 1461 CA GLU A 130 -1.328 -14.389 -4.139 1.00 0.00 C ATOM 1462 C GLU A 130 -0.786 -13.316 -5.071 1.00 0.00 C ATOM 1463 O GLU A 130 -0.823 -13.476 -6.292 1.00 0.00 O ATOM 1464 CB GLU A 130 -0.425 -15.626 -4.166 1.00 0.00 C ATOM 1465 CG GLU A 130 0.460 -15.759 -2.937 1.00 0.00 C ATOM 1466 CD GLU A 130 1.244 -17.056 -2.922 1.00 0.00 C ATOM 1467 OE1 GLU A 130 1.504 -17.581 -1.818 1.00 0.00 O ATOM 1468 OE2 GLU A 130 1.599 -17.549 -4.013 1.00 0.00 O ATOM 0 H GLU A 130 -2.760 -15.010 -5.535 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.347 -14.014 -3.116 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -1.046 -16.517 -4.255 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.205 -15.587 -5.055 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.154 -14.919 -2.900 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -0.158 -15.702 -2.041 1.00 0.00 H new ATOM 1475 N ASN A 131 -0.318 -12.206 -4.511 1.00 0.00 N ATOM 1476 CA ASN A 131 0.176 -11.114 -5.337 1.00 0.00 C ATOM 1477 C ASN A 131 1.510 -10.577 -4.858 1.00 0.00 C ATOM 1478 O ASN A 131 1.790 -10.529 -3.661 1.00 0.00 O ATOM 1479 CB ASN A 131 -0.836 -9.965 -5.362 1.00 0.00 C ATOM 1480 CG ASN A 131 -2.259 -10.426 -5.118 1.00 0.00 C ATOM 1481 OD1 ASN A 131 -2.662 -11.496 -5.570 1.00 0.00 O ATOM 1482 ND2 ASN A 131 -3.028 -9.618 -4.400 1.00 0.00 N ATOM 0 H ASN A 131 -0.271 -12.041 -3.506 1.00 0.00 H new ATOM 0 HA ASN A 131 0.315 -11.523 -6.338 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.563 -9.230 -4.605 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -0.783 -9.462 -6.328 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -3.995 -9.876 -4.204 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -2.652 -8.739 -4.044 1.00 0.00 H new ATOM 1489 N THR A 132 2.306 -10.121 -5.815 1.00 0.00 N ATOM 1490 CA THR A 132 3.591 -9.521 -5.515 1.00 0.00 C ATOM 1491 C THR A 132 3.343 -8.096 -5.053 1.00 0.00 C ATOM 1492 O THR A 132 2.979 -7.228 -5.853 1.00 0.00 O ATOM 1493 CB THR A 132 4.498 -9.534 -6.747 1.00 0.00 C ATOM 1494 OG1 THR A 132 4.632 -10.848 -7.258 1.00 0.00 O ATOM 1495 CG2 THR A 132 5.890 -9.004 -6.470 1.00 0.00 C ATOM 0 H THR A 132 2.080 -10.157 -6.809 1.00 0.00 H new ATOM 0 HA THR A 132 4.095 -10.090 -4.734 1.00 0.00 H new ATOM 0 HB THR A 132 4.013 -8.878 -7.470 1.00 0.00 H new ATOM 0 HG1 THR A 132 5.214 -10.835 -8.046 1.00 0.00 H new ATOM 0 HG21 THR A 132 6.482 -9.041 -7.385 1.00 0.00 H new ATOM 0 HG22 THR A 132 5.824 -7.973 -6.121 1.00 0.00 H new ATOM 0 HG23 THR A 132 6.367 -9.616 -5.705 1.00 0.00 H new ATOM 1503 N VAL A 133 3.488 -7.867 -3.754 1.00 0.00 N ATOM 1504 CA VAL A 133 3.228 -6.551 -3.188 1.00 0.00 C ATOM 1505 C VAL A 133 4.487 -5.888 -2.651 1.00 0.00 C ATOM 1506 O VAL A 133 5.265 -6.494 -1.915 1.00 0.00 O ATOM 1507 CB VAL A 133 2.170 -6.606 -2.056 1.00 0.00 C ATOM 1508 CG1 VAL A 133 0.858 -6.006 -2.528 1.00 0.00 C ATOM 1509 CG2 VAL A 133 1.951 -8.029 -1.557 1.00 0.00 C ATOM 0 H VAL A 133 3.782 -8.571 -3.077 1.00 0.00 H new ATOM 0 HA VAL A 133 2.843 -5.953 -4.014 1.00 0.00 H new ATOM 0 HB VAL A 133 2.551 -6.018 -1.221 1.00 0.00 H new ATOM 0 HG11 VAL A 133 0.126 -6.052 -1.722 1.00 0.00 H new ATOM 0 HG12 VAL A 133 1.016 -4.967 -2.816 1.00 0.00 H new ATOM 0 HG13 VAL A 133 0.489 -6.568 -3.386 1.00 0.00 H new ATOM 0 HG21 VAL A 133 1.203 -8.026 -0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 133 1.605 -8.654 -2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 133 2.889 -8.427 -1.169 1.00 0.00 H new ATOM 1519 N GLU A 134 4.647 -4.620 -3.004 1.00 0.00 N ATOM 1520 CA GLU A 134 5.771 -3.824 -2.546 1.00 0.00 C ATOM 1521 C GLU A 134 5.226 -2.638 -1.773 1.00 0.00 C ATOM 1522 O GLU A 134 4.506 -1.803 -2.326 1.00 0.00 O ATOM 1523 CB GLU A 134 6.625 -3.349 -3.717 1.00 0.00 C ATOM 1524 CG GLU A 134 7.126 -4.478 -4.604 1.00 0.00 C ATOM 1525 CD GLU A 134 6.026 -5.089 -5.450 1.00 0.00 C ATOM 1526 OE1 GLU A 134 5.597 -6.221 -5.139 1.00 0.00 O ATOM 1527 OE2 GLU A 134 5.593 -4.436 -6.422 1.00 0.00 O ATOM 0 H GLU A 134 4.002 -4.118 -3.614 1.00 0.00 H new ATOM 0 HA GLU A 134 6.411 -4.432 -1.906 1.00 0.00 H new ATOM 0 HB2 GLU A 134 6.042 -2.654 -4.322 1.00 0.00 H new ATOM 0 HB3 GLU A 134 7.481 -2.795 -3.330 1.00 0.00 H new ATOM 0 HG2 GLU A 134 7.913 -4.100 -5.256 1.00 0.00 H new ATOM 0 HG3 GLU A 134 7.573 -5.253 -3.981 1.00 0.00 H new ATOM 1534 N LEU A 135 5.527 -2.589 -0.487 1.00 0.00 N ATOM 1535 CA LEU A 135 5.010 -1.524 0.358 1.00 0.00 C ATOM 1536 C LEU A 135 6.020 -1.050 1.389 1.00 0.00 C ATOM 1537 O LEU A 135 6.915 -1.789 1.792 1.00 0.00 O ATOM 1538 CB LEU A 135 3.758 -2.023 1.084 1.00 0.00 C ATOM 1539 CG LEU A 135 3.958 -3.289 1.923 1.00 0.00 C ATOM 1540 CD1 LEU A 135 4.735 -2.977 3.191 1.00 0.00 C ATOM 1541 CD2 LEU A 135 2.617 -3.922 2.258 1.00 0.00 C ATOM 0 H LEU A 135 6.120 -3.266 -0.008 1.00 0.00 H new ATOM 0 HA LEU A 135 4.781 -0.678 -0.290 1.00 0.00 H new ATOM 0 HB2 LEU A 135 3.392 -1.228 1.734 1.00 0.00 H new ATOM 0 HB3 LEU A 135 2.980 -2.214 0.345 1.00 0.00 H new ATOM 0 HG LEU A 135 4.538 -4.001 1.336 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.866 -3.890 3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.712 -2.571 2.928 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.186 -2.246 3.784 1.00 0.00 H new ATOM 0 HD21 LEU A 135 2.777 -4.820 2.854 1.00 0.00 H new ATOM 0 HD22 LEU A 135 2.012 -3.214 2.824 1.00 0.00 H new ATOM 0 HD23 LEU A 135 2.099 -4.186 1.336 1.00 0.00 H new ATOM 1553 N ILE A 136 5.827 0.178 1.847 1.00 0.00 N ATOM 1554 CA ILE A 136 6.677 0.759 2.874 1.00 0.00 C ATOM 1555 C ILE A 136 5.870 0.843 4.158 1.00 0.00 C ATOM 1556 O ILE A 136 4.663 0.647 4.126 1.00 0.00 O ATOM 1557 CB ILE A 136 7.197 2.170 2.499 1.00 0.00 C ATOM 1558 CG1 ILE A 136 6.880 2.523 1.040 1.00 0.00 C ATOM 1559 CG2 ILE A 136 8.691 2.255 2.743 1.00 0.00 C ATOM 1560 CD1 ILE A 136 5.692 3.447 0.891 1.00 0.00 C ATOM 0 H ILE A 136 5.083 0.795 1.520 1.00 0.00 H new ATOM 0 HA ILE A 136 7.554 0.122 2.990 1.00 0.00 H new ATOM 0 HB ILE A 136 6.684 2.893 3.133 1.00 0.00 H new ATOM 0 HG12 ILE A 136 7.755 2.992 0.589 1.00 0.00 H new ATOM 0 HG13 ILE A 136 6.689 1.605 0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 136 9.047 3.250 2.477 1.00 0.00 H new ATOM 0 HG22 ILE A 136 8.899 2.065 3.796 1.00 0.00 H new ATOM 0 HG23 ILE A 136 9.202 1.511 2.132 1.00 0.00 H new ATOM 0 HD11 ILE A 136 5.524 3.656 -0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 136 4.806 2.972 1.313 1.00 0.00 H new ATOM 0 HD13 ILE A 136 5.889 4.380 1.418 1.00 0.00 H new ATOM 1572 N HIS A 137 6.518 1.105 5.284 1.00 0.00 N ATOM 1573 CA HIS A 137 5.801 1.175 6.554 1.00 0.00 C ATOM 1574 C HIS A 137 5.707 2.608 7.069 1.00 0.00 C ATOM 1575 O HIS A 137 6.721 3.258 7.324 1.00 0.00 O ATOM 1576 CB HIS A 137 6.475 0.259 7.572 1.00 0.00 C ATOM 1577 CG HIS A 137 6.672 -1.127 7.037 1.00 0.00 C ATOM 1578 ND1 HIS A 137 6.165 -2.256 7.645 1.00 0.00 N ATOM 1579 CD2 HIS A 137 7.300 -1.556 5.918 1.00 0.00 C ATOM 1580 CE1 HIS A 137 6.473 -3.319 6.918 1.00 0.00 C ATOM 1581 NE2 HIS A 137 7.162 -2.920 5.867 1.00 0.00 N ATOM 0 H HIS A 137 7.522 1.271 5.348 1.00 0.00 H new ATOM 0 HA HIS A 137 4.778 0.833 6.396 1.00 0.00 H new ATOM 0 HB2 HIS A 137 7.440 0.679 7.854 1.00 0.00 H new ATOM 0 HB3 HIS A 137 5.869 0.215 8.477 1.00 0.00 H new ATOM 0 HD1 HIS A 137 5.636 -2.270 8.517 1.00 0.00 H new ATOM 0 HD2 HIS A 137 7.815 -0.938 5.197 1.00 0.00 H new ATOM 0 HE1 HIS A 137 6.205 -4.340 7.147 1.00 0.00 H new ATOM 1590 N THR A 138 4.473 3.096 7.207 1.00 0.00 N ATOM 1591 CA THR A 138 4.230 4.455 7.676 1.00 0.00 C ATOM 1592 C THR A 138 4.209 4.509 9.202 1.00 0.00 C ATOM 1593 O THR A 138 4.697 3.600 9.873 1.00 0.00 O ATOM 1594 CB THR A 138 2.897 4.972 7.125 1.00 0.00 C ATOM 1595 OG1 THR A 138 1.821 4.522 7.927 1.00 0.00 O ATOM 1596 CG2 THR A 138 2.612 4.543 5.701 1.00 0.00 C ATOM 0 H THR A 138 3.627 2.566 6.999 1.00 0.00 H new ATOM 0 HA THR A 138 5.041 5.088 7.316 1.00 0.00 H new ATOM 0 HB THR A 138 2.988 6.058 7.141 1.00 0.00 H new ATOM 0 HG1 THR A 138 1.318 3.834 7.443 1.00 0.00 H new ATOM 0 HG21 THR A 138 1.651 4.949 5.384 1.00 0.00 H new ATOM 0 HG22 THR A 138 3.398 4.916 5.044 1.00 0.00 H new ATOM 0 HG23 THR A 138 2.581 3.455 5.648 1.00 0.00 H new ATOM 1604 N ASP A 139 3.621 5.575 9.743 1.00 0.00 N ATOM 1605 CA ASP A 139 3.514 5.737 11.188 1.00 0.00 C ATOM 1606 C ASP A 139 2.308 4.967 11.718 1.00 0.00 C ATOM 1607 O ASP A 139 2.123 4.830 12.928 1.00 0.00 O ATOM 1608 CB ASP A 139 3.390 7.218 11.550 1.00 0.00 C ATOM 1609 CG ASP A 139 3.558 7.467 13.036 1.00 0.00 C ATOM 1610 OD1 ASP A 139 4.642 7.936 13.440 1.00 0.00 O ATOM 1611 OD2 ASP A 139 2.605 7.193 13.795 1.00 0.00 O ATOM 0 H ASP A 139 3.213 6.337 9.202 1.00 0.00 H new ATOM 0 HA ASP A 139 4.418 5.338 11.649 1.00 0.00 H new ATOM 0 HB2 ASP A 139 4.141 7.787 11.002 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.415 7.587 11.231 1.00 0.00 H new ATOM 1616 N SER A 140 1.494 4.461 10.796 1.00 0.00 N ATOM 1617 CA SER A 140 0.304 3.697 11.138 1.00 0.00 C ATOM 1618 C SER A 140 0.385 2.305 10.529 1.00 0.00 C ATOM 1619 O SER A 140 0.557 1.309 11.232 1.00 0.00 O ATOM 1620 CB SER A 140 -0.944 4.419 10.625 1.00 0.00 C ATOM 1621 OG SER A 140 -0.628 5.286 9.544 1.00 0.00 O ATOM 0 H SER A 140 1.643 4.570 9.793 1.00 0.00 H new ATOM 0 HA SER A 140 0.242 3.605 12.222 1.00 0.00 H new ATOM 0 HB2 SER A 140 -1.684 3.687 10.303 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.394 4.993 11.435 1.00 0.00 H new ATOM 0 HG SER A 140 -0.561 6.207 9.872 1.00 0.00 H new ATOM 1627 N LEU A 141 0.273 2.257 9.210 1.00 0.00 N ATOM 1628 CA LEU A 141 0.343 1.009 8.469 1.00 0.00 C ATOM 1629 C LEU A 141 1.195 1.194 7.218 1.00 0.00 C ATOM 1630 O LEU A 141 1.528 2.318 6.844 1.00 0.00 O ATOM 1631 CB LEU A 141 -1.061 0.535 8.084 1.00 0.00 C ATOM 1632 CG LEU A 141 -2.025 1.642 7.655 1.00 0.00 C ATOM 1633 CD1 LEU A 141 -1.816 1.994 6.192 1.00 0.00 C ATOM 1634 CD2 LEU A 141 -3.465 1.217 7.903 1.00 0.00 C ATOM 0 H LEU A 141 0.131 3.081 8.625 1.00 0.00 H new ATOM 0 HA LEU A 141 0.802 0.251 9.104 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.974 -0.185 7.270 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -1.494 0.006 8.933 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.820 2.530 8.253 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -2.511 2.783 5.905 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.793 2.339 6.043 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -1.994 1.112 5.577 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -4.139 2.016 7.593 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -3.682 0.316 7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -3.607 1.015 8.965 1.00 0.00 H new ATOM 1646 N PRO A 142 1.588 0.095 6.565 1.00 0.00 N ATOM 1647 CA PRO A 142 2.418 0.153 5.369 1.00 0.00 C ATOM 1648 C PRO A 142 1.642 0.571 4.124 1.00 0.00 C ATOM 1649 O PRO A 142 0.540 0.085 3.871 1.00 0.00 O ATOM 1650 CB PRO A 142 2.945 -1.282 5.211 1.00 0.00 C ATOM 1651 CG PRO A 142 2.507 -2.013 6.439 1.00 0.00 C ATOM 1652 CD PRO A 142 1.294 -1.287 6.946 1.00 0.00 C ATOM 0 HA PRO A 142 3.204 0.901 5.474 1.00 0.00 H new ATOM 0 HB2 PRO A 142 2.542 -1.750 4.313 1.00 0.00 H new ATOM 0 HB3 PRO A 142 4.031 -1.292 5.116 1.00 0.00 H new ATOM 0 HG2 PRO A 142 2.272 -3.053 6.211 1.00 0.00 H new ATOM 0 HG3 PRO A 142 3.297 -2.023 7.190 1.00 0.00 H new ATOM 0 HD2 PRO A 142 0.377 -1.652 6.484 1.00 0.00 H new ATOM 0 HD3 PRO A 142 1.173 -1.397 8.024 1.00 0.00 H new ATOM 1660 N LEU A 143 2.241 1.464 3.344 1.00 0.00 N ATOM 1661 CA LEU A 143 1.631 1.943 2.109 1.00 0.00 C ATOM 1662 C LEU A 143 2.135 1.130 0.926 1.00 0.00 C ATOM 1663 O LEU A 143 3.333 1.100 0.647 1.00 0.00 O ATOM 1664 CB LEU A 143 1.951 3.424 1.887 1.00 0.00 C ATOM 1665 CG LEU A 143 1.078 4.142 0.847 1.00 0.00 C ATOM 1666 CD1 LEU A 143 1.249 3.535 -0.538 1.00 0.00 C ATOM 1667 CD2 LEU A 143 -0.378 4.090 1.255 1.00 0.00 C ATOM 0 H LEU A 143 3.153 1.873 3.547 1.00 0.00 H new ATOM 0 HA LEU A 143 0.551 1.825 2.194 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.853 3.945 2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.994 3.510 1.582 1.00 0.00 H new ATOM 0 HG LEU A 143 1.403 5.182 0.805 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.617 4.067 -1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.291 3.619 -0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 143 0.961 2.484 -0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 143 -0.984 4.603 0.508 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.698 3.051 1.330 1.00 0.00 H new ATOM 0 HD23 LEU A 143 -0.503 4.579 2.221 1.00 0.00 H new ATOM 1679 N VAL A 144 1.217 0.476 0.231 1.00 0.00 N ATOM 1680 CA VAL A 144 1.577 -0.328 -0.925 1.00 0.00 C ATOM 1681 C VAL A 144 1.802 0.561 -2.141 1.00 0.00 C ATOM 1682 O VAL A 144 0.853 1.017 -2.779 1.00 0.00 O ATOM 1683 CB VAL A 144 0.499 -1.389 -1.228 1.00 0.00 C ATOM 1684 CG1 VAL A 144 1.015 -2.401 -2.239 1.00 0.00 C ATOM 1685 CG2 VAL A 144 0.055 -2.088 0.054 1.00 0.00 C ATOM 0 H VAL A 144 0.220 0.486 0.447 1.00 0.00 H new ATOM 0 HA VAL A 144 2.505 -0.850 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 144 -0.366 -0.885 -1.658 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.241 -3.141 -2.440 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.277 -1.889 -3.165 1.00 0.00 H new ATOM 0 HG13 VAL A 144 1.898 -2.899 -1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -0.706 -2.832 -0.182 1.00 0.00 H new ATOM 0 HG22 VAL A 144 0.912 -2.578 0.516 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -0.359 -1.353 0.745 1.00 0.00 H new ATOM 1695 N ILE A 145 3.074 0.826 -2.436 1.00 0.00 N ATOM 1696 CA ILE A 145 3.445 1.686 -3.555 1.00 0.00 C ATOM 1697 C ILE A 145 3.356 0.961 -4.893 1.00 0.00 C ATOM 1698 O ILE A 145 3.154 1.592 -5.933 1.00 0.00 O ATOM 1699 CB ILE A 145 4.872 2.245 -3.381 1.00 0.00 C ATOM 1700 CG1 ILE A 145 5.899 1.107 -3.352 1.00 0.00 C ATOM 1701 CG2 ILE A 145 4.961 3.078 -2.112 1.00 0.00 C ATOM 1702 CD1 ILE A 145 6.911 1.180 -4.476 1.00 0.00 C ATOM 0 H ILE A 145 3.867 0.455 -1.912 1.00 0.00 H new ATOM 0 HA ILE A 145 2.729 2.508 -3.557 1.00 0.00 H new ATOM 0 HB ILE A 145 5.098 2.886 -4.233 1.00 0.00 H new ATOM 0 HG12 ILE A 145 6.425 1.127 -2.398 1.00 0.00 H new ATOM 0 HG13 ILE A 145 5.375 0.153 -3.407 1.00 0.00 H new ATOM 0 HG21 ILE A 145 5.974 3.466 -2.002 1.00 0.00 H new ATOM 0 HG22 ILE A 145 4.258 3.909 -2.172 1.00 0.00 H new ATOM 0 HG23 ILE A 145 4.715 2.457 -1.251 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.607 0.345 -4.394 1.00 0.00 H new ATOM 0 HD12 ILE A 145 6.394 1.129 -5.435 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.461 2.118 -4.410 1.00 0.00 H new ATOM 1714 N SER A 146 3.507 -0.359 -4.874 1.00 0.00 N ATOM 1715 CA SER A 146 3.439 -1.134 -6.110 1.00 0.00 C ATOM 1716 C SER A 146 2.767 -2.485 -5.894 1.00 0.00 C ATOM 1717 O SER A 146 2.699 -2.991 -4.773 1.00 0.00 O ATOM 1718 CB SER A 146 4.840 -1.331 -6.693 1.00 0.00 C ATOM 1719 OG SER A 146 5.841 -0.985 -5.753 1.00 0.00 O ATOM 0 H SER A 146 3.675 -0.909 -4.031 1.00 0.00 H new ATOM 0 HA SER A 146 2.832 -0.569 -6.817 1.00 0.00 H new ATOM 0 HB2 SER A 146 4.967 -2.370 -6.997 1.00 0.00 H new ATOM 0 HB3 SER A 146 4.953 -0.721 -7.589 1.00 0.00 H new ATOM 0 HG SER A 146 6.726 -1.122 -6.152 1.00 0.00 H new ATOM 1725 N LEU A 147 2.275 -3.062 -6.987 1.00 0.00 N ATOM 1726 CA LEU A 147 1.608 -4.354 -6.948 1.00 0.00 C ATOM 1727 C LEU A 147 1.949 -5.152 -8.198 1.00 0.00 C ATOM 1728 O LEU A 147 2.394 -4.588 -9.198 1.00 0.00 O ATOM 1729 CB LEU A 147 0.091 -4.165 -6.846 1.00 0.00 C ATOM 1730 CG LEU A 147 -0.632 -5.167 -5.943 1.00 0.00 C ATOM 1731 CD1 LEU A 147 -0.784 -4.601 -4.540 1.00 0.00 C ATOM 1732 CD2 LEU A 147 -1.992 -5.525 -6.521 1.00 0.00 C ATOM 0 H LEU A 147 2.328 -2.648 -7.918 1.00 0.00 H new ATOM 0 HA LEU A 147 1.953 -4.901 -6.071 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -0.110 -3.159 -6.478 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -0.335 -4.229 -7.847 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.033 -6.076 -5.889 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -1.300 -5.325 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.201 -4.394 -4.123 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -1.362 -3.678 -4.581 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -2.490 -6.238 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -2.600 -4.624 -6.606 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -1.862 -5.969 -7.508 1.00 0.00 H new ATOM 1744 N ASN A 148 1.752 -6.462 -8.137 1.00 0.00 N ATOM 1745 CA ASN A 148 2.054 -7.331 -9.272 1.00 0.00 C ATOM 1746 C ASN A 148 1.544 -6.754 -10.593 1.00 0.00 C ATOM 1747 O ASN A 148 0.372 -6.908 -10.934 1.00 0.00 O ATOM 1748 CB ASN A 148 1.413 -8.698 -9.052 1.00 0.00 C ATOM 1749 CG ASN A 148 -0.008 -8.580 -8.529 1.00 0.00 C ATOM 1750 OD1 ASN A 148 -0.256 -7.905 -7.530 1.00 0.00 O ATOM 1751 ND2 ASN A 148 -0.951 -9.221 -9.210 1.00 0.00 N ATOM 0 H ASN A 148 1.386 -6.947 -7.318 1.00 0.00 H new ATOM 0 HA ASN A 148 3.139 -7.417 -9.337 1.00 0.00 H new ATOM 0 HB2 ASN A 148 1.410 -9.252 -9.990 1.00 0.00 H new ATOM 0 HB3 ASN A 148 2.013 -9.271 -8.345 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -1.924 -9.165 -8.910 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -0.702 -9.770 -10.033 1.00 0.00 H new ATOM 1758 N GLY A 149 2.442 -6.135 -11.352 1.00 0.00 N ATOM 1759 CA GLY A 149 2.077 -5.587 -12.649 1.00 0.00 C ATOM 1760 C GLY A 149 1.331 -4.263 -12.583 1.00 0.00 C ATOM 1761 O GLY A 149 0.593 -3.924 -13.507 1.00 0.00 O ATOM 0 H GLY A 149 3.419 -6.002 -11.093 1.00 0.00 H new ATOM 0 HA2 GLY A 149 2.982 -5.451 -13.241 1.00 0.00 H new ATOM 0 HA3 GLY A 149 1.458 -6.313 -13.176 1.00 0.00 H new ATOM 1765 N HIS A 150 1.526 -3.505 -11.509 1.00 0.00 N ATOM 1766 CA HIS A 150 0.864 -2.208 -11.369 1.00 0.00 C ATOM 1767 C HIS A 150 1.646 -1.296 -10.440 1.00 0.00 C ATOM 1768 O HIS A 150 2.495 -1.751 -9.673 1.00 0.00 O ATOM 1769 CB HIS A 150 -0.565 -2.369 -10.846 1.00 0.00 C ATOM 1770 CG HIS A 150 -1.300 -3.511 -11.462 1.00 0.00 C ATOM 1771 ND1 HIS A 150 -2.125 -3.381 -12.559 1.00 0.00 N ATOM 1772 CD2 HIS A 150 -1.318 -4.816 -11.130 1.00 0.00 C ATOM 1773 CE1 HIS A 150 -2.621 -4.564 -12.874 1.00 0.00 C ATOM 1774 NE2 HIS A 150 -2.145 -5.454 -12.022 1.00 0.00 N ATOM 0 H HIS A 150 2.131 -3.761 -10.728 1.00 0.00 H new ATOM 0 HA HIS A 150 0.825 -1.756 -12.360 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -0.534 -2.508 -9.765 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -1.118 -1.448 -11.033 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -0.781 -5.276 -10.313 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -3.300 -4.769 -13.689 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -2.357 -6.452 -12.026 1.00 0.00 H new ATOM 1783 N THR A 151 1.358 -0.004 -10.519 1.00 0.00 N ATOM 1784 CA THR A 151 2.039 0.975 -9.689 1.00 0.00 C ATOM 1785 C THR A 151 1.101 2.108 -9.291 1.00 0.00 C ATOM 1786 O THR A 151 0.149 2.423 -10.004 1.00 0.00 O ATOM 1787 CB THR A 151 3.256 1.517 -10.428 1.00 0.00 C ATOM 1788 OG1 THR A 151 2.869 2.446 -11.427 1.00 0.00 O ATOM 1789 CG2 THR A 151 4.066 0.427 -11.097 1.00 0.00 C ATOM 0 H THR A 151 0.658 0.388 -11.149 1.00 0.00 H new ATOM 0 HA THR A 151 2.368 0.485 -8.773 1.00 0.00 H new ATOM 0 HB THR A 151 3.872 2.000 -9.669 1.00 0.00 H new ATOM 0 HG1 THR A 151 3.666 2.782 -11.887 1.00 0.00 H new ATOM 0 HG21 THR A 151 4.920 0.870 -11.608 1.00 0.00 H new ATOM 0 HG22 THR A 151 4.419 -0.278 -10.344 1.00 0.00 H new ATOM 0 HG23 THR A 151 3.442 -0.098 -11.821 1.00 0.00 H new ATOM 1797 N LEU A 152 1.374 2.706 -8.137 1.00 0.00 N ATOM 1798 CA LEU A 152 0.554 3.794 -7.622 1.00 0.00 C ATOM 1799 C LEU A 152 0.456 4.948 -8.612 1.00 0.00 C ATOM 1800 O LEU A 152 -0.610 5.536 -8.789 1.00 0.00 O ATOM 1801 CB LEU A 152 1.125 4.285 -6.292 1.00 0.00 C ATOM 1802 CG LEU A 152 0.338 3.861 -5.053 1.00 0.00 C ATOM 1803 CD1 LEU A 152 1.063 4.288 -3.786 1.00 0.00 C ATOM 1804 CD2 LEU A 152 -1.063 4.450 -5.092 1.00 0.00 C ATOM 0 H LEU A 152 2.161 2.454 -7.539 1.00 0.00 H new ATOM 0 HA LEU A 152 -0.455 3.410 -7.468 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.148 3.920 -6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 152 1.176 5.374 -6.316 1.00 0.00 H new ATOM 0 HG LEU A 152 0.257 2.774 -5.049 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.487 3.977 -2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.048 3.821 -3.755 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.175 5.372 -3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -1.613 4.140 -4.203 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -1.000 5.538 -5.118 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -1.582 4.095 -5.982 1.00 0.00 H new