USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1128 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 14 HIS : no HD1:sc= 0.201 X(o=0.43,f=0.013) USER MOD Set 1.2: A 82 TYR OH : rot 26:sc= 0.231 USER MOD Set 2.1: A 37 ASN : amide:sc= -5! C(o=-5!,f=-2.1!) USER MOD Set 2.2: A 106 THR OG1 : rot -170:sc= 0 USER MOD Single : A 1 MET CE :methyl -149:sc= 0 (180deg=-0.351) USER MOD Single : A 1 MET N :NH3+ 175:sc= 1.29 (180deg=1.23) USER MOD Single : A 2 LYS NZ :NH3+ -170:sc= 1.16 (180deg=0.793) USER MOD Single : A 3 THR OG1 : rot 58:sc= 0.0143 USER MOD Single : A 4 THR OG1 : rot 180:sc= -1.09 USER MOD Single : A 10 GLN : amide:sc= -0.792 K(o=-0.79,f=-0.13) USER MOD Single : A 19 TYR OH : rot -130:sc= 0 USER MOD Single : A 24 CYS SG : rot 180:sc= 0.118 USER MOD Single : A 30 THR OG1 : rot -90:sc= 0.244 USER MOD Single : A 32 THR OG1 : rot -150:sc= 0.13 USER MOD Single : A 43 HIS : no HD1:sc= -2.23 K(o=-2.2,f=-5.9!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= 0.0134 X(o=0.013,f=-0.45) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -1.26! K(o=-1.3!,f=-0.017) USER MOD Single : A 54 THR OG1 : rot -45:sc= 0.825 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot -123:sc= 0.752 USER MOD Single : A 72 GLN : amide:sc= -0.216 K(o=-0.22,f=-1) USER MOD Single : A 74 GLN : amide:sc= -1.31! K(o=-1.3!,f=-0.052) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 129:sc= 0.955 USER MOD Single : A 85 HIS : no HD1:sc= -0.0138 X(o=-0.014,f=0) USER MOD Single : A 88 HIS : no HE2:sc= 0.315 K(o=0.32,f=-1.9) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot -41:sc= 0.856 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 TYR OH : rot 24:sc= 0.216 USER MOD Single : A 111 SER OG : rot 140:sc= 1.26 USER MOD Single : A 121 THR OG1 : rot -30:sc= 1.2 USER MOD Single : A 130 SER OG : rot 180:sc= -0.0243 USER MOD Single : A 133 HIS : no HD1:sc= -0.0963 K(o=-0.096,f=-0.66) USER MOD Single : A 148 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 149 HIS : no HE2:sc= 0.667 K(o=0.67,f=-2.7!) USER MOD Single : A 150 HIS : no HD1:sc= -0.0344 X(o=-0.034,f=-0.0018) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 152 HIS : no HD1:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 153 HIS : no HD1:sc= -0.444 X(o=-0.44,f=-0.093) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.056 -7.665 5.176 1.00 0.00 N ATOM 2 CA MET A 1 -9.194 -7.117 4.107 1.00 0.00 C ATOM 3 C MET A 1 -8.856 -8.190 3.085 1.00 0.00 C ATOM 4 O MET A 1 -8.413 -9.284 3.441 1.00 0.00 O ATOM 5 CB MET A 1 -7.904 -6.554 4.707 1.00 0.00 C ATOM 6 CG MET A 1 -6.922 -6.027 3.673 1.00 0.00 C ATOM 7 SD MET A 1 -5.315 -5.630 4.386 1.00 0.00 S ATOM 8 CE MET A 1 -4.414 -5.123 2.924 1.00 0.00 C ATOM 0 H1 MET A 1 -10.206 -6.940 5.907 1.00 0.00 H new ATOM 0 H2 MET A 1 -10.973 -7.945 4.773 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.596 -8.496 5.601 1.00 0.00 H new ATOM 0 HA MET A 1 -9.739 -6.316 3.607 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.157 -5.749 5.397 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.417 -7.334 5.292 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.793 -6.771 2.887 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.338 -5.136 3.203 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.359 -5.370 3.043 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.812 -5.643 2.053 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.522 -4.047 2.785 1.00 0.00 H new ATOM 20 N LYS A 2 -9.064 -7.869 1.818 1.00 0.00 N ATOM 21 CA LYS A 2 -8.740 -8.779 0.730 1.00 0.00 C ATOM 22 C LYS A 2 -7.643 -8.193 -0.141 1.00 0.00 C ATOM 23 O LYS A 2 -7.577 -6.977 -0.340 1.00 0.00 O ATOM 24 CB LYS A 2 -9.970 -9.062 -0.135 1.00 0.00 C ATOM 25 CG LYS A 2 -10.777 -10.283 0.282 1.00 0.00 C ATOM 26 CD LYS A 2 -11.244 -10.199 1.722 1.00 0.00 C ATOM 27 CE LYS A 2 -12.581 -10.891 1.910 1.00 0.00 C ATOM 28 NZ LYS A 2 -13.658 -10.206 1.145 1.00 0.00 N ATOM 0 H LYS A 2 -9.459 -6.978 1.516 1.00 0.00 H new ATOM 0 HA LYS A 2 -8.396 -9.714 1.172 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -10.621 -8.188 -0.112 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -9.648 -9.192 -1.168 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -11.642 -10.385 -0.373 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -10.170 -11.179 0.151 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -10.501 -10.656 2.375 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -11.328 -9.154 2.019 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -12.505 -11.928 1.585 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -12.838 -10.907 2.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -14.582 -10.594 1.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -13.634 -9.187 1.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -13.511 -10.359 0.127 1.00 0.00 H new ATOM 42 N THR A 3 -6.782 -9.054 -0.642 1.00 0.00 N ATOM 43 CA THR A 3 -5.752 -8.644 -1.576 1.00 0.00 C ATOM 44 C THR A 3 -5.305 -9.847 -2.395 1.00 0.00 C ATOM 45 O THR A 3 -5.376 -10.984 -1.924 1.00 0.00 O ATOM 46 CB THR A 3 -4.549 -7.997 -0.850 1.00 0.00 C ATOM 47 OG1 THR A 3 -3.598 -7.505 -1.802 1.00 0.00 O ATOM 48 CG2 THR A 3 -3.873 -8.985 0.090 1.00 0.00 C ATOM 0 H THR A 3 -6.775 -10.049 -0.417 1.00 0.00 H new ATOM 0 HA THR A 3 -6.169 -7.888 -2.241 1.00 0.00 H new ATOM 0 HB THR A 3 -4.928 -7.165 -0.257 1.00 0.00 H new ATOM 0 HG1 THR A 3 -4.033 -6.856 -2.394 1.00 0.00 H new ATOM 0 HG21 THR A 3 -3.032 -8.499 0.585 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.589 -9.322 0.839 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.513 -9.842 -0.480 1.00 0.00 H new ATOM 56 N THR A 4 -4.882 -9.605 -3.622 1.00 0.00 N ATOM 57 CA THR A 4 -4.522 -10.685 -4.516 1.00 0.00 C ATOM 58 C THR A 4 -3.106 -11.183 -4.238 1.00 0.00 C ATOM 59 O THR A 4 -2.237 -10.412 -3.820 1.00 0.00 O ATOM 60 CB THR A 4 -4.630 -10.244 -5.988 1.00 0.00 C ATOM 61 OG1 THR A 4 -3.858 -9.057 -6.203 1.00 0.00 O ATOM 62 CG2 THR A 4 -6.079 -9.986 -6.375 1.00 0.00 C ATOM 0 H THR A 4 -4.780 -8.671 -4.020 1.00 0.00 H new ATOM 0 HA THR A 4 -5.224 -11.499 -4.336 1.00 0.00 H new ATOM 0 HB THR A 4 -4.242 -11.049 -6.611 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.931 -8.785 -7.142 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.127 -9.676 -7.419 1.00 0.00 H new ATOM 0 HG22 THR A 4 -6.660 -10.899 -6.240 1.00 0.00 H new ATOM 0 HG23 THR A 4 -6.490 -9.198 -5.743 1.00 0.00 H new ATOM 70 N PRO A 5 -2.858 -12.482 -4.468 1.00 0.00 N ATOM 71 CA PRO A 5 -1.522 -13.063 -4.338 1.00 0.00 C ATOM 72 C PRO A 5 -0.551 -12.388 -5.293 1.00 0.00 C ATOM 73 O PRO A 5 0.650 -12.320 -5.039 1.00 0.00 O ATOM 74 CB PRO A 5 -1.718 -14.536 -4.715 1.00 0.00 C ATOM 75 CG PRO A 5 -3.020 -14.589 -5.442 1.00 0.00 C ATOM 76 CD PRO A 5 -3.857 -13.482 -4.874 1.00 0.00 C ATOM 0 HA PRO A 5 -1.104 -12.939 -3.339 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -0.902 -14.893 -5.344 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.737 -15.169 -3.828 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -2.874 -14.457 -6.514 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -3.505 -15.555 -5.303 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -4.551 -13.081 -5.613 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -4.454 -13.822 -4.028 1.00 0.00 H new ATOM 84 N ASP A 6 -1.105 -11.882 -6.388 1.00 0.00 N ATOM 85 CA ASP A 6 -0.354 -11.096 -7.358 1.00 0.00 C ATOM 86 C ASP A 6 0.302 -9.904 -6.667 1.00 0.00 C ATOM 87 O ASP A 6 1.502 -9.672 -6.800 1.00 0.00 O ATOM 88 CB ASP A 6 -1.305 -10.600 -8.443 1.00 0.00 C ATOM 89 CG ASP A 6 -0.608 -10.097 -9.690 1.00 0.00 C ATOM 90 OD1 ASP A 6 0.333 -9.291 -9.579 1.00 0.00 O ATOM 91 OD2 ASP A 6 -1.024 -10.494 -10.795 1.00 0.00 O ATOM 0 H ASP A 6 -2.089 -12.005 -6.628 1.00 0.00 H new ATOM 0 HA ASP A 6 0.423 -11.717 -7.804 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -1.980 -11.410 -8.718 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.920 -9.798 -8.034 1.00 0.00 H new ATOM 96 N ILE A 7 -0.497 -9.174 -5.898 1.00 0.00 N ATOM 97 CA ILE A 7 -0.012 -8.014 -5.163 1.00 0.00 C ATOM 98 C ILE A 7 0.943 -8.439 -4.054 1.00 0.00 C ATOM 99 O ILE A 7 2.015 -7.861 -3.897 1.00 0.00 O ATOM 100 CB ILE A 7 -1.192 -7.206 -4.563 1.00 0.00 C ATOM 101 CG1 ILE A 7 -2.018 -6.557 -5.680 1.00 0.00 C ATOM 102 CG2 ILE A 7 -0.697 -6.152 -3.587 1.00 0.00 C ATOM 103 CD1 ILE A 7 -1.227 -5.619 -6.571 1.00 0.00 C ATOM 0 H ILE A 7 -1.490 -9.367 -5.767 1.00 0.00 H new ATOM 0 HA ILE A 7 0.526 -7.376 -5.865 1.00 0.00 H new ATOM 0 HB ILE A 7 -1.829 -7.899 -4.013 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -2.456 -7.342 -6.296 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -2.844 -6.005 -5.232 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.547 -5.602 -3.183 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -0.157 -6.635 -2.772 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.031 -5.461 -4.104 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.884 -5.202 -7.334 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -0.811 -4.811 -5.970 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -0.417 -6.169 -7.050 1.00 0.00 H new ATOM 115 N LEU A 8 0.558 -9.473 -3.314 1.00 0.00 N ATOM 116 CA LEU A 8 1.361 -9.972 -2.199 1.00 0.00 C ATOM 117 C LEU A 8 2.766 -10.371 -2.646 1.00 0.00 C ATOM 118 O LEU A 8 3.752 -10.066 -1.971 1.00 0.00 O ATOM 119 CB LEU A 8 0.665 -11.160 -1.532 1.00 0.00 C ATOM 120 CG LEU A 8 -0.638 -10.819 -0.807 1.00 0.00 C ATOM 121 CD1 LEU A 8 -1.272 -12.076 -0.231 1.00 0.00 C ATOM 122 CD2 LEU A 8 -0.380 -9.801 0.295 1.00 0.00 C ATOM 0 H LEU A 8 -0.310 -9.986 -3.466 1.00 0.00 H new ATOM 0 HA LEU A 8 1.459 -9.161 -1.478 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.455 -11.913 -2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.354 -11.612 -0.818 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.330 -10.383 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -2.198 -11.815 0.281 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.489 -12.777 -1.037 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.584 -12.539 0.477 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -1.316 -9.568 0.802 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.328 -10.214 1.013 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.033 -8.891 -0.140 1.00 0.00 H new ATOM 134 N ASP A 9 2.855 -11.040 -3.789 1.00 0.00 N ATOM 135 CA ASP A 9 4.146 -11.471 -4.319 1.00 0.00 C ATOM 136 C ASP A 9 4.957 -10.267 -4.779 1.00 0.00 C ATOM 137 O ASP A 9 6.167 -10.203 -4.581 1.00 0.00 O ATOM 138 CB ASP A 9 3.952 -12.454 -5.471 1.00 0.00 C ATOM 139 CG ASP A 9 5.238 -13.168 -5.840 1.00 0.00 C ATOM 140 OD1 ASP A 9 5.852 -13.796 -4.949 1.00 0.00 O ATOM 141 OD2 ASP A 9 5.626 -13.131 -7.028 1.00 0.00 O ATOM 0 H ASP A 9 2.053 -11.296 -4.366 1.00 0.00 H new ATOM 0 HA ASP A 9 4.694 -11.977 -3.524 1.00 0.00 H new ATOM 0 HB2 ASP A 9 3.197 -13.190 -5.195 1.00 0.00 H new ATOM 0 HB3 ASP A 9 3.573 -11.920 -6.342 1.00 0.00 H new ATOM 146 N GLN A 10 4.278 -9.306 -5.380 1.00 0.00 N ATOM 147 CA GLN A 10 4.922 -8.066 -5.786 1.00 0.00 C ATOM 148 C GLN A 10 5.483 -7.316 -4.579 1.00 0.00 C ATOM 149 O GLN A 10 6.564 -6.745 -4.654 1.00 0.00 O ATOM 150 CB GLN A 10 3.948 -7.168 -6.546 1.00 0.00 C ATOM 151 CG GLN A 10 3.565 -7.703 -7.913 1.00 0.00 C ATOM 152 CD GLN A 10 2.699 -6.732 -8.688 1.00 0.00 C ATOM 153 OE1 GLN A 10 3.202 -5.880 -9.421 1.00 0.00 O ATOM 154 NE2 GLN A 10 1.394 -6.867 -8.548 1.00 0.00 N ATOM 0 H GLN A 10 3.283 -9.358 -5.598 1.00 0.00 H new ATOM 0 HA GLN A 10 5.748 -8.328 -6.448 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.045 -7.040 -5.950 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.394 -6.181 -6.664 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.469 -7.916 -8.484 1.00 0.00 H new ATOM 0 HG3 GLN A 10 3.033 -8.647 -7.795 1.00 0.00 H new ATOM 0 HE21 GLN A 10 1.019 -7.587 -7.930 1.00 0.00 H new ATOM 0 HE22 GLN A 10 0.760 -6.252 -9.058 1.00 0.00 H new ATOM 163 N ILE A 11 4.753 -7.332 -3.465 1.00 0.00 N ATOM 164 CA ILE A 11 5.186 -6.640 -2.251 1.00 0.00 C ATOM 165 C ILE A 11 6.477 -7.241 -1.705 1.00 0.00 C ATOM 166 O ILE A 11 7.434 -6.520 -1.419 1.00 0.00 O ATOM 167 CB ILE A 11 4.107 -6.682 -1.141 1.00 0.00 C ATOM 168 CG1 ILE A 11 2.822 -6.002 -1.615 1.00 0.00 C ATOM 169 CG2 ILE A 11 4.624 -6.012 0.128 1.00 0.00 C ATOM 170 CD1 ILE A 11 1.697 -6.068 -0.605 1.00 0.00 C ATOM 0 H ILE A 11 3.859 -7.816 -3.377 1.00 0.00 H new ATOM 0 HA ILE A 11 5.356 -5.602 -2.535 1.00 0.00 H new ATOM 0 HB ILE A 11 3.883 -7.725 -0.918 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.035 -4.957 -1.842 1.00 0.00 H new ATOM 0 HG13 ILE A 11 2.494 -6.469 -2.544 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.854 -6.050 0.899 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.514 -6.534 0.478 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.874 -4.973 -0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.817 -5.566 -1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 11 1.457 -7.110 -0.396 1.00 0.00 H new ATOM 0 HD13 ILE A 11 2.006 -5.575 0.317 1.00 0.00 H new ATOM 182 N ARG A 12 6.507 -8.562 -1.573 1.00 0.00 N ATOM 183 CA ARG A 12 7.678 -9.242 -1.032 1.00 0.00 C ATOM 184 C ARG A 12 8.892 -9.048 -1.941 1.00 0.00 C ATOM 185 O ARG A 12 10.012 -8.878 -1.460 1.00 0.00 O ATOM 186 CB ARG A 12 7.386 -10.733 -0.812 1.00 0.00 C ATOM 187 CG ARG A 12 6.877 -11.446 -2.051 1.00 0.00 C ATOM 188 CD ARG A 12 6.509 -12.891 -1.772 1.00 0.00 C ATOM 189 NE ARG A 12 7.667 -13.683 -1.375 1.00 0.00 N ATOM 190 CZ ARG A 12 8.118 -14.729 -2.063 1.00 0.00 C ATOM 191 NH1 ARG A 12 7.564 -15.059 -3.225 1.00 0.00 N ATOM 192 NH2 ARG A 12 9.142 -15.432 -1.602 1.00 0.00 N ATOM 0 H ARG A 12 5.738 -9.181 -1.832 1.00 0.00 H new ATOM 0 HA ARG A 12 7.912 -8.797 -0.065 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.296 -11.225 -0.469 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.648 -10.836 -0.016 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.005 -10.919 -2.438 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.641 -11.411 -2.827 1.00 0.00 H new ATOM 0 HD2 ARG A 12 5.757 -12.928 -0.984 1.00 0.00 H new ATOM 0 HD3 ARG A 12 6.059 -13.329 -2.663 1.00 0.00 H new ATOM 0 HE ARG A 12 8.159 -13.420 -0.521 1.00 0.00 H new ATOM 0 HH11 ARG A 12 6.788 -14.509 -3.595 1.00 0.00 H new ATOM 0 HH12 ARG A 12 7.915 -15.862 -3.747 1.00 0.00 H new ATOM 0 HH21 ARG A 12 9.584 -15.171 -0.720 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.488 -16.234 -2.129 1.00 0.00 H new ATOM 206 N VAL A 13 8.666 -9.056 -3.254 1.00 0.00 N ATOM 207 CA VAL A 13 9.736 -8.786 -4.207 1.00 0.00 C ATOM 208 C VAL A 13 10.153 -7.320 -4.130 1.00 0.00 C ATOM 209 O VAL A 13 11.337 -6.998 -4.173 1.00 0.00 O ATOM 210 CB VAL A 13 9.324 -9.140 -5.656 1.00 0.00 C ATOM 211 CG1 VAL A 13 10.430 -8.774 -6.638 1.00 0.00 C ATOM 212 CG2 VAL A 13 8.993 -10.620 -5.765 1.00 0.00 C ATOM 0 H VAL A 13 7.758 -9.245 -3.678 1.00 0.00 H new ATOM 0 HA VAL A 13 10.580 -9.421 -3.937 1.00 0.00 H new ATOM 0 HB VAL A 13 8.436 -8.561 -5.909 1.00 0.00 H new ATOM 0 HG11 VAL A 13 10.118 -9.032 -7.650 1.00 0.00 H new ATOM 0 HG12 VAL A 13 10.628 -7.704 -6.581 1.00 0.00 H new ATOM 0 HG13 VAL A 13 11.337 -9.324 -6.387 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.705 -10.854 -6.790 1.00 0.00 H new ATOM 0 HG22 VAL A 13 9.868 -11.210 -5.490 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.169 -10.859 -5.093 1.00 0.00 H new ATOM 222 N HIS A 14 9.166 -6.440 -3.990 1.00 0.00 N ATOM 223 CA HIS A 14 9.414 -5.006 -3.846 1.00 0.00 C ATOM 224 C HIS A 14 10.301 -4.736 -2.632 1.00 0.00 C ATOM 225 O HIS A 14 11.132 -3.832 -2.652 1.00 0.00 O ATOM 226 CB HIS A 14 8.086 -4.249 -3.710 1.00 0.00 C ATOM 227 CG HIS A 14 8.225 -2.755 -3.614 1.00 0.00 C ATOM 228 ND1 HIS A 14 8.212 -1.926 -4.715 1.00 0.00 N ATOM 229 CD2 HIS A 14 8.363 -1.940 -2.538 1.00 0.00 C ATOM 230 CE1 HIS A 14 8.335 -0.671 -4.323 1.00 0.00 C ATOM 231 NE2 HIS A 14 8.430 -0.651 -3.005 1.00 0.00 N ATOM 0 H HIS A 14 8.179 -6.696 -3.973 1.00 0.00 H new ATOM 0 HA HIS A 14 9.931 -4.653 -4.739 1.00 0.00 H new ATOM 0 HB2 HIS A 14 7.457 -4.488 -4.568 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.566 -4.610 -2.823 1.00 0.00 H new ATOM 0 HD2 HIS A 14 8.411 -2.249 -1.504 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.355 0.193 -4.970 1.00 0.00 H new ATOM 0 HE2 HIS A 14 8.536 0.185 -2.430 1.00 0.00 H new ATOM 240 N GLY A 15 10.115 -5.524 -1.580 1.00 0.00 N ATOM 241 CA GLY A 15 10.937 -5.392 -0.391 1.00 0.00 C ATOM 242 C GLY A 15 12.403 -5.645 -0.681 1.00 0.00 C ATOM 243 O GLY A 15 13.263 -4.847 -0.321 1.00 0.00 O ATOM 0 H GLY A 15 9.406 -6.256 -1.529 1.00 0.00 H new ATOM 0 HA2 GLY A 15 10.817 -4.391 0.023 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.592 -6.094 0.368 1.00 0.00 H new ATOM 247 N ALA A 16 12.684 -6.745 -1.363 1.00 0.00 N ATOM 248 CA ALA A 16 14.056 -7.102 -1.705 1.00 0.00 C ATOM 249 C ALA A 16 14.609 -6.183 -2.792 1.00 0.00 C ATOM 250 O ALA A 16 15.819 -5.972 -2.889 1.00 0.00 O ATOM 251 CB ALA A 16 14.128 -8.553 -2.153 1.00 0.00 C ATOM 0 H ALA A 16 11.981 -7.407 -1.691 1.00 0.00 H new ATOM 0 HA ALA A 16 14.670 -6.977 -0.813 1.00 0.00 H new ATOM 0 HB1 ALA A 16 15.158 -8.805 -2.405 1.00 0.00 H new ATOM 0 HB2 ALA A 16 13.783 -9.200 -1.347 1.00 0.00 H new ATOM 0 HB3 ALA A 16 13.495 -8.695 -3.029 1.00 0.00 H new ATOM 257 N ASP A 17 13.709 -5.646 -3.602 1.00 0.00 N ATOM 258 CA ASP A 17 14.075 -4.768 -4.713 1.00 0.00 C ATOM 259 C ASP A 17 14.472 -3.389 -4.216 1.00 0.00 C ATOM 260 O ASP A 17 15.414 -2.778 -4.722 1.00 0.00 O ATOM 261 CB ASP A 17 12.881 -4.642 -5.656 1.00 0.00 C ATOM 262 CG ASP A 17 13.179 -3.859 -6.921 1.00 0.00 C ATOM 263 OD1 ASP A 17 13.725 -4.449 -7.875 1.00 0.00 O ATOM 264 OD2 ASP A 17 12.822 -2.662 -6.986 1.00 0.00 O ATOM 0 H ASP A 17 12.705 -5.804 -3.511 1.00 0.00 H new ATOM 0 HA ASP A 17 14.930 -5.201 -5.233 1.00 0.00 H new ATOM 0 HB2 ASP A 17 12.539 -5.640 -5.930 1.00 0.00 H new ATOM 0 HB3 ASP A 17 12.061 -4.159 -5.126 1.00 0.00 H new ATOM 269 N ALA A 18 13.755 -2.918 -3.213 1.00 0.00 N ATOM 270 CA ALA A 18 13.980 -1.588 -2.665 1.00 0.00 C ATOM 271 C ALA A 18 15.120 -1.579 -1.657 1.00 0.00 C ATOM 272 O ALA A 18 15.867 -0.601 -1.567 1.00 0.00 O ATOM 273 CB ALA A 18 12.708 -1.060 -2.023 1.00 0.00 C ATOM 0 H ALA A 18 13.006 -3.439 -2.757 1.00 0.00 H new ATOM 0 HA ALA A 18 14.263 -0.935 -3.491 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.891 -0.065 -1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 18 11.917 -1.007 -2.772 1.00 0.00 H new ATOM 0 HB3 ALA A 18 12.402 -1.729 -1.219 1.00 0.00 H new ATOM 279 N TYR A 19 15.260 -2.669 -0.909 1.00 0.00 N ATOM 280 CA TYR A 19 16.267 -2.740 0.146 1.00 0.00 C ATOM 281 C TYR A 19 17.676 -2.789 -0.442 1.00 0.00 C ATOM 282 O TYR A 19 17.843 -3.094 -1.622 1.00 0.00 O ATOM 283 CB TYR A 19 16.000 -3.928 1.074 1.00 0.00 C ATOM 284 CG TYR A 19 15.121 -3.556 2.250 1.00 0.00 C ATOM 285 CD1 TYR A 19 13.804 -3.155 2.062 1.00 0.00 C ATOM 286 CD2 TYR A 19 15.617 -3.585 3.547 1.00 0.00 C ATOM 287 CE1 TYR A 19 13.008 -2.794 3.129 1.00 0.00 C ATOM 288 CE2 TYR A 19 14.824 -3.229 4.620 1.00 0.00 C ATOM 289 CZ TYR A 19 13.523 -2.833 4.406 1.00 0.00 C ATOM 290 OH TYR A 19 12.733 -2.473 5.474 1.00 0.00 O ATOM 0 H TYR A 19 14.693 -3.511 -1.012 1.00 0.00 H new ATOM 0 HA TYR A 19 16.197 -1.832 0.745 1.00 0.00 H new ATOM 0 HB2 TYR A 19 15.524 -4.728 0.507 1.00 0.00 H new ATOM 0 HB3 TYR A 19 16.949 -4.318 1.442 1.00 0.00 H new ATOM 0 HD1 TYR A 19 13.396 -3.125 1.062 1.00 0.00 H new ATOM 0 HD2 TYR A 19 16.638 -3.891 3.719 1.00 0.00 H new ATOM 0 HE1 TYR A 19 11.987 -2.483 2.964 1.00 0.00 H new ATOM 0 HE2 TYR A 19 15.223 -3.261 5.623 1.00 0.00 H new ATOM 0 HH TYR A 19 13.213 -1.826 6.032 1.00 0.00 H new ATOM 300 N PRO A 20 18.724 -2.495 0.362 1.00 0.00 N ATOM 301 CA PRO A 20 18.632 -2.270 1.820 1.00 0.00 C ATOM 302 C PRO A 20 17.895 -0.990 2.222 1.00 0.00 C ATOM 303 O PRO A 20 17.687 -0.746 3.413 1.00 0.00 O ATOM 304 CB PRO A 20 20.098 -2.186 2.276 1.00 0.00 C ATOM 305 CG PRO A 20 20.906 -2.681 1.124 1.00 0.00 C ATOM 306 CD PRO A 20 20.110 -2.363 -0.105 1.00 0.00 C ATOM 0 HA PRO A 20 18.054 -3.070 2.283 1.00 0.00 H new ATOM 0 HB2 PRO A 20 20.370 -1.163 2.534 1.00 0.00 H new ATOM 0 HB3 PRO A 20 20.268 -2.795 3.164 1.00 0.00 H new ATOM 0 HG2 PRO A 20 21.881 -2.195 1.094 1.00 0.00 H new ATOM 0 HG3 PRO A 20 21.086 -3.753 1.206 1.00 0.00 H new ATOM 0 HD2 PRO A 20 20.319 -1.359 -0.473 1.00 0.00 H new ATOM 0 HD3 PRO A 20 20.330 -3.053 -0.919 1.00 0.00 H new ATOM 314 N GLU A 21 17.507 -0.179 1.250 1.00 0.00 N ATOM 315 CA GLU A 21 16.737 1.028 1.526 1.00 0.00 C ATOM 316 C GLU A 21 15.303 0.654 1.880 1.00 0.00 C ATOM 317 O GLU A 21 14.700 -0.199 1.226 1.00 0.00 O ATOM 318 CB GLU A 21 16.728 1.950 0.309 1.00 0.00 C ATOM 319 CG GLU A 21 18.104 2.215 -0.271 1.00 0.00 C ATOM 320 CD GLU A 21 18.041 3.045 -1.534 1.00 0.00 C ATOM 321 OE1 GLU A 21 17.787 2.472 -2.614 1.00 0.00 O ATOM 322 OE2 GLU A 21 18.237 4.274 -1.454 1.00 0.00 O ATOM 0 H GLU A 21 17.712 -0.333 0.263 1.00 0.00 H new ATOM 0 HA GLU A 21 17.202 1.549 2.363 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.097 1.510 -0.463 1.00 0.00 H new ATOM 0 HB3 GLU A 21 16.273 2.900 0.589 1.00 0.00 H new ATOM 0 HG2 GLU A 21 18.716 2.730 0.470 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.595 1.266 -0.486 1.00 0.00 H new ATOM 329 N GLU A 22 14.756 1.275 2.914 1.00 0.00 N ATOM 330 CA GLU A 22 13.379 1.009 3.304 1.00 0.00 C ATOM 331 C GLU A 22 12.420 1.684 2.330 1.00 0.00 C ATOM 332 O GLU A 22 12.050 2.847 2.506 1.00 0.00 O ATOM 333 CB GLU A 22 13.094 1.484 4.736 1.00 0.00 C ATOM 334 CG GLU A 22 14.089 0.976 5.770 1.00 0.00 C ATOM 335 CD GLU A 22 15.215 1.955 6.024 1.00 0.00 C ATOM 336 OE1 GLU A 22 16.049 2.165 5.120 1.00 0.00 O ATOM 337 OE2 GLU A 22 15.265 2.528 7.133 1.00 0.00 O ATOM 0 H GLU A 22 15.239 1.961 3.494 1.00 0.00 H new ATOM 0 HA GLU A 22 13.228 -0.070 3.274 1.00 0.00 H new ATOM 0 HB2 GLU A 22 13.094 2.574 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.093 1.161 5.022 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.566 0.779 6.706 1.00 0.00 H new ATOM 0 HG3 GLU A 22 14.506 0.028 5.432 1.00 0.00 H new ATOM 344 N GLY A 23 12.068 0.963 1.278 1.00 0.00 N ATOM 345 CA GLY A 23 11.129 1.473 0.304 1.00 0.00 C ATOM 346 C GLY A 23 9.711 1.479 0.833 1.00 0.00 C ATOM 347 O GLY A 23 9.114 0.422 1.040 1.00 0.00 O ATOM 0 H GLY A 23 12.419 0.026 1.081 1.00 0.00 H new ATOM 0 HA2 GLY A 23 11.415 2.486 0.021 1.00 0.00 H new ATOM 0 HA3 GLY A 23 11.177 0.864 -0.599 1.00 0.00 H new ATOM 351 N CYS A 24 9.184 2.670 1.067 1.00 0.00 N ATOM 352 CA CYS A 24 7.836 2.827 1.585 1.00 0.00 C ATOM 353 C CYS A 24 6.863 3.154 0.457 1.00 0.00 C ATOM 354 O CYS A 24 7.257 3.237 -0.712 1.00 0.00 O ATOM 355 CB CYS A 24 7.821 3.933 2.643 1.00 0.00 C ATOM 356 SG CYS A 24 8.574 5.485 2.096 1.00 0.00 S ATOM 0 H CYS A 24 9.675 3.549 0.904 1.00 0.00 H new ATOM 0 HA CYS A 24 7.519 1.890 2.043 1.00 0.00 H new ATOM 0 HB2 CYS A 24 6.789 4.126 2.938 1.00 0.00 H new ATOM 0 HB3 CYS A 24 8.346 3.580 3.531 1.00 0.00 H new ATOM 0 HG CYS A 24 8.512 6.359 3.056 1.00 0.00 H new ATOM 362 N GLY A 25 5.593 3.326 0.799 1.00 0.00 N ATOM 363 CA GLY A 25 4.613 3.692 -0.202 1.00 0.00 C ATOM 364 C GLY A 25 3.192 3.625 0.315 1.00 0.00 C ATOM 365 O GLY A 25 2.959 3.668 1.521 1.00 0.00 O ATOM 0 H GLY A 25 5.227 3.219 1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 25 4.820 4.703 -0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 25 4.714 3.029 -1.061 1.00 0.00 H new ATOM 369 N PHE A 26 2.244 3.496 -0.605 1.00 0.00 N ATOM 370 CA PHE A 26 0.825 3.502 -0.268 1.00 0.00 C ATOM 371 C PHE A 26 0.108 2.378 -1.005 1.00 0.00 C ATOM 372 O PHE A 26 0.649 1.809 -1.953 1.00 0.00 O ATOM 373 CB PHE A 26 0.188 4.849 -0.630 1.00 0.00 C ATOM 374 CG PHE A 26 0.670 6.007 0.204 1.00 0.00 C ATOM 375 CD1 PHE A 26 1.789 6.736 -0.172 1.00 0.00 C ATOM 376 CD2 PHE A 26 -0.002 6.369 1.360 1.00 0.00 C ATOM 377 CE1 PHE A 26 2.230 7.800 0.594 1.00 0.00 C ATOM 378 CE2 PHE A 26 0.434 7.430 2.128 1.00 0.00 C ATOM 379 CZ PHE A 26 1.550 8.148 1.745 1.00 0.00 C ATOM 0 H PHE A 26 2.435 3.385 -1.601 1.00 0.00 H new ATOM 0 HA PHE A 26 0.727 3.348 0.807 1.00 0.00 H new ATOM 0 HB2 PHE A 26 0.391 5.063 -1.679 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -0.894 4.766 -0.525 1.00 0.00 H new ATOM 0 HD1 PHE A 26 2.322 6.470 -1.073 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -0.877 5.815 1.664 1.00 0.00 H new ATOM 0 HE1 PHE A 26 3.104 8.358 0.293 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -0.098 7.699 3.029 1.00 0.00 H new ATOM 0 HZ PHE A 26 1.890 8.980 2.344 1.00 0.00 H new ATOM 389 N LEU A 27 -1.107 2.071 -0.571 1.00 0.00 N ATOM 390 CA LEU A 27 -1.897 1.012 -1.181 1.00 0.00 C ATOM 391 C LEU A 27 -3.143 1.592 -1.842 1.00 0.00 C ATOM 392 O LEU A 27 -3.840 2.423 -1.256 1.00 0.00 O ATOM 393 CB LEU A 27 -2.307 -0.020 -0.130 1.00 0.00 C ATOM 394 CG LEU A 27 -1.148 -0.697 0.608 1.00 0.00 C ATOM 395 CD1 LEU A 27 -1.677 -1.603 1.706 1.00 0.00 C ATOM 396 CD2 LEU A 27 -0.284 -1.490 -0.363 1.00 0.00 C ATOM 0 H LEU A 27 -1.568 2.544 0.206 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.286 0.524 -1.940 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.948 0.468 0.604 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.907 -0.790 -0.615 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.531 0.078 1.063 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.841 -2.077 2.221 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.255 -1.013 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.315 -2.370 1.268 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.534 -1.963 0.181 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.890 -2.256 -0.847 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.123 -0.819 -1.119 1.00 0.00 H new ATOM 408 N LEU A 28 -3.419 1.152 -3.061 1.00 0.00 N ATOM 409 CA LEU A 28 -4.575 1.628 -3.806 1.00 0.00 C ATOM 410 C LEU A 28 -5.543 0.477 -4.052 1.00 0.00 C ATOM 411 O LEU A 28 -5.121 -0.663 -4.260 1.00 0.00 O ATOM 412 CB LEU A 28 -4.130 2.232 -5.143 1.00 0.00 C ATOM 413 CG LEU A 28 -3.089 3.350 -5.043 1.00 0.00 C ATOM 414 CD1 LEU A 28 -2.679 3.825 -6.429 1.00 0.00 C ATOM 415 CD2 LEU A 28 -3.623 4.510 -4.220 1.00 0.00 C ATOM 0 H LEU A 28 -2.855 0.462 -3.557 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.078 2.399 -3.222 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.724 1.435 -5.765 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -5.009 2.621 -5.657 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.208 2.951 -4.541 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.939 4.620 -6.337 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.250 2.992 -6.987 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.554 4.204 -6.957 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.867 5.293 -4.162 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.522 4.907 -4.692 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.864 4.163 -3.215 1.00 0.00 H new ATOM 427 N GLY A 29 -6.836 0.762 -4.028 1.00 0.00 N ATOM 428 CA GLY A 29 -7.810 -0.291 -4.244 1.00 0.00 C ATOM 429 C GLY A 29 -9.235 0.179 -4.066 1.00 0.00 C ATOM 430 O GLY A 29 -9.532 1.361 -4.249 1.00 0.00 O ATOM 0 H GLY A 29 -7.226 1.690 -3.865 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -7.688 -0.691 -5.251 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -7.613 -1.109 -3.550 1.00 0.00 H new ATOM 434 N THR A 30 -10.114 -0.742 -3.700 1.00 0.00 N ATOM 435 CA THR A 30 -11.523 -0.434 -3.539 1.00 0.00 C ATOM 436 C THR A 30 -11.983 -0.669 -2.106 1.00 0.00 C ATOM 437 O THR A 30 -11.492 -1.567 -1.416 1.00 0.00 O ATOM 438 CB THR A 30 -12.391 -1.268 -4.501 1.00 0.00 C ATOM 439 OG1 THR A 30 -11.686 -2.460 -4.891 1.00 0.00 O ATOM 440 CG2 THR A 30 -12.761 -0.460 -5.734 1.00 0.00 C ATOM 0 H THR A 30 -9.872 -1.714 -3.508 1.00 0.00 H new ATOM 0 HA THR A 30 -11.646 0.622 -3.778 1.00 0.00 H new ATOM 0 HB THR A 30 -13.309 -1.545 -3.982 1.00 0.00 H new ATOM 0 HG1 THR A 30 -11.163 -2.281 -5.700 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.374 -1.070 -6.398 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.322 0.425 -5.434 1.00 0.00 H new ATOM 0 HG23 THR A 30 -11.853 -0.155 -6.255 1.00 0.00 H new ATOM 448 N VAL A 31 -12.919 0.148 -1.659 1.00 0.00 N ATOM 449 CA VAL A 31 -13.451 0.024 -0.315 1.00 0.00 C ATOM 450 C VAL A 31 -14.736 -0.781 -0.329 1.00 0.00 C ATOM 451 O VAL A 31 -15.762 -0.336 -0.844 1.00 0.00 O ATOM 452 CB VAL A 31 -13.728 1.397 0.327 1.00 0.00 C ATOM 453 CG1 VAL A 31 -14.114 1.241 1.791 1.00 0.00 C ATOM 454 CG2 VAL A 31 -12.527 2.318 0.180 1.00 0.00 C ATOM 0 H VAL A 31 -13.327 0.905 -2.208 1.00 0.00 H new ATOM 0 HA VAL A 31 -12.694 -0.487 0.280 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.567 1.852 -0.199 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -14.305 2.223 2.224 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -15.013 0.630 1.867 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -13.300 0.758 2.332 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.748 3.281 0.641 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -11.663 1.870 0.671 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -12.308 2.464 -0.878 1.00 0.00 H new ATOM 464 N THR A 32 -14.659 -1.974 0.220 1.00 0.00 N ATOM 465 CA THR A 32 -15.804 -2.850 0.327 1.00 0.00 C ATOM 466 C THR A 32 -16.836 -2.245 1.275 1.00 0.00 C ATOM 467 O THR A 32 -16.475 -1.720 2.329 1.00 0.00 O ATOM 468 CB THR A 32 -15.362 -4.226 0.850 1.00 0.00 C ATOM 469 OG1 THR A 32 -14.000 -4.474 0.462 1.00 0.00 O ATOM 470 CG2 THR A 32 -16.252 -5.322 0.299 1.00 0.00 C ATOM 0 H THR A 32 -13.799 -2.364 0.605 1.00 0.00 H new ATOM 0 HA THR A 32 -16.252 -2.969 -0.659 1.00 0.00 H new ATOM 0 HB THR A 32 -15.443 -4.226 1.937 1.00 0.00 H new ATOM 0 HG1 THR A 32 -13.862 -5.438 0.350 1.00 0.00 H new ATOM 0 HG21 THR A 32 -15.921 -6.287 0.682 1.00 0.00 H new ATOM 0 HG22 THR A 32 -17.282 -5.143 0.607 1.00 0.00 H new ATOM 0 HG23 THR A 32 -16.194 -5.325 -0.789 1.00 0.00 H new ATOM 478 N ASP A 33 -18.109 -2.324 0.906 1.00 0.00 N ATOM 479 CA ASP A 33 -19.184 -1.714 1.693 1.00 0.00 C ATOM 480 C ASP A 33 -19.255 -2.323 3.094 1.00 0.00 C ATOM 481 O ASP A 33 -19.755 -1.701 4.032 1.00 0.00 O ATOM 482 CB ASP A 33 -20.524 -1.881 0.971 1.00 0.00 C ATOM 483 CG ASP A 33 -21.642 -1.074 1.607 1.00 0.00 C ATOM 484 OD1 ASP A 33 -21.635 0.165 1.466 1.00 0.00 O ATOM 485 OD2 ASP A 33 -22.540 -1.678 2.236 1.00 0.00 O ATOM 0 H ASP A 33 -18.427 -2.805 0.065 1.00 0.00 H new ATOM 0 HA ASP A 33 -18.968 -0.651 1.799 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -20.411 -1.578 -0.070 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -20.800 -2.935 0.968 1.00 0.00 H new ATOM 490 N ASP A 34 -18.726 -3.537 3.224 1.00 0.00 N ATOM 491 CA ASP A 34 -18.681 -4.237 4.509 1.00 0.00 C ATOM 492 C ASP A 34 -17.619 -3.639 5.425 1.00 0.00 C ATOM 493 O ASP A 34 -17.648 -3.845 6.636 1.00 0.00 O ATOM 494 CB ASP A 34 -18.361 -5.722 4.311 1.00 0.00 C ATOM 495 CG ASP A 34 -19.286 -6.410 3.333 1.00 0.00 C ATOM 496 OD1 ASP A 34 -20.366 -6.872 3.754 1.00 0.00 O ATOM 497 OD2 ASP A 34 -18.921 -6.513 2.144 1.00 0.00 O ATOM 0 H ASP A 34 -18.319 -4.061 2.450 1.00 0.00 H new ATOM 0 HA ASP A 34 -19.664 -4.126 4.966 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.334 -5.821 3.960 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -18.419 -6.230 5.274 1.00 0.00 H new ATOM 502 N GLY A 35 -16.685 -2.899 4.840 1.00 0.00 N ATOM 503 CA GLY A 35 -15.538 -2.425 5.591 1.00 0.00 C ATOM 504 C GLY A 35 -14.400 -3.422 5.530 1.00 0.00 C ATOM 505 O GLY A 35 -13.550 -3.476 6.414 1.00 0.00 O ATOM 0 H GLY A 35 -16.701 -2.619 3.859 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.208 -1.466 5.191 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -15.823 -2.256 6.629 1.00 0.00 H new ATOM 509 N ASP A 36 -14.402 -4.217 4.469 1.00 0.00 N ATOM 510 CA ASP A 36 -13.418 -5.279 4.284 1.00 0.00 C ATOM 511 C ASP A 36 -12.095 -4.725 3.759 1.00 0.00 C ATOM 512 O ASP A 36 -11.037 -5.029 4.302 1.00 0.00 O ATOM 513 CB ASP A 36 -13.984 -6.330 3.328 1.00 0.00 C ATOM 514 CG ASP A 36 -12.967 -7.368 2.907 1.00 0.00 C ATOM 515 OD1 ASP A 36 -12.298 -7.950 3.785 1.00 0.00 O ATOM 516 OD2 ASP A 36 -12.846 -7.613 1.687 1.00 0.00 O ATOM 0 H ASP A 36 -15.083 -4.146 3.713 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.214 -5.741 5.250 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.826 -6.830 3.807 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -14.372 -5.831 2.440 1.00 0.00 H new ATOM 521 N ASN A 37 -12.190 -3.896 2.718 1.00 0.00 N ATOM 522 CA ASN A 37 -11.037 -3.218 2.100 1.00 0.00 C ATOM 523 C ASN A 37 -10.259 -4.166 1.191 1.00 0.00 C ATOM 524 O ASN A 37 -9.649 -5.136 1.646 1.00 0.00 O ATOM 525 CB ASN A 37 -10.109 -2.623 3.170 1.00 0.00 C ATOM 526 CG ASN A 37 -8.951 -1.833 2.590 1.00 0.00 C ATOM 527 OD1 ASN A 37 -7.885 -2.374 2.313 1.00 0.00 O ATOM 528 ND2 ASN A 37 -9.144 -0.534 2.435 1.00 0.00 N ATOM 0 H ASN A 37 -13.079 -3.670 2.271 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.426 -2.403 1.489 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -10.690 -1.974 3.825 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.715 -3.430 3.789 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.393 0.054 2.074 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.044 -0.120 2.676 1.00 0.00 H new ATOM 535 N ARG A 38 -10.302 -3.879 -0.107 1.00 0.00 N ATOM 536 CA ARG A 38 -9.647 -4.711 -1.104 1.00 0.00 C ATOM 537 C ARG A 38 -8.531 -3.938 -1.809 1.00 0.00 C ATOM 538 O ARG A 38 -8.797 -3.021 -2.590 1.00 0.00 O ATOM 539 CB ARG A 38 -10.672 -5.206 -2.132 1.00 0.00 C ATOM 540 CG ARG A 38 -10.113 -6.218 -3.119 1.00 0.00 C ATOM 541 CD ARG A 38 -11.161 -6.657 -4.135 1.00 0.00 C ATOM 542 NE ARG A 38 -11.563 -5.566 -5.027 1.00 0.00 N ATOM 543 CZ ARG A 38 -12.068 -5.752 -6.249 1.00 0.00 C ATOM 544 NH1 ARG A 38 -12.252 -6.983 -6.718 1.00 0.00 N ATOM 545 NH2 ARG A 38 -12.390 -4.705 -7.000 1.00 0.00 N ATOM 0 H ARG A 38 -10.788 -3.069 -0.492 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.205 -5.569 -0.597 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -11.514 -5.654 -1.605 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -11.061 -4.350 -2.684 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -9.260 -5.784 -3.641 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.745 -7.089 -2.577 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.765 -7.481 -4.728 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.038 -7.035 -3.609 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.450 -4.608 -4.695 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.007 -7.790 -6.144 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -12.638 -7.120 -7.652 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -12.251 -3.760 -6.643 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -12.776 -4.846 -7.934 1.00 0.00 H new ATOM 559 N VAL A 39 -7.286 -4.309 -1.534 1.00 0.00 N ATOM 560 CA VAL A 39 -6.139 -3.674 -2.173 1.00 0.00 C ATOM 561 C VAL A 39 -5.830 -4.365 -3.497 1.00 0.00 C ATOM 562 O VAL A 39 -5.613 -5.578 -3.535 1.00 0.00 O ATOM 563 CB VAL A 39 -4.888 -3.712 -1.266 1.00 0.00 C ATOM 564 CG1 VAL A 39 -3.695 -3.066 -1.961 1.00 0.00 C ATOM 565 CG2 VAL A 39 -5.170 -3.024 0.061 1.00 0.00 C ATOM 0 H VAL A 39 -7.045 -5.047 -0.872 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.397 -2.630 -2.352 1.00 0.00 H new ATOM 0 HB VAL A 39 -4.642 -4.755 -1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.826 -3.104 -1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -3.476 -3.604 -2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.928 -2.027 -2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -4.278 -3.060 0.687 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.445 -1.985 -0.119 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.990 -3.533 0.568 1.00 0.00 H new ATOM 575 N ALA A 40 -5.812 -3.592 -4.576 1.00 0.00 N ATOM 576 CA ALA A 40 -5.645 -4.156 -5.909 1.00 0.00 C ATOM 577 C ALA A 40 -4.484 -3.514 -6.666 1.00 0.00 C ATOM 578 O ALA A 40 -4.119 -3.967 -7.755 1.00 0.00 O ATOM 579 CB ALA A 40 -6.933 -4.011 -6.702 1.00 0.00 C ATOM 0 H ALA A 40 -5.911 -2.577 -4.554 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.408 -5.213 -5.789 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.798 -4.436 -7.697 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.737 -4.538 -6.189 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.189 -2.955 -6.790 1.00 0.00 H new ATOM 585 N ALA A 41 -3.899 -2.468 -6.100 1.00 0.00 N ATOM 586 CA ALA A 41 -2.804 -1.773 -6.757 1.00 0.00 C ATOM 587 C ALA A 41 -1.777 -1.282 -5.746 1.00 0.00 C ATOM 588 O ALA A 41 -2.125 -0.868 -4.638 1.00 0.00 O ATOM 589 CB ALA A 41 -3.332 -0.610 -7.585 1.00 0.00 C ATOM 0 H ALA A 41 -4.163 -2.084 -5.192 1.00 0.00 H new ATOM 0 HA ALA A 41 -2.309 -2.481 -7.422 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -2.499 -0.101 -8.070 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -4.019 -0.986 -8.344 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -3.857 0.090 -6.935 1.00 0.00 H new ATOM 595 N LEU A 42 -0.512 -1.340 -6.132 1.00 0.00 N ATOM 596 CA LEU A 42 0.578 -0.889 -5.276 1.00 0.00 C ATOM 597 C LEU A 42 1.063 0.488 -5.703 1.00 0.00 C ATOM 598 O LEU A 42 0.905 0.883 -6.859 1.00 0.00 O ATOM 599 CB LEU A 42 1.746 -1.878 -5.332 1.00 0.00 C ATOM 600 CG LEU A 42 1.476 -3.252 -4.722 1.00 0.00 C ATOM 601 CD1 LEU A 42 2.665 -4.175 -4.939 1.00 0.00 C ATOM 602 CD2 LEU A 42 1.173 -3.119 -3.242 1.00 0.00 C ATOM 0 H LEU A 42 -0.212 -1.697 -7.039 1.00 0.00 H new ATOM 0 HA LEU A 42 0.201 -0.833 -4.255 1.00 0.00 H new ATOM 0 HB2 LEU A 42 2.035 -2.013 -6.374 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.600 -1.434 -4.820 1.00 0.00 H new ATOM 0 HG LEU A 42 0.608 -3.687 -5.218 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.455 -5.149 -4.498 1.00 0.00 H new ATOM 0 HD12 LEU A 42 2.845 -4.292 -6.008 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.549 -3.746 -4.467 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.982 -4.106 -2.820 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.025 -2.666 -2.735 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.293 -2.490 -3.106 1.00 0.00 H new ATOM 614 N HIS A 43 1.645 1.220 -4.767 1.00 0.00 N ATOM 615 CA HIS A 43 2.246 2.505 -5.076 1.00 0.00 C ATOM 616 C HIS A 43 3.617 2.623 -4.422 1.00 0.00 C ATOM 617 O HIS A 43 3.743 2.579 -3.196 1.00 0.00 O ATOM 618 CB HIS A 43 1.321 3.644 -4.614 1.00 0.00 C ATOM 619 CG HIS A 43 1.972 4.996 -4.563 1.00 0.00 C ATOM 620 ND1 HIS A 43 2.136 5.695 -3.387 1.00 0.00 N ATOM 621 CD2 HIS A 43 2.495 5.780 -5.538 1.00 0.00 C ATOM 622 CE1 HIS A 43 2.732 6.843 -3.638 1.00 0.00 C ATOM 623 NE2 HIS A 43 2.961 6.923 -4.933 1.00 0.00 N ATOM 0 H HIS A 43 1.713 0.945 -3.787 1.00 0.00 H new ATOM 0 HA HIS A 43 2.378 2.582 -6.155 1.00 0.00 H new ATOM 0 HB2 HIS A 43 0.464 3.693 -5.285 1.00 0.00 H new ATOM 0 HB3 HIS A 43 0.936 3.403 -3.623 1.00 0.00 H new ATOM 0 HD2 HIS A 43 2.537 5.550 -6.592 1.00 0.00 H new ATOM 0 HE1 HIS A 43 2.990 7.593 -2.905 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.411 7.705 -5.409 1.00 0.00 H new ATOM 632 N ARG A 44 4.629 2.795 -5.255 1.00 0.00 N ATOM 633 CA ARG A 44 5.985 3.046 -4.792 1.00 0.00 C ATOM 634 C ARG A 44 6.158 4.527 -4.505 1.00 0.00 C ATOM 635 O ARG A 44 5.647 5.367 -5.251 1.00 0.00 O ATOM 636 CB ARG A 44 7.008 2.585 -5.840 1.00 0.00 C ATOM 637 CG ARG A 44 6.796 3.203 -7.214 1.00 0.00 C ATOM 638 CD ARG A 44 7.825 2.717 -8.224 1.00 0.00 C ATOM 639 NE ARG A 44 7.495 3.152 -9.582 1.00 0.00 N ATOM 640 CZ ARG A 44 8.378 3.249 -10.577 1.00 0.00 C ATOM 641 NH1 ARG A 44 9.660 2.959 -10.379 1.00 0.00 N ATOM 642 NH2 ARG A 44 7.966 3.638 -11.776 1.00 0.00 N ATOM 0 H ARG A 44 4.535 2.765 -6.270 1.00 0.00 H new ATOM 0 HA ARG A 44 6.156 2.479 -3.877 1.00 0.00 H new ATOM 0 HB2 ARG A 44 8.010 2.833 -5.490 1.00 0.00 H new ATOM 0 HB3 ARG A 44 6.961 1.500 -5.928 1.00 0.00 H new ATOM 0 HG2 ARG A 44 5.795 2.959 -7.570 1.00 0.00 H new ATOM 0 HG3 ARG A 44 6.850 4.289 -7.135 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.810 3.094 -7.950 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.880 1.629 -8.193 1.00 0.00 H new ATOM 0 HE ARG A 44 6.525 3.397 -9.781 1.00 0.00 H new ATOM 0 HH11 ARG A 44 9.978 2.658 -9.458 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.325 3.037 -11.148 1.00 0.00 H new ATOM 0 HH21 ARG A 44 6.982 3.860 -11.930 1.00 0.00 H new ATOM 0 HH22 ARG A 44 8.633 3.716 -12.544 1.00 0.00 H new ATOM 656 N ALA A 45 6.833 4.844 -3.410 1.00 0.00 N ATOM 657 CA ALA A 45 7.089 6.230 -3.047 1.00 0.00 C ATOM 658 C ALA A 45 7.861 6.944 -4.147 1.00 0.00 C ATOM 659 O ALA A 45 9.048 6.694 -4.357 1.00 0.00 O ATOM 660 CB ALA A 45 7.851 6.306 -1.733 1.00 0.00 C ATOM 0 H ALA A 45 7.214 4.159 -2.757 1.00 0.00 H new ATOM 0 HA ALA A 45 6.128 6.730 -2.922 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.033 7.350 -1.478 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.263 5.837 -0.944 1.00 0.00 H new ATOM 0 HB3 ALA A 45 8.803 5.786 -1.834 1.00 0.00 H new ATOM 666 N THR A 46 7.179 7.837 -4.849 1.00 0.00 N ATOM 667 CA THR A 46 7.797 8.612 -5.906 1.00 0.00 C ATOM 668 C THR A 46 8.508 9.810 -5.283 1.00 0.00 C ATOM 669 O THR A 46 9.200 10.585 -5.952 1.00 0.00 O ATOM 670 CB THR A 46 6.734 9.063 -6.930 1.00 0.00 C ATOM 671 OG1 THR A 46 5.904 7.939 -7.272 1.00 0.00 O ATOM 672 CG2 THR A 46 7.377 9.617 -8.194 1.00 0.00 C ATOM 0 H THR A 46 6.191 8.041 -4.701 1.00 0.00 H new ATOM 0 HA THR A 46 8.527 8.002 -6.439 1.00 0.00 H new ATOM 0 HB THR A 46 6.138 9.856 -6.478 1.00 0.00 H new ATOM 0 HG1 THR A 46 5.225 8.219 -7.921 1.00 0.00 H new ATOM 0 HG21 THR A 46 6.599 9.925 -8.893 1.00 0.00 H new ATOM 0 HG22 THR A 46 7.997 10.476 -7.940 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.995 8.847 -8.655 1.00 0.00 H new ATOM 680 N ASN A 47 8.338 9.912 -3.969 1.00 0.00 N ATOM 681 CA ASN A 47 8.993 10.909 -3.150 1.00 0.00 C ATOM 682 C ASN A 47 8.541 12.321 -3.490 1.00 0.00 C ATOM 683 O ASN A 47 7.466 12.530 -4.055 1.00 0.00 O ATOM 684 CB ASN A 47 10.509 10.776 -3.254 1.00 0.00 C ATOM 685 CG ASN A 47 11.061 9.752 -2.283 1.00 0.00 C ATOM 686 OD1 ASN A 47 11.398 10.084 -1.149 1.00 0.00 O ATOM 687 ND2 ASN A 47 11.142 8.501 -2.711 1.00 0.00 N ATOM 0 H ASN A 47 7.728 9.289 -3.439 1.00 0.00 H new ATOM 0 HA ASN A 47 8.699 10.726 -2.117 1.00 0.00 H new ATOM 0 HB2 ASN A 47 10.778 10.492 -4.271 1.00 0.00 H new ATOM 0 HB3 ASN A 47 10.971 11.744 -3.060 1.00 0.00 H new ATOM 0 HD21 ASN A 47 11.495 7.772 -2.091 1.00 0.00 H new ATOM 0 HD22 ASN A 47 10.852 8.267 -3.660 1.00 0.00 H new ATOM 694 N ARG A 48 9.368 13.286 -3.136 1.00 0.00 N ATOM 695 CA ARG A 48 8.975 14.679 -3.182 1.00 0.00 C ATOM 696 C ARG A 48 9.200 15.276 -4.566 1.00 0.00 C ATOM 697 O ARG A 48 10.283 15.763 -4.879 1.00 0.00 O ATOM 698 CB ARG A 48 9.734 15.484 -2.117 1.00 0.00 C ATOM 699 CG ARG A 48 9.334 15.152 -0.680 1.00 0.00 C ATOM 700 CD ARG A 48 9.750 13.743 -0.268 1.00 0.00 C ATOM 701 NE ARG A 48 9.183 13.363 1.026 1.00 0.00 N ATOM 702 CZ ARG A 48 8.820 12.122 1.356 1.00 0.00 C ATOM 703 NH1 ARG A 48 9.068 11.102 0.544 1.00 0.00 N ATOM 704 NH2 ARG A 48 8.238 11.907 2.526 1.00 0.00 N ATOM 0 H ARG A 48 10.322 13.128 -2.812 1.00 0.00 H new ATOM 0 HA ARG A 48 7.908 14.733 -2.968 1.00 0.00 H new ATOM 0 HB2 ARG A 48 10.803 15.306 -2.236 1.00 0.00 H new ATOM 0 HB3 ARG A 48 9.567 16.547 -2.293 1.00 0.00 H new ATOM 0 HG2 ARG A 48 9.790 15.874 -0.003 1.00 0.00 H new ATOM 0 HG3 ARG A 48 8.254 15.254 -0.574 1.00 0.00 H new ATOM 0 HD2 ARG A 48 9.427 13.032 -1.029 1.00 0.00 H new ATOM 0 HD3 ARG A 48 10.837 13.685 -0.219 1.00 0.00 H new ATOM 0 HE ARG A 48 9.057 14.097 1.723 1.00 0.00 H new ATOM 0 HH11 ARG A 48 9.542 11.261 -0.345 1.00 0.00 H new ATOM 0 HH12 ARG A 48 8.785 10.159 0.809 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.072 12.686 3.164 1.00 0.00 H new ATOM 0 HH22 ARG A 48 7.956 10.963 2.789 1.00 0.00 H new ATOM 718 N ARG A 49 8.176 15.198 -5.399 1.00 0.00 N ATOM 719 CA ARG A 49 8.203 15.816 -6.712 1.00 0.00 C ATOM 720 C ARG A 49 6.878 16.504 -6.990 1.00 0.00 C ATOM 721 O ARG A 49 5.852 15.850 -7.168 1.00 0.00 O ATOM 722 CB ARG A 49 8.494 14.782 -7.804 1.00 0.00 C ATOM 723 CG ARG A 49 8.346 15.342 -9.213 1.00 0.00 C ATOM 724 CD ARG A 49 8.666 14.305 -10.276 1.00 0.00 C ATOM 725 NE ARG A 49 10.090 13.982 -10.322 1.00 0.00 N ATOM 726 CZ ARG A 49 10.638 13.176 -11.229 1.00 0.00 C ATOM 727 NH1 ARG A 49 9.880 12.618 -12.170 1.00 0.00 N ATOM 728 NH2 ARG A 49 11.941 12.937 -11.202 1.00 0.00 N ATOM 0 H ARG A 49 7.308 14.707 -5.185 1.00 0.00 H new ATOM 0 HA ARG A 49 9.004 16.556 -6.722 1.00 0.00 H new ATOM 0 HB2 ARG A 49 9.507 14.402 -7.675 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.818 13.935 -7.683 1.00 0.00 H new ATOM 0 HG2 ARG A 49 7.327 15.703 -9.354 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.008 16.200 -9.333 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.096 13.397 -10.079 1.00 0.00 H new ATOM 0 HD3 ARG A 49 8.348 14.676 -11.250 1.00 0.00 H new ATOM 0 HE ARG A 49 10.700 14.398 -9.618 1.00 0.00 H new ATOM 0 HH11 ARG A 49 8.878 12.808 -12.197 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.301 12.001 -12.864 1.00 0.00 H new ATOM 0 HH21 ARG A 49 12.524 13.371 -10.486 1.00 0.00 H new ATOM 0 HH22 ARG A 49 12.361 12.319 -11.897 1.00 0.00 H new ATOM 742 N SER A 50 6.902 17.822 -7.002 1.00 0.00 N ATOM 743 CA SER A 50 5.710 18.596 -7.265 1.00 0.00 C ATOM 744 C SER A 50 6.087 20.009 -7.667 1.00 0.00 C ATOM 745 O SER A 50 6.836 20.682 -6.959 1.00 0.00 O ATOM 746 CB SER A 50 4.813 18.622 -6.024 1.00 0.00 C ATOM 747 OG SER A 50 3.602 19.319 -6.277 1.00 0.00 O ATOM 0 H SER A 50 7.739 18.379 -6.832 1.00 0.00 H new ATOM 0 HA SER A 50 5.161 18.131 -8.084 1.00 0.00 H new ATOM 0 HB2 SER A 50 4.590 17.602 -5.713 1.00 0.00 H new ATOM 0 HB3 SER A 50 5.343 19.098 -5.199 1.00 0.00 H new ATOM 0 HG SER A 50 3.049 19.318 -5.468 1.00 0.00 H new ATOM 753 N GLU A 51 5.593 20.443 -8.819 1.00 0.00 N ATOM 754 CA GLU A 51 5.758 21.824 -9.247 1.00 0.00 C ATOM 755 C GLU A 51 5.013 22.732 -8.278 1.00 0.00 C ATOM 756 O GLU A 51 5.522 23.783 -7.879 1.00 0.00 O ATOM 757 CB GLU A 51 5.268 22.025 -10.695 1.00 0.00 C ATOM 758 CG GLU A 51 3.769 21.814 -10.911 1.00 0.00 C ATOM 759 CD GLU A 51 3.294 20.432 -10.503 1.00 0.00 C ATOM 760 OE1 GLU A 51 3.619 19.455 -11.206 1.00 0.00 O ATOM 761 OE2 GLU A 51 2.618 20.316 -9.459 1.00 0.00 O ATOM 0 H GLU A 51 5.074 19.857 -9.474 1.00 0.00 H new ATOM 0 HA GLU A 51 6.817 22.080 -9.237 1.00 0.00 H new ATOM 0 HB2 GLU A 51 5.526 23.036 -11.012 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.812 21.339 -11.344 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.218 22.563 -10.342 1.00 0.00 H new ATOM 0 HG3 GLU A 51 3.534 21.976 -11.963 1.00 0.00 H new ATOM 768 N GLN A 52 3.811 22.289 -7.896 1.00 0.00 N ATOM 769 CA GLN A 52 3.015 22.923 -6.851 1.00 0.00 C ATOM 770 C GLN A 52 2.541 24.312 -7.289 1.00 0.00 C ATOM 771 O GLN A 52 3.021 24.857 -8.281 1.00 0.00 O ATOM 772 CB GLN A 52 3.831 22.991 -5.554 1.00 0.00 C ATOM 773 CG GLN A 52 3.009 23.274 -4.309 1.00 0.00 C ATOM 774 CD GLN A 52 3.815 23.149 -3.028 1.00 0.00 C ATOM 775 OE1 GLN A 52 3.552 23.844 -2.054 1.00 0.00 O ATOM 776 NE2 GLN A 52 4.789 22.251 -3.011 1.00 0.00 N ATOM 0 H GLN A 52 3.363 21.472 -8.310 1.00 0.00 H new ATOM 0 HA GLN A 52 2.123 22.323 -6.669 1.00 0.00 H new ATOM 0 HB2 GLN A 52 4.357 22.046 -5.420 1.00 0.00 H new ATOM 0 HB3 GLN A 52 4.590 23.766 -5.657 1.00 0.00 H new ATOM 0 HG2 GLN A 52 2.594 24.280 -4.375 1.00 0.00 H new ATOM 0 HG3 GLN A 52 2.167 22.583 -4.271 1.00 0.00 H new ATOM 0 HE21 GLN A 52 4.980 21.690 -3.841 1.00 0.00 H new ATOM 0 HE22 GLN A 52 5.348 22.121 -2.168 1.00 0.00 H new ATOM 785 N ARG A 53 1.565 24.857 -6.566 1.00 0.00 N ATOM 786 CA ARG A 53 1.047 26.197 -6.841 1.00 0.00 C ATOM 787 C ARG A 53 0.376 26.261 -8.212 1.00 0.00 C ATOM 788 O ARG A 53 0.488 27.250 -8.937 1.00 0.00 O ATOM 789 CB ARG A 53 2.164 27.240 -6.724 1.00 0.00 C ATOM 790 CG ARG A 53 2.632 27.467 -5.295 1.00 0.00 C ATOM 791 CD ARG A 53 1.532 28.090 -4.450 1.00 0.00 C ATOM 792 NE ARG A 53 1.917 28.220 -3.046 1.00 0.00 N ATOM 793 CZ ARG A 53 2.210 29.380 -2.461 1.00 0.00 C ATOM 794 NH1 ARG A 53 2.223 30.503 -3.169 1.00 0.00 N ATOM 795 NH2 ARG A 53 2.498 29.418 -1.167 1.00 0.00 N ATOM 0 H ARG A 53 1.114 24.388 -5.780 1.00 0.00 H new ATOM 0 HA ARG A 53 0.287 26.426 -6.094 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.012 26.922 -7.330 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.813 28.185 -7.138 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.939 26.518 -4.855 1.00 0.00 H new ATOM 0 HG3 ARG A 53 3.507 28.117 -5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 53 1.284 29.074 -4.849 1.00 0.00 H new ATOM 0 HD3 ARG A 53 0.632 27.480 -4.523 1.00 0.00 H new ATOM 0 HE ARG A 53 1.964 27.372 -2.481 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.008 30.480 -4.166 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.448 31.389 -2.716 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.495 28.558 -0.618 1.00 0.00 H new ATOM 0 HH22 ARG A 53 2.722 30.307 -0.720 1.00 0.00 H new ATOM 809 N THR A 54 -0.338 25.198 -8.545 1.00 0.00 N ATOM 810 CA THR A 54 -1.144 25.147 -9.756 1.00 0.00 C ATOM 811 C THR A 54 -2.624 25.248 -9.369 1.00 0.00 C ATOM 812 O THR A 54 -3.524 24.922 -10.146 1.00 0.00 O ATOM 813 CB THR A 54 -0.865 23.842 -10.545 1.00 0.00 C ATOM 814 OG1 THR A 54 -1.656 23.788 -11.739 1.00 0.00 O ATOM 815 CG2 THR A 54 -1.137 22.613 -9.688 1.00 0.00 C ATOM 0 H THR A 54 -0.376 24.347 -7.985 1.00 0.00 H new ATOM 0 HA THR A 54 -0.883 25.983 -10.405 1.00 0.00 H new ATOM 0 HB THR A 54 0.189 23.845 -10.821 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.576 24.055 -11.534 1.00 0.00 H new ATOM 0 HG21 THR A 54 -0.933 21.713 -10.268 1.00 0.00 H new ATOM 0 HG22 THR A 54 -0.493 22.633 -8.809 1.00 0.00 H new ATOM 0 HG23 THR A 54 -2.181 22.613 -9.373 1.00 0.00 H new ATOM 823 N ARG A 55 -2.835 25.741 -8.153 1.00 0.00 N ATOM 824 CA ARG A 55 -4.152 25.852 -7.532 1.00 0.00 C ATOM 825 C ARG A 55 -4.805 24.485 -7.354 1.00 0.00 C ATOM 826 O ARG A 55 -5.642 24.061 -8.154 1.00 0.00 O ATOM 827 CB ARG A 55 -5.079 26.805 -8.289 1.00 0.00 C ATOM 828 CG ARG A 55 -6.335 27.123 -7.498 1.00 0.00 C ATOM 829 CD ARG A 55 -7.185 28.193 -8.160 1.00 0.00 C ATOM 830 NE ARG A 55 -8.374 28.482 -7.364 1.00 0.00 N ATOM 831 CZ ARG A 55 -9.404 29.214 -7.775 1.00 0.00 C ATOM 832 NH1 ARG A 55 -9.385 29.805 -8.965 1.00 0.00 N ATOM 833 NH2 ARG A 55 -10.448 29.368 -6.973 1.00 0.00 N ATOM 0 H ARG A 55 -2.080 26.082 -7.558 1.00 0.00 H new ATOM 0 HA ARG A 55 -3.989 26.282 -6.544 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -4.546 27.730 -8.511 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -5.355 26.359 -9.245 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -6.926 26.215 -7.381 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -6.056 27.453 -6.497 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -6.598 29.102 -8.287 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -7.481 27.863 -9.156 1.00 0.00 H new ATOM 0 HE ARG A 55 -8.417 28.093 -6.422 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -8.574 29.699 -9.574 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -10.182 30.364 -9.269 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -10.454 28.927 -6.053 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -11.245 29.927 -7.276 1.00 0.00 H new ATOM 847 N ARG A 56 -4.370 23.801 -6.306 1.00 0.00 N ATOM 848 CA ARG A 56 -4.943 22.534 -5.862 1.00 0.00 C ATOM 849 C ARG A 56 -4.185 22.092 -4.623 1.00 0.00 C ATOM 850 O ARG A 56 -3.323 22.832 -4.134 1.00 0.00 O ATOM 851 CB ARG A 56 -4.877 21.441 -6.942 1.00 0.00 C ATOM 852 CG ARG A 56 -3.468 21.008 -7.316 1.00 0.00 C ATOM 853 CD ARG A 56 -3.485 19.769 -8.202 1.00 0.00 C ATOM 854 NE ARG A 56 -4.025 18.597 -7.509 1.00 0.00 N ATOM 855 CZ ARG A 56 -3.942 17.349 -7.976 1.00 0.00 C ATOM 856 NH1 ARG A 56 -3.379 17.106 -9.155 1.00 0.00 N ATOM 857 NH2 ARG A 56 -4.428 16.341 -7.266 1.00 0.00 N ATOM 0 H ARG A 56 -3.592 24.116 -5.727 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.001 22.685 -5.647 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.431 20.569 -6.593 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.382 21.802 -7.838 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -2.961 21.822 -7.835 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -2.896 20.802 -6.411 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.082 19.969 -9.092 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -2.472 19.553 -8.540 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.493 18.743 -6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -3.006 17.876 -9.711 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.320 16.150 -9.504 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.866 16.518 -6.362 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.364 15.388 -7.624 1.00 0.00 H new ATOM 871 N TYR A 57 -4.479 20.908 -4.113 1.00 0.00 N ATOM 872 CA TYR A 57 -3.785 20.420 -2.932 1.00 0.00 C ATOM 873 C TYR A 57 -2.296 20.226 -3.200 1.00 0.00 C ATOM 874 O TYR A 57 -1.873 19.936 -4.326 1.00 0.00 O ATOM 875 CB TYR A 57 -4.421 19.135 -2.404 1.00 0.00 C ATOM 876 CG TYR A 57 -5.620 19.396 -1.520 1.00 0.00 C ATOM 877 CD1 TYR A 57 -5.451 19.869 -0.225 1.00 0.00 C ATOM 878 CD2 TYR A 57 -6.916 19.187 -1.978 1.00 0.00 C ATOM 879 CE1 TYR A 57 -6.535 20.121 0.592 1.00 0.00 C ATOM 880 CE2 TYR A 57 -8.007 19.436 -1.165 1.00 0.00 C ATOM 881 CZ TYR A 57 -7.809 19.907 0.118 1.00 0.00 C ATOM 882 OH TYR A 57 -8.891 20.164 0.930 1.00 0.00 O ATOM 0 H TYR A 57 -5.183 20.274 -4.491 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.885 21.182 -2.159 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -4.724 18.512 -3.246 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.677 18.571 -1.842 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -4.453 20.043 0.150 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.073 18.825 -2.983 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -6.384 20.484 1.598 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -9.008 19.263 -1.532 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.719 19.962 0.446 1.00 0.00 H new ATOM 892 N GLU A 58 -1.515 20.412 -2.153 1.00 0.00 N ATOM 893 CA GLU A 58 -0.066 20.363 -2.233 1.00 0.00 C ATOM 894 C GLU A 58 0.411 18.914 -2.179 1.00 0.00 C ATOM 895 O GLU A 58 -0.381 17.991 -2.388 1.00 0.00 O ATOM 896 CB GLU A 58 0.508 21.168 -1.067 1.00 0.00 C ATOM 897 CG GLU A 58 -0.108 22.553 -0.940 1.00 0.00 C ATOM 898 CD GLU A 58 0.200 23.213 0.389 1.00 0.00 C ATOM 899 OE1 GLU A 58 -0.430 22.843 1.399 1.00 0.00 O ATOM 900 OE2 GLU A 58 1.076 24.105 0.427 1.00 0.00 O ATOM 0 H GLU A 58 -1.870 20.603 -1.216 1.00 0.00 H new ATOM 0 HA GLU A 58 0.276 20.792 -3.175 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.347 20.619 -0.139 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.586 21.266 -1.196 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.260 23.185 -1.748 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.189 22.478 -1.061 1.00 0.00 H new ATOM 907 N LEU A 59 1.698 18.712 -1.925 1.00 0.00 N ATOM 908 CA LEU A 59 2.234 17.367 -1.747 1.00 0.00 C ATOM 909 C LEU A 59 1.537 16.705 -0.563 1.00 0.00 C ATOM 910 O LEU A 59 1.128 15.547 -0.633 1.00 0.00 O ATOM 911 CB LEU A 59 3.748 17.422 -1.518 1.00 0.00 C ATOM 912 CG LEU A 59 4.448 16.066 -1.401 1.00 0.00 C ATOM 913 CD1 LEU A 59 4.361 15.301 -2.712 1.00 0.00 C ATOM 914 CD2 LEU A 59 5.898 16.252 -0.982 1.00 0.00 C ATOM 0 H LEU A 59 2.388 19.458 -1.838 1.00 0.00 H new ATOM 0 HA LEU A 59 2.051 16.780 -2.647 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.202 17.976 -2.340 1.00 0.00 H new ATOM 0 HB3 LEU A 59 3.939 17.990 -0.607 1.00 0.00 H new ATOM 0 HG LEU A 59 3.940 15.482 -0.634 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.865 14.340 -2.607 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.314 15.136 -2.968 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.841 15.878 -3.502 1.00 0.00 H new ATOM 0 HD21 LEU A 59 6.382 15.278 -0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.417 16.856 -1.726 1.00 0.00 H new ATOM 0 HD23 LEU A 59 5.936 16.755 -0.016 1.00 0.00 H new ATOM 926 N THR A 60 1.400 17.481 0.511 1.00 0.00 N ATOM 927 CA THR A 60 0.598 17.106 1.670 1.00 0.00 C ATOM 928 C THR A 60 1.089 15.819 2.339 1.00 0.00 C ATOM 929 O THR A 60 0.511 14.751 2.142 1.00 0.00 O ATOM 930 CB THR A 60 -0.888 16.958 1.288 1.00 0.00 C ATOM 931 OG1 THR A 60 -1.272 18.038 0.424 1.00 0.00 O ATOM 932 CG2 THR A 60 -1.775 16.963 2.526 1.00 0.00 C ATOM 0 H THR A 60 1.846 18.394 0.600 1.00 0.00 H new ATOM 0 HA THR A 60 0.709 17.915 2.392 1.00 0.00 H new ATOM 0 HB THR A 60 -1.016 16.005 0.775 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.216 17.942 0.180 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.818 16.857 2.227 1.00 0.00 H new ATOM 0 HG22 THR A 60 -1.498 16.133 3.176 1.00 0.00 H new ATOM 0 HG23 THR A 60 -1.645 17.903 3.063 1.00 0.00 H new ATOM 940 N ALA A 61 2.165 15.946 3.117 1.00 0.00 N ATOM 941 CA ALA A 61 2.692 14.856 3.945 1.00 0.00 C ATOM 942 C ALA A 61 3.069 13.618 3.127 1.00 0.00 C ATOM 943 O ALA A 61 2.217 12.786 2.804 1.00 0.00 O ATOM 944 CB ALA A 61 1.699 14.488 5.043 1.00 0.00 C ATOM 0 H ALA A 61 2.699 16.812 3.192 1.00 0.00 H new ATOM 0 HA ALA A 61 3.611 15.225 4.401 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.108 13.678 5.647 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.518 15.357 5.676 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.760 14.166 4.592 1.00 0.00 H new ATOM 950 N ASP A 62 4.359 13.517 2.812 1.00 0.00 N ATOM 951 CA ASP A 62 4.918 12.370 2.089 1.00 0.00 C ATOM 952 C ASP A 62 4.398 12.355 0.651 1.00 0.00 C ATOM 953 O ASP A 62 3.920 13.372 0.151 1.00 0.00 O ATOM 954 CB ASP A 62 4.596 11.049 2.811 1.00 0.00 C ATOM 955 CG ASP A 62 5.626 9.963 2.546 1.00 0.00 C ATOM 956 OD1 ASP A 62 6.623 9.882 3.301 1.00 0.00 O ATOM 957 OD2 ASP A 62 5.450 9.180 1.589 1.00 0.00 O ATOM 0 H ASP A 62 5.050 14.229 3.050 1.00 0.00 H new ATOM 0 HA ASP A 62 6.003 12.470 2.064 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.537 11.232 3.884 1.00 0.00 H new ATOM 0 HB3 ASP A 62 3.615 10.697 2.493 1.00 0.00 H new ATOM 962 N ASP A 63 4.494 11.216 -0.017 1.00 0.00 N ATOM 963 CA ASP A 63 4.107 11.128 -1.421 1.00 0.00 C ATOM 964 C ASP A 63 2.620 10.813 -1.565 1.00 0.00 C ATOM 965 O ASP A 63 2.229 9.742 -2.044 1.00 0.00 O ATOM 966 CB ASP A 63 4.954 10.079 -2.150 1.00 0.00 C ATOM 967 CG ASP A 63 4.606 9.964 -3.623 1.00 0.00 C ATOM 968 OD1 ASP A 63 4.131 10.960 -4.209 1.00 0.00 O ATOM 969 OD2 ASP A 63 4.816 8.873 -4.202 1.00 0.00 O ATOM 0 H ASP A 63 4.834 10.343 0.385 1.00 0.00 H new ATOM 0 HA ASP A 63 4.290 12.100 -1.880 1.00 0.00 H new ATOM 0 HB2 ASP A 63 6.008 10.336 -2.049 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.815 9.110 -1.671 1.00 0.00 H new ATOM 974 N TYR A 64 1.785 11.732 -1.098 1.00 0.00 N ATOM 975 CA TYR A 64 0.350 11.611 -1.294 1.00 0.00 C ATOM 976 C TYR A 64 -0.012 11.852 -2.756 1.00 0.00 C ATOM 977 O TYR A 64 -0.858 11.160 -3.319 1.00 0.00 O ATOM 978 CB TYR A 64 -0.426 12.585 -0.399 1.00 0.00 C ATOM 979 CG TYR A 64 -1.921 12.545 -0.650 1.00 0.00 C ATOM 980 CD1 TYR A 64 -2.695 11.494 -0.172 1.00 0.00 C ATOM 981 CD2 TYR A 64 -2.554 13.544 -1.382 1.00 0.00 C ATOM 982 CE1 TYR A 64 -4.053 11.434 -0.424 1.00 0.00 C ATOM 983 CE2 TYR A 64 -3.913 13.494 -1.634 1.00 0.00 C ATOM 984 CZ TYR A 64 -4.658 12.438 -1.152 1.00 0.00 C ATOM 985 OH TYR A 64 -6.012 12.375 -1.412 1.00 0.00 O ATOM 0 H TYR A 64 2.076 12.564 -0.584 1.00 0.00 H new ATOM 0 HA TYR A 64 0.067 10.596 -1.016 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -0.231 12.346 0.646 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.060 13.598 -0.568 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -2.227 10.711 0.406 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -1.974 14.373 -1.760 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -4.638 10.605 -0.053 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -4.388 14.278 -2.205 1.00 0.00 H new ATOM 0 HH TYR A 64 -6.161 12.402 -2.380 1.00 0.00 H new ATOM 995 N ARG A 65 0.644 12.836 -3.366 1.00 0.00 N ATOM 996 CA ARG A 65 0.295 13.286 -4.710 1.00 0.00 C ATOM 997 C ARG A 65 0.345 12.172 -5.746 1.00 0.00 C ATOM 998 O ARG A 65 -0.598 12.010 -6.520 1.00 0.00 O ATOM 999 CB ARG A 65 1.189 14.442 -5.150 1.00 0.00 C ATOM 1000 CG ARG A 65 0.587 15.799 -4.853 1.00 0.00 C ATOM 1001 CD ARG A 65 1.354 16.903 -5.549 1.00 0.00 C ATOM 1002 NE ARG A 65 0.594 18.147 -5.594 1.00 0.00 N ATOM 1003 CZ ARG A 65 0.492 18.908 -6.683 1.00 0.00 C ATOM 1004 NH1 ARG A 65 1.078 18.531 -7.814 1.00 0.00 N ATOM 1005 NH2 ARG A 65 -0.212 20.031 -6.643 1.00 0.00 N ATOM 0 H ARG A 65 1.426 13.340 -2.947 1.00 0.00 H new ATOM 0 HA ARG A 65 -0.739 13.627 -4.652 1.00 0.00 H new ATOM 0 HB2 ARG A 65 2.153 14.360 -4.648 1.00 0.00 H new ATOM 0 HB3 ARG A 65 1.379 14.361 -6.220 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -0.454 15.816 -5.176 1.00 0.00 H new ATOM 0 HG3 ARG A 65 0.590 15.973 -3.777 1.00 0.00 H new ATOM 0 HD2 ARG A 65 2.298 17.072 -5.030 1.00 0.00 H new ATOM 0 HD3 ARG A 65 1.600 16.591 -6.564 1.00 0.00 H new ATOM 0 HE ARG A 65 0.115 18.451 -4.746 1.00 0.00 H new ATOM 0 HH11 ARG A 65 1.606 17.659 -7.849 1.00 0.00 H new ATOM 0 HH12 ARG A 65 1.000 19.114 -8.648 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -0.675 20.312 -5.779 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -0.290 20.614 -7.476 1.00 0.00 H new ATOM 1019 N ALA A 66 1.425 11.404 -5.770 1.00 0.00 N ATOM 1020 CA ALA A 66 1.552 10.339 -6.756 1.00 0.00 C ATOM 1021 C ALA A 66 0.583 9.207 -6.450 1.00 0.00 C ATOM 1022 O ALA A 66 0.148 8.486 -7.348 1.00 0.00 O ATOM 1023 CB ALA A 66 2.980 9.826 -6.826 1.00 0.00 C ATOM 0 H ALA A 66 2.214 11.495 -5.130 1.00 0.00 H new ATOM 0 HA ALA A 66 1.298 10.751 -7.733 1.00 0.00 H new ATOM 0 HB1 ALA A 66 3.045 9.032 -7.570 1.00 0.00 H new ATOM 0 HB2 ALA A 66 3.646 10.642 -7.107 1.00 0.00 H new ATOM 0 HB3 ALA A 66 3.275 9.436 -5.852 1.00 0.00 H new ATOM 1029 N ALA A 67 0.242 9.059 -5.178 1.00 0.00 N ATOM 1030 CA ALA A 67 -0.750 8.079 -4.768 1.00 0.00 C ATOM 1031 C ALA A 67 -2.135 8.499 -5.243 1.00 0.00 C ATOM 1032 O ALA A 67 -2.891 7.687 -5.772 1.00 0.00 O ATOM 1033 CB ALA A 67 -0.731 7.908 -3.255 1.00 0.00 C ATOM 0 H ALA A 67 0.638 9.605 -4.413 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.505 7.120 -5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.479 7.171 -2.963 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.256 7.568 -2.940 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.956 8.862 -2.778 1.00 0.00 H new ATOM 1039 N ASP A 68 -2.443 9.779 -5.066 1.00 0.00 N ATOM 1040 CA ASP A 68 -3.732 10.335 -5.473 1.00 0.00 C ATOM 1041 C ASP A 68 -3.889 10.268 -6.987 1.00 0.00 C ATOM 1042 O ASP A 68 -4.912 9.811 -7.493 1.00 0.00 O ATOM 1043 CB ASP A 68 -3.858 11.789 -4.995 1.00 0.00 C ATOM 1044 CG ASP A 68 -5.235 12.388 -5.245 1.00 0.00 C ATOM 1045 OD1 ASP A 68 -5.499 12.843 -6.380 1.00 0.00 O ATOM 1046 OD2 ASP A 68 -6.051 12.427 -4.296 1.00 0.00 O ATOM 0 H ASP A 68 -1.812 10.458 -4.640 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.523 9.742 -5.014 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.638 11.834 -3.928 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -3.108 12.397 -5.501 1.00 0.00 H new ATOM 1051 N ALA A 69 -2.850 10.700 -7.701 1.00 0.00 N ATOM 1052 CA ALA A 69 -2.872 10.735 -9.163 1.00 0.00 C ATOM 1053 C ALA A 69 -3.125 9.350 -9.751 1.00 0.00 C ATOM 1054 O ALA A 69 -4.054 9.164 -10.537 1.00 0.00 O ATOM 1055 CB ALA A 69 -1.564 11.305 -9.696 1.00 0.00 C ATOM 0 H ALA A 69 -1.978 11.032 -7.288 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.694 11.382 -9.470 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.593 11.326 -10.785 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.427 12.318 -9.317 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.734 10.680 -9.367 1.00 0.00 H new ATOM 1061 N ALA A 70 -2.319 8.374 -9.346 1.00 0.00 N ATOM 1062 CA ALA A 70 -2.448 7.015 -9.864 1.00 0.00 C ATOM 1063 C ALA A 70 -3.773 6.399 -9.443 1.00 0.00 C ATOM 1064 O ALA A 70 -4.360 5.600 -10.173 1.00 0.00 O ATOM 1065 CB ALA A 70 -1.287 6.156 -9.395 1.00 0.00 C ATOM 0 H ALA A 70 -1.572 8.497 -8.663 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.427 7.061 -10.953 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -1.399 5.146 -9.790 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.350 6.584 -9.752 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.278 6.120 -8.306 1.00 0.00 H new ATOM 1071 N ALA A 71 -4.247 6.773 -8.265 1.00 0.00 N ATOM 1072 CA ALA A 71 -5.543 6.319 -7.798 1.00 0.00 C ATOM 1073 C ALA A 71 -6.646 6.846 -8.703 1.00 0.00 C ATOM 1074 O ALA A 71 -7.493 6.084 -9.158 1.00 0.00 O ATOM 1075 CB ALA A 71 -5.778 6.752 -6.361 1.00 0.00 C ATOM 0 H ALA A 71 -3.754 7.388 -7.618 1.00 0.00 H new ATOM 0 HA ALA A 71 -5.559 5.230 -7.831 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -6.756 6.401 -6.031 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -5.005 6.326 -5.722 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -5.743 7.840 -6.298 1.00 0.00 H new ATOM 1081 N GLN A 72 -6.614 8.145 -8.982 1.00 0.00 N ATOM 1082 CA GLN A 72 -7.604 8.762 -9.857 1.00 0.00 C ATOM 1083 C GLN A 72 -7.548 8.147 -11.250 1.00 0.00 C ATOM 1084 O GLN A 72 -8.580 7.907 -11.877 1.00 0.00 O ATOM 1085 CB GLN A 72 -7.394 10.277 -9.950 1.00 0.00 C ATOM 1086 CG GLN A 72 -7.468 10.998 -8.610 1.00 0.00 C ATOM 1087 CD GLN A 72 -8.745 10.702 -7.842 1.00 0.00 C ATOM 1088 OE1 GLN A 72 -9.796 10.440 -8.430 1.00 0.00 O ATOM 1089 NE2 GLN A 72 -8.663 10.750 -6.520 1.00 0.00 N ATOM 0 H GLN A 72 -5.914 8.790 -8.615 1.00 0.00 H new ATOM 0 HA GLN A 72 -8.587 8.575 -9.425 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.421 10.471 -10.402 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.146 10.697 -10.619 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.611 10.710 -8.002 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -7.393 12.072 -8.778 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -7.774 10.971 -6.072 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -9.489 10.566 -5.951 1.00 0.00 H new ATOM 1098 N GLU A 73 -6.334 7.878 -11.720 1.00 0.00 N ATOM 1099 CA GLU A 73 -6.127 7.243 -13.013 1.00 0.00 C ATOM 1100 C GLU A 73 -6.840 5.897 -13.089 1.00 0.00 C ATOM 1101 O GLU A 73 -7.504 5.583 -14.077 1.00 0.00 O ATOM 1102 CB GLU A 73 -4.633 7.038 -13.252 1.00 0.00 C ATOM 1103 CG GLU A 73 -3.852 8.319 -13.485 1.00 0.00 C ATOM 1104 CD GLU A 73 -2.399 8.047 -13.810 1.00 0.00 C ATOM 1105 OE1 GLU A 73 -1.660 7.584 -12.918 1.00 0.00 O ATOM 1106 OE2 GLU A 73 -1.991 8.276 -14.970 1.00 0.00 O ATOM 0 H GLU A 73 -5.473 8.093 -11.218 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.542 7.896 -13.781 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -4.208 6.519 -12.393 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -4.502 6.385 -14.115 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.308 8.878 -14.302 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.913 8.947 -12.596 1.00 0.00 H new ATOM 1113 N GLN A 74 -6.718 5.127 -12.024 1.00 0.00 N ATOM 1114 CA GLN A 74 -7.256 3.776 -11.976 1.00 0.00 C ATOM 1115 C GLN A 74 -8.700 3.743 -11.472 1.00 0.00 C ATOM 1116 O GLN A 74 -9.332 2.685 -11.446 1.00 0.00 O ATOM 1117 CB GLN A 74 -6.362 2.926 -11.081 1.00 0.00 C ATOM 1118 CG GLN A 74 -5.012 2.609 -11.703 1.00 0.00 C ATOM 1119 CD GLN A 74 -4.028 2.009 -10.716 1.00 0.00 C ATOM 1120 OE1 GLN A 74 -3.194 1.179 -11.080 1.00 0.00 O ATOM 1121 NE2 GLN A 74 -4.090 2.447 -9.465 1.00 0.00 N ATOM 0 H GLN A 74 -6.245 5.417 -11.168 1.00 0.00 H new ATOM 0 HA GLN A 74 -7.270 3.375 -12.990 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -6.205 3.447 -10.137 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.875 1.993 -10.849 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.154 1.916 -12.532 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -4.588 3.522 -12.120 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -4.795 3.135 -9.200 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -3.433 2.096 -8.768 1.00 0.00 H new ATOM 1130 N GLY A 75 -9.219 4.896 -11.075 1.00 0.00 N ATOM 1131 CA GLY A 75 -10.573 4.950 -10.552 1.00 0.00 C ATOM 1132 C GLY A 75 -10.659 4.381 -9.149 1.00 0.00 C ATOM 1133 O GLY A 75 -11.671 3.796 -8.757 1.00 0.00 O ATOM 0 H GLY A 75 -8.732 5.792 -11.104 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.919 5.983 -10.547 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.239 4.394 -11.211 1.00 0.00 H new ATOM 1137 N LEU A 76 -9.577 4.545 -8.404 1.00 0.00 N ATOM 1138 CA LEU A 76 -9.471 4.041 -7.044 1.00 0.00 C ATOM 1139 C LEU A 76 -9.098 5.185 -6.113 1.00 0.00 C ATOM 1140 O LEU A 76 -9.029 6.339 -6.543 1.00 0.00 O ATOM 1141 CB LEU A 76 -8.391 2.958 -6.975 1.00 0.00 C ATOM 1142 CG LEU A 76 -8.588 1.769 -7.920 1.00 0.00 C ATOM 1143 CD1 LEU A 76 -7.414 0.808 -7.811 1.00 0.00 C ATOM 1144 CD2 LEU A 76 -9.894 1.047 -7.616 1.00 0.00 C ATOM 0 H LEU A 76 -8.743 5.034 -8.728 1.00 0.00 H new ATOM 0 HA LEU A 76 -10.427 3.615 -6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.427 3.417 -7.193 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -8.342 2.583 -5.953 1.00 0.00 H new ATOM 0 HG LEU A 76 -8.637 2.148 -8.941 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -7.568 -0.032 -8.488 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.493 1.326 -8.079 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -7.339 0.440 -6.788 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -10.013 0.206 -8.300 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -9.877 0.681 -6.590 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -10.729 1.737 -7.741 1.00 0.00 H new ATOM 1156 N ASP A 77 -8.865 4.869 -4.850 1.00 0.00 N ATOM 1157 CA ASP A 77 -8.322 5.833 -3.912 1.00 0.00 C ATOM 1158 C ASP A 77 -7.315 5.145 -3.011 1.00 0.00 C ATOM 1159 O ASP A 77 -7.122 3.928 -3.098 1.00 0.00 O ATOM 1160 CB ASP A 77 -9.422 6.497 -3.079 1.00 0.00 C ATOM 1161 CG ASP A 77 -10.056 5.577 -2.054 1.00 0.00 C ATOM 1162 OD1 ASP A 77 -10.781 4.642 -2.451 1.00 0.00 O ATOM 1163 OD2 ASP A 77 -9.856 5.807 -0.842 1.00 0.00 O ATOM 0 H ASP A 77 -9.045 3.948 -4.451 1.00 0.00 H new ATOM 0 HA ASP A 77 -7.828 6.622 -4.479 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.003 7.363 -2.566 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -10.198 6.868 -3.749 1.00 0.00 H new ATOM 1168 N VAL A 78 -6.663 5.922 -2.164 1.00 0.00 N ATOM 1169 CA VAL A 78 -5.656 5.388 -1.262 1.00 0.00 C ATOM 1170 C VAL A 78 -6.331 4.718 -0.073 1.00 0.00 C ATOM 1171 O VAL A 78 -6.760 5.387 0.866 1.00 0.00 O ATOM 1172 CB VAL A 78 -4.701 6.494 -0.759 1.00 0.00 C ATOM 1173 CG1 VAL A 78 -3.553 5.898 0.041 1.00 0.00 C ATOM 1174 CG2 VAL A 78 -4.174 7.326 -1.920 1.00 0.00 C ATOM 0 H VAL A 78 -6.813 6.928 -2.081 1.00 0.00 H new ATOM 0 HA VAL A 78 -5.067 4.656 -1.815 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.267 7.152 -0.100 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.895 6.697 0.384 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.950 5.360 0.902 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.990 5.209 -0.589 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -3.504 8.098 -1.540 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.631 6.682 -2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -5.009 7.795 -2.440 1.00 0.00 H new ATOM 1184 N VAL A 79 -6.422 3.399 -0.121 1.00 0.00 N ATOM 1185 CA VAL A 79 -7.154 2.649 0.887 1.00 0.00 C ATOM 1186 C VAL A 79 -6.234 2.143 1.990 1.00 0.00 C ATOM 1187 O VAL A 79 -6.692 1.547 2.964 1.00 0.00 O ATOM 1188 CB VAL A 79 -7.908 1.453 0.266 1.00 0.00 C ATOM 1189 CG1 VAL A 79 -8.957 1.942 -0.720 1.00 0.00 C ATOM 1190 CG2 VAL A 79 -6.939 0.492 -0.413 1.00 0.00 C ATOM 0 H VAL A 79 -5.997 2.824 -0.849 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.877 3.339 1.321 1.00 0.00 H new ATOM 0 HB VAL A 79 -8.411 0.913 1.068 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.480 1.087 -1.149 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.672 2.582 -0.203 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.473 2.508 -1.516 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -7.494 -0.342 -0.842 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.401 1.016 -1.204 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.227 0.114 0.321 1.00 0.00 H new ATOM 1200 N GLY A 80 -4.940 2.374 1.841 1.00 0.00 N ATOM 1201 CA GLY A 80 -4.006 1.911 2.841 1.00 0.00 C ATOM 1202 C GLY A 80 -2.604 2.435 2.637 1.00 0.00 C ATOM 1203 O GLY A 80 -2.315 3.113 1.651 1.00 0.00 O ATOM 0 H GLY A 80 -4.523 2.869 1.053 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.360 2.214 3.827 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -3.984 0.821 2.831 1.00 0.00 H new ATOM 1207 N VAL A 81 -1.738 2.111 3.583 1.00 0.00 N ATOM 1208 CA VAL A 81 -0.336 2.495 3.534 1.00 0.00 C ATOM 1209 C VAL A 81 0.498 1.302 3.976 1.00 0.00 C ATOM 1210 O VAL A 81 0.001 0.433 4.695 1.00 0.00 O ATOM 1211 CB VAL A 81 -0.022 3.681 4.476 1.00 0.00 C ATOM 1212 CG1 VAL A 81 1.325 4.304 4.146 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -1.124 4.731 4.441 1.00 0.00 C ATOM 0 H VAL A 81 -1.989 1.571 4.411 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.104 2.803 2.514 1.00 0.00 H new ATOM 0 HB VAL A 81 0.027 3.284 5.490 1.00 0.00 H new ATOM 0 HG11 VAL A 81 1.518 5.135 4.825 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.109 3.555 4.257 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.315 4.669 3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.869 5.549 5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.228 5.116 3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.065 4.281 4.757 1.00 0.00 H new ATOM 1223 N TYR A 82 1.750 1.247 3.568 1.00 0.00 N ATOM 1224 CA TYR A 82 2.613 0.162 3.996 1.00 0.00 C ATOM 1225 C TYR A 82 3.964 0.693 4.444 1.00 0.00 C ATOM 1226 O TYR A 82 4.491 1.651 3.873 1.00 0.00 O ATOM 1227 CB TYR A 82 2.767 -0.922 2.908 1.00 0.00 C ATOM 1228 CG TYR A 82 3.580 -0.535 1.686 1.00 0.00 C ATOM 1229 CD1 TYR A 82 4.959 -0.734 1.651 1.00 0.00 C ATOM 1230 CD2 TYR A 82 2.968 -0.005 0.559 1.00 0.00 C ATOM 1231 CE1 TYR A 82 5.699 -0.412 0.529 1.00 0.00 C ATOM 1232 CE2 TYR A 82 3.702 0.322 -0.564 1.00 0.00 C ATOM 1233 CZ TYR A 82 5.064 0.118 -0.575 1.00 0.00 C ATOM 1234 OH TYR A 82 5.793 0.443 -1.698 1.00 0.00 O ATOM 0 H TYR A 82 2.189 1.929 2.950 1.00 0.00 H new ATOM 0 HA TYR A 82 2.135 -0.317 4.851 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.227 -1.800 3.362 1.00 0.00 H new ATOM 0 HB3 TYR A 82 1.772 -1.219 2.577 1.00 0.00 H new ATOM 0 HD1 TYR A 82 5.458 -1.147 2.515 1.00 0.00 H new ATOM 0 HD2 TYR A 82 1.900 0.154 0.560 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.767 -0.574 0.517 1.00 0.00 H new ATOM 0 HE2 TYR A 82 3.209 0.737 -1.431 1.00 0.00 H new ATOM 0 HH TYR A 82 6.603 -0.108 -1.733 1.00 0.00 H new ATOM 1244 N HIS A 83 4.499 0.085 5.490 1.00 0.00 N ATOM 1245 CA HIS A 83 5.805 0.459 6.009 1.00 0.00 C ATOM 1246 C HIS A 83 6.745 -0.730 5.901 1.00 0.00 C ATOM 1247 O HIS A 83 6.350 -1.864 6.181 1.00 0.00 O ATOM 1248 CB HIS A 83 5.746 0.879 7.489 1.00 0.00 C ATOM 1249 CG HIS A 83 4.812 2.005 7.822 1.00 0.00 C ATOM 1250 ND1 HIS A 83 4.931 3.277 7.309 1.00 0.00 N ATOM 1251 CD2 HIS A 83 3.764 2.046 8.678 1.00 0.00 C ATOM 1252 CE1 HIS A 83 4.002 4.051 7.841 1.00 0.00 C ATOM 1253 NE2 HIS A 83 3.277 3.329 8.676 1.00 0.00 N ATOM 0 H HIS A 83 4.046 -0.674 5.999 1.00 0.00 H new ATOM 0 HA HIS A 83 6.156 1.306 5.420 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.459 0.010 8.081 1.00 0.00 H new ATOM 0 HB3 HIS A 83 6.750 1.162 7.805 1.00 0.00 H new ATOM 0 HD2 HIS A 83 3.381 1.219 9.257 1.00 0.00 H new ATOM 0 HE1 HIS A 83 3.859 5.100 7.628 1.00 0.00 H new ATOM 0 HE2 HIS A 83 2.488 3.668 9.227 1.00 0.00 H new ATOM 1262 N SER A 84 7.980 -0.474 5.519 1.00 0.00 N ATOM 1263 CA SER A 84 8.988 -1.517 5.488 1.00 0.00 C ATOM 1264 C SER A 84 9.948 -1.319 6.652 1.00 0.00 C ATOM 1265 O SER A 84 10.496 -0.231 6.834 1.00 0.00 O ATOM 1266 CB SER A 84 9.740 -1.482 4.155 1.00 0.00 C ATOM 1267 OG SER A 84 8.835 -1.529 3.062 1.00 0.00 O ATOM 0 H SER A 84 8.310 0.445 5.226 1.00 0.00 H new ATOM 0 HA SER A 84 8.510 -2.492 5.582 1.00 0.00 H new ATOM 0 HB2 SER A 84 10.341 -0.575 4.096 1.00 0.00 H new ATOM 0 HB3 SER A 84 10.429 -2.325 4.099 1.00 0.00 H new ATOM 0 HG SER A 84 9.038 -0.801 2.438 1.00 0.00 H new ATOM 1273 N HIS A 85 10.128 -2.354 7.460 1.00 0.00 N ATOM 1274 CA HIS A 85 11.014 -2.261 8.612 1.00 0.00 C ATOM 1275 C HIS A 85 12.062 -3.367 8.575 1.00 0.00 C ATOM 1276 O HIS A 85 11.772 -4.498 8.185 1.00 0.00 O ATOM 1277 CB HIS A 85 10.218 -2.329 9.925 1.00 0.00 C ATOM 1278 CG HIS A 85 9.388 -1.106 10.206 1.00 0.00 C ATOM 1279 ND1 HIS A 85 8.183 -1.145 10.884 1.00 0.00 N ATOM 1280 CD2 HIS A 85 9.602 0.200 9.908 1.00 0.00 C ATOM 1281 CE1 HIS A 85 7.700 0.081 10.991 1.00 0.00 C ATOM 1282 NE2 HIS A 85 8.538 0.913 10.407 1.00 0.00 N ATOM 0 H HIS A 85 9.677 -3.261 7.341 1.00 0.00 H new ATOM 0 HA HIS A 85 11.521 -1.297 8.567 1.00 0.00 H new ATOM 0 HB2 HIS A 85 9.563 -3.200 9.895 1.00 0.00 H new ATOM 0 HB3 HIS A 85 10.913 -2.481 10.751 1.00 0.00 H new ATOM 0 HD2 HIS A 85 10.451 0.605 9.377 1.00 0.00 H new ATOM 0 HE1 HIS A 85 6.774 0.354 11.476 1.00 0.00 H new ATOM 0 HE2 HIS A 85 8.417 1.923 10.336 1.00 0.00 H new ATOM 1291 N PRO A 86 13.296 -3.046 8.985 1.00 0.00 N ATOM 1292 CA PRO A 86 14.406 -3.987 9.001 1.00 0.00 C ATOM 1293 C PRO A 86 14.549 -4.718 10.333 1.00 0.00 C ATOM 1294 O PRO A 86 14.560 -4.090 11.396 1.00 0.00 O ATOM 1295 CB PRO A 86 15.628 -3.087 8.761 1.00 0.00 C ATOM 1296 CG PRO A 86 15.147 -1.669 8.897 1.00 0.00 C ATOM 1297 CD PRO A 86 13.741 -1.725 9.422 1.00 0.00 C ATOM 0 HA PRO A 86 14.274 -4.777 8.261 1.00 0.00 H new ATOM 0 HB2 PRO A 86 16.415 -3.301 9.484 1.00 0.00 H new ATOM 0 HB3 PRO A 86 16.049 -3.261 7.771 1.00 0.00 H new ATOM 0 HG2 PRO A 86 15.789 -1.108 9.576 1.00 0.00 H new ATOM 0 HG3 PRO A 86 15.178 -1.158 7.935 1.00 0.00 H new ATOM 0 HD2 PRO A 86 13.708 -1.623 10.507 1.00 0.00 H new ATOM 0 HD3 PRO A 86 13.121 -0.930 9.008 1.00 0.00 H new ATOM 1305 N ASP A 87 14.645 -6.047 10.254 1.00 0.00 N ATOM 1306 CA ASP A 87 14.934 -6.903 11.414 1.00 0.00 C ATOM 1307 C ASP A 87 13.962 -6.649 12.564 1.00 0.00 C ATOM 1308 O ASP A 87 14.306 -6.007 13.553 1.00 0.00 O ATOM 1309 CB ASP A 87 16.384 -6.698 11.880 1.00 0.00 C ATOM 1310 CG ASP A 87 16.804 -7.667 12.970 1.00 0.00 C ATOM 1311 OD1 ASP A 87 17.186 -8.810 12.637 1.00 0.00 O ATOM 1312 OD2 ASP A 87 16.782 -7.288 14.158 1.00 0.00 O ATOM 0 H ASP A 87 14.525 -6.564 9.383 1.00 0.00 H new ATOM 0 HA ASP A 87 14.804 -7.939 11.100 1.00 0.00 H new ATOM 0 HB2 ASP A 87 17.052 -6.810 11.026 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.501 -5.678 12.245 1.00 0.00 H new ATOM 1317 N HIS A 88 12.734 -7.124 12.410 1.00 0.00 N ATOM 1318 CA HIS A 88 11.704 -6.963 13.432 1.00 0.00 C ATOM 1319 C HIS A 88 10.665 -8.073 13.302 1.00 0.00 C ATOM 1320 O HIS A 88 10.595 -8.731 12.272 1.00 0.00 O ATOM 1321 CB HIS A 88 11.032 -5.582 13.318 1.00 0.00 C ATOM 1322 CG HIS A 88 11.756 -4.491 14.053 1.00 0.00 C ATOM 1323 ND1 HIS A 88 12.627 -3.616 13.443 1.00 0.00 N ATOM 1324 CD2 HIS A 88 11.725 -4.134 15.360 1.00 0.00 C ATOM 1325 CE1 HIS A 88 13.098 -2.772 14.342 1.00 0.00 C ATOM 1326 NE2 HIS A 88 12.568 -3.063 15.512 1.00 0.00 N ATOM 0 H HIS A 88 12.423 -7.629 11.580 1.00 0.00 H new ATOM 0 HA HIS A 88 12.174 -7.030 14.413 1.00 0.00 H new ATOM 0 HB2 HIS A 88 10.958 -5.310 12.265 1.00 0.00 H new ATOM 0 HB3 HIS A 88 10.014 -5.651 13.701 1.00 0.00 H new ATOM 0 HD1 HIS A 88 12.870 -3.620 12.452 1.00 0.00 H new ATOM 0 HD2 HIS A 88 11.144 -4.606 16.138 1.00 0.00 H new ATOM 0 HE1 HIS A 88 13.801 -1.975 14.150 1.00 0.00 H new ATOM 1335 N PRO A 89 9.843 -8.298 14.340 1.00 0.00 N ATOM 1336 CA PRO A 89 8.803 -9.344 14.337 1.00 0.00 C ATOM 1337 C PRO A 89 7.632 -9.024 13.403 1.00 0.00 C ATOM 1338 O PRO A 89 6.628 -9.737 13.397 1.00 0.00 O ATOM 1339 CB PRO A 89 8.314 -9.379 15.791 1.00 0.00 C ATOM 1340 CG PRO A 89 9.319 -8.600 16.573 1.00 0.00 C ATOM 1341 CD PRO A 89 9.873 -7.583 15.624 1.00 0.00 C ATOM 0 HA PRO A 89 9.203 -10.292 13.977 1.00 0.00 H new ATOM 0 HB2 PRO A 89 7.321 -8.939 15.881 1.00 0.00 H new ATOM 0 HB3 PRO A 89 8.243 -10.404 16.156 1.00 0.00 H new ATOM 0 HG2 PRO A 89 8.857 -8.120 17.435 1.00 0.00 H new ATOM 0 HG3 PRO A 89 10.107 -9.249 16.954 1.00 0.00 H new ATOM 0 HD2 PRO A 89 9.266 -6.678 15.599 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.884 -7.281 15.897 1.00 0.00 H new ATOM 1349 N ALA A 90 7.775 -7.946 12.631 1.00 0.00 N ATOM 1350 CA ALA A 90 6.720 -7.448 11.753 1.00 0.00 C ATOM 1351 C ALA A 90 5.550 -6.917 12.576 1.00 0.00 C ATOM 1352 O ALA A 90 4.538 -7.585 12.768 1.00 0.00 O ATOM 1353 CB ALA A 90 6.273 -8.511 10.751 1.00 0.00 C ATOM 0 H ALA A 90 8.631 -7.392 12.598 1.00 0.00 H new ATOM 0 HA ALA A 90 7.125 -6.620 11.171 1.00 0.00 H new ATOM 0 HB1 ALA A 90 5.487 -8.104 10.115 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.121 -8.809 10.134 1.00 0.00 H new ATOM 0 HB3 ALA A 90 5.892 -9.380 11.288 1.00 0.00 H new ATOM 1359 N ARG A 91 5.735 -5.712 13.093 1.00 0.00 N ATOM 1360 CA ARG A 91 4.744 -5.041 13.916 1.00 0.00 C ATOM 1361 C ARG A 91 5.092 -3.559 13.986 1.00 0.00 C ATOM 1362 O ARG A 91 6.221 -3.179 13.657 1.00 0.00 O ATOM 1363 CB ARG A 91 4.695 -5.655 15.325 1.00 0.00 C ATOM 1364 CG ARG A 91 6.064 -5.908 15.926 1.00 0.00 C ATOM 1365 CD ARG A 91 5.975 -6.284 17.394 1.00 0.00 C ATOM 1366 NE ARG A 91 5.909 -5.105 18.257 1.00 0.00 N ATOM 1367 CZ ARG A 91 5.158 -5.018 19.353 1.00 0.00 C ATOM 1368 NH1 ARG A 91 4.296 -5.978 19.665 1.00 0.00 N ATOM 1369 NH2 ARG A 91 5.255 -3.951 20.128 1.00 0.00 N ATOM 0 H ARG A 91 6.586 -5.168 12.951 1.00 0.00 H new ATOM 0 HA ARG A 91 3.757 -5.166 13.472 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.136 -4.989 15.983 1.00 0.00 H new ATOM 0 HB3 ARG A 91 4.146 -6.596 15.283 1.00 0.00 H new ATOM 0 HG2 ARG A 91 6.560 -6.707 15.376 1.00 0.00 H new ATOM 0 HG3 ARG A 91 6.680 -5.015 15.816 1.00 0.00 H new ATOM 0 HD2 ARG A 91 5.093 -6.903 17.557 1.00 0.00 H new ATOM 0 HD3 ARG A 91 6.842 -6.886 17.668 1.00 0.00 H new ATOM 0 HE ARG A 91 6.476 -4.296 18.002 1.00 0.00 H new ATOM 0 HH11 ARG A 91 4.203 -6.795 19.062 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.727 -5.898 20.508 1.00 0.00 H new ATOM 0 HH21 ARG A 91 5.902 -3.201 19.885 1.00 0.00 H new ATOM 0 HH22 ARG A 91 4.683 -3.878 20.969 1.00 0.00 H new ATOM 1383 N PRO A 92 4.139 -2.702 14.381 1.00 0.00 N ATOM 1384 CA PRO A 92 4.367 -1.259 14.476 1.00 0.00 C ATOM 1385 C PRO A 92 5.342 -0.892 15.589 1.00 0.00 C ATOM 1386 O PRO A 92 5.435 -1.580 16.608 1.00 0.00 O ATOM 1387 CB PRO A 92 2.978 -0.681 14.786 1.00 0.00 C ATOM 1388 CG PRO A 92 2.014 -1.785 14.503 1.00 0.00 C ATOM 1389 CD PRO A 92 2.763 -3.059 14.749 1.00 0.00 C ATOM 0 HA PRO A 92 4.811 -0.870 13.560 1.00 0.00 H new ATOM 0 HB2 PRO A 92 2.910 -0.358 15.825 1.00 0.00 H new ATOM 0 HB3 PRO A 92 2.769 0.191 14.167 1.00 0.00 H new ATOM 0 HG2 PRO A 92 1.140 -1.715 15.150 1.00 0.00 H new ATOM 0 HG3 PRO A 92 1.655 -1.736 13.475 1.00 0.00 H new ATOM 0 HD2 PRO A 92 2.692 -3.376 15.789 1.00 0.00 H new ATOM 0 HD3 PRO A 92 2.380 -3.878 14.139 1.00 0.00 H new ATOM 1397 N SER A 93 6.077 0.185 15.379 1.00 0.00 N ATOM 1398 CA SER A 93 6.949 0.728 16.405 1.00 0.00 C ATOM 1399 C SER A 93 6.208 1.822 17.165 1.00 0.00 C ATOM 1400 O SER A 93 5.193 2.326 16.684 1.00 0.00 O ATOM 1401 CB SER A 93 8.233 1.270 15.775 1.00 0.00 C ATOM 1402 OG SER A 93 8.952 0.235 15.123 1.00 0.00 O ATOM 0 H SER A 93 6.087 0.704 14.501 1.00 0.00 H new ATOM 0 HA SER A 93 7.228 -0.060 17.105 1.00 0.00 H new ATOM 0 HB2 SER A 93 7.989 2.055 15.060 1.00 0.00 H new ATOM 0 HB3 SER A 93 8.858 1.723 16.545 1.00 0.00 H new ATOM 0 HG SER A 93 9.768 0.604 14.726 1.00 0.00 H new ATOM 1408 N ALA A 94 6.705 2.185 18.341 1.00 0.00 N ATOM 1409 CA ALA A 94 6.015 3.139 19.208 1.00 0.00 C ATOM 1410 C ALA A 94 5.730 4.460 18.497 1.00 0.00 C ATOM 1411 O ALA A 94 4.604 4.947 18.521 1.00 0.00 O ATOM 1412 CB ALA A 94 6.825 3.377 20.472 1.00 0.00 C ATOM 0 H ALA A 94 7.585 1.834 18.719 1.00 0.00 H new ATOM 0 HA ALA A 94 5.052 2.704 19.475 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.302 4.089 21.111 1.00 0.00 H new ATOM 0 HB2 ALA A 94 6.951 2.435 21.006 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.803 3.778 20.207 1.00 0.00 H new ATOM 1418 N THR A 95 6.733 5.014 17.833 1.00 0.00 N ATOM 1419 CA THR A 95 6.580 6.293 17.156 1.00 0.00 C ATOM 1420 C THR A 95 5.902 6.120 15.798 1.00 0.00 C ATOM 1421 O THR A 95 5.170 6.999 15.346 1.00 0.00 O ATOM 1422 CB THR A 95 7.939 7.007 17.019 1.00 0.00 C ATOM 1423 OG1 THR A 95 8.467 7.253 18.328 1.00 0.00 O ATOM 1424 CG2 THR A 95 7.806 8.328 16.272 1.00 0.00 C ATOM 0 H THR A 95 7.661 4.599 17.748 1.00 0.00 H new ATOM 0 HA THR A 95 5.933 6.923 17.767 1.00 0.00 H new ATOM 0 HB THR A 95 8.609 6.365 16.448 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.745 7.548 18.922 1.00 0.00 H new ATOM 0 HG21 THR A 95 8.784 8.803 16.195 1.00 0.00 H new ATOM 0 HG22 THR A 95 7.413 8.143 15.272 1.00 0.00 H new ATOM 0 HG23 THR A 95 7.126 8.985 16.813 1.00 0.00 H new ATOM 1432 N ASP A 96 6.130 4.978 15.156 1.00 0.00 N ATOM 1433 CA ASP A 96 5.438 4.655 13.906 1.00 0.00 C ATOM 1434 C ASP A 96 3.931 4.617 14.163 1.00 0.00 C ATOM 1435 O ASP A 96 3.127 5.015 13.321 1.00 0.00 O ATOM 1436 CB ASP A 96 5.929 3.311 13.358 1.00 0.00 C ATOM 1437 CG ASP A 96 5.360 2.972 11.988 1.00 0.00 C ATOM 1438 OD1 ASP A 96 5.658 3.705 11.020 1.00 0.00 O ATOM 1439 OD2 ASP A 96 4.641 1.959 11.871 1.00 0.00 O ATOM 0 H ASP A 96 6.784 4.263 15.476 1.00 0.00 H new ATOM 0 HA ASP A 96 5.654 5.420 13.161 1.00 0.00 H new ATOM 0 HB2 ASP A 96 7.017 3.328 13.297 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.661 2.521 14.060 1.00 0.00 H new ATOM 1444 N LEU A 97 3.574 4.150 15.356 1.00 0.00 N ATOM 1445 CA LEU A 97 2.194 4.160 15.829 1.00 0.00 C ATOM 1446 C LEU A 97 1.739 5.594 16.101 1.00 0.00 C ATOM 1447 O LEU A 97 0.641 5.991 15.709 1.00 0.00 O ATOM 1448 CB LEU A 97 2.086 3.294 17.101 1.00 0.00 C ATOM 1449 CG LEU A 97 0.675 3.034 17.648 1.00 0.00 C ATOM 1450 CD1 LEU A 97 0.680 1.794 18.529 1.00 0.00 C ATOM 1451 CD2 LEU A 97 0.161 4.227 18.447 1.00 0.00 C ATOM 0 H LEU A 97 4.236 3.753 16.023 1.00 0.00 H new ATOM 0 HA LEU A 97 1.541 3.742 15.063 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.553 2.331 16.896 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.672 3.771 17.887 1.00 0.00 H new ATOM 0 HG LEU A 97 0.010 2.879 16.799 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.325 1.616 18.913 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.002 0.933 17.943 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.366 1.943 19.363 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.840 4.011 18.820 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.829 4.417 19.287 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.127 5.107 17.805 1.00 0.00 H new ATOM 1463 N GLU A 98 2.592 6.367 16.768 1.00 0.00 N ATOM 1464 CA GLU A 98 2.268 7.751 17.120 1.00 0.00 C ATOM 1465 C GLU A 98 1.946 8.586 15.883 1.00 0.00 C ATOM 1466 O GLU A 98 1.016 9.391 15.892 1.00 0.00 O ATOM 1467 CB GLU A 98 3.430 8.401 17.874 1.00 0.00 C ATOM 1468 CG GLU A 98 3.758 7.736 19.201 1.00 0.00 C ATOM 1469 CD GLU A 98 4.906 8.411 19.918 1.00 0.00 C ATOM 1470 OE1 GLU A 98 6.079 8.055 19.657 1.00 0.00 O ATOM 1471 OE2 GLU A 98 4.646 9.303 20.750 1.00 0.00 O ATOM 0 H GLU A 98 3.514 6.060 17.077 1.00 0.00 H new ATOM 0 HA GLU A 98 1.386 7.721 17.759 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.317 8.381 17.241 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.191 9.449 18.054 1.00 0.00 H new ATOM 0 HG2 GLU A 98 2.875 7.752 19.840 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.007 6.689 19.028 1.00 0.00 H new ATOM 1478 N GLU A 99 2.696 8.376 14.813 1.00 0.00 N ATOM 1479 CA GLU A 99 2.526 9.165 13.601 1.00 0.00 C ATOM 1480 C GLU A 99 1.246 8.791 12.860 1.00 0.00 C ATOM 1481 O GLU A 99 0.793 9.518 11.973 1.00 0.00 O ATOM 1482 CB GLU A 99 3.745 9.011 12.695 1.00 0.00 C ATOM 1483 CG GLU A 99 5.018 9.568 13.313 1.00 0.00 C ATOM 1484 CD GLU A 99 4.930 11.060 13.588 1.00 0.00 C ATOM 1485 OE1 GLU A 99 4.248 11.464 14.557 1.00 0.00 O ATOM 1486 OE2 GLU A 99 5.542 11.841 12.827 1.00 0.00 O ATOM 0 H GLU A 99 3.428 7.667 14.758 1.00 0.00 H new ATOM 0 HA GLU A 99 2.436 10.212 13.892 1.00 0.00 H new ATOM 0 HB2 GLU A 99 3.890 7.955 12.467 1.00 0.00 H new ATOM 0 HB3 GLU A 99 3.554 9.518 11.749 1.00 0.00 H new ATOM 0 HG2 GLU A 99 5.225 9.042 14.245 1.00 0.00 H new ATOM 0 HG3 GLU A 99 5.857 9.374 12.644 1.00 0.00 H new ATOM 1493 N ALA A 100 0.651 7.667 13.233 1.00 0.00 N ATOM 1494 CA ALA A 100 -0.630 7.273 12.675 1.00 0.00 C ATOM 1495 C ALA A 100 -1.748 8.066 13.341 1.00 0.00 C ATOM 1496 O ALA A 100 -2.313 7.653 14.353 1.00 0.00 O ATOM 1497 CB ALA A 100 -0.851 5.776 12.829 1.00 0.00 C ATOM 0 H ALA A 100 1.035 7.015 13.917 1.00 0.00 H new ATOM 0 HA ALA A 100 -0.634 7.496 11.608 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -1.817 5.505 12.403 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -0.061 5.236 12.308 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.834 5.513 13.887 1.00 0.00 H new ATOM 1503 N THR A 101 -2.022 9.238 12.794 1.00 0.00 N ATOM 1504 CA THR A 101 -3.060 10.107 13.327 1.00 0.00 C ATOM 1505 C THR A 101 -4.208 10.245 12.323 1.00 0.00 C ATOM 1506 O THR A 101 -5.141 11.024 12.519 1.00 0.00 O ATOM 1507 CB THR A 101 -2.474 11.496 13.664 1.00 0.00 C ATOM 1508 OG1 THR A 101 -1.213 11.338 14.331 1.00 0.00 O ATOM 1509 CG2 THR A 101 -3.410 12.297 14.562 1.00 0.00 C ATOM 0 H THR A 101 -1.538 9.612 11.977 1.00 0.00 H new ATOM 0 HA THR A 101 -3.450 9.661 14.242 1.00 0.00 H new ATOM 0 HB THR A 101 -2.345 12.038 12.727 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.842 12.220 14.543 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.964 13.268 14.778 1.00 0.00 H new ATOM 0 HG22 THR A 101 -4.365 12.440 14.057 1.00 0.00 H new ATOM 0 HG23 THR A 101 -3.571 11.756 15.495 1.00 0.00 H new ATOM 1517 N PHE A 102 -4.142 9.459 11.257 1.00 0.00 N ATOM 1518 CA PHE A 102 -5.140 9.522 10.196 1.00 0.00 C ATOM 1519 C PHE A 102 -5.775 8.150 9.945 1.00 0.00 C ATOM 1520 O PHE A 102 -5.309 7.372 9.112 1.00 0.00 O ATOM 1521 CB PHE A 102 -4.535 10.108 8.905 1.00 0.00 C ATOM 1522 CG PHE A 102 -3.221 9.493 8.475 1.00 0.00 C ATOM 1523 CD1 PHE A 102 -2.036 9.833 9.115 1.00 0.00 C ATOM 1524 CD2 PHE A 102 -3.169 8.592 7.421 1.00 0.00 C ATOM 1525 CE1 PHE A 102 -0.832 9.281 8.717 1.00 0.00 C ATOM 1526 CE2 PHE A 102 -1.968 8.036 7.021 1.00 0.00 C ATOM 1527 CZ PHE A 102 -0.799 8.383 7.667 1.00 0.00 C ATOM 0 H PHE A 102 -3.407 8.769 11.103 1.00 0.00 H new ATOM 0 HA PHE A 102 -5.935 10.192 10.524 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.256 9.987 8.097 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -4.389 11.179 9.044 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -2.055 10.537 9.934 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -4.079 8.321 6.906 1.00 0.00 H new ATOM 0 HE1 PHE A 102 0.081 9.551 9.226 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -1.945 7.331 6.204 1.00 0.00 H new ATOM 0 HZ PHE A 102 0.141 7.953 7.352 1.00 0.00 H new ATOM 1537 N PRO A 103 -6.833 7.817 10.707 1.00 0.00 N ATOM 1538 CA PRO A 103 -7.556 6.551 10.555 1.00 0.00 C ATOM 1539 C PRO A 103 -8.309 6.473 9.230 1.00 0.00 C ATOM 1540 O PRO A 103 -8.577 7.493 8.594 1.00 0.00 O ATOM 1541 CB PRO A 103 -8.546 6.543 11.732 1.00 0.00 C ATOM 1542 CG PRO A 103 -8.086 7.628 12.648 1.00 0.00 C ATOM 1543 CD PRO A 103 -7.406 8.643 11.776 1.00 0.00 C ATOM 0 HA PRO A 103 -6.876 5.699 10.554 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -9.565 6.725 11.389 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -8.547 5.577 12.237 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -8.927 8.072 13.181 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -7.401 7.239 13.401 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -8.110 9.379 11.386 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.637 9.193 12.319 1.00 0.00 H new ATOM 1551 N GLY A 104 -8.652 5.260 8.820 1.00 0.00 N ATOM 1552 CA GLY A 104 -9.339 5.071 7.556 1.00 0.00 C ATOM 1553 C GLY A 104 -8.474 4.340 6.556 1.00 0.00 C ATOM 1554 O GLY A 104 -8.950 3.885 5.515 1.00 0.00 O ATOM 0 H GLY A 104 -8.467 4.402 9.340 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -10.258 4.509 7.722 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -9.626 6.040 7.149 1.00 0.00 H new ATOM 1558 N PHE A 105 -7.194 4.237 6.879 1.00 0.00 N ATOM 1559 CA PHE A 105 -6.236 3.539 6.040 1.00 0.00 C ATOM 1560 C PHE A 105 -5.841 2.214 6.680 1.00 0.00 C ATOM 1561 O PHE A 105 -5.744 2.116 7.904 1.00 0.00 O ATOM 1562 CB PHE A 105 -4.983 4.397 5.833 1.00 0.00 C ATOM 1563 CG PHE A 105 -5.228 5.669 5.070 1.00 0.00 C ATOM 1564 CD1 PHE A 105 -5.765 6.784 5.696 1.00 0.00 C ATOM 1565 CD2 PHE A 105 -4.911 5.750 3.724 1.00 0.00 C ATOM 1566 CE1 PHE A 105 -5.985 7.953 4.992 1.00 0.00 C ATOM 1567 CE2 PHE A 105 -5.127 6.915 3.017 1.00 0.00 C ATOM 1568 CZ PHE A 105 -5.663 8.018 3.650 1.00 0.00 C ATOM 0 H PHE A 105 -6.792 4.634 7.728 1.00 0.00 H new ATOM 0 HA PHE A 105 -6.703 3.348 5.074 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -4.561 4.646 6.807 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -4.235 3.807 5.303 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -6.014 6.738 6.746 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.490 4.891 3.222 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.408 8.813 5.490 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -4.876 6.964 1.968 1.00 0.00 H new ATOM 0 HZ PHE A 105 -5.830 8.931 3.097 1.00 0.00 H new ATOM 1578 N THR A 106 -5.619 1.204 5.856 1.00 0.00 N ATOM 1579 CA THR A 106 -5.123 -0.072 6.339 1.00 0.00 C ATOM 1580 C THR A 106 -3.601 -0.073 6.282 1.00 0.00 C ATOM 1581 O THR A 106 -3.014 0.269 5.255 1.00 0.00 O ATOM 1582 CB THR A 106 -5.672 -1.239 5.496 1.00 0.00 C ATOM 1583 OG1 THR A 106 -7.088 -1.095 5.333 1.00 0.00 O ATOM 1584 CG2 THR A 106 -5.370 -2.575 6.157 1.00 0.00 C ATOM 0 H THR A 106 -5.775 1.244 4.849 1.00 0.00 H new ATOM 0 HA THR A 106 -5.461 -0.207 7.367 1.00 0.00 H new ATOM 0 HB THR A 106 -5.185 -1.216 4.521 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.456 -1.912 4.936 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.768 -3.383 5.543 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.291 -2.694 6.260 1.00 0.00 H new ATOM 0 HG23 THR A 106 -5.834 -2.606 7.143 1.00 0.00 H new ATOM 1592 N TYR A 107 -2.962 -0.436 7.382 1.00 0.00 N ATOM 1593 CA TYR A 107 -1.514 -0.367 7.463 1.00 0.00 C ATOM 1594 C TYR A 107 -0.892 -1.751 7.348 1.00 0.00 C ATOM 1595 O TYR A 107 -1.131 -2.623 8.182 1.00 0.00 O ATOM 1596 CB TYR A 107 -1.082 0.294 8.772 1.00 0.00 C ATOM 1597 CG TYR A 107 -1.566 1.719 8.920 1.00 0.00 C ATOM 1598 CD1 TYR A 107 -0.876 2.773 8.333 1.00 0.00 C ATOM 1599 CD2 TYR A 107 -2.712 2.011 9.649 1.00 0.00 C ATOM 1600 CE1 TYR A 107 -1.313 4.077 8.474 1.00 0.00 C ATOM 1601 CE2 TYR A 107 -3.153 3.312 9.793 1.00 0.00 C ATOM 1602 CZ TYR A 107 -2.453 4.340 9.202 1.00 0.00 C ATOM 1603 OH TYR A 107 -2.894 5.636 9.342 1.00 0.00 O ATOM 0 H TYR A 107 -3.420 -0.779 8.226 1.00 0.00 H new ATOM 0 HA TYR A 107 -1.161 0.238 6.627 1.00 0.00 H new ATOM 0 HB2 TYR A 107 -1.456 -0.297 9.608 1.00 0.00 H new ATOM 0 HB3 TYR A 107 0.006 0.281 8.834 1.00 0.00 H new ATOM 0 HD1 TYR A 107 0.015 2.570 7.758 1.00 0.00 H new ATOM 0 HD2 TYR A 107 -3.267 1.208 10.111 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -0.763 4.886 8.016 1.00 0.00 H new ATOM 0 HE2 TYR A 107 -4.043 3.522 10.367 1.00 0.00 H new ATOM 0 HH TYR A 107 -2.556 6.179 8.599 1.00 0.00 H new ATOM 1613 N VAL A 108 -0.104 -1.950 6.306 1.00 0.00 N ATOM 1614 CA VAL A 108 0.613 -3.199 6.117 1.00 0.00 C ATOM 1615 C VAL A 108 2.091 -3.000 6.424 1.00 0.00 C ATOM 1616 O VAL A 108 2.729 -2.094 5.889 1.00 0.00 O ATOM 1617 CB VAL A 108 0.446 -3.747 4.683 1.00 0.00 C ATOM 1618 CG1 VAL A 108 1.252 -5.023 4.489 1.00 0.00 C ATOM 1619 CG2 VAL A 108 -1.023 -3.994 4.382 1.00 0.00 C ATOM 0 H VAL A 108 0.056 -1.258 5.574 1.00 0.00 H new ATOM 0 HA VAL A 108 0.188 -3.931 6.804 1.00 0.00 H new ATOM 0 HB VAL A 108 0.826 -3.000 3.986 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.117 -5.388 3.471 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.308 -4.816 4.663 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.910 -5.780 5.194 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.127 -4.380 3.368 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.422 -4.721 5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -1.575 -3.059 4.472 1.00 0.00 H new ATOM 1629 N ILE A 109 2.624 -3.822 7.308 1.00 0.00 N ATOM 1630 CA ILE A 109 4.019 -3.721 7.690 1.00 0.00 C ATOM 1631 C ILE A 109 4.775 -4.980 7.281 1.00 0.00 C ATOM 1632 O ILE A 109 4.375 -6.100 7.617 1.00 0.00 O ATOM 1633 CB ILE A 109 4.168 -3.481 9.207 1.00 0.00 C ATOM 1634 CG1 ILE A 109 3.429 -2.198 9.599 1.00 0.00 C ATOM 1635 CG2 ILE A 109 5.639 -3.402 9.599 1.00 0.00 C ATOM 1636 CD1 ILE A 109 3.497 -1.876 11.073 1.00 0.00 C ATOM 0 H ILE A 109 2.110 -4.569 7.776 1.00 0.00 H new ATOM 0 HA ILE A 109 4.447 -2.865 7.168 1.00 0.00 H new ATOM 0 HB ILE A 109 3.727 -4.320 9.744 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.847 -1.364 9.036 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.383 -2.289 9.305 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.721 -3.232 10.673 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.135 -4.337 9.341 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.114 -2.580 9.065 1.00 0.00 H new ATOM 0 HD11 ILE A 109 2.950 -0.954 11.270 1.00 0.00 H new ATOM 0 HD12 ILE A 109 3.052 -2.691 11.644 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.538 -1.751 11.370 1.00 0.00 H new ATOM 1648 N VAL A 110 5.856 -4.787 6.542 1.00 0.00 N ATOM 1649 CA VAL A 110 6.675 -5.895 6.088 1.00 0.00 C ATOM 1650 C VAL A 110 8.033 -5.872 6.773 1.00 0.00 C ATOM 1651 O VAL A 110 8.625 -4.808 6.981 1.00 0.00 O ATOM 1652 CB VAL A 110 6.851 -5.882 4.548 1.00 0.00 C ATOM 1653 CG1 VAL A 110 7.427 -4.558 4.071 1.00 0.00 C ATOM 1654 CG2 VAL A 110 7.724 -7.039 4.089 1.00 0.00 C ATOM 0 H VAL A 110 6.186 -3.869 6.244 1.00 0.00 H new ATOM 0 HA VAL A 110 6.158 -6.816 6.357 1.00 0.00 H new ATOM 0 HB VAL A 110 5.863 -6.001 4.103 1.00 0.00 H new ATOM 0 HG11 VAL A 110 7.539 -4.579 2.987 1.00 0.00 H new ATOM 0 HG12 VAL A 110 6.755 -3.747 4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 110 8.401 -4.397 4.533 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.831 -7.006 3.005 1.00 0.00 H new ATOM 0 HG22 VAL A 110 8.707 -6.960 4.553 1.00 0.00 H new ATOM 0 HG23 VAL A 110 7.261 -7.982 4.379 1.00 0.00 H new ATOM 1664 N SER A 111 8.499 -7.047 7.151 1.00 0.00 N ATOM 1665 CA SER A 111 9.800 -7.192 7.763 1.00 0.00 C ATOM 1666 C SER A 111 10.799 -7.685 6.727 1.00 0.00 C ATOM 1667 O SER A 111 10.717 -8.823 6.264 1.00 0.00 O ATOM 1668 CB SER A 111 9.713 -8.176 8.925 1.00 0.00 C ATOM 1669 OG SER A 111 10.948 -8.281 9.614 1.00 0.00 O ATOM 0 H SER A 111 7.987 -7.922 7.042 1.00 0.00 H new ATOM 0 HA SER A 111 10.134 -6.227 8.144 1.00 0.00 H new ATOM 0 HB2 SER A 111 8.936 -7.854 9.618 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.420 -9.157 8.551 1.00 0.00 H new ATOM 0 HG SER A 111 10.781 -8.329 10.579 1.00 0.00 H new ATOM 1675 N VAL A 112 11.716 -6.819 6.334 1.00 0.00 N ATOM 1676 CA VAL A 112 12.752 -7.195 5.390 1.00 0.00 C ATOM 1677 C VAL A 112 14.113 -7.027 6.043 1.00 0.00 C ATOM 1678 O VAL A 112 14.502 -5.921 6.414 1.00 0.00 O ATOM 1679 CB VAL A 112 12.695 -6.359 4.092 1.00 0.00 C ATOM 1680 CG1 VAL A 112 13.735 -6.849 3.094 1.00 0.00 C ATOM 1681 CG2 VAL A 112 11.302 -6.407 3.482 1.00 0.00 C ATOM 0 H VAL A 112 11.764 -5.852 6.654 1.00 0.00 H new ATOM 0 HA VAL A 112 12.586 -8.237 5.115 1.00 0.00 H new ATOM 0 HB VAL A 112 12.922 -5.323 4.343 1.00 0.00 H new ATOM 0 HG11 VAL A 112 13.680 -6.248 2.186 1.00 0.00 H new ATOM 0 HG12 VAL A 112 14.730 -6.757 3.530 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.541 -7.894 2.850 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.284 -5.812 2.569 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.043 -7.439 3.247 1.00 0.00 H new ATOM 0 HG23 VAL A 112 10.580 -6.004 4.192 1.00 0.00 H new ATOM 1691 N ARG A 113 14.827 -8.128 6.194 1.00 0.00 N ATOM 1692 CA ARG A 113 16.113 -8.111 6.864 1.00 0.00 C ATOM 1693 C ARG A 113 17.230 -8.210 5.837 1.00 0.00 C ATOM 1694 O ARG A 113 17.761 -9.292 5.585 1.00 0.00 O ATOM 1695 CB ARG A 113 16.196 -9.249 7.888 1.00 0.00 C ATOM 1696 CG ARG A 113 14.994 -9.308 8.822 1.00 0.00 C ATOM 1697 CD ARG A 113 15.183 -10.320 9.941 1.00 0.00 C ATOM 1698 NE ARG A 113 13.955 -10.506 10.714 1.00 0.00 N ATOM 1699 CZ ARG A 113 13.909 -10.619 12.043 1.00 0.00 C ATOM 1700 NH1 ARG A 113 15.003 -10.459 12.771 1.00 0.00 N ATOM 1701 NH2 ARG A 113 12.752 -10.866 12.638 1.00 0.00 N ATOM 0 H ARG A 113 14.536 -9.047 5.860 1.00 0.00 H new ATOM 0 HA ARG A 113 16.226 -7.170 7.403 1.00 0.00 H new ATOM 0 HB2 ARG A 113 16.284 -10.198 7.360 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.103 -9.129 8.481 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.822 -8.321 9.252 1.00 0.00 H new ATOM 0 HG3 ARG A 113 14.103 -9.565 8.249 1.00 0.00 H new ATOM 0 HD2 ARG A 113 15.496 -11.275 9.519 1.00 0.00 H new ATOM 0 HD3 ARG A 113 15.983 -9.986 10.602 1.00 0.00 H new ATOM 0 HE ARG A 113 13.074 -10.552 10.202 1.00 0.00 H new ATOM 0 HH11 ARG A 113 15.891 -10.247 12.317 1.00 0.00 H new ATOM 0 HH12 ARG A 113 14.958 -10.547 13.786 1.00 0.00 H new ATOM 0 HH21 ARG A 113 11.904 -10.969 12.081 1.00 0.00 H new ATOM 0 HH22 ARG A 113 12.709 -10.954 13.653 1.00 0.00 H new ATOM 1715 N ASP A 114 17.539 -7.063 5.235 1.00 0.00 N ATOM 1716 CA ASP A 114 18.535 -6.943 4.168 1.00 0.00 C ATOM 1717 C ASP A 114 18.303 -7.959 3.054 1.00 0.00 C ATOM 1718 O ASP A 114 18.931 -9.016 3.008 1.00 0.00 O ATOM 1719 CB ASP A 114 19.954 -7.068 4.726 1.00 0.00 C ATOM 1720 CG ASP A 114 21.018 -6.803 3.677 1.00 0.00 C ATOM 1721 OD1 ASP A 114 21.053 -5.680 3.137 1.00 0.00 O ATOM 1722 OD2 ASP A 114 21.825 -7.712 3.383 1.00 0.00 O ATOM 0 H ASP A 114 17.098 -6.176 5.478 1.00 0.00 H new ATOM 0 HA ASP A 114 18.421 -5.950 3.733 1.00 0.00 H new ATOM 0 HB2 ASP A 114 20.079 -6.367 5.551 1.00 0.00 H new ATOM 0 HB3 ASP A 114 20.093 -8.069 5.135 1.00 0.00 H new ATOM 1727 N GLY A 115 17.355 -7.651 2.180 1.00 0.00 N ATOM 1728 CA GLY A 115 17.085 -8.508 1.043 1.00 0.00 C ATOM 1729 C GLY A 115 16.220 -9.705 1.394 1.00 0.00 C ATOM 1730 O GLY A 115 15.670 -10.356 0.507 1.00 0.00 O ATOM 0 H GLY A 115 16.766 -6.820 2.238 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.591 -7.925 0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 115 18.030 -8.859 0.627 1.00 0.00 H new ATOM 1734 N ALA A 116 16.096 -9.994 2.684 1.00 0.00 N ATOM 1735 CA ALA A 116 15.323 -11.142 3.140 1.00 0.00 C ATOM 1736 C ALA A 116 13.944 -10.728 3.642 1.00 0.00 C ATOM 1737 O ALA A 116 13.815 -10.176 4.735 1.00 0.00 O ATOM 1738 CB ALA A 116 16.073 -11.887 4.234 1.00 0.00 C ATOM 0 H ALA A 116 16.522 -9.448 3.433 1.00 0.00 H new ATOM 0 HA ALA A 116 15.185 -11.804 2.285 1.00 0.00 H new ATOM 0 HB1 ALA A 116 15.482 -12.741 4.563 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.030 -12.236 3.846 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.245 -11.218 5.077 1.00 0.00 H new ATOM 1744 N PRO A 117 12.897 -10.970 2.837 1.00 0.00 N ATOM 1745 CA PRO A 117 11.513 -10.703 3.223 1.00 0.00 C ATOM 1746 C PRO A 117 10.991 -11.779 4.171 1.00 0.00 C ATOM 1747 O PRO A 117 10.813 -12.931 3.780 1.00 0.00 O ATOM 1748 CB PRO A 117 10.739 -10.735 1.892 1.00 0.00 C ATOM 1749 CG PRO A 117 11.772 -10.898 0.821 1.00 0.00 C ATOM 1750 CD PRO A 117 12.968 -11.519 1.481 1.00 0.00 C ATOM 0 HA PRO A 117 11.406 -9.756 3.752 1.00 0.00 H new ATOM 0 HB2 PRO A 117 10.025 -11.559 1.875 1.00 0.00 H new ATOM 0 HB3 PRO A 117 10.170 -9.817 1.749 1.00 0.00 H new ATOM 0 HG2 PRO A 117 11.400 -11.531 0.015 1.00 0.00 H new ATOM 0 HG3 PRO A 117 12.028 -9.936 0.378 1.00 0.00 H new ATOM 0 HD2 PRO A 117 12.914 -12.608 1.480 1.00 0.00 H new ATOM 0 HD3 PRO A 117 13.897 -11.246 0.980 1.00 0.00 H new ATOM 1758 N GLU A 118 10.762 -11.394 5.413 1.00 0.00 N ATOM 1759 CA GLU A 118 10.374 -12.335 6.449 1.00 0.00 C ATOM 1760 C GLU A 118 8.876 -12.609 6.417 1.00 0.00 C ATOM 1761 O GLU A 118 8.444 -13.714 6.087 1.00 0.00 O ATOM 1762 CB GLU A 118 10.780 -11.781 7.811 1.00 0.00 C ATOM 1763 CG GLU A 118 10.414 -12.675 8.977 1.00 0.00 C ATOM 1764 CD GLU A 118 10.965 -12.161 10.287 1.00 0.00 C ATOM 1765 OE1 GLU A 118 11.188 -10.937 10.403 1.00 0.00 O ATOM 1766 OE2 GLU A 118 11.199 -12.982 11.198 1.00 0.00 O ATOM 0 H GLU A 118 10.839 -10.428 5.731 1.00 0.00 H new ATOM 0 HA GLU A 118 10.886 -13.280 6.269 1.00 0.00 H new ATOM 0 HB2 GLU A 118 11.857 -11.616 7.818 1.00 0.00 H new ATOM 0 HB3 GLU A 118 10.308 -10.808 7.951 1.00 0.00 H new ATOM 0 HG2 GLU A 118 9.329 -12.752 9.047 1.00 0.00 H new ATOM 0 HG3 GLU A 118 10.794 -13.680 8.795 1.00 0.00 H new ATOM 1773 N ALA A 119 8.087 -11.602 6.755 1.00 0.00 N ATOM 1774 CA ALA A 119 6.646 -11.774 6.841 1.00 0.00 C ATOM 1775 C ALA A 119 5.905 -10.489 6.498 1.00 0.00 C ATOM 1776 O ALA A 119 6.462 -9.390 6.578 1.00 0.00 O ATOM 1777 CB ALA A 119 6.257 -12.247 8.235 1.00 0.00 C ATOM 0 H ALA A 119 8.418 -10.662 6.973 1.00 0.00 H new ATOM 0 HA ALA A 119 6.357 -12.529 6.110 1.00 0.00 H new ATOM 0 HB1 ALA A 119 5.176 -12.372 8.288 1.00 0.00 H new ATOM 0 HB2 ALA A 119 6.744 -13.200 8.445 1.00 0.00 H new ATOM 0 HB3 ALA A 119 6.573 -11.508 8.971 1.00 0.00 H new ATOM 1783 N LEU A 120 4.645 -10.649 6.115 1.00 0.00 N ATOM 1784 CA LEU A 120 3.759 -9.528 5.828 1.00 0.00 C ATOM 1785 C LEU A 120 2.653 -9.468 6.869 1.00 0.00 C ATOM 1786 O LEU A 120 1.907 -10.430 7.046 1.00 0.00 O ATOM 1787 CB LEU A 120 3.143 -9.682 4.436 1.00 0.00 C ATOM 1788 CG LEU A 120 4.084 -9.389 3.272 1.00 0.00 C ATOM 1789 CD1 LEU A 120 3.481 -9.884 1.966 1.00 0.00 C ATOM 1790 CD2 LEU A 120 4.363 -7.898 3.191 1.00 0.00 C ATOM 0 H LEU A 120 4.207 -11.562 5.994 1.00 0.00 H new ATOM 0 HA LEU A 120 4.339 -8.606 5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.770 -10.701 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.282 -9.018 4.362 1.00 0.00 H new ATOM 0 HG LEU A 120 5.024 -9.915 3.440 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.164 -9.668 1.145 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.315 -10.960 2.026 1.00 0.00 H new ATOM 0 HD13 LEU A 120 2.531 -9.380 1.790 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.036 -7.699 2.357 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.427 -7.360 3.039 1.00 0.00 H new ATOM 0 HD23 LEU A 120 4.827 -7.564 4.119 1.00 0.00 H new ATOM 1802 N THR A 121 2.545 -8.345 7.556 1.00 0.00 N ATOM 1803 CA THR A 121 1.528 -8.187 8.579 1.00 0.00 C ATOM 1804 C THR A 121 0.602 -7.029 8.246 1.00 0.00 C ATOM 1805 O THR A 121 1.059 -5.941 7.896 1.00 0.00 O ATOM 1806 CB THR A 121 2.153 -7.966 9.972 1.00 0.00 C ATOM 1807 OG1 THR A 121 3.078 -6.867 9.939 1.00 0.00 O ATOM 1808 CG2 THR A 121 2.863 -9.222 10.446 1.00 0.00 C ATOM 0 H THR A 121 3.147 -7.532 7.425 1.00 0.00 H new ATOM 0 HA THR A 121 0.951 -9.112 8.604 1.00 0.00 H new ATOM 0 HB THR A 121 1.349 -7.732 10.670 1.00 0.00 H new ATOM 0 HG1 THR A 121 3.475 -6.800 9.045 1.00 0.00 H new ATOM 0 HG21 THR A 121 3.297 -9.045 11.430 1.00 0.00 H new ATOM 0 HG22 THR A 121 2.149 -10.043 10.507 1.00 0.00 H new ATOM 0 HG23 THR A 121 3.654 -9.481 9.742 1.00 0.00 H new ATOM 1816 N ALA A 122 -0.695 -7.273 8.331 1.00 0.00 N ATOM 1817 CA ALA A 122 -1.676 -6.237 8.076 1.00 0.00 C ATOM 1818 C ALA A 122 -2.358 -5.845 9.371 1.00 0.00 C ATOM 1819 O ALA A 122 -2.767 -6.702 10.159 1.00 0.00 O ATOM 1820 CB ALA A 122 -2.697 -6.698 7.046 1.00 0.00 C ATOM 0 H ALA A 122 -1.091 -8.181 8.575 1.00 0.00 H new ATOM 0 HA ALA A 122 -1.165 -5.364 7.669 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.422 -5.903 6.872 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.189 -6.937 6.112 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.212 -7.585 7.416 1.00 0.00 H new ATOM 1826 N TRP A 123 -2.465 -4.548 9.588 1.00 0.00 N ATOM 1827 CA TRP A 123 -2.964 -4.024 10.840 1.00 0.00 C ATOM 1828 C TRP A 123 -4.107 -3.055 10.607 1.00 0.00 C ATOM 1829 O TRP A 123 -4.068 -2.231 9.690 1.00 0.00 O ATOM 1830 CB TRP A 123 -1.835 -3.317 11.590 1.00 0.00 C ATOM 1831 CG TRP A 123 -0.655 -4.199 11.854 1.00 0.00 C ATOM 1832 CD1 TRP A 123 0.402 -4.430 11.019 1.00 0.00 C ATOM 1833 CD2 TRP A 123 -0.422 -4.979 13.027 1.00 0.00 C ATOM 1834 NE1 TRP A 123 1.286 -5.299 11.612 1.00 0.00 N ATOM 1835 CE2 TRP A 123 0.802 -5.648 12.847 1.00 0.00 C ATOM 1836 CE3 TRP A 123 -1.128 -5.169 14.216 1.00 0.00 C ATOM 1837 CZ2 TRP A 123 1.333 -6.497 13.812 1.00 0.00 C ATOM 1838 CZ3 TRP A 123 -0.603 -6.011 15.174 1.00 0.00 C ATOM 1839 CH2 TRP A 123 0.620 -6.666 14.968 1.00 0.00 C ATOM 0 H TRP A 123 -2.210 -3.834 8.905 1.00 0.00 H new ATOM 0 HA TRP A 123 -3.336 -4.857 11.436 1.00 0.00 H new ATOM 0 HB2 TRP A 123 -1.511 -2.452 11.012 1.00 0.00 H new ATOM 0 HB3 TRP A 123 -2.218 -2.941 12.539 1.00 0.00 H new ATOM 0 HD1 TRP A 123 0.524 -3.994 10.038 1.00 0.00 H new ATOM 0 HE1 TRP A 123 2.159 -5.630 11.201 1.00 0.00 H new ATOM 0 HE3 TRP A 123 -2.069 -4.666 14.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 2.273 -7.004 13.655 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 -1.142 -6.168 16.097 1.00 0.00 H new ATOM 0 HH2 TRP A 123 1.007 -7.317 15.738 1.00 0.00 H new ATOM 1850 N ALA A 124 -5.120 -3.156 11.446 1.00 0.00 N ATOM 1851 CA ALA A 124 -6.237 -2.240 11.398 1.00 0.00 C ATOM 1852 C ALA A 124 -6.138 -1.259 12.554 1.00 0.00 C ATOM 1853 O ALA A 124 -5.970 -1.660 13.708 1.00 0.00 O ATOM 1854 CB ALA A 124 -7.554 -3.000 11.447 1.00 0.00 C ATOM 0 H ALA A 124 -5.190 -3.869 12.172 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.206 -1.686 10.460 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -8.383 -2.294 11.410 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -7.615 -3.677 10.595 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -7.608 -3.575 12.372 1.00 0.00 H new ATOM 1860 N LEU A 125 -6.211 0.022 12.240 1.00 0.00 N ATOM 1861 CA LEU A 125 -6.146 1.056 13.257 1.00 0.00 C ATOM 1862 C LEU A 125 -7.522 1.268 13.866 1.00 0.00 C ATOM 1863 O LEU A 125 -8.531 1.263 13.157 1.00 0.00 O ATOM 1864 CB LEU A 125 -5.621 2.366 12.654 1.00 0.00 C ATOM 1865 CG LEU A 125 -5.507 3.540 13.630 1.00 0.00 C ATOM 1866 CD1 LEU A 125 -4.537 3.217 14.756 1.00 0.00 C ATOM 1867 CD2 LEU A 125 -5.070 4.797 12.893 1.00 0.00 C ATOM 0 H LEU A 125 -6.315 0.371 11.287 1.00 0.00 H new ATOM 0 HA LEU A 125 -5.458 0.738 14.041 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -4.638 2.179 12.221 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.279 2.659 11.836 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.488 3.716 14.070 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.473 4.066 15.436 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -4.890 2.342 15.301 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.551 3.011 14.339 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.993 5.624 13.599 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -4.100 4.626 12.426 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.804 5.042 12.125 1.00 0.00 H new ATOM 1879 N ALA A 126 -7.561 1.417 15.186 1.00 0.00 N ATOM 1880 CA ALA A 126 -8.802 1.720 15.881 1.00 0.00 C ATOM 1881 C ALA A 126 -9.443 2.970 15.281 1.00 0.00 C ATOM 1882 O ALA A 126 -8.751 3.956 15.027 1.00 0.00 O ATOM 1883 CB ALA A 126 -8.544 1.913 17.370 1.00 0.00 C ATOM 0 H ALA A 126 -6.746 1.332 15.794 1.00 0.00 H new ATOM 0 HA ALA A 126 -9.488 0.882 15.760 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -9.483 2.139 17.876 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -8.118 1.000 17.787 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -7.846 2.738 17.514 1.00 0.00 H new ATOM 1889 N PRO A 127 -10.764 2.942 15.045 1.00 0.00 N ATOM 1890 CA PRO A 127 -11.488 4.032 14.368 1.00 0.00 C ATOM 1891 C PRO A 127 -11.249 5.402 15.000 1.00 0.00 C ATOM 1892 O PRO A 127 -11.172 6.412 14.298 1.00 0.00 O ATOM 1893 CB PRO A 127 -12.957 3.626 14.515 1.00 0.00 C ATOM 1894 CG PRO A 127 -12.925 2.146 14.650 1.00 0.00 C ATOM 1895 CD PRO A 127 -11.668 1.834 15.413 1.00 0.00 C ATOM 0 HA PRO A 127 -11.156 4.147 13.336 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -13.412 4.094 15.388 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -13.542 3.932 13.648 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -13.805 1.782 15.180 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -12.920 1.664 13.673 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -11.847 1.801 16.488 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -11.255 0.866 15.129 1.00 0.00 H new ATOM 1903 N ASP A 128 -11.124 5.432 16.323 1.00 0.00 N ATOM 1904 CA ASP A 128 -10.920 6.686 17.045 1.00 0.00 C ATOM 1905 C ASP A 128 -9.439 6.953 17.291 1.00 0.00 C ATOM 1906 O ASP A 128 -9.085 7.894 18.001 1.00 0.00 O ATOM 1907 CB ASP A 128 -11.674 6.671 18.377 1.00 0.00 C ATOM 1908 CG ASP A 128 -13.177 6.743 18.199 1.00 0.00 C ATOM 1909 OD1 ASP A 128 -13.803 5.691 17.949 1.00 0.00 O ATOM 1910 OD2 ASP A 128 -13.741 7.853 18.313 1.00 0.00 O ATOM 0 H ASP A 128 -11.160 4.604 16.918 1.00 0.00 H new ATOM 0 HA ASP A 128 -11.313 7.489 16.422 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -11.420 5.763 18.923 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -11.344 7.512 18.986 1.00 0.00 H new ATOM 1915 N ARG A 129 -8.584 6.126 16.686 1.00 0.00 N ATOM 1916 CA ARG A 129 -7.129 6.252 16.815 1.00 0.00 C ATOM 1917 C ARG A 129 -6.697 6.040 18.267 1.00 0.00 C ATOM 1918 O ARG A 129 -6.770 6.945 19.095 1.00 0.00 O ATOM 1919 CB ARG A 129 -6.660 7.618 16.277 1.00 0.00 C ATOM 1920 CG ARG A 129 -5.153 7.757 16.078 1.00 0.00 C ATOM 1921 CD ARG A 129 -4.431 8.131 17.362 1.00 0.00 C ATOM 1922 NE ARG A 129 -3.021 8.440 17.127 1.00 0.00 N ATOM 1923 CZ ARG A 129 -2.225 9.017 18.030 1.00 0.00 C ATOM 1924 NH1 ARG A 129 -2.683 9.288 19.245 1.00 0.00 N ATOM 1925 NH2 ARG A 129 -0.966 9.309 17.726 1.00 0.00 N ATOM 0 H ARG A 129 -8.879 5.350 16.093 1.00 0.00 H new ATOM 0 HA ARG A 129 -6.654 5.476 16.215 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -7.155 7.804 15.324 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -6.992 8.395 16.965 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -4.751 6.817 15.699 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -4.958 8.516 15.320 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -4.920 8.993 17.815 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -4.508 7.309 18.074 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.622 8.200 16.219 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -3.645 9.055 19.491 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -2.073 9.729 19.933 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.602 9.092 16.798 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.363 9.750 18.420 1.00 0.00 H new ATOM 1939 N SER A 130 -6.274 4.822 18.573 1.00 0.00 N ATOM 1940 CA SER A 130 -5.833 4.480 19.920 1.00 0.00 C ATOM 1941 C SER A 130 -4.775 3.387 19.871 1.00 0.00 C ATOM 1942 O SER A 130 -3.719 3.496 20.491 1.00 0.00 O ATOM 1943 CB SER A 130 -7.019 4.006 20.769 1.00 0.00 C ATOM 1944 OG SER A 130 -8.059 4.968 20.780 1.00 0.00 O ATOM 0 H SER A 130 -6.226 4.052 17.906 1.00 0.00 H new ATOM 0 HA SER A 130 -5.404 5.373 20.374 1.00 0.00 H new ATOM 0 HB2 SER A 130 -7.397 3.063 20.375 1.00 0.00 H new ATOM 0 HB3 SER A 130 -6.686 3.815 21.789 1.00 0.00 H new ATOM 0 HG SER A 130 -8.803 4.639 21.327 1.00 0.00 H new ATOM 1950 N GLU A 131 -5.065 2.339 19.119 1.00 0.00 N ATOM 1951 CA GLU A 131 -4.173 1.200 19.026 1.00 0.00 C ATOM 1952 C GLU A 131 -4.371 0.491 17.699 1.00 0.00 C ATOM 1953 O GLU A 131 -5.297 0.806 16.945 1.00 0.00 O ATOM 1954 CB GLU A 131 -4.443 0.233 20.181 1.00 0.00 C ATOM 1955 CG GLU A 131 -5.884 -0.244 20.221 1.00 0.00 C ATOM 1956 CD GLU A 131 -6.234 -0.976 21.500 1.00 0.00 C ATOM 1957 OE1 GLU A 131 -6.160 -0.363 22.582 1.00 0.00 O ATOM 1958 OE2 GLU A 131 -6.607 -2.164 21.424 1.00 0.00 O ATOM 0 H GLU A 131 -5.916 2.255 18.562 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.143 1.550 19.088 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -3.782 -0.629 20.090 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -4.200 0.723 21.124 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -6.547 0.614 20.107 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -6.066 -0.902 19.372 1.00 0.00 H new ATOM 1965 N PHE A 132 -3.507 -0.467 17.428 1.00 0.00 N ATOM 1966 CA PHE A 132 -3.595 -1.267 16.218 1.00 0.00 C ATOM 1967 C PHE A 132 -4.062 -2.669 16.563 1.00 0.00 C ATOM 1968 O PHE A 132 -3.778 -3.176 17.647 1.00 0.00 O ATOM 1969 CB PHE A 132 -2.242 -1.340 15.506 1.00 0.00 C ATOM 1970 CG PHE A 132 -1.868 -0.084 14.773 1.00 0.00 C ATOM 1971 CD1 PHE A 132 -1.177 0.931 15.412 1.00 0.00 C ATOM 1972 CD2 PHE A 132 -2.200 0.072 13.438 1.00 0.00 C ATOM 1973 CE1 PHE A 132 -0.828 2.082 14.734 1.00 0.00 C ATOM 1974 CE2 PHE A 132 -1.852 1.219 12.755 1.00 0.00 C ATOM 1975 CZ PHE A 132 -1.165 2.226 13.403 1.00 0.00 C ATOM 0 H PHE A 132 -2.726 -0.714 18.036 1.00 0.00 H new ATOM 0 HA PHE A 132 -4.312 -0.793 15.548 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -1.468 -1.564 16.240 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -2.260 -2.169 14.799 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -0.908 0.821 16.452 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -2.737 -0.713 12.926 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -0.292 2.869 15.244 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -2.117 1.329 11.714 1.00 0.00 H new ATOM 0 HZ PHE A 132 -0.892 3.125 12.870 1.00 0.00 H new ATOM 1985 N HIS A 133 -4.792 -3.284 15.654 1.00 0.00 N ATOM 1986 CA HIS A 133 -5.224 -4.655 15.837 1.00 0.00 C ATOM 1987 C HIS A 133 -4.787 -5.497 14.659 1.00 0.00 C ATOM 1988 O HIS A 133 -4.741 -5.026 13.522 1.00 0.00 O ATOM 1989 CB HIS A 133 -6.743 -4.746 16.012 1.00 0.00 C ATOM 1990 CG HIS A 133 -7.231 -4.230 17.330 1.00 0.00 C ATOM 1991 ND1 HIS A 133 -7.452 -5.045 18.417 1.00 0.00 N ATOM 1992 CD2 HIS A 133 -7.532 -2.974 17.739 1.00 0.00 C ATOM 1993 CE1 HIS A 133 -7.870 -4.318 19.434 1.00 0.00 C ATOM 1994 NE2 HIS A 133 -7.925 -3.054 19.055 1.00 0.00 N ATOM 0 H HIS A 133 -5.099 -2.856 14.781 1.00 0.00 H new ATOM 0 HA HIS A 133 -4.759 -5.035 16.747 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -7.226 -4.185 15.212 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -7.050 -5.786 15.903 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -7.474 -2.076 17.142 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -8.125 -4.693 20.414 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -8.211 -2.269 19.640 1.00 0.00 H new ATOM 2003 N ARG A 134 -4.452 -6.738 14.943 1.00 0.00 N ATOM 2004 CA ARG A 134 -3.982 -7.650 13.923 1.00 0.00 C ATOM 2005 C ARG A 134 -5.146 -8.436 13.336 1.00 0.00 C ATOM 2006 O ARG A 134 -6.055 -8.854 14.056 1.00 0.00 O ATOM 2007 CB ARG A 134 -2.940 -8.604 14.511 1.00 0.00 C ATOM 2008 CG ARG A 134 -2.496 -9.689 13.549 1.00 0.00 C ATOM 2009 CD ARG A 134 -1.712 -9.129 12.375 1.00 0.00 C ATOM 2010 NE ARG A 134 -1.645 -10.087 11.271 1.00 0.00 N ATOM 2011 CZ ARG A 134 -0.617 -10.909 11.051 1.00 0.00 C ATOM 2012 NH1 ARG A 134 0.422 -10.928 11.875 1.00 0.00 N ATOM 2013 NH2 ARG A 134 -0.632 -11.736 10.012 1.00 0.00 N ATOM 0 H ARG A 134 -4.497 -7.140 15.879 1.00 0.00 H new ATOM 0 HA ARG A 134 -3.518 -7.072 13.124 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -2.069 -8.029 14.823 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -3.351 -9.070 15.406 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -1.881 -10.415 14.081 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -3.371 -10.223 13.178 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -2.180 -8.207 12.030 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -0.703 -8.873 12.698 1.00 0.00 H new ATOM 0 HE ARG A 134 -2.435 -10.129 10.628 1.00 0.00 H new ATOM 0 HH11 ARG A 134 0.441 -10.310 12.686 1.00 0.00 H new ATOM 0 HH12 ARG A 134 1.202 -11.560 11.697 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -1.431 -11.745 9.378 1.00 0.00 H new ATOM 0 HH22 ARG A 134 0.156 -12.363 9.848 1.00 0.00 H new ATOM 2027 N GLU A 135 -5.116 -8.618 12.029 1.00 0.00 N ATOM 2028 CA GLU A 135 -6.103 -9.432 11.347 1.00 0.00 C ATOM 2029 C GLU A 135 -5.390 -10.375 10.388 1.00 0.00 C ATOM 2030 O GLU A 135 -4.210 -10.179 10.077 1.00 0.00 O ATOM 2031 CB GLU A 135 -7.122 -8.556 10.600 1.00 0.00 C ATOM 2032 CG GLU A 135 -8.321 -9.334 10.071 1.00 0.00 C ATOM 2033 CD GLU A 135 -9.339 -8.464 9.361 1.00 0.00 C ATOM 2034 OE1 GLU A 135 -10.208 -7.882 10.044 1.00 0.00 O ATOM 2035 OE2 GLU A 135 -9.300 -8.387 8.114 1.00 0.00 O ATOM 0 H GLU A 135 -4.412 -8.209 11.415 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.657 -10.015 12.082 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -7.475 -7.772 11.270 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -6.623 -8.063 9.766 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -7.970 -10.104 9.384 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -8.808 -9.845 10.901 1.00 0.00 H new ATOM 2042 N ASP A 136 -6.086 -11.406 9.949 1.00 0.00 N ATOM 2043 CA ASP A 136 -5.511 -12.368 9.026 1.00 0.00 C ATOM 2044 C ASP A 136 -5.719 -11.897 7.596 1.00 0.00 C ATOM 2045 O ASP A 136 -6.720 -11.245 7.290 1.00 0.00 O ATOM 2046 CB ASP A 136 -6.139 -13.752 9.220 1.00 0.00 C ATOM 2047 CG ASP A 136 -6.060 -14.232 10.655 1.00 0.00 C ATOM 2048 OD1 ASP A 136 -4.953 -14.579 11.119 1.00 0.00 O ATOM 2049 OD2 ASP A 136 -7.111 -14.260 11.331 1.00 0.00 O ATOM 0 H ASP A 136 -7.051 -11.600 10.216 1.00 0.00 H new ATOM 0 HA ASP A 136 -4.443 -12.446 9.228 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -7.183 -13.720 8.908 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -5.635 -14.470 8.573 1.00 0.00 H new ATOM 2054 N ILE A 137 -4.780 -12.223 6.726 1.00 0.00 N ATOM 2055 CA ILE A 137 -4.867 -11.823 5.332 1.00 0.00 C ATOM 2056 C ILE A 137 -5.723 -12.826 4.573 1.00 0.00 C ATOM 2057 O ILE A 137 -5.465 -14.031 4.612 1.00 0.00 O ATOM 2058 CB ILE A 137 -3.468 -11.712 4.662 1.00 0.00 C ATOM 2059 CG1 ILE A 137 -2.650 -10.556 5.261 1.00 0.00 C ATOM 2060 CG2 ILE A 137 -3.603 -11.526 3.156 1.00 0.00 C ATOM 2061 CD1 ILE A 137 -2.056 -10.851 6.626 1.00 0.00 C ATOM 0 H ILE A 137 -3.948 -12.764 6.960 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.322 -10.833 5.298 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.938 -12.644 4.857 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -1.843 -10.304 4.574 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -3.289 -9.676 5.339 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -2.612 -11.451 2.708 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.130 -12.380 2.730 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.164 -10.614 2.951 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -1.496 -9.983 6.974 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -2.857 -11.073 7.331 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -1.388 -11.709 6.554 1.00 0.00 H new ATOM 2073 N VAL A 138 -6.754 -12.328 3.906 1.00 0.00 N ATOM 2074 CA VAL A 138 -7.678 -13.191 3.191 1.00 0.00 C ATOM 2075 C VAL A 138 -7.498 -13.033 1.691 1.00 0.00 C ATOM 2076 O VAL A 138 -7.049 -11.989 1.209 1.00 0.00 O ATOM 2077 CB VAL A 138 -9.156 -12.895 3.529 1.00 0.00 C ATOM 2078 CG1 VAL A 138 -9.994 -14.159 3.418 1.00 0.00 C ATOM 2079 CG2 VAL A 138 -9.298 -12.265 4.908 1.00 0.00 C ATOM 0 H VAL A 138 -6.970 -11.333 3.846 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.447 -14.208 3.507 1.00 0.00 H new ATOM 0 HB VAL A 138 -9.526 -12.173 2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -11.032 -13.930 3.660 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.935 -14.546 2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -9.616 -14.908 4.114 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.351 -12.070 5.112 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.902 -12.946 5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -8.743 -11.327 4.939 1.00 0.00 H new ATOM 2089 N ARG A 139 -7.865 -14.069 0.966 1.00 0.00 N ATOM 2090 CA ARG A 139 -7.737 -14.092 -0.476 1.00 0.00 C ATOM 2091 C ARG A 139 -8.900 -13.337 -1.106 1.00 0.00 C ATOM 2092 O ARG A 139 -9.976 -13.250 -0.513 1.00 0.00 O ATOM 2093 CB ARG A 139 -7.701 -15.541 -0.956 1.00 0.00 C ATOM 2094 CG ARG A 139 -6.566 -16.346 -0.340 1.00 0.00 C ATOM 2095 CD ARG A 139 -6.603 -17.803 -0.768 1.00 0.00 C ATOM 2096 NE ARG A 139 -6.312 -17.976 -2.190 1.00 0.00 N ATOM 2097 CZ ARG A 139 -5.600 -18.989 -2.681 1.00 0.00 C ATOM 2098 NH1 ARG A 139 -5.123 -19.925 -1.869 1.00 0.00 N ATOM 2099 NH2 ARG A 139 -5.370 -19.070 -3.984 1.00 0.00 N ATOM 0 H ARG A 139 -8.262 -14.921 1.361 1.00 0.00 H new ATOM 0 HA ARG A 139 -6.810 -13.603 -0.776 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -8.650 -16.020 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -7.601 -15.556 -2.041 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -5.611 -15.907 -0.630 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -6.627 -16.286 0.747 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -5.880 -18.369 -0.181 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -7.587 -18.218 -0.549 1.00 0.00 H new ATOM 0 HE ARG A 139 -6.675 -17.282 -2.843 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -5.301 -19.870 -0.866 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -4.578 -20.700 -2.248 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -5.738 -18.356 -4.612 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -4.825 -19.846 -4.358 1.00 0.00 H new ATOM 2113 N PRO A 140 -8.698 -12.774 -2.307 1.00 0.00 N ATOM 2114 CA PRO A 140 -9.710 -11.954 -2.985 1.00 0.00 C ATOM 2115 C PRO A 140 -11.021 -12.707 -3.186 1.00 0.00 C ATOM 2116 O PRO A 140 -11.015 -13.917 -3.420 1.00 0.00 O ATOM 2117 CB PRO A 140 -9.067 -11.623 -4.340 1.00 0.00 C ATOM 2118 CG PRO A 140 -7.952 -12.599 -4.499 1.00 0.00 C ATOM 2119 CD PRO A 140 -7.477 -12.909 -3.111 1.00 0.00 C ATOM 0 HA PRO A 140 -9.972 -11.071 -2.402 1.00 0.00 H new ATOM 0 HB2 PRO A 140 -9.789 -11.717 -5.151 1.00 0.00 H new ATOM 0 HB3 PRO A 140 -8.697 -10.598 -4.359 1.00 0.00 H new ATOM 0 HG2 PRO A 140 -8.292 -13.502 -5.006 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -7.148 -12.178 -5.102 1.00 0.00 H new ATOM 0 HD2 PRO A 140 -7.058 -13.913 -3.043 1.00 0.00 H new ATOM 0 HD3 PRO A 140 -6.701 -12.216 -2.786 1.00 0.00 H new ATOM 2127 N ASP A 141 -12.131 -11.974 -3.084 1.00 0.00 N ATOM 2128 CA ASP A 141 -13.474 -12.543 -3.206 1.00 0.00 C ATOM 2129 C ASP A 141 -13.571 -13.467 -4.419 1.00 0.00 C ATOM 2130 O ASP A 141 -13.521 -13.010 -5.564 1.00 0.00 O ATOM 2131 CB ASP A 141 -14.511 -11.418 -3.293 1.00 0.00 C ATOM 2132 CG ASP A 141 -14.609 -10.624 -2.002 1.00 0.00 C ATOM 2133 OD1 ASP A 141 -13.673 -9.855 -1.690 1.00 0.00 O ATOM 2134 OD2 ASP A 141 -15.615 -10.779 -1.277 1.00 0.00 O ATOM 0 H ASP A 141 -12.124 -10.968 -2.914 1.00 0.00 H new ATOM 0 HA ASP A 141 -13.679 -13.142 -2.319 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -14.248 -10.747 -4.111 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -15.486 -11.843 -3.530 1.00 0.00 H new ATOM 2139 N PRO A 142 -13.732 -14.778 -4.154 1.00 0.00 N ATOM 2140 CA PRO A 142 -13.543 -15.854 -5.144 1.00 0.00 C ATOM 2141 C PRO A 142 -14.423 -15.740 -6.380 1.00 0.00 C ATOM 2142 O PRO A 142 -15.535 -16.276 -6.414 1.00 0.00 O ATOM 2143 CB PRO A 142 -13.894 -17.128 -4.367 1.00 0.00 C ATOM 2144 CG PRO A 142 -13.741 -16.760 -2.935 1.00 0.00 C ATOM 2145 CD PRO A 142 -14.135 -15.317 -2.845 1.00 0.00 C ATOM 0 HA PRO A 142 -12.528 -15.825 -5.541 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -14.911 -17.455 -4.584 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -13.231 -17.950 -4.636 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -14.375 -17.380 -2.301 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -12.714 -16.908 -2.600 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -15.205 -15.201 -2.674 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -13.625 -14.810 -2.026 1.00 0.00 H new ATOM 2153 N GLU A 143 -13.910 -15.029 -7.388 1.00 0.00 N ATOM 2154 CA GLU A 143 -14.565 -14.899 -8.690 1.00 0.00 C ATOM 2155 C GLU A 143 -16.032 -14.501 -8.560 1.00 0.00 C ATOM 2156 O GLU A 143 -16.872 -14.869 -9.383 1.00 0.00 O ATOM 2157 CB GLU A 143 -14.445 -16.198 -9.469 1.00 0.00 C ATOM 2158 CG GLU A 143 -13.014 -16.537 -9.866 1.00 0.00 C ATOM 2159 CD GLU A 143 -12.926 -17.756 -10.757 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -13.093 -17.613 -11.985 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -12.695 -18.868 -10.234 1.00 0.00 O ATOM 0 H GLU A 143 -13.025 -14.526 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 143 -14.056 -14.101 -9.230 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -14.850 -17.012 -8.868 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -15.057 -16.131 -10.368 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -12.573 -15.684 -10.381 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -12.423 -16.707 -8.966 1.00 0.00 H new ATOM 2168 N ALA A 144 -16.320 -13.740 -7.525 1.00 0.00 N ATOM 2169 CA ALA A 144 -17.664 -13.252 -7.268 1.00 0.00 C ATOM 2170 C ALA A 144 -17.836 -11.858 -7.854 1.00 0.00 C ATOM 2171 O ALA A 144 -17.307 -10.881 -7.320 1.00 0.00 O ATOM 2172 CB ALA A 144 -17.952 -13.244 -5.774 1.00 0.00 C ATOM 0 H ALA A 144 -15.630 -13.441 -6.836 1.00 0.00 H new ATOM 0 HA ALA A 144 -18.377 -13.922 -7.749 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -18.963 -12.876 -5.600 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -17.862 -14.257 -5.381 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -17.237 -12.594 -5.269 1.00 0.00 H new ATOM 2178 N PRO A 145 -18.549 -11.752 -8.981 1.00 0.00 N ATOM 2179 CA PRO A 145 -18.769 -10.489 -9.659 1.00 0.00 C ATOM 2180 C PRO A 145 -20.074 -9.815 -9.247 1.00 0.00 C ATOM 2181 O PRO A 145 -20.994 -10.464 -8.745 1.00 0.00 O ATOM 2182 CB PRO A 145 -18.830 -10.918 -11.121 1.00 0.00 C ATOM 2183 CG PRO A 145 -19.398 -12.307 -11.101 1.00 0.00 C ATOM 2184 CD PRO A 145 -19.192 -12.860 -9.706 1.00 0.00 C ATOM 0 HA PRO A 145 -17.998 -9.753 -9.430 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -19.459 -10.244 -11.703 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -17.840 -10.904 -11.577 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -20.458 -12.292 -11.355 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -18.902 -12.935 -11.840 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -20.138 -13.145 -9.245 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -18.562 -13.750 -9.717 1.00 0.00 H new ATOM 2192 N LEU A 146 -20.143 -8.513 -9.460 1.00 0.00 N ATOM 2193 CA LEU A 146 -21.362 -7.763 -9.211 1.00 0.00 C ATOM 2194 C LEU A 146 -22.260 -7.860 -10.435 1.00 0.00 C ATOM 2195 O LEU A 146 -21.792 -8.249 -11.510 1.00 0.00 O ATOM 2196 CB LEU A 146 -21.045 -6.291 -8.912 1.00 0.00 C ATOM 2197 CG LEU A 146 -20.308 -6.006 -7.597 1.00 0.00 C ATOM 2198 CD1 LEU A 146 -18.853 -6.442 -7.673 1.00 0.00 C ATOM 2199 CD2 LEU A 146 -20.401 -4.531 -7.245 1.00 0.00 C ATOM 0 H LEU A 146 -19.366 -7.951 -9.806 1.00 0.00 H new ATOM 0 HA LEU A 146 -21.868 -8.184 -8.342 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -20.445 -5.897 -9.732 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -21.982 -5.734 -8.906 1.00 0.00 H new ATOM 0 HG LEU A 146 -20.791 -6.586 -6.811 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -18.359 -6.226 -6.726 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -18.804 -7.512 -7.873 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -18.352 -5.900 -8.475 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -19.873 -4.346 -6.309 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -19.949 -3.938 -8.040 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -21.448 -4.249 -7.133 1.00 0.00 H new ATOM 2211 N GLU A 147 -23.534 -7.524 -10.287 1.00 0.00 N ATOM 2212 CA GLU A 147 -24.442 -7.523 -11.420 1.00 0.00 C ATOM 2213 C GLU A 147 -24.040 -6.405 -12.370 1.00 0.00 C ATOM 2214 O GLU A 147 -24.240 -5.221 -12.078 1.00 0.00 O ATOM 2215 CB GLU A 147 -25.886 -7.346 -10.948 1.00 0.00 C ATOM 2216 CG GLU A 147 -26.915 -8.061 -11.814 1.00 0.00 C ATOM 2217 CD GLU A 147 -27.116 -7.421 -13.177 1.00 0.00 C ATOM 2218 OE1 GLU A 147 -26.317 -7.692 -14.103 1.00 0.00 O ATOM 2219 OE2 GLU A 147 -28.085 -6.655 -13.332 1.00 0.00 O ATOM 0 H GLU A 147 -23.957 -7.251 -9.400 1.00 0.00 H new ATOM 0 HA GLU A 147 -24.381 -8.478 -11.942 1.00 0.00 H new ATOM 0 HB2 GLU A 147 -25.970 -7.713 -9.925 1.00 0.00 H new ATOM 0 HB3 GLU A 147 -26.122 -6.282 -10.926 1.00 0.00 H new ATOM 0 HG2 GLU A 147 -26.605 -9.097 -11.951 1.00 0.00 H new ATOM 0 HG3 GLU A 147 -27.869 -8.081 -11.287 1.00 0.00 H new ATOM 2226 N HIS A 148 -23.452 -6.792 -13.495 1.00 0.00 N ATOM 2227 CA HIS A 148 -22.887 -5.838 -14.440 1.00 0.00 C ATOM 2228 C HIS A 148 -23.934 -4.863 -14.956 1.00 0.00 C ATOM 2229 O HIS A 148 -23.674 -3.661 -15.022 1.00 0.00 O ATOM 2230 CB HIS A 148 -22.234 -6.557 -15.625 1.00 0.00 C ATOM 2231 CG HIS A 148 -20.807 -6.954 -15.392 1.00 0.00 C ATOM 2232 ND1 HIS A 148 -20.413 -8.251 -15.150 1.00 0.00 N ATOM 2233 CD2 HIS A 148 -19.673 -6.214 -15.395 1.00 0.00 C ATOM 2234 CE1 HIS A 148 -19.101 -8.292 -15.016 1.00 0.00 C ATOM 2235 NE2 HIS A 148 -18.624 -7.069 -15.162 1.00 0.00 N ATOM 0 H HIS A 148 -23.354 -7.768 -13.776 1.00 0.00 H new ATOM 0 HA HIS A 148 -22.128 -5.274 -13.898 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -22.814 -7.450 -15.859 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -22.281 -5.908 -16.500 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -19.606 -5.148 -15.552 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -18.515 -9.178 -14.820 1.00 0.00 H new ATOM 0 HE2 HIS A 148 -17.640 -6.804 -15.110 1.00 0.00 H new ATOM 2244 N HIS A 149 -25.115 -5.385 -15.307 1.00 0.00 N ATOM 2245 CA HIS A 149 -26.171 -4.599 -15.965 1.00 0.00 C ATOM 2246 C HIS A 149 -25.757 -4.203 -17.384 1.00 0.00 C ATOM 2247 O HIS A 149 -26.527 -4.364 -18.332 1.00 0.00 O ATOM 2248 CB HIS A 149 -26.528 -3.335 -15.169 1.00 0.00 C ATOM 2249 CG HIS A 149 -27.222 -3.587 -13.865 1.00 0.00 C ATOM 2250 ND1 HIS A 149 -26.554 -3.855 -12.690 1.00 0.00 N ATOM 2251 CD2 HIS A 149 -28.537 -3.570 -13.552 1.00 0.00 C ATOM 2252 CE1 HIS A 149 -27.429 -3.987 -11.711 1.00 0.00 C ATOM 2253 NE2 HIS A 149 -28.640 -3.817 -12.205 1.00 0.00 N ATOM 0 H HIS A 149 -25.367 -6.360 -15.145 1.00 0.00 H new ATOM 0 HA HIS A 149 -27.053 -5.238 -16.009 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -25.613 -2.775 -14.975 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -27.165 -2.702 -15.787 1.00 0.00 H new ATOM 0 HD1 HIS A 149 -25.542 -3.938 -12.592 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -29.355 -3.395 -14.235 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -27.193 -4.199 -10.679 1.00 0.00 H new ATOM 2262 N HIS A 150 -24.541 -3.674 -17.509 1.00 0.00 N ATOM 2263 CA HIS A 150 -23.992 -3.219 -18.780 1.00 0.00 C ATOM 2264 C HIS A 150 -24.849 -2.087 -19.334 1.00 0.00 C ATOM 2265 O HIS A 150 -25.239 -2.088 -20.502 1.00 0.00 O ATOM 2266 CB HIS A 150 -23.890 -4.374 -19.785 1.00 0.00 C ATOM 2267 CG HIS A 150 -22.850 -4.163 -20.847 1.00 0.00 C ATOM 2268 ND1 HIS A 150 -21.701 -4.920 -20.934 1.00 0.00 N ATOM 2269 CD2 HIS A 150 -22.788 -3.279 -21.872 1.00 0.00 C ATOM 2270 CE1 HIS A 150 -20.981 -4.509 -21.961 1.00 0.00 C ATOM 2271 NE2 HIS A 150 -21.618 -3.515 -22.546 1.00 0.00 N ATOM 0 H HIS A 150 -23.905 -3.549 -16.721 1.00 0.00 H new ATOM 0 HA HIS A 150 -22.982 -2.846 -18.611 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -23.664 -5.294 -19.246 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -24.860 -4.515 -20.262 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -23.525 -2.527 -22.113 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -20.030 -4.918 -22.270 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -21.293 -3.004 -23.367 1.00 0.00 H new ATOM 2280 N HIS A 151 -25.142 -1.126 -18.473 1.00 0.00 N ATOM 2281 CA HIS A 151 -25.944 0.024 -18.851 1.00 0.00 C ATOM 2282 C HIS A 151 -25.027 1.215 -19.088 1.00 0.00 C ATOM 2283 O HIS A 151 -24.062 1.400 -18.346 1.00 0.00 O ATOM 2284 CB HIS A 151 -26.952 0.344 -17.746 1.00 0.00 C ATOM 2285 CG HIS A 151 -28.165 1.088 -18.218 1.00 0.00 C ATOM 2286 ND1 HIS A 151 -28.346 2.440 -18.042 1.00 0.00 N ATOM 2287 CD2 HIS A 151 -29.278 0.642 -18.842 1.00 0.00 C ATOM 2288 CE1 HIS A 151 -29.518 2.794 -18.535 1.00 0.00 C ATOM 2289 NE2 HIS A 151 -30.106 1.721 -19.027 1.00 0.00 N ATOM 0 H HIS A 151 -24.833 -1.121 -17.501 1.00 0.00 H new ATOM 0 HA HIS A 151 -26.493 -0.197 -19.766 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -27.270 -0.588 -17.279 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -26.455 0.933 -16.976 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -29.479 -0.376 -19.140 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -29.927 3.794 -18.535 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -31.024 1.697 -19.471 1.00 0.00 H new ATOM 2298 N HIS A 152 -25.327 1.997 -20.125 1.00 0.00 N ATOM 2299 CA HIS A 152 -24.513 3.153 -20.511 1.00 0.00 C ATOM 2300 C HIS A 152 -23.188 2.698 -21.123 1.00 0.00 C ATOM 2301 O HIS A 152 -22.252 2.331 -20.413 1.00 0.00 O ATOM 2302 CB HIS A 152 -24.267 4.099 -19.317 1.00 0.00 C ATOM 2303 CG HIS A 152 -23.305 5.221 -19.596 1.00 0.00 C ATOM 2304 ND1 HIS A 152 -23.697 6.468 -20.032 1.00 0.00 N ATOM 2305 CD2 HIS A 152 -21.955 5.272 -19.496 1.00 0.00 C ATOM 2306 CE1 HIS A 152 -22.632 7.233 -20.188 1.00 0.00 C ATOM 2307 NE2 HIS A 152 -21.561 6.532 -19.869 1.00 0.00 N ATOM 0 H HIS A 152 -26.141 1.848 -20.722 1.00 0.00 H new ATOM 0 HA HIS A 152 -25.069 3.712 -21.263 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -25.221 4.525 -19.005 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -23.889 3.514 -18.478 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -21.307 4.468 -19.180 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -22.637 8.260 -20.521 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -20.599 6.871 -19.895 1.00 0.00 H new ATOM 2316 N HIS A 153 -23.126 2.707 -22.443 1.00 0.00 N ATOM 2317 CA HIS A 153 -21.886 2.409 -23.147 1.00 0.00 C ATOM 2318 C HIS A 153 -21.129 3.699 -23.437 1.00 0.00 C ATOM 2319 O HIS A 153 -21.759 4.666 -23.917 1.00 0.00 O ATOM 2320 CB HIS A 153 -22.140 1.616 -24.443 1.00 0.00 C ATOM 2321 CG HIS A 153 -23.168 2.202 -25.372 1.00 0.00 C ATOM 2322 ND1 HIS A 153 -24.372 1.586 -25.639 1.00 0.00 N ATOM 2323 CD2 HIS A 153 -23.167 3.341 -26.105 1.00 0.00 C ATOM 2324 CE1 HIS A 153 -25.063 2.319 -26.490 1.00 0.00 C ATOM 2325 NE2 HIS A 153 -24.356 3.387 -26.788 1.00 0.00 N ATOM 2326 OXT HIS A 153 -19.910 3.749 -23.180 1.00 0.00 O ATOM 0 H HIS A 153 -23.918 2.917 -23.051 1.00 0.00 H new ATOM 0 HA HIS A 153 -21.275 1.778 -22.502 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -21.198 1.526 -24.983 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -22.452 0.607 -24.175 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -22.377 4.076 -26.144 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -26.043 2.082 -26.877 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -24.645 4.130 -27.424 1.00 0.00 H new TER 2335 HIS A 153