USER MOD reduce.3.24.130724 H: found=0, std=0, add=376, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 375 hydrogens (6 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 NoAdj-H: A 5 TPO H2 : A 5 TPO N : A 4 LEU C :(H bumps) USER MOD Single : A 1 GLU N :NH3+ -178:sc= 0.762 (180deg=0.664) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 THR OG1 : rot -32:sc= 0.853 USER MOD Single : B 1 LYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 LYS NZ :NH3+ 165:sc= 2.38 (180deg=2.17) USER MOD Single : B 8 LYS NZ :NH3+ 151:sc= 2.28 (180deg=1.12) USER MOD Single : B 10 MET CE :methyl -100:sc= -0.149 (180deg=-2.55!) USER MOD Single : B 11 SER OG : rot 122:sc= 0.202 USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= 0.00685 USER MOD Single : B 19 TYR OH : rot -31:sc= 0.0156 USER MOD Single : B 21 ASN : amide:sc=-0.00793 X(o=-0.0079,f=0) USER MOD Single : B 22 HIS : no HE2:sc= 0.0201 K(o=0.02,f=-0.49) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= 0.594 K(o=0.59,f=0) USER MOD Single : B 27 SER OG : rot 72:sc= 1.21 USER MOD Single : B 28 GLN : amide:sc= -0.472 X(o=-0.47,f=0) USER MOD Single : B 33 SER OG : rot 180:sc= 0.0271 USER MOD Single : B 35 ASN : amide:sc= 0.492 K(o=0.49,f=-5.9!) USER MOD Single : B 36 SER OG : rot 88:sc= 1.18 USER MOD Single : B 37 SER OG : rot 7:sc= 0.591 USER MOD Single : B 38 SER OG : rot -50:sc= 1.29 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 1 -53.856 -12.025 39.742 1.00 0.00 N ATOM 2 CA GLU A 1 -54.126 -13.194 40.627 1.00 0.00 C ATOM 3 C GLU A 1 -53.035 -14.306 40.662 1.00 0.00 C ATOM 4 O GLU A 1 -52.391 -14.581 41.674 1.00 0.00 O ATOM 5 CB GLU A 1 -55.610 -13.644 40.443 1.00 0.00 C ATOM 6 CG GLU A 1 -56.045 -14.312 39.098 1.00 0.00 C ATOM 7 CD GLU A 1 -55.722 -13.534 37.841 1.00 0.00 C ATOM 8 OE1 GLU A 1 -54.520 -13.450 37.513 1.00 0.00 O ATOM 9 OE2 GLU A 1 -56.615 -12.900 37.266 1.00 0.00 O ATOM 0 H1 GLU A 1 -54.632 -11.338 39.827 1.00 0.00 H new ATOM 0 H2 GLU A 1 -52.963 -11.574 40.025 1.00 0.00 H new ATOM 0 H3 GLU A 1 -53.784 -12.346 38.755 1.00 0.00 H new ATOM 0 HA GLU A 1 -54.022 -12.867 41.662 1.00 0.00 H new ATOM 0 HB2 GLU A 1 -55.843 -14.343 41.246 1.00 0.00 H new ATOM 0 HB3 GLU A 1 -56.239 -12.767 40.592 1.00 0.00 H new ATOM 0 HG2 GLU A 1 -55.569 -15.290 39.029 1.00 0.00 H new ATOM 0 HG3 GLU A 1 -57.121 -14.483 39.130 1.00 0.00 H new ATOM 18 N GLN A 2 -52.848 -14.869 39.492 1.00 0.00 N ATOM 19 CA GLN A 2 -51.715 -15.777 39.146 1.00 0.00 C ATOM 20 C GLN A 2 -50.379 -14.995 38.831 1.00 0.00 C ATOM 21 O GLN A 2 -49.448 -15.170 39.622 1.00 0.00 O ATOM 22 CB GLN A 2 -52.181 -16.785 38.058 1.00 0.00 C ATOM 23 CG GLN A 2 -53.204 -17.854 38.535 1.00 0.00 C ATOM 24 CD GLN A 2 -53.719 -18.776 37.430 1.00 0.00 C ATOM 25 OE1 GLN A 2 -53.222 -19.872 37.209 1.00 0.00 O ATOM 26 NE2 GLN A 2 -54.728 -18.375 36.698 1.00 0.00 N ATOM 0 H GLN A 2 -53.486 -14.720 38.710 1.00 0.00 H new ATOM 0 HA GLN A 2 -51.437 -16.371 40.017 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -52.623 -16.225 37.234 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -51.304 -17.297 37.661 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -52.740 -18.462 39.311 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -54.053 -17.347 38.993 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -55.153 -17.464 36.870 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -55.089 -18.974 35.955 1.00 0.00 H new ATOM 35 N PRO A 3 -50.212 -14.103 37.800 1.00 0.00 N ATOM 36 CA PRO A 3 -49.015 -13.213 37.697 1.00 0.00 C ATOM 37 C PRO A 3 -48.902 -12.100 38.800 1.00 0.00 C ATOM 38 O PRO A 3 -47.928 -12.093 39.554 1.00 0.00 O ATOM 39 CB PRO A 3 -49.116 -12.718 36.237 1.00 0.00 C ATOM 40 CG PRO A 3 -50.604 -12.778 35.880 1.00 0.00 C ATOM 41 CD PRO A 3 -51.131 -13.988 36.649 1.00 0.00 C ATOM 0 HA PRO A 3 -48.076 -13.726 37.903 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -48.731 -11.703 36.140 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -48.528 -13.347 35.569 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -51.120 -11.864 36.175 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -50.751 -12.895 34.806 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -52.161 -13.838 36.973 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -51.118 -14.889 36.035 1.00 0.00 H new ATOM 49 N LEU A 4 -49.892 -11.189 38.902 1.00 0.00 N ATOM 50 CA LEU A 4 -49.976 -10.145 39.972 1.00 0.00 C ATOM 51 C LEU A 4 -48.798 -9.103 40.029 1.00 0.00 C ATOM 52 O LEU A 4 -47.956 -9.131 40.931 1.00 0.00 O ATOM 53 CB LEU A 4 -50.330 -10.827 41.334 1.00 0.00 C ATOM 54 CG LEU A 4 -50.814 -9.903 42.482 1.00 0.00 C ATOM 55 CD1 LEU A 4 -52.186 -9.262 42.210 1.00 0.00 C ATOM 56 CD2 LEU A 4 -50.882 -10.694 43.799 1.00 0.00 C ATOM 0 H LEU A 4 -50.669 -11.148 38.242 1.00 0.00 H new ATOM 0 HA LEU A 4 -50.794 -9.478 39.700 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -51.105 -11.571 41.149 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -49.448 -11.365 41.682 1.00 0.00 H new ATOM 0 HG LEU A 4 -50.086 -9.094 42.553 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -52.465 -8.628 43.052 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -52.132 -8.659 41.304 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -52.934 -10.044 42.081 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -51.223 -10.038 44.600 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -51.579 -11.525 43.689 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -49.892 -11.081 44.043 1.00 0.00 H new HETATM 68 N TPO A 5 -48.773 -8.136 39.093 1.00 0.00 N HETATM 69 CA TPO A 5 -47.746 -7.050 39.085 1.00 0.00 C HETATM 70 CB TPO A 5 -47.431 -6.542 37.630 1.00 0.00 C HETATM 71 CG2 TPO A 5 -48.458 -5.594 37.006 1.00 0.00 C HETATM 72 OG1 TPO A 5 -47.294 -7.581 36.632 1.00 0.00 O HETATM 73 P TPO A 5 -46.325 -8.847 36.754 1.00 0.00 P HETATM 74 O1P TPO A 5 -47.101 -10.056 37.266 1.00 0.00 O HETATM 75 O2P TPO A 5 -45.857 -9.257 35.355 1.00 0.00 O HETATM 76 O3P TPO A 5 -45.057 -8.531 37.674 1.00 0.00 O HETATM 77 C TPO A 5 -48.093 -5.891 40.100 1.00 0.00 C HETATM 78 O TPO A 5 -49.250 -5.452 40.103 1.00 0.00 O HETATM 0 HG23 TPO A 5 -49.425 -6.093 36.946 1.00 0.00 H new HETATM 0 HG22 TPO A 5 -48.549 -4.700 37.622 1.00 0.00 H new HETATM 0 HG21 TPO A 5 -48.132 -5.313 36.005 1.00 0.00 H new HETATM 0 HB TPO A 5 -46.491 -6.032 37.839 1.00 0.00 H new HETATM 0 HA TPO A 5 -46.815 -7.485 39.450 1.00 0.00 H new HETATM 0 H TPO A 5 -49.180 -8.460 38.215 1.00 0.00 H new ATOM 85 N PRO A 6 -47.180 -5.357 40.965 1.00 0.00 N ATOM 86 CA PRO A 6 -47.569 -4.378 42.025 1.00 0.00 C ATOM 87 C PRO A 6 -47.828 -2.919 41.519 1.00 0.00 C ATOM 88 O PRO A 6 -46.925 -2.240 41.011 1.00 0.00 O ATOM 89 CB PRO A 6 -46.384 -4.492 43.007 1.00 0.00 C ATOM 90 CG PRO A 6 -45.197 -4.899 42.133 1.00 0.00 C ATOM 91 CD PRO A 6 -45.808 -5.863 41.123 1.00 0.00 C ATOM 0 HA PRO A 6 -48.538 -4.606 42.470 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -46.197 -3.545 43.514 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -46.580 -5.235 43.780 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -44.747 -4.036 41.642 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -44.413 -5.377 42.720 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -45.264 -5.855 40.178 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -45.797 -6.890 41.488 1.00 0.00 H new ATOM 99 N VAL A 7 -49.064 -2.432 41.696 1.00 0.00 N ATOM 100 CA VAL A 7 -49.483 -1.062 41.270 1.00 0.00 C ATOM 101 C VAL A 7 -49.244 -0.021 42.402 1.00 0.00 C ATOM 102 O VAL A 7 -48.217 0.662 42.464 1.00 0.00 O ATOM 103 CB VAL A 7 -50.863 -1.075 40.501 1.00 0.00 C ATOM 104 CG1 VAL A 7 -51.293 0.320 39.986 1.00 0.00 C ATOM 105 CG2 VAL A 7 -50.899 -2.027 39.280 1.00 0.00 C ATOM 0 H VAL A 7 -49.812 -2.966 42.138 1.00 0.00 H new ATOM 0 HA VAL A 7 -48.828 -0.681 40.487 1.00 0.00 H new ATOM 0 HB VAL A 7 -51.553 -1.430 41.266 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -52.248 0.238 39.468 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -51.395 1.004 40.829 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -50.539 0.702 39.298 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -51.880 -1.977 38.808 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -50.136 -1.727 38.562 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -50.706 -3.048 39.609 1.00 0.00 H new ATOM 115 N THR A 8 -50.224 0.049 43.276 1.00 0.00 N ATOM 116 CA THR A 8 -50.180 0.852 44.552 1.00 0.00 C ATOM 117 C THR A 8 -50.791 0.257 45.872 1.00 0.00 C ATOM 118 O THR A 8 -50.669 0.882 46.932 1.00 0.00 O ATOM 119 CB THR A 8 -50.679 2.314 44.291 1.00 0.00 C ATOM 120 OG1 THR A 8 -50.391 3.133 45.421 1.00 0.00 O ATOM 121 CG2 THR A 8 -52.186 2.469 44.017 1.00 0.00 C ATOM 0 H THR A 8 -51.106 -0.448 43.149 1.00 0.00 H new ATOM 0 HA THR A 8 -49.119 0.820 44.801 1.00 0.00 H new ATOM 0 HB THR A 8 -50.149 2.612 43.387 1.00 0.00 H new ATOM 0 HG1 THR A 8 -50.442 2.593 46.238 1.00 0.00 H new ATOM 0 HG21 THR A 8 -52.419 3.521 43.851 1.00 0.00 H new ATOM 0 HG22 THR A 8 -52.456 1.893 43.132 1.00 0.00 H new ATOM 0 HG23 THR A 8 -52.751 2.103 44.874 1.00 0.00 H new ATOM 129 N ASP A 9 -51.438 -0.899 45.798 1.00 0.00 N ATOM 130 CA ASP A 9 -52.069 -1.613 46.949 1.00 0.00 C ATOM 131 C ASP A 9 -51.910 -3.155 46.715 1.00 0.00 C ATOM 132 O ASP A 9 -51.013 -3.830 47.233 1.00 0.00 O ATOM 133 CB ASP A 9 -53.496 -1.017 47.173 1.00 0.00 C ATOM 134 CG ASP A 9 -54.226 -1.502 48.417 1.00 0.00 C ATOM 135 OD1 ASP A 9 -53.794 -1.167 49.541 1.00 0.00 O ATOM 136 OD2 ASP A 9 -55.262 -2.187 48.279 1.00 0.00 O ATOM 0 H ASP A 9 -51.553 -1.398 44.916 1.00 0.00 H new ATOM 0 HA ASP A 9 -51.585 -1.459 47.913 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -53.412 0.069 47.223 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -54.108 -1.250 46.301 1.00 0.00 H new ATOM 141 N LEU A 10 -52.728 -3.630 45.791 1.00 0.00 N ATOM 142 CA LEU A 10 -52.264 -4.542 44.711 1.00 0.00 C ATOM 143 C LEU A 10 -51.576 -3.817 43.502 1.00 0.00 C ATOM 144 O LEU A 10 -50.935 -4.511 42.678 1.00 0.00 O ATOM 145 CB LEU A 10 -53.409 -5.526 44.313 1.00 0.00 C ATOM 146 CG LEU A 10 -54.748 -5.086 43.642 1.00 0.00 C ATOM 147 CD1 LEU A 10 -55.635 -4.201 44.532 1.00 0.00 C ATOM 148 CD2 LEU A 10 -54.561 -4.423 42.270 1.00 0.00 C ATOM 149 OXT LEU A 10 -51.643 -2.571 43.364 1.00 0.00 O ATOM 0 H LEU A 10 -53.723 -3.410 45.751 1.00 0.00 H new ATOM 0 HA LEU A 10 -51.447 -5.141 45.114 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -52.960 -6.259 43.643 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -53.686 -6.055 45.225 1.00 0.00 H new ATOM 0 HG LEU A 10 -55.272 -6.030 43.492 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -56.545 -3.939 43.993 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -55.895 -4.744 45.441 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -55.094 -3.292 44.795 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -55.534 -4.144 41.865 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -53.944 -3.531 42.378 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -54.073 -5.122 41.591 1.00 0.00 H new TER 161 LEU A 10 ATOM 162 N LYS B 1 -32.088 13.535 40.003 1.00 0.00 N ATOM 163 CA LYS B 1 -32.405 12.072 39.921 1.00 0.00 C ATOM 164 C LYS B 1 -33.929 11.869 40.247 1.00 0.00 C ATOM 165 O LYS B 1 -34.256 11.433 41.350 1.00 0.00 O ATOM 166 CB LYS B 1 -31.379 11.371 40.872 1.00 0.00 C ATOM 167 CG LYS B 1 -31.190 9.834 40.753 1.00 0.00 C ATOM 168 CD LYS B 1 -32.381 8.935 41.148 1.00 0.00 C ATOM 169 CE LYS B 1 -32.807 8.994 42.634 1.00 0.00 C ATOM 170 NZ LYS B 1 -34.031 8.154 42.729 1.00 0.00 N ATOM 0 H1 LYS B 1 -31.081 13.685 39.789 1.00 0.00 H new ATOM 0 H2 LYS B 1 -32.669 14.055 39.315 1.00 0.00 H new ATOM 0 H3 LYS B 1 -32.294 13.882 40.962 1.00 0.00 H new ATOM 0 HA LYS B 1 -32.289 11.620 38.936 1.00 0.00 H new ATOM 0 HB2 LYS B 1 -30.407 11.838 40.713 1.00 0.00 H new ATOM 0 HB3 LYS B 1 -31.674 11.590 41.898 1.00 0.00 H new ATOM 0 HG2 LYS B 1 -30.926 9.607 39.720 1.00 0.00 H new ATOM 0 HG3 LYS B 1 -30.337 9.552 41.370 1.00 0.00 H new ATOM 0 HD2 LYS B 1 -33.238 9.209 40.533 1.00 0.00 H new ATOM 0 HD3 LYS B 1 -32.130 7.903 40.903 1.00 0.00 H new ATOM 0 HE2 LYS B 1 -32.019 8.614 43.284 1.00 0.00 H new ATOM 0 HE3 LYS B 1 -33.009 10.019 42.944 1.00 0.00 H new ATOM 0 HZ1 LYS B 1 -34.228 7.940 43.727 1.00 0.00 H new ATOM 0 HZ2 LYS B 1 -34.837 8.668 42.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 1 -33.884 7.267 42.207 1.00 0.00 H new ATOM 186 N LEU B 2 -34.855 12.328 39.367 1.00 0.00 N ATOM 187 CA LEU B 2 -36.262 12.695 39.761 1.00 0.00 C ATOM 188 C LEU B 2 -36.438 13.531 41.109 1.00 0.00 C ATOM 189 O LEU B 2 -35.418 14.040 41.598 1.00 0.00 O ATOM 190 CB LEU B 2 -37.181 11.465 39.485 1.00 0.00 C ATOM 191 CG LEU B 2 -37.170 10.280 40.482 1.00 0.00 C ATOM 192 CD1 LEU B 2 -38.616 10.003 40.902 1.00 0.00 C ATOM 193 CD2 LEU B 2 -36.553 9.011 39.874 1.00 0.00 C ATOM 0 H LEU B 2 -34.663 12.457 38.374 1.00 0.00 H new ATOM 0 HA LEU B 2 -36.632 13.496 39.121 1.00 0.00 H new ATOM 0 HB2 LEU B 2 -38.206 11.829 39.418 1.00 0.00 H new ATOM 0 HB3 LEU B 2 -36.918 11.071 38.503 1.00 0.00 H new ATOM 0 HG LEU B 2 -36.554 10.551 41.339 1.00 0.00 H new ATOM 0 HD11 LEU B 2 -38.637 9.171 41.606 1.00 0.00 H new ATOM 0 HD12 LEU B 2 -39.033 10.891 41.377 1.00 0.00 H new ATOM 0 HD13 LEU B 2 -39.208 9.750 40.023 1.00 0.00 H new ATOM 0 HD21 LEU B 2 -36.569 8.209 40.612 1.00 0.00 H new ATOM 0 HD22 LEU B 2 -37.129 8.710 38.999 1.00 0.00 H new ATOM 0 HD23 LEU B 2 -35.523 9.213 39.579 1.00 0.00 H new ATOM 205 N PRO B 3 -37.628 13.731 41.746 1.00 0.00 N ATOM 206 CA PRO B 3 -37.717 14.374 43.093 1.00 0.00 C ATOM 207 C PRO B 3 -36.994 13.721 44.346 1.00 0.00 C ATOM 208 O PRO B 3 -36.637 12.528 44.321 1.00 0.00 O ATOM 209 CB PRO B 3 -39.243 14.565 43.209 1.00 0.00 C ATOM 210 CG PRO B 3 -39.727 14.792 41.792 1.00 0.00 C ATOM 211 CD PRO B 3 -38.947 13.706 41.070 1.00 0.00 C ATOM 0 HA PRO B 3 -37.116 15.282 43.139 1.00 0.00 H new ATOM 0 HB2 PRO B 3 -39.717 13.688 43.651 1.00 0.00 H new ATOM 0 HB3 PRO B 3 -39.486 15.414 43.848 1.00 0.00 H new ATOM 0 HG2 PRO B 3 -40.805 14.666 41.695 1.00 0.00 H new ATOM 0 HG3 PRO B 3 -39.489 15.790 41.425 1.00 0.00 H new ATOM 0 HD2 PRO B 3 -39.430 12.733 41.164 1.00 0.00 H new ATOM 0 HD3 PRO B 3 -38.857 13.915 40.004 1.00 0.00 H new ATOM 219 N PRO B 4 -36.727 14.479 45.458 1.00 0.00 N ATOM 220 CA PRO B 4 -35.907 13.988 46.596 1.00 0.00 C ATOM 221 C PRO B 4 -36.633 12.935 47.494 1.00 0.00 C ATOM 222 O PRO B 4 -37.790 13.094 47.895 1.00 0.00 O ATOM 223 CB PRO B 4 -35.551 15.300 47.322 1.00 0.00 C ATOM 224 CG PRO B 4 -36.736 16.230 47.065 1.00 0.00 C ATOM 225 CD PRO B 4 -37.208 15.865 45.658 1.00 0.00 C ATOM 0 HA PRO B 4 -35.030 13.421 46.283 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -35.405 15.133 48.389 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -34.625 15.726 46.936 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -37.526 16.079 47.801 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -36.440 17.277 47.125 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -38.293 15.925 45.574 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -36.793 16.542 44.911 1.00 0.00 H new ATOM 233 N GLY B 5 -35.938 11.824 47.759 1.00 0.00 N ATOM 234 CA GLY B 5 -36.574 10.625 48.366 1.00 0.00 C ATOM 235 C GLY B 5 -37.425 9.721 47.444 1.00 0.00 C ATOM 236 O GLY B 5 -38.431 9.194 47.912 1.00 0.00 O ATOM 0 H GLY B 5 -34.941 11.719 47.568 1.00 0.00 H new ATOM 0 HA2 GLY B 5 -35.786 10.012 48.803 1.00 0.00 H new ATOM 0 HA3 GLY B 5 -37.209 10.960 49.186 1.00 0.00 H new ATOM 240 N TRP B 6 -37.018 9.463 46.193 1.00 0.00 N ATOM 241 CA TRP B 6 -37.626 8.420 45.347 1.00 0.00 C ATOM 242 C TRP B 6 -36.623 7.271 44.994 1.00 0.00 C ATOM 243 O TRP B 6 -35.403 7.467 45.027 1.00 0.00 O ATOM 244 CB TRP B 6 -38.011 9.253 44.099 1.00 0.00 C ATOM 245 CG TRP B 6 -39.424 9.848 44.098 1.00 0.00 C ATOM 246 CD1 TRP B 6 -39.740 11.193 44.351 1.00 0.00 C ATOM 247 CD2 TRP B 6 -40.594 9.284 43.638 1.00 0.00 C ATOM 248 NE1 TRP B 6 -41.086 11.485 44.091 1.00 0.00 N ATOM 249 CE2 TRP B 6 -41.595 10.292 43.651 1.00 0.00 C ATOM 250 CE3 TRP B 6 -40.860 8.023 43.050 1.00 0.00 C ATOM 251 CZ2 TRP B 6 -42.865 10.040 43.114 1.00 0.00 C ATOM 252 CZ3 TRP B 6 -42.185 7.741 42.702 1.00 0.00 C ATOM 253 CH2 TRP B 6 -43.171 8.738 42.717 1.00 0.00 C ATOM 0 H TRP B 6 -36.259 9.970 45.737 1.00 0.00 H new ATOM 0 HA TRP B 6 -38.455 7.893 45.818 1.00 0.00 H new ATOM 0 HB2 TRP B 6 -37.295 10.068 43.996 1.00 0.00 H new ATOM 0 HB3 TRP B 6 -37.904 8.621 43.218 1.00 0.00 H new ATOM 0 HD1 TRP B 6 -39.026 11.921 44.706 1.00 0.00 H new ATOM 0 HE1 TRP B 6 -41.571 12.375 44.203 1.00 0.00 H new ATOM 0 HE3 TRP B 6 -40.070 7.307 42.877 1.00 0.00 H new ATOM 0 HZ2 TRP B 6 -43.589 10.835 43.010 1.00 0.00 H new ATOM 0 HZ3 TRP B 6 -42.454 6.735 42.416 1.00 0.00 H new ATOM 0 HH2 TRP B 6 -44.180 8.495 42.418 1.00 0.00 H new ATOM 264 N GLU B 7 -37.124 6.115 44.511 1.00 0.00 N ATOM 265 CA GLU B 7 -36.367 5.275 43.554 1.00 0.00 C ATOM 266 C GLU B 7 -37.263 4.245 42.776 1.00 0.00 C ATOM 267 O GLU B 7 -38.238 3.680 43.282 1.00 0.00 O ATOM 268 CB GLU B 7 -35.125 4.551 44.188 1.00 0.00 C ATOM 269 CG GLU B 7 -33.743 4.763 43.498 1.00 0.00 C ATOM 270 CD GLU B 7 -33.685 4.779 41.980 1.00 0.00 C ATOM 271 OE1 GLU B 7 -34.025 5.823 41.390 1.00 0.00 O ATOM 272 OE2 GLU B 7 -33.333 3.758 41.366 1.00 0.00 O ATOM 0 H GLU B 7 -38.040 5.743 44.763 1.00 0.00 H new ATOM 0 HA GLU B 7 -35.986 5.994 42.828 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -35.038 4.877 45.224 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -35.332 3.481 44.207 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -33.336 5.709 43.855 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -33.074 3.976 43.847 1.00 0.00 H new ATOM 279 N LYS B 8 -36.841 3.945 41.543 1.00 0.00 N ATOM 280 CA LYS B 8 -37.303 2.747 40.776 1.00 0.00 C ATOM 281 C LYS B 8 -36.818 1.364 41.339 1.00 0.00 C ATOM 282 O LYS B 8 -35.646 1.183 41.689 1.00 0.00 O ATOM 283 CB LYS B 8 -37.067 2.971 39.248 1.00 0.00 C ATOM 284 CG LYS B 8 -35.623 2.885 38.693 1.00 0.00 C ATOM 285 CD LYS B 8 -35.143 1.433 38.408 1.00 0.00 C ATOM 286 CE LYS B 8 -33.646 1.160 38.657 1.00 0.00 C ATOM 287 NZ LYS B 8 -33.324 1.400 40.101 1.00 0.00 N ATOM 0 H LYS B 8 -36.168 4.518 41.034 1.00 0.00 H new ATOM 0 HA LYS B 8 -38.379 2.658 40.925 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -37.671 2.240 38.711 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -37.459 3.956 38.995 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -35.563 3.464 37.772 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -34.942 3.349 39.406 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -35.725 0.750 39.027 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -35.369 1.193 37.369 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -33.403 0.132 38.386 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -33.038 1.808 38.026 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -32.530 0.791 40.386 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -33.061 2.397 40.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -34.156 1.179 40.684 1.00 0.00 H new ATOM 301 N ARG B 9 -37.707 0.357 41.394 1.00 0.00 N ATOM 302 CA ARG B 9 -37.339 -1.044 41.724 1.00 0.00 C ATOM 303 C ARG B 9 -37.814 -1.991 40.560 1.00 0.00 C ATOM 304 O ARG B 9 -38.093 -1.557 39.438 1.00 0.00 O ATOM 305 CB ARG B 9 -37.891 -1.358 43.152 1.00 0.00 C ATOM 306 CG ARG B 9 -37.467 -0.374 44.276 1.00 0.00 C ATOM 307 CD ARG B 9 -37.555 -0.984 45.678 1.00 0.00 C ATOM 308 NE ARG B 9 -37.392 0.118 46.664 1.00 0.00 N ATOM 309 CZ ARG B 9 -38.327 0.587 47.473 1.00 0.00 C ATOM 310 NH1 ARG B 9 -39.524 0.080 47.587 1.00 0.00 N ATOM 311 NH2 ARG B 9 -38.033 1.614 48.190 1.00 0.00 N ATOM 0 H ARG B 9 -38.703 0.484 41.212 1.00 0.00 H new ATOM 0 HA ARG B 9 -36.263 -1.211 41.781 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -38.980 -1.376 43.103 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -37.568 -2.360 43.433 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -36.444 -0.044 44.094 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -38.100 0.512 44.232 1.00 0.00 H new ATOM 0 HD2 ARG B 9 -38.514 -1.483 45.818 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -36.780 -1.738 45.816 1.00 0.00 H new ATOM 0 HE ARG B 9 -36.471 0.553 46.721 1.00 0.00 H new ATOM 0 HH11 ARG B 9 -39.789 -0.732 47.030 1.00 0.00 H new ATOM 0 HH12 ARG B 9 -40.195 0.496 48.233 1.00 0.00 H new ATOM 0 HH21 ARG B 9 -37.107 2.036 48.121 1.00 0.00 H new ATOM 0 HH22 ARG B 9 -38.726 2.007 48.827 1.00 0.00 H new ATOM 325 N MET B 10 -37.884 -3.299 40.814 1.00 0.00 N ATOM 326 CA MET B 10 -38.502 -4.280 39.867 1.00 0.00 C ATOM 327 C MET B 10 -39.998 -4.613 40.225 1.00 0.00 C ATOM 328 O MET B 10 -40.506 -4.201 41.265 1.00 0.00 O ATOM 329 CB MET B 10 -37.534 -5.486 39.680 1.00 0.00 C ATOM 330 CG MET B 10 -37.540 -6.626 40.722 1.00 0.00 C ATOM 331 SD MET B 10 -37.059 -6.071 42.371 1.00 0.00 S ATOM 332 CE MET B 10 -38.668 -5.895 43.165 1.00 0.00 C ATOM 0 H MET B 10 -37.523 -3.723 41.668 1.00 0.00 H new ATOM 0 HA MET B 10 -38.614 -3.838 38.877 1.00 0.00 H new ATOM 0 HB2 MET B 10 -37.747 -5.930 38.707 1.00 0.00 H new ATOM 0 HB3 MET B 10 -36.520 -5.089 39.634 1.00 0.00 H new ATOM 0 HG2 MET B 10 -38.537 -7.065 40.768 1.00 0.00 H new ATOM 0 HG3 MET B 10 -36.860 -7.413 40.396 1.00 0.00 H new ATOM 0 HE1 MET B 10 -38.960 -4.845 43.166 1.00 0.00 H new ATOM 0 HE2 MET B 10 -39.409 -6.478 42.618 1.00 0.00 H new ATOM 0 HE3 MET B 10 -38.608 -6.256 44.192 1.00 0.00 H new ATOM 342 N SER B 11 -40.720 -5.350 39.362 1.00 0.00 N ATOM 343 CA SER B 11 -42.151 -5.735 39.604 1.00 0.00 C ATOM 344 C SER B 11 -42.371 -6.781 40.772 1.00 0.00 C ATOM 345 O SER B 11 -41.927 -6.524 41.892 1.00 0.00 O ATOM 346 CB SER B 11 -42.724 -6.117 38.212 1.00 0.00 C ATOM 347 OG SER B 11 -42.090 -7.279 37.667 1.00 0.00 O ATOM 0 H SER B 11 -40.346 -5.700 38.480 1.00 0.00 H new ATOM 0 HA SER B 11 -42.722 -4.902 40.014 1.00 0.00 H new ATOM 0 HB2 SER B 11 -43.796 -6.297 38.299 1.00 0.00 H new ATOM 0 HB3 SER B 11 -42.596 -5.280 37.526 1.00 0.00 H new ATOM 0 HG SER B 11 -42.764 -7.970 37.498 1.00 0.00 H new ATOM 353 N ARG B 12 -43.026 -7.954 40.591 1.00 0.00 N ATOM 354 CA ARG B 12 -42.958 -9.059 41.613 1.00 0.00 C ATOM 355 C ARG B 12 -41.639 -9.914 41.506 1.00 0.00 C ATOM 356 O ARG B 12 -41.635 -11.054 41.035 1.00 0.00 O ATOM 357 CB ARG B 12 -44.287 -9.870 41.718 1.00 0.00 C ATOM 358 CG ARG B 12 -45.018 -10.417 40.466 1.00 0.00 C ATOM 359 CD ARG B 12 -44.213 -11.369 39.566 1.00 0.00 C ATOM 360 NE ARG B 12 -45.082 -11.750 38.425 1.00 0.00 N ATOM 361 CZ ARG B 12 -44.668 -12.067 37.211 1.00 0.00 C ATOM 362 NH1 ARG B 12 -43.442 -12.380 36.921 1.00 0.00 N ATOM 363 NH2 ARG B 12 -45.532 -12.022 36.258 1.00 0.00 N ATOM 0 H ARG B 12 -43.597 -8.169 39.773 1.00 0.00 H new ATOM 0 HA ARG B 12 -42.872 -8.585 42.591 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -44.083 -10.726 42.361 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -45.000 -9.237 42.247 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -45.917 -10.937 40.796 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -45.343 -9.569 39.863 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -43.305 -10.883 39.210 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -43.904 -12.253 40.124 1.00 0.00 H new ATOM 0 HE ARG B 12 -46.088 -11.769 38.593 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -42.732 -12.391 37.653 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -43.189 -12.615 35.961 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -46.495 -11.749 36.455 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -45.254 -12.259 35.306 1.00 0.00 H new ATOM 377 N SER B 13 -40.495 -9.338 41.928 1.00 0.00 N ATOM 378 CA SER B 13 -39.132 -9.958 41.819 1.00 0.00 C ATOM 379 C SER B 13 -38.498 -10.166 40.394 1.00 0.00 C ATOM 380 O SER B 13 -37.275 -10.079 40.273 1.00 0.00 O ATOM 381 CB SER B 13 -38.987 -11.216 42.713 1.00 0.00 C ATOM 382 OG SER B 13 -37.611 -11.567 42.885 1.00 0.00 O ATOM 0 H SER B 13 -40.477 -8.415 42.362 1.00 0.00 H new ATOM 0 HA SER B 13 -38.508 -9.153 42.208 1.00 0.00 H new ATOM 0 HB2 SER B 13 -39.443 -11.030 43.685 1.00 0.00 H new ATOM 0 HB3 SER B 13 -39.525 -12.050 42.263 1.00 0.00 H new ATOM 0 HG SER B 13 -37.545 -12.362 43.454 1.00 0.00 H new ATOM 388 N SER B 14 -39.275 -10.485 39.343 1.00 0.00 N ATOM 389 CA SER B 14 -38.740 -10.787 37.986 1.00 0.00 C ATOM 390 C SER B 14 -39.710 -10.298 36.857 1.00 0.00 C ATOM 391 O SER B 14 -40.820 -10.821 36.683 1.00 0.00 O ATOM 392 CB SER B 14 -38.447 -12.305 37.896 1.00 0.00 C ATOM 393 OG SER B 14 -37.837 -12.625 36.644 1.00 0.00 O ATOM 0 H SER B 14 -40.292 -10.543 39.402 1.00 0.00 H new ATOM 0 HA SER B 14 -37.811 -10.239 37.830 1.00 0.00 H new ATOM 0 HB2 SER B 14 -37.791 -12.603 38.713 1.00 0.00 H new ATOM 0 HB3 SER B 14 -39.374 -12.867 38.010 1.00 0.00 H new ATOM 0 HG SER B 14 -37.657 -13.588 36.604 1.00 0.00 H new ATOM 399 N GLY B 15 -39.281 -9.296 36.074 1.00 0.00 N ATOM 400 CA GLY B 15 -39.867 -9.009 34.732 1.00 0.00 C ATOM 401 C GLY B 15 -39.813 -7.539 34.269 1.00 0.00 C ATOM 402 O GLY B 15 -39.228 -7.222 33.236 1.00 0.00 O ATOM 0 H GLY B 15 -38.527 -8.662 36.339 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -39.349 -9.621 33.993 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -40.909 -9.329 34.737 1.00 0.00 H new ATOM 406 N ARG B 16 -40.508 -6.663 34.999 1.00 0.00 N ATOM 407 CA ARG B 16 -40.568 -5.202 34.701 1.00 0.00 C ATOM 408 C ARG B 16 -40.347 -4.357 36.006 1.00 0.00 C ATOM 409 O ARG B 16 -39.398 -4.614 36.746 1.00 0.00 O ATOM 410 CB ARG B 16 -41.782 -4.888 33.756 1.00 0.00 C ATOM 411 CG ARG B 16 -43.180 -5.476 34.094 1.00 0.00 C ATOM 412 CD ARG B 16 -43.443 -6.864 33.475 1.00 0.00 C ATOM 413 NE ARG B 16 -44.828 -7.345 33.730 1.00 0.00 N ATOM 414 CZ ARG B 16 -45.913 -7.065 33.027 1.00 0.00 C ATOM 415 NH1 ARG B 16 -45.952 -6.195 32.062 1.00 0.00 N ATOM 416 NH2 ARG B 16 -46.988 -7.706 33.339 1.00 0.00 N ATOM 0 H ARG B 16 -41.052 -6.933 35.819 1.00 0.00 H new ATOM 0 HA ARG B 16 -39.730 -4.861 34.094 1.00 0.00 H new ATOM 0 HB2 ARG B 16 -41.886 -3.804 33.705 1.00 0.00 H new ATOM 0 HB3 ARG B 16 -41.516 -5.230 32.756 1.00 0.00 H new ATOM 0 HG2 ARG B 16 -43.281 -5.548 35.177 1.00 0.00 H new ATOM 0 HG3 ARG B 16 -43.947 -4.784 33.748 1.00 0.00 H new ATOM 0 HD2 ARG B 16 -43.269 -6.818 32.400 1.00 0.00 H new ATOM 0 HD3 ARG B 16 -42.731 -7.582 33.883 1.00 0.00 H new ATOM 0 HE ARG B 16 -44.955 -7.958 34.535 1.00 0.00 H new ATOM 0 HH11 ARG B 16 -45.110 -5.679 31.806 1.00 0.00 H new ATOM 0 HH12 ARG B 16 -46.824 -6.028 31.561 1.00 0.00 H new ATOM 0 HH21 ARG B 16 -46.973 -8.390 34.096 1.00 0.00 H new ATOM 0 HH22 ARG B 16 -47.853 -7.529 32.829 1.00 0.00 H new ATOM 430 N VAL B 17 -41.164 -3.332 36.277 1.00 0.00 N ATOM 431 CA VAL B 17 -40.794 -2.179 37.169 1.00 0.00 C ATOM 432 C VAL B 17 -41.973 -1.725 38.101 1.00 0.00 C ATOM 433 O VAL B 17 -43.134 -1.702 37.690 1.00 0.00 O ATOM 434 CB VAL B 17 -40.247 -1.021 36.249 1.00 0.00 C ATOM 435 CG1 VAL B 17 -41.256 -0.486 35.205 1.00 0.00 C ATOM 436 CG2 VAL B 17 -39.673 0.206 36.993 1.00 0.00 C ATOM 0 H VAL B 17 -42.106 -3.260 35.893 1.00 0.00 H new ATOM 0 HA VAL B 17 -40.015 -2.487 37.867 1.00 0.00 H new ATOM 0 HB VAL B 17 -39.435 -1.545 35.744 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -40.789 0.307 34.621 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -41.557 -1.297 34.541 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -42.134 -0.091 35.717 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -39.325 0.941 36.268 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -40.450 0.650 37.616 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -38.839 -0.107 37.621 1.00 0.00 H new ATOM 446 N TYR B 18 -41.675 -1.251 39.321 1.00 0.00 N ATOM 447 CA TYR B 18 -42.471 -0.152 39.953 1.00 0.00 C ATOM 448 C TYR B 18 -41.517 1.029 40.343 1.00 0.00 C ATOM 449 O TYR B 18 -40.293 0.854 40.410 1.00 0.00 O ATOM 450 CB TYR B 18 -43.352 -0.697 41.117 1.00 0.00 C ATOM 451 CG TYR B 18 -42.657 -1.141 42.421 1.00 0.00 C ATOM 452 CD1 TYR B 18 -42.210 -0.203 43.359 1.00 0.00 C ATOM 453 CD2 TYR B 18 -42.470 -2.498 42.679 1.00 0.00 C ATOM 454 CE1 TYR B 18 -41.577 -0.621 44.527 1.00 0.00 C ATOM 455 CE2 TYR B 18 -41.843 -2.918 43.849 1.00 0.00 C ATOM 456 CZ TYR B 18 -41.406 -1.979 44.778 1.00 0.00 C ATOM 457 OH TYR B 18 -40.811 -2.390 45.941 1.00 0.00 O ATOM 0 H TYR B 18 -40.904 -1.596 39.893 1.00 0.00 H new ATOM 0 HA TYR B 18 -43.186 0.259 39.240 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -44.077 0.076 41.374 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -43.916 -1.548 40.735 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -42.357 0.851 43.176 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -42.815 -3.231 41.964 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -41.219 0.109 45.238 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -41.696 -3.972 44.035 1.00 0.00 H new ATOM 0 HH TYR B 18 -40.770 -3.369 45.959 1.00 0.00 H new ATOM 467 N TYR B 19 -42.033 2.234 40.657 1.00 0.00 N ATOM 468 CA TYR B 19 -41.169 3.339 41.168 1.00 0.00 C ATOM 469 C TYR B 19 -41.838 4.051 42.385 1.00 0.00 C ATOM 470 O TYR B 19 -43.039 4.329 42.375 1.00 0.00 O ATOM 471 CB TYR B 19 -40.648 4.184 39.958 1.00 0.00 C ATOM 472 CG TYR B 19 -41.328 5.476 39.629 1.00 0.00 C ATOM 473 CD1 TYR B 19 -42.682 5.412 39.311 1.00 0.00 C ATOM 474 CD2 TYR B 19 -40.673 6.714 39.662 1.00 0.00 C ATOM 475 CE1 TYR B 19 -43.404 6.575 39.237 1.00 0.00 C ATOM 476 CE2 TYR B 19 -41.425 7.877 39.575 1.00 0.00 C ATOM 477 CZ TYR B 19 -42.812 7.793 39.473 1.00 0.00 C ATOM 478 OH TYR B 19 -43.646 8.863 39.589 1.00 0.00 O ATOM 0 H TYR B 19 -43.021 2.473 40.572 1.00 0.00 H new ATOM 0 HA TYR B 19 -40.245 2.988 41.628 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -39.595 4.403 40.138 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -40.695 3.552 39.071 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -43.157 4.460 39.125 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -39.598 6.763 39.754 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -44.454 6.534 38.989 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -40.938 8.841 39.586 1.00 0.00 H new ATOM 0 HH TYR B 19 -44.438 8.723 39.029 1.00 0.00 H new ATOM 488 N PHE B 20 -41.076 4.246 43.468 1.00 0.00 N ATOM 489 CA PHE B 20 -41.624 4.398 44.840 1.00 0.00 C ATOM 490 C PHE B 20 -41.082 5.678 45.543 1.00 0.00 C ATOM 491 O PHE B 20 -39.867 5.869 45.657 1.00 0.00 O ATOM 492 CB PHE B 20 -41.264 3.062 45.558 1.00 0.00 C ATOM 493 CG PHE B 20 -41.575 2.975 47.064 1.00 0.00 C ATOM 494 CD1 PHE B 20 -40.664 3.476 47.981 1.00 0.00 C ATOM 495 CD2 PHE B 20 -42.751 2.403 47.522 1.00 0.00 C ATOM 496 CE1 PHE B 20 -40.916 3.400 49.346 1.00 0.00 C ATOM 497 CE2 PHE B 20 -43.016 2.325 48.885 1.00 0.00 C ATOM 498 CZ PHE B 20 -42.100 2.807 49.855 1.00 0.00 C ATOM 0 H PHE B 20 -40.058 4.304 43.428 1.00 0.00 H new ATOM 0 HA PHE B 20 -42.703 4.555 44.854 1.00 0.00 H new ATOM 0 HB2 PHE B 20 -41.794 2.253 45.055 1.00 0.00 H new ATOM 0 HB3 PHE B 20 -40.198 2.879 45.420 1.00 0.00 H new ATOM 0 HD1 PHE B 20 -39.749 3.930 47.631 1.00 0.00 H new ATOM 0 HD2 PHE B 20 -43.468 2.014 46.814 1.00 0.00 H new ATOM 0 HE1 PHE B 20 -40.191 3.803 50.038 1.00 0.00 H new ATOM 0 HE2 PHE B 20 -43.946 1.885 49.214 1.00 0.00 H new ATOM 0 HZ PHE B 20 -42.292 2.727 50.915 1.00 0.00 H new ATOM 508 N ASN B 21 -41.978 6.504 46.101 1.00 0.00 N ATOM 509 CA ASN B 21 -41.580 7.628 46.987 1.00 0.00 C ATOM 510 C ASN B 21 -41.345 7.116 48.450 1.00 0.00 C ATOM 511 O ASN B 21 -42.261 6.598 49.084 1.00 0.00 O ATOM 512 CB ASN B 21 -42.681 8.729 46.912 1.00 0.00 C ATOM 513 CG ASN B 21 -42.334 10.190 47.217 1.00 0.00 C ATOM 514 OD1 ASN B 21 -43.022 11.110 46.798 1.00 0.00 O ATOM 515 ND2 ASN B 21 -41.314 10.488 47.972 1.00 0.00 N ATOM 0 H ASN B 21 -42.985 6.422 45.960 1.00 0.00 H new ATOM 0 HA ASN B 21 -40.635 8.060 46.656 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -43.099 8.700 45.906 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -43.477 8.437 47.597 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -41.112 11.463 48.195 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -40.718 9.747 48.340 1.00 0.00 H new ATOM 522 N HIS B 22 -40.144 7.298 49.011 1.00 0.00 N ATOM 523 CA HIS B 22 -39.872 7.060 50.465 1.00 0.00 C ATOM 524 C HIS B 22 -40.631 8.001 51.469 1.00 0.00 C ATOM 525 O HIS B 22 -41.125 7.523 52.490 1.00 0.00 O ATOM 526 CB HIS B 22 -38.334 7.104 50.682 1.00 0.00 C ATOM 527 CG HIS B 22 -37.586 5.843 50.258 1.00 0.00 C ATOM 528 ND1 HIS B 22 -37.159 4.899 51.162 1.00 0.00 N ATOM 529 CD2 HIS B 22 -37.197 5.473 48.958 1.00 0.00 C ATOM 530 CE1 HIS B 22 -36.499 4.045 50.330 1.00 0.00 C ATOM 531 NE2 HIS B 22 -36.490 4.274 48.976 1.00 0.00 N ATOM 0 H HIS B 22 -39.327 7.612 48.488 1.00 0.00 H new ATOM 0 HA HIS B 22 -40.279 6.078 50.705 1.00 0.00 H new ATOM 0 HB2 HIS B 22 -37.928 7.952 50.130 1.00 0.00 H new ATOM 0 HB3 HIS B 22 -38.136 7.288 51.738 1.00 0.00 H new ATOM 0 HD1 HIS B 22 -37.297 4.851 52.171 1.00 0.00 H new ATOM 0 HD2 HIS B 22 -37.417 6.042 48.067 1.00 0.00 H new ATOM 0 HE1 HIS B 22 -35.983 3.188 50.736 1.00 0.00 H new ATOM 539 N ILE B 23 -40.737 9.314 51.189 1.00 0.00 N ATOM 540 CA ILE B 23 -41.504 10.286 52.040 1.00 0.00 C ATOM 541 C ILE B 23 -43.065 10.045 52.019 1.00 0.00 C ATOM 542 O ILE B 23 -43.691 9.970 53.077 1.00 0.00 O ATOM 543 CB ILE B 23 -41.100 11.771 51.683 1.00 0.00 C ATOM 544 CG1 ILE B 23 -39.577 12.083 51.525 1.00 0.00 C ATOM 545 CG2 ILE B 23 -41.717 12.810 52.658 1.00 0.00 C ATOM 546 CD1 ILE B 23 -38.672 11.719 52.719 1.00 0.00 C ATOM 0 H ILE B 23 -40.301 9.744 50.373 1.00 0.00 H new ATOM 0 HA ILE B 23 -41.218 10.105 53.076 1.00 0.00 H new ATOM 0 HB ILE B 23 -41.527 11.865 50.684 1.00 0.00 H new ATOM 0 HG12 ILE B 23 -39.210 11.554 50.645 1.00 0.00 H new ATOM 0 HG13 ILE B 23 -39.466 13.149 51.326 1.00 0.00 H new ATOM 0 HG21 ILE B 23 -41.406 13.813 52.365 1.00 0.00 H new ATOM 0 HG22 ILE B 23 -42.804 12.742 52.622 1.00 0.00 H new ATOM 0 HG23 ILE B 23 -41.374 12.605 53.672 1.00 0.00 H new ATOM 0 HD11 ILE B 23 -37.640 11.983 52.487 1.00 0.00 H new ATOM 0 HD12 ILE B 23 -38.998 12.268 53.603 1.00 0.00 H new ATOM 0 HD13 ILE B 23 -38.737 10.648 52.912 1.00 0.00 H new ATOM 558 N THR B 24 -43.688 9.931 50.832 1.00 0.00 N ATOM 559 CA THR B 24 -45.134 9.548 50.684 1.00 0.00 C ATOM 560 C THR B 24 -45.509 8.028 50.907 1.00 0.00 C ATOM 561 O THR B 24 -46.668 7.734 51.199 1.00 0.00 O ATOM 562 CB THR B 24 -45.642 10.199 49.341 1.00 0.00 C ATOM 563 OG1 THR B 24 -46.466 11.320 49.639 1.00 0.00 O ATOM 564 CG2 THR B 24 -46.457 9.335 48.369 1.00 0.00 C ATOM 0 H THR B 24 -43.219 10.098 49.942 1.00 0.00 H new ATOM 0 HA THR B 24 -45.690 9.953 51.530 1.00 0.00 H new ATOM 0 HB THR B 24 -44.705 10.423 48.832 1.00 0.00 H new ATOM 0 HG1 THR B 24 -46.781 11.726 48.804 1.00 0.00 H new ATOM 0 HG21 THR B 24 -46.730 9.928 47.496 1.00 0.00 H new ATOM 0 HG22 THR B 24 -45.859 8.480 48.054 1.00 0.00 H new ATOM 0 HG23 THR B 24 -47.361 8.983 48.866 1.00 0.00 H new ATOM 572 N ASN B 25 -44.576 7.081 50.726 1.00 0.00 N ATOM 573 CA ASN B 25 -44.803 5.597 50.768 1.00 0.00 C ATOM 574 C ASN B 25 -45.591 4.899 49.591 1.00 0.00 C ATOM 575 O ASN B 25 -45.966 3.730 49.710 1.00 0.00 O ATOM 576 CB ASN B 25 -45.020 5.073 52.227 1.00 0.00 C ATOM 577 CG ASN B 25 -46.416 4.653 52.697 1.00 0.00 C ATOM 578 OD1 ASN B 25 -46.694 3.485 52.938 1.00 0.00 O ATOM 579 ND2 ASN B 25 -47.332 5.558 52.892 1.00 0.00 N ATOM 0 H ASN B 25 -43.602 7.318 50.538 1.00 0.00 H new ATOM 0 HA ASN B 25 -43.845 5.181 50.456 1.00 0.00 H new ATOM 0 HB2 ASN B 25 -44.362 4.215 52.363 1.00 0.00 H new ATOM 0 HB3 ASN B 25 -44.672 5.852 52.905 1.00 0.00 H new ATOM 0 HD21 ASN B 25 -48.253 5.286 53.237 1.00 0.00 H new ATOM 0 HD22 ASN B 25 -47.129 6.539 52.700 1.00 0.00 H new ATOM 586 N ALA B 26 -45.781 5.563 48.437 1.00 0.00 N ATOM 587 CA ALA B 26 -46.544 5.006 47.289 1.00 0.00 C ATOM 588 C ALA B 26 -45.646 4.583 46.078 1.00 0.00 C ATOM 589 O ALA B 26 -44.886 5.385 45.523 1.00 0.00 O ATOM 590 CB ALA B 26 -47.572 6.082 46.887 1.00 0.00 C ATOM 0 H ALA B 26 -45.414 6.499 48.267 1.00 0.00 H new ATOM 0 HA ALA B 26 -47.029 4.078 47.592 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -48.163 5.724 46.044 1.00 0.00 H new ATOM 0 HB2 ALA B 26 -48.231 6.289 47.730 1.00 0.00 H new ATOM 0 HB3 ALA B 26 -47.050 6.996 46.602 1.00 0.00 H new ATOM 596 N SER B 27 -45.799 3.329 45.628 1.00 0.00 N ATOM 597 CA SER B 27 -45.426 2.900 44.250 1.00 0.00 C ATOM 598 C SER B 27 -46.470 3.332 43.172 1.00 0.00 C ATOM 599 O SER B 27 -47.683 3.281 43.387 1.00 0.00 O ATOM 600 CB SER B 27 -45.291 1.356 44.268 1.00 0.00 C ATOM 601 OG SER B 27 -46.516 0.683 44.581 1.00 0.00 O ATOM 0 H SER B 27 -46.183 2.576 46.199 1.00 0.00 H new ATOM 0 HA SER B 27 -44.490 3.386 43.974 1.00 0.00 H new ATOM 0 HB2 SER B 27 -44.938 1.018 43.294 1.00 0.00 H new ATOM 0 HB3 SER B 27 -44.533 1.073 44.998 1.00 0.00 H new ATOM 0 HG SER B 27 -47.130 0.751 43.820 1.00 0.00 H new ATOM 607 N GLN B 28 -45.992 3.680 41.976 1.00 0.00 N ATOM 608 CA GLN B 28 -46.813 3.614 40.734 1.00 0.00 C ATOM 609 C GLN B 28 -45.941 3.127 39.518 1.00 0.00 C ATOM 610 O GLN B 28 -44.835 2.597 39.677 1.00 0.00 O ATOM 611 CB GLN B 28 -47.637 4.927 40.553 1.00 0.00 C ATOM 612 CG GLN B 28 -46.831 6.186 40.199 1.00 0.00 C ATOM 613 CD GLN B 28 -47.725 7.352 39.759 1.00 0.00 C ATOM 614 OE1 GLN B 28 -48.232 8.152 40.533 1.00 0.00 O ATOM 615 NE2 GLN B 28 -47.959 7.404 38.471 1.00 0.00 N ATOM 0 H GLN B 28 -45.040 4.013 41.826 1.00 0.00 H new ATOM 0 HA GLN B 28 -47.583 2.846 40.808 1.00 0.00 H new ATOM 0 HB2 GLN B 28 -48.378 4.762 39.771 1.00 0.00 H new ATOM 0 HB3 GLN B 28 -48.185 5.118 41.476 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -46.241 6.491 41.064 1.00 0.00 H new ATOM 0 HG3 GLN B 28 -46.128 5.950 39.400 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -47.524 6.725 37.846 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -48.576 8.123 38.093 1.00 0.00 H new ATOM 624 N TRP B 29 -46.451 3.294 38.290 1.00 0.00 N ATOM 625 CA TRP B 29 -45.700 2.964 37.037 1.00 0.00 C ATOM 626 C TRP B 29 -45.196 4.200 36.198 1.00 0.00 C ATOM 627 O TRP B 29 -44.464 3.969 35.234 1.00 0.00 O ATOM 628 CB TRP B 29 -46.571 1.980 36.198 1.00 0.00 C ATOM 629 CG TRP B 29 -46.766 0.566 36.738 1.00 0.00 C ATOM 630 CD1 TRP B 29 -47.494 0.244 37.889 1.00 0.00 C ATOM 631 CD2 TRP B 29 -46.216 -0.630 36.292 1.00 0.00 C ATOM 632 NE1 TRP B 29 -47.358 -1.101 38.219 1.00 0.00 N ATOM 633 CE2 TRP B 29 -46.591 -1.629 37.212 1.00 0.00 C ATOM 634 CE3 TRP B 29 -45.357 -0.949 35.200 1.00 0.00 C ATOM 635 CZ2 TRP B 29 -46.106 -2.941 37.083 1.00 0.00 C ATOM 636 CZ3 TRP B 29 -44.917 -2.271 35.065 1.00 0.00 C ATOM 637 CH2 TRP B 29 -45.295 -3.253 35.993 1.00 0.00 C ATOM 0 H TRP B 29 -47.389 3.658 38.121 1.00 0.00 H new ATOM 0 HA TRP B 29 -44.763 2.492 37.333 1.00 0.00 H new ATOM 0 HB2 TRP B 29 -47.556 2.429 36.071 1.00 0.00 H new ATOM 0 HB3 TRP B 29 -46.126 1.901 35.206 1.00 0.00 H new ATOM 0 HD1 TRP B 29 -48.087 0.951 38.451 1.00 0.00 H new ATOM 0 HE1 TRP B 29 -47.743 -1.586 39.029 1.00 0.00 H new ATOM 0 HE3 TRP B 29 -45.053 -0.190 34.495 1.00 0.00 H new ATOM 0 HZ2 TRP B 29 -46.357 -3.694 37.815 1.00 0.00 H new ATOM 0 HZ3 TRP B 29 -44.278 -2.538 34.236 1.00 0.00 H new ATOM 0 HH2 TRP B 29 -44.952 -4.268 35.861 1.00 0.00 H new ATOM 648 N GLU B 30 -45.535 5.471 36.535 1.00 0.00 N ATOM 649 CA GLU B 30 -45.042 6.674 35.805 1.00 0.00 C ATOM 650 C GLU B 30 -44.730 7.929 36.702 1.00 0.00 C ATOM 651 O GLU B 30 -45.446 8.358 37.607 1.00 0.00 O ATOM 652 CB GLU B 30 -46.084 7.053 34.712 1.00 0.00 C ATOM 653 CG GLU B 30 -45.886 8.391 33.932 1.00 0.00 C ATOM 654 CD GLU B 30 -44.615 8.667 33.118 1.00 0.00 C ATOM 655 OE1 GLU B 30 -43.534 8.124 33.423 1.00 0.00 O ATOM 656 OE2 GLU B 30 -44.652 9.565 32.252 1.00 0.00 O ATOM 0 H GLU B 30 -46.154 5.693 37.315 1.00 0.00 H new ATOM 0 HA GLU B 30 -44.080 6.393 35.376 1.00 0.00 H new ATOM 0 HB2 GLU B 30 -46.110 6.244 33.982 1.00 0.00 H new ATOM 0 HB3 GLU B 30 -47.065 7.086 35.186 1.00 0.00 H new ATOM 0 HG2 GLU B 30 -46.728 8.484 33.246 1.00 0.00 H new ATOM 0 HG3 GLU B 30 -45.977 9.198 34.659 1.00 0.00 H new ATOM 663 N ARG B 31 -43.566 8.465 36.399 1.00 0.00 N ATOM 664 CA ARG B 31 -42.964 9.758 36.845 1.00 0.00 C ATOM 665 C ARG B 31 -43.811 10.946 37.432 1.00 0.00 C ATOM 666 O ARG B 31 -44.860 11.257 36.860 1.00 0.00 O ATOM 667 CB ARG B 31 -42.211 10.014 35.538 1.00 0.00 C ATOM 668 CG ARG B 31 -41.168 11.131 35.396 1.00 0.00 C ATOM 669 CD ARG B 31 -40.351 10.916 34.102 1.00 0.00 C ATOM 670 NE ARG B 31 -41.271 10.788 32.925 1.00 0.00 N ATOM 671 CZ ARG B 31 -41.763 11.782 32.206 1.00 0.00 C ATOM 672 NH1 ARG B 31 -41.166 12.923 32.065 1.00 0.00 N ATOM 673 NH2 ARG B 31 -42.898 11.609 31.613 1.00 0.00 N ATOM 0 H ARG B 31 -42.932 7.974 35.769 1.00 0.00 H new ATOM 0 HA ARG B 31 -42.421 9.689 37.787 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -41.708 9.082 35.279 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -42.966 10.192 34.772 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -41.662 12.102 35.369 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -40.504 11.135 36.261 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -39.669 11.753 33.951 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -39.739 10.019 34.194 1.00 0.00 H new ATOM 0 HE ARG B 31 -41.543 9.843 32.653 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -40.269 13.089 32.522 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -41.593 13.655 31.497 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -43.392 10.721 31.706 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -43.300 12.360 31.052 1.00 0.00 H new ATOM 687 N PRO B 32 -43.409 11.649 38.550 1.00 0.00 N ATOM 688 CA PRO B 32 -44.286 12.648 39.232 1.00 0.00 C ATOM 689 C PRO B 32 -44.671 13.911 38.377 1.00 0.00 C ATOM 690 O PRO B 32 -45.764 14.456 38.527 1.00 0.00 O ATOM 691 CB PRO B 32 -43.462 13.025 40.501 1.00 0.00 C ATOM 692 CG PRO B 32 -42.032 12.627 40.217 1.00 0.00 C ATOM 693 CD PRO B 32 -42.107 11.483 39.226 1.00 0.00 C ATOM 0 HA PRO B 32 -45.268 12.224 39.442 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -43.534 14.093 40.707 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -43.843 12.504 41.380 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -41.468 13.464 39.805 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -41.524 12.319 41.131 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -41.284 11.524 38.513 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -42.044 10.519 39.730 1.00 0.00 H new ATOM 701 N SER B 33 -43.753 14.354 37.497 1.00 0.00 N ATOM 702 CA SER B 33 -44.055 15.299 36.383 1.00 0.00 C ATOM 703 C SER B 33 -42.845 15.316 35.383 1.00 0.00 C ATOM 704 O SER B 33 -42.715 14.403 34.563 1.00 0.00 O ATOM 705 CB SER B 33 -44.551 16.701 36.857 1.00 0.00 C ATOM 706 OG SER B 33 -43.622 17.310 37.755 1.00 0.00 O ATOM 0 H SER B 33 -42.774 14.070 37.531 1.00 0.00 H new ATOM 0 HA SER B 33 -44.924 14.934 35.835 1.00 0.00 H new ATOM 0 HB2 SER B 33 -44.699 17.347 35.992 1.00 0.00 H new ATOM 0 HB3 SER B 33 -45.519 16.599 37.348 1.00 0.00 H new ATOM 0 HG SER B 33 -43.961 18.187 38.032 1.00 0.00 H new ATOM 712 N GLY B 34 -41.965 16.338 35.424 1.00 0.00 N ATOM 713 CA GLY B 34 -40.881 16.538 34.412 1.00 0.00 C ATOM 714 C GLY B 34 -41.271 16.608 32.912 1.00 0.00 C ATOM 715 O GLY B 34 -40.694 15.884 32.100 1.00 0.00 O ATOM 0 H GLY B 34 -41.977 17.051 36.153 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -40.360 17.462 34.662 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -40.163 15.726 34.530 1.00 0.00 H new ATOM 719 N ASN B 35 -42.255 17.446 32.556 1.00 0.00 N ATOM 720 CA ASN B 35 -42.828 17.496 31.178 1.00 0.00 C ATOM 721 C ASN B 35 -42.924 18.986 30.703 1.00 0.00 C ATOM 722 O ASN B 35 -43.820 19.721 31.127 1.00 0.00 O ATOM 723 CB ASN B 35 -44.215 16.787 31.160 1.00 0.00 C ATOM 724 CG ASN B 35 -44.220 15.275 31.431 1.00 0.00 C ATOM 725 OD1 ASN B 35 -43.411 14.507 30.920 1.00 0.00 O ATOM 726 ND2 ASN B 35 -45.138 14.790 32.228 1.00 0.00 N ATOM 0 H ASN B 35 -42.683 18.110 33.202 1.00 0.00 H new ATOM 0 HA ASN B 35 -42.178 16.967 30.482 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -44.853 17.268 31.902 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -44.673 16.960 30.186 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -45.173 13.788 32.416 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -45.819 15.414 32.661 1.00 0.00 H new ATOM 733 N SER B 36 -41.991 19.426 29.843 1.00 0.00 N ATOM 734 CA SER B 36 -41.937 20.828 29.316 1.00 0.00 C ATOM 735 C SER B 36 -41.357 20.867 27.859 1.00 0.00 C ATOM 736 O SER B 36 -40.488 20.069 27.484 1.00 0.00 O ATOM 737 CB SER B 36 -41.083 21.678 30.293 1.00 0.00 C ATOM 738 OG SER B 36 -40.954 23.033 29.851 1.00 0.00 O ATOM 0 H SER B 36 -41.245 18.830 29.484 1.00 0.00 H new ATOM 0 HA SER B 36 -42.944 21.241 29.256 1.00 0.00 H new ATOM 0 HB2 SER B 36 -41.540 21.661 31.283 1.00 0.00 H new ATOM 0 HB3 SER B 36 -40.093 21.233 30.391 1.00 0.00 H new ATOM 0 HG SER B 36 -41.705 23.562 30.193 1.00 0.00 H new ATOM 744 N SER B 37 -41.836 21.793 27.014 1.00 0.00 N ATOM 745 CA SER B 37 -41.272 22.038 25.647 1.00 0.00 C ATOM 746 C SER B 37 -41.432 23.530 25.202 1.00 0.00 C ATOM 747 O SER B 37 -42.247 23.913 24.357 1.00 0.00 O ATOM 748 CB SER B 37 -41.938 21.086 24.648 1.00 0.00 C ATOM 749 OG SER B 37 -41.607 19.721 24.913 1.00 0.00 O ATOM 0 H SER B 37 -42.623 22.400 27.244 1.00 0.00 H new ATOM 0 HA SER B 37 -40.200 21.840 25.676 1.00 0.00 H new ATOM 0 HB2 SER B 37 -43.020 21.213 24.691 1.00 0.00 H new ATOM 0 HB3 SER B 37 -41.627 21.345 23.636 1.00 0.00 H new ATOM 0 HG SER B 37 -41.106 19.663 25.753 1.00 0.00 H new ATOM 755 N SER B 38 -40.613 24.362 25.840 1.00 0.00 N ATOM 756 CA SER B 38 -40.749 25.860 25.867 1.00 0.00 C ATOM 757 C SER B 38 -41.827 26.433 26.852 1.00 0.00 C ATOM 758 O SER B 38 -41.507 27.302 27.668 1.00 0.00 O ATOM 759 CB SER B 38 -40.690 26.558 24.481 1.00 0.00 C ATOM 760 OG SER B 38 -41.892 26.387 23.733 1.00 0.00 O ATOM 0 H SER B 38 -39.809 24.030 26.373 1.00 0.00 H new ATOM 0 HA SER B 38 -39.814 26.163 26.339 1.00 0.00 H new ATOM 0 HB2 SER B 38 -40.501 27.622 24.621 1.00 0.00 H new ATOM 0 HB3 SER B 38 -39.851 26.158 23.911 1.00 0.00 H new ATOM 0 HG SER B 38 -42.135 25.438 23.718 1.00 0.00 H new ATOM 766 N GLY B 39 -43.064 25.917 26.817 1.00 0.00 N ATOM 767 CA GLY B 39 -43.861 25.733 28.057 1.00 0.00 C ATOM 768 C GLY B 39 -43.689 24.311 28.615 1.00 0.00 C ATOM 769 O GLY B 39 -44.032 23.329 27.922 1.00 0.00 O ATOM 770 OXT GLY B 39 -43.180 24.160 29.744 1.00 0.00 O ATOM 0 H GLY B 39 -43.536 25.621 25.962 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -43.550 26.462 28.805 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -44.914 25.921 27.848 1.00 0.00 H new TER 774 GLY B 39