USER MOD reduce.3.24.130724 H: found=0, std=0, add=830, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 831 hydrogens (13 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 44 SEP H2 : A 44 SEP N : A 43 ILE C :(H bumps) USER MOD NoAdj-H: A 44 SEP H : A 44 SEP N : A 43 ILE C :(H bumps) USER MOD NoAdj-H: A 46 SEP H2 : A 46 SEP N : A 45 ASP C :(H bumps) USER MOD Set 1.1: B 57 GLN : amide:sc= 0.561 K(o=1.4,f=-0.12) USER MOD Set 1.2: B 88 GLN : amide:sc= 0.88 K(o=1.4,f=-0.98) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -178:sc= 0 (180deg=-0.00778) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 75:sc= 1.24 USER MOD Single : B 14 ASN : amide:sc= -0.42 K(o=-0.42,f=-2.5!) USER MOD Single : B 15 ASN : amide:sc= 0.0644 K(o=0.064,f=-2.2!) USER MOD Single : B 17 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-1.1) USER MOD Single : B 19 ASN : amide:sc= 0.728 K(o=0.73,f=-0.0093) USER MOD Single : B 21 LYS NZ :NH3+ -170:sc= 1.24 (180deg=1.21) USER MOD Single : B 25 GLN : amide:sc= 0.533 K(o=0.53,f=-0.44) USER MOD Single : B 28 SER OG : rot -80:sc= 1.31 USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -108:sc= 0.011 (180deg=0) USER MOD Single : B 37 HIS : no HD1:sc= 0.783 K(o=0.78,f=-3.8!) USER MOD Single : B 38 THR OG1 : rot -60:sc= 0.358 USER MOD Single : B 41 SER OG : rot 180:sc= 0.00162 USER MOD Single : B 42 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0012) USER MOD Single : B 44 MET CE :methyl 178:sc= -0.189 (180deg=-0.193) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 CYS SG : rot 44:sc= 0.982 USER MOD Single : B 51 GLN : amide:sc= -0.0333 K(o=-0.033,f=-1.7) USER MOD Single : B 54 SER OG : rot 180:sc= 0.00775 USER MOD Single : B 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 65 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : B 68 ASN : amide:sc= 1 K(o=1,f=0) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0.0154 USER MOD Single : B 72 THR OG1 : rot 180:sc= 0.0962 USER MOD Single : B 75 GLN : amide:sc= -0.997 K(o=-1,f=-1.7) USER MOD Single : B 78 MET CE :methyl 147:sc= 0 (180deg=-0.757) USER MOD Single : B 83 THR OG1 : rot 180:sc= 0 USER MOD Single : B 89 GLN : amide:sc= 0.13 K(o=0.13,f=-1.7) USER MOD Single : B 90 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : B 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 95 TYR OH : rot 180:sc= 0.117 USER MOD ----------------------------------------------------------------- HETATM 1 C ACE A 36 10.746 12.431 -44.754 1.00 0.00 C HETATM 2 O ACE A 36 11.067 11.804 -43.752 1.00 0.00 O HETATM 3 CH3 ACE A 36 10.524 13.920 -44.605 1.00 0.00 C HETATM 0 H1 ACE A 36 11.216 14.458 -45.253 1.00 0.00 H new HETATM 0 H2 ACE A 36 9.500 14.165 -44.886 1.00 0.00 H new HETATM 0 H3 ACE A 36 10.696 14.212 -43.569 1.00 0.00 H new ATOM 7 N GLU A 37 10.446 11.892 -45.955 1.00 0.00 N ATOM 8 CA GLU A 37 10.526 10.470 -46.219 1.00 0.00 C ATOM 9 C GLU A 37 11.846 9.780 -45.798 1.00 0.00 C ATOM 10 O GLU A 37 11.879 8.680 -45.252 1.00 0.00 O ATOM 11 CB GLU A 37 9.981 10.139 -47.648 1.00 0.00 C ATOM 12 CG GLU A 37 9.653 8.610 -47.795 1.00 0.00 C ATOM 13 CD GLU A 37 8.871 7.856 -46.746 1.00 0.00 C ATOM 14 OE1 GLU A 37 7.820 8.314 -46.393 1.00 0.00 O ATOM 15 OE2 GLU A 37 9.248 6.714 -46.394 1.00 0.00 O ATOM 0 H GLU A 37 10.143 12.444 -46.757 1.00 0.00 H new ATOM 0 HA GLU A 37 9.845 9.979 -45.524 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.083 10.726 -47.842 1.00 0.00 H new ATOM 0 HB3 GLU A 37 10.719 10.428 -48.397 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.113 8.493 -48.735 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.606 8.093 -47.909 1.00 0.00 H new ATOM 22 N ASP A 38 12.946 10.513 -45.930 1.00 0.00 N ATOM 23 CA ASP A 38 14.334 10.108 -45.718 1.00 0.00 C ATOM 24 C ASP A 38 14.903 10.793 -44.469 1.00 0.00 C ATOM 25 O ASP A 38 16.122 10.828 -44.193 1.00 0.00 O ATOM 26 CB ASP A 38 15.062 10.222 -47.038 1.00 0.00 C ATOM 27 CG ASP A 38 16.509 9.702 -46.910 1.00 0.00 C ATOM 28 OD1 ASP A 38 16.634 8.594 -46.384 1.00 0.00 O ATOM 29 OD2 ASP A 38 17.523 10.307 -47.302 1.00 0.00 O ATOM 0 H ASP A 38 12.886 11.491 -46.213 1.00 0.00 H new ATOM 0 HA ASP A 38 14.462 9.059 -45.450 1.00 0.00 H new ATOM 0 HB2 ASP A 38 14.532 9.653 -47.802 1.00 0.00 H new ATOM 0 HB3 ASP A 38 15.072 11.262 -47.365 1.00 0.00 H new ATOM 34 N ALA A 39 14.084 11.387 -43.555 1.00 0.00 N ATOM 35 CA ALA A 39 14.467 12.025 -42.324 1.00 0.00 C ATOM 36 C ALA A 39 14.624 11.034 -41.244 1.00 0.00 C ATOM 37 O ALA A 39 14.464 11.311 -40.054 1.00 0.00 O ATOM 38 CB ALA A 39 13.457 13.147 -41.999 1.00 0.00 C ATOM 0 H ALA A 39 13.074 11.419 -43.697 1.00 0.00 H new ATOM 0 HA ALA A 39 15.446 12.493 -42.429 1.00 0.00 H new ATOM 0 HB1 ALA A 39 13.742 13.634 -41.067 1.00 0.00 H new ATOM 0 HB2 ALA A 39 13.455 13.880 -42.806 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.460 12.720 -41.895 1.00 0.00 H new ATOM 44 N PHE A 40 14.825 9.763 -41.602 1.00 0.00 N ATOM 45 CA PHE A 40 14.409 8.621 -40.750 1.00 0.00 C ATOM 46 C PHE A 40 15.467 7.535 -40.886 1.00 0.00 C ATOM 47 O PHE A 40 15.453 6.768 -41.877 1.00 0.00 O ATOM 48 CB PHE A 40 12.998 8.280 -41.201 1.00 0.00 C ATOM 49 CG PHE A 40 12.266 7.483 -40.092 1.00 0.00 C ATOM 50 CD1 PHE A 40 12.426 6.081 -39.835 1.00 0.00 C ATOM 51 CD2 PHE A 40 11.341 8.206 -39.371 1.00 0.00 C ATOM 52 CE1 PHE A 40 11.738 5.440 -38.778 1.00 0.00 C ATOM 53 CE2 PHE A 40 10.525 7.564 -38.427 1.00 0.00 C ATOM 54 CZ PHE A 40 10.800 6.207 -38.110 1.00 0.00 C ATOM 0 H PHE A 40 15.273 9.488 -42.476 1.00 0.00 H new ATOM 0 HA PHE A 40 14.356 8.809 -39.678 1.00 0.00 H new ATOM 0 HB2 PHE A 40 12.449 9.194 -41.427 1.00 0.00 H new ATOM 0 HB3 PHE A 40 13.032 7.694 -42.119 1.00 0.00 H new ATOM 0 HD1 PHE A 40 13.087 5.501 -40.463 1.00 0.00 H new ATOM 0 HD2 PHE A 40 11.244 9.269 -39.533 1.00 0.00 H new ATOM 0 HE1 PHE A 40 11.933 4.413 -38.508 1.00 0.00 H new ATOM 0 HE2 PHE A 40 9.708 8.089 -37.953 1.00 0.00 H new ATOM 0 HZ PHE A 40 10.247 5.749 -37.304 1.00 0.00 H new ATOM 64 N ILE A 41 16.345 7.403 -39.884 1.00 0.00 N ATOM 65 CA ILE A 41 17.467 6.512 -39.825 1.00 0.00 C ATOM 66 C ILE A 41 17.258 5.325 -38.887 1.00 0.00 C ATOM 67 O ILE A 41 16.705 5.542 -37.827 1.00 0.00 O ATOM 68 CB ILE A 41 18.814 7.250 -39.420 1.00 0.00 C ATOM 69 CG1 ILE A 41 19.244 8.504 -40.340 1.00 0.00 C ATOM 70 CG2 ILE A 41 19.997 6.303 -39.465 1.00 0.00 C ATOM 71 CD1 ILE A 41 18.306 9.737 -40.163 1.00 0.00 C ATOM 0 H ILE A 41 16.267 7.968 -39.038 1.00 0.00 H new ATOM 0 HA ILE A 41 17.555 6.132 -40.843 1.00 0.00 H new ATOM 0 HB ILE A 41 18.581 7.615 -38.420 1.00 0.00 H new ATOM 0 HG12 ILE A 41 20.266 8.794 -40.096 1.00 0.00 H new ATOM 0 HG13 ILE A 41 19.240 8.199 -41.386 1.00 0.00 H new ATOM 0 HG21 ILE A 41 20.903 6.839 -39.183 1.00 0.00 H new ATOM 0 HG22 ILE A 41 19.831 5.480 -38.770 1.00 0.00 H new ATOM 0 HG23 ILE A 41 20.109 5.908 -40.475 1.00 0.00 H new ATOM 0 HD11 ILE A 41 18.646 10.548 -40.807 1.00 0.00 H new ATOM 0 HD12 ILE A 41 17.287 9.461 -40.434 1.00 0.00 H new ATOM 0 HD13 ILE A 41 18.329 10.065 -39.124 1.00 0.00 H new ATOM 83 N VAL A 42 17.479 4.061 -39.297 1.00 0.00 N ATOM 84 CA VAL A 42 16.840 2.874 -38.660 1.00 0.00 C ATOM 85 C VAL A 42 17.863 1.759 -38.315 1.00 0.00 C ATOM 86 O VAL A 42 18.327 1.020 -39.208 1.00 0.00 O ATOM 87 CB VAL A 42 15.530 2.379 -39.419 1.00 0.00 C ATOM 88 CG1 VAL A 42 14.742 1.333 -38.696 1.00 0.00 C ATOM 89 CG2 VAL A 42 14.537 3.582 -39.698 1.00 0.00 C ATOM 0 H VAL A 42 18.099 3.826 -40.072 1.00 0.00 H new ATOM 0 HA VAL A 42 16.463 3.205 -37.692 1.00 0.00 H new ATOM 0 HB VAL A 42 15.919 1.944 -40.340 1.00 0.00 H new ATOM 0 HG11 VAL A 42 13.870 1.059 -39.290 1.00 0.00 H new ATOM 0 HG12 VAL A 42 15.365 0.452 -38.539 1.00 0.00 H new ATOM 0 HG13 VAL A 42 14.417 1.724 -37.732 1.00 0.00 H new ATOM 0 HG21 VAL A 42 13.653 3.211 -40.217 1.00 0.00 H new ATOM 0 HG22 VAL A 42 14.239 4.035 -38.752 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.035 4.329 -40.317 1.00 0.00 H new ATOM 99 N ILE A 43 18.237 1.632 -37.021 1.00 0.00 N ATOM 100 CA ILE A 43 19.512 1.011 -36.676 1.00 0.00 C ATOM 101 C ILE A 43 19.419 0.091 -35.493 1.00 0.00 C ATOM 102 O ILE A 43 18.582 0.375 -34.598 1.00 0.00 O ATOM 103 CB ILE A 43 20.601 2.111 -36.388 1.00 0.00 C ATOM 104 CG1 ILE A 43 20.909 2.955 -37.655 1.00 0.00 C ATOM 105 CG2 ILE A 43 21.891 1.622 -35.735 1.00 0.00 C ATOM 106 CD1 ILE A 43 21.732 4.220 -37.264 1.00 0.00 C ATOM 0 H ILE A 43 17.682 1.946 -36.225 1.00 0.00 H new ATOM 0 HA ILE A 43 19.799 0.410 -37.539 1.00 0.00 H new ATOM 0 HB ILE A 43 20.135 2.742 -35.631 1.00 0.00 H new ATOM 0 HG12 ILE A 43 21.467 2.356 -38.375 1.00 0.00 H new ATOM 0 HG13 ILE A 43 19.979 3.251 -38.140 1.00 0.00 H new ATOM 0 HG21 ILE A 43 22.565 2.465 -35.585 1.00 0.00 H new ATOM 0 HG22 ILE A 43 21.661 1.165 -34.772 1.00 0.00 H new ATOM 0 HG23 ILE A 43 22.369 0.886 -36.381 1.00 0.00 H new ATOM 0 HD11 ILE A 43 21.944 4.807 -38.158 1.00 0.00 H new ATOM 0 HD12 ILE A 43 21.159 4.824 -36.561 1.00 0.00 H new ATOM 0 HD13 ILE A 43 22.670 3.915 -36.799 1.00 0.00 H new HETATM 118 N SEP A 44 20.031 -1.128 -35.500 1.00 0.00 N HETATM 119 CA SEP A 44 20.039 -2.018 -34.271 1.00 0.00 C HETATM 120 CB SEP A 44 18.891 -3.076 -34.373 1.00 0.00 C HETATM 121 OG SEP A 44 19.293 -4.223 -35.104 1.00 0.00 O HETATM 122 C SEP A 44 21.409 -2.760 -34.108 1.00 0.00 C HETATM 123 O SEP A 44 22.412 -2.581 -34.748 1.00 0.00 O HETATM 124 P SEP A 44 18.302 -5.446 -35.100 1.00 0.00 P HETATM 125 O1P SEP A 44 19.060 -6.439 -35.840 1.00 0.00 O HETATM 126 O2P SEP A 44 18.080 -5.834 -33.730 1.00 0.00 O HETATM 127 O3P SEP A 44 17.045 -5.118 -35.831 1.00 0.00 O HETATM 0 HB3 SEP A 44 18.582 -3.374 -33.371 1.00 0.00 H new HETATM 0 HB2 SEP A 44 18.023 -2.625 -34.854 1.00 0.00 H new HETATM 0 HA SEP A 44 19.886 -1.381 -33.400 1.00 0.00 H new ATOM 132 N ASP A 45 21.510 -3.675 -33.052 1.00 0.00 N ATOM 133 CA ASP A 45 22.759 -4.313 -32.620 1.00 0.00 C ATOM 134 C ASP A 45 22.684 -5.859 -32.658 1.00 0.00 C ATOM 135 O ASP A 45 23.652 -6.382 -33.249 1.00 0.00 O ATOM 136 CB ASP A 45 23.266 -3.833 -31.115 1.00 0.00 C ATOM 137 CG ASP A 45 24.779 -3.957 -30.867 1.00 0.00 C ATOM 138 OD1 ASP A 45 25.557 -3.873 -31.846 1.00 0.00 O ATOM 139 OD2 ASP A 45 25.093 -4.096 -29.694 1.00 0.00 O ATOM 0 H ASP A 45 20.703 -3.965 -32.500 1.00 0.00 H new ATOM 0 HA ASP A 45 23.495 -3.973 -33.349 1.00 0.00 H new ATOM 0 HB2 ASP A 45 22.972 -2.794 -30.964 1.00 0.00 H new ATOM 0 HB3 ASP A 45 22.741 -4.425 -30.366 1.00 0.00 H new HETATM 144 N SEP A 46 21.654 -6.651 -32.326 1.00 0.00 N HETATM 145 CA SEP A 46 21.781 -8.080 -31.967 1.00 0.00 C HETATM 146 CB SEP A 46 20.797 -8.541 -30.958 1.00 0.00 C HETATM 147 OG SEP A 46 19.513 -8.332 -31.524 1.00 0.00 O HETATM 148 C SEP A 46 21.811 -8.963 -33.247 1.00 0.00 C HETATM 149 O SEP A 46 20.866 -9.165 -34.006 1.00 0.00 O HETATM 150 P SEP A 46 18.233 -8.412 -30.632 1.00 0.00 P HETATM 151 O1P SEP A 46 17.263 -8.739 -31.677 1.00 0.00 O HETATM 152 O2P SEP A 46 18.505 -9.524 -29.692 1.00 0.00 O HETATM 153 O3P SEP A 46 18.137 -7.134 -29.957 1.00 0.00 O HETATM 0 HB3 SEP A 46 20.949 -9.594 -30.720 1.00 0.00 H new HETATM 0 HB2 SEP A 46 20.906 -7.985 -30.027 1.00 0.00 H new HETATM 0 HA SEP A 46 22.740 -8.195 -31.461 1.00 0.00 H new HETATM 0 H SEP A 46 20.934 -6.077 -31.887 1.00 0.00 H new ATOM 158 N ASP A 47 22.971 -9.598 -33.445 1.00 0.00 N ATOM 159 CA ASP A 47 23.139 -10.483 -34.605 1.00 0.00 C ATOM 160 C ASP A 47 23.687 -11.852 -34.013 1.00 0.00 C ATOM 161 O ASP A 47 24.630 -11.839 -33.218 1.00 0.00 O ATOM 162 CB ASP A 47 24.123 -9.908 -35.561 1.00 0.00 C ATOM 163 CG ASP A 47 24.607 -10.871 -36.714 1.00 0.00 C ATOM 164 OD1 ASP A 47 23.811 -11.162 -37.617 1.00 0.00 O ATOM 165 OD2 ASP A 47 25.747 -11.406 -36.644 1.00 0.00 O ATOM 0 H ASP A 47 23.787 -9.521 -32.837 1.00 0.00 H new ATOM 0 HA ASP A 47 22.204 -10.617 -35.150 1.00 0.00 H new ATOM 0 HB2 ASP A 47 23.683 -9.021 -36.016 1.00 0.00 H new ATOM 0 HB3 ASP A 47 24.997 -9.578 -34.999 1.00 0.00 H new ATOM 170 N GLY A 48 23.046 -12.950 -34.492 1.00 0.00 N ATOM 171 CA GLY A 48 23.552 -14.285 -34.279 1.00 0.00 C ATOM 172 C GLY A 48 22.381 -15.232 -34.307 1.00 0.00 C ATOM 173 O GLY A 48 21.388 -15.058 -35.029 1.00 0.00 O ATOM 0 H GLY A 48 22.178 -12.912 -35.026 1.00 0.00 H new ATOM 0 HA2 GLY A 48 24.274 -14.548 -35.052 1.00 0.00 H new ATOM 0 HA3 GLY A 48 24.072 -14.348 -33.323 1.00 0.00 H new ATOM 177 N GLU A 49 22.759 -16.370 -33.746 1.00 0.00 N ATOM 178 CA GLU A 49 22.035 -17.629 -33.767 1.00 0.00 C ATOM 179 C GLU A 49 22.344 -18.535 -32.578 1.00 0.00 C ATOM 180 O GLU A 49 23.473 -19.061 -32.413 1.00 0.00 O ATOM 181 CB GLU A 49 22.362 -18.371 -35.052 1.00 0.00 C ATOM 182 CG GLU A 49 21.386 -19.560 -35.453 1.00 0.00 C ATOM 183 CD GLU A 49 20.086 -19.045 -36.044 1.00 0.00 C ATOM 184 OE1 GLU A 49 20.145 -18.489 -37.218 1.00 0.00 O ATOM 185 OE2 GLU A 49 19.123 -18.891 -35.225 1.00 0.00 O ATOM 0 H GLU A 49 23.636 -16.442 -33.231 1.00 0.00 H new ATOM 0 HA GLU A 49 20.975 -17.380 -33.706 1.00 0.00 H new ATOM 0 HB2 GLU A 49 22.374 -17.649 -35.869 1.00 0.00 H new ATOM 0 HB3 GLU A 49 23.372 -18.773 -34.966 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.881 -20.210 -36.174 1.00 0.00 H new ATOM 0 HG3 GLU A 49 21.171 -20.166 -34.573 1.00 0.00 H new HETATM 192 N NH2 A 50 21.330 -18.844 -31.827 1.00 0.00 N TER 195 NH2 A 50 ATOM 196 N MET B 1 -10.203 -28.951 -39.266 1.00 0.00 N ATOM 197 CA MET B 1 -10.008 -27.498 -38.949 1.00 0.00 C ATOM 198 C MET B 1 -8.652 -26.974 -39.374 1.00 0.00 C ATOM 199 O MET B 1 -7.672 -27.742 -39.458 1.00 0.00 O ATOM 200 CB MET B 1 -10.172 -27.197 -37.431 1.00 0.00 C ATOM 201 CG MET B 1 -11.293 -27.916 -36.654 1.00 0.00 C ATOM 202 SD MET B 1 -12.896 -27.239 -37.215 1.00 0.00 S ATOM 203 CE MET B 1 -13.181 -25.728 -36.310 1.00 0.00 C ATOM 0 H1 MET B 1 -11.160 -29.243 -38.983 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.083 -29.103 -40.288 1.00 0.00 H new ATOM 0 H3 MET B 1 -9.501 -29.517 -38.747 1.00 0.00 H new ATOM 0 HA MET B 1 -10.787 -26.991 -39.519 1.00 0.00 H new ATOM 0 HB2 MET B 1 -9.227 -27.433 -36.943 1.00 0.00 H new ATOM 0 HB3 MET B 1 -10.329 -26.124 -37.321 1.00 0.00 H new ATOM 0 HG2 MET B 1 -11.250 -28.991 -36.831 1.00 0.00 H new ATOM 0 HG3 MET B 1 -11.170 -27.765 -35.582 1.00 0.00 H new ATOM 0 HE1 MET B 1 -14.132 -25.293 -36.618 1.00 0.00 H new ATOM 0 HE2 MET B 1 -13.210 -25.944 -35.242 1.00 0.00 H new ATOM 0 HE3 MET B 1 -12.376 -25.023 -36.516 1.00 0.00 H new ATOM 215 N ALA B 2 -8.575 -25.635 -39.578 1.00 0.00 N ATOM 216 CA ALA B 2 -7.250 -24.992 -39.823 1.00 0.00 C ATOM 217 C ALA B 2 -6.322 -25.085 -38.615 1.00 0.00 C ATOM 218 O ALA B 2 -6.594 -25.400 -37.429 1.00 0.00 O ATOM 219 CB ALA B 2 -7.465 -23.539 -40.203 1.00 0.00 C ATOM 0 H ALA B 2 -9.373 -25.000 -39.580 1.00 0.00 H new ATOM 0 HA ALA B 2 -6.764 -25.530 -40.637 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -6.501 -23.064 -40.383 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -8.071 -23.485 -41.108 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -7.978 -23.023 -39.392 1.00 0.00 H new ATOM 225 N ASP B 3 -5.074 -24.787 -38.908 1.00 0.00 N ATOM 226 CA ASP B 3 -4.021 -24.457 -37.994 1.00 0.00 C ATOM 227 C ASP B 3 -4.125 -22.969 -37.479 1.00 0.00 C ATOM 228 O ASP B 3 -3.922 -22.028 -38.248 1.00 0.00 O ATOM 229 CB ASP B 3 -2.622 -24.630 -38.623 1.00 0.00 C ATOM 230 CG ASP B 3 -1.492 -24.318 -37.658 1.00 0.00 C ATOM 231 OD1 ASP B 3 -1.732 -24.309 -36.408 1.00 0.00 O ATOM 232 OD2 ASP B 3 -0.440 -23.913 -38.200 1.00 0.00 O ATOM 0 H ASP B 3 -4.752 -24.770 -39.876 1.00 0.00 H new ATOM 0 HA ASP B 3 -4.143 -25.151 -37.163 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -2.515 -25.654 -38.980 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -2.539 -23.979 -39.493 1.00 0.00 H new ATOM 237 N GLU B 4 -4.345 -22.832 -36.159 1.00 0.00 N ATOM 238 CA GLU B 4 -4.592 -21.576 -35.456 1.00 0.00 C ATOM 239 C GLU B 4 -3.971 -21.599 -34.031 1.00 0.00 C ATOM 240 O GLU B 4 -3.657 -22.604 -33.427 1.00 0.00 O ATOM 241 CB GLU B 4 -6.123 -21.403 -35.395 1.00 0.00 C ATOM 242 CG GLU B 4 -6.746 -20.069 -35.074 1.00 0.00 C ATOM 243 CD GLU B 4 -6.177 -18.892 -35.961 1.00 0.00 C ATOM 244 OE1 GLU B 4 -6.316 -18.982 -37.208 1.00 0.00 O ATOM 245 OE2 GLU B 4 -5.727 -17.816 -35.437 1.00 0.00 O ATOM 0 H GLU B 4 -4.354 -23.636 -35.531 1.00 0.00 H new ATOM 0 HA GLU B 4 -4.126 -20.739 -35.977 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -6.517 -21.714 -36.363 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -6.494 -22.114 -34.657 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -7.825 -20.135 -35.216 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -6.576 -19.839 -34.022 1.00 0.00 H new ATOM 252 N LYS B 5 -3.744 -20.408 -33.460 1.00 0.00 N ATOM 253 CA LYS B 5 -3.191 -19.975 -32.178 1.00 0.00 C ATOM 254 C LYS B 5 -3.941 -18.763 -31.617 1.00 0.00 C ATOM 255 O LYS B 5 -4.051 -17.838 -32.387 1.00 0.00 O ATOM 256 CB LYS B 5 -1.641 -19.633 -32.353 1.00 0.00 C ATOM 257 CG LYS B 5 -0.821 -19.878 -31.062 1.00 0.00 C ATOM 258 CD LYS B 5 0.584 -19.402 -31.155 1.00 0.00 C ATOM 259 CE LYS B 5 1.444 -19.864 -30.027 1.00 0.00 C ATOM 260 NZ LYS B 5 2.776 -19.234 -30.140 1.00 0.00 N ATOM 0 H LYS B 5 -3.995 -19.577 -33.996 1.00 0.00 H new ATOM 0 HA LYS B 5 -3.309 -20.791 -31.465 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -1.229 -20.239 -33.160 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -1.536 -18.590 -32.652 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -1.312 -19.377 -30.228 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -0.821 -20.945 -30.837 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.015 -19.747 -32.095 1.00 0.00 H new ATOM 0 HD3 LYS B 5 0.589 -18.312 -31.183 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.985 -19.603 -29.074 1.00 0.00 H new ATOM 0 HE3 LYS B 5 1.539 -20.950 -30.048 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 3.379 -19.554 -29.355 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 3.212 -19.505 -31.044 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.675 -18.200 -30.100 1.00 0.00 H new ATOM 274 N PRO B 6 -4.130 -18.616 -30.300 1.00 0.00 N ATOM 275 CA PRO B 6 -4.506 -17.322 -29.687 1.00 0.00 C ATOM 276 C PRO B 6 -3.517 -16.235 -30.021 1.00 0.00 C ATOM 277 O PRO B 6 -2.259 -16.422 -29.900 1.00 0.00 O ATOM 278 CB PRO B 6 -4.709 -17.578 -28.183 1.00 0.00 C ATOM 279 CG PRO B 6 -4.792 -19.096 -28.103 1.00 0.00 C ATOM 280 CD PRO B 6 -3.912 -19.589 -29.198 1.00 0.00 C ATOM 0 HA PRO B 6 -5.440 -16.939 -30.097 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -3.881 -17.187 -27.592 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -5.618 -17.104 -27.812 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -4.455 -19.459 -27.132 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -5.817 -19.443 -28.234 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -2.867 -19.615 -28.889 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -4.180 -20.601 -29.500 1.00 0.00 H new ATOM 288 N LYS B 7 -3.925 -15.022 -30.359 1.00 0.00 N ATOM 289 CA LYS B 7 -3.133 -13.829 -30.834 1.00 0.00 C ATOM 290 C LYS B 7 -2.614 -13.065 -29.706 1.00 0.00 C ATOM 291 O LYS B 7 -3.396 -12.572 -28.897 1.00 0.00 O ATOM 292 CB LYS B 7 -3.925 -12.927 -31.792 1.00 0.00 C ATOM 293 CG LYS B 7 -3.006 -11.963 -32.537 1.00 0.00 C ATOM 294 CD LYS B 7 -3.893 -11.022 -33.435 1.00 0.00 C ATOM 295 CE LYS B 7 -2.989 -9.986 -34.175 1.00 0.00 C ATOM 296 NZ LYS B 7 -3.547 -9.611 -35.453 1.00 0.00 N ATOM 0 H LYS B 7 -4.918 -14.794 -30.313 1.00 0.00 H new ATOM 0 HA LYS B 7 -2.292 -14.223 -31.405 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -4.467 -13.543 -32.509 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -4.669 -12.362 -31.231 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -2.423 -11.373 -31.830 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -2.296 -12.516 -33.153 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -4.449 -11.616 -34.160 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -4.627 -10.503 -32.819 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -2.870 -9.098 -33.555 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -1.995 -10.409 -34.321 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -2.921 -8.922 -35.917 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -3.638 -10.455 -36.053 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -4.485 -9.185 -35.311 1.00 0.00 H new ATOM 310 N GLU B 8 -1.318 -12.962 -29.478 1.00 0.00 N ATOM 311 CA GLU B 8 -0.737 -12.130 -28.385 1.00 0.00 C ATOM 312 C GLU B 8 0.739 -11.819 -28.579 1.00 0.00 C ATOM 313 O GLU B 8 1.604 -12.669 -28.829 1.00 0.00 O ATOM 314 CB GLU B 8 -0.940 -12.795 -26.942 1.00 0.00 C ATOM 315 CG GLU B 8 -0.124 -14.109 -26.816 1.00 0.00 C ATOM 316 CD GLU B 8 -0.578 -15.035 -25.677 1.00 0.00 C ATOM 317 OE1 GLU B 8 -1.701 -14.882 -25.245 1.00 0.00 O ATOM 318 OE2 GLU B 8 0.032 -16.083 -25.306 1.00 0.00 O ATOM 0 H GLU B 8 -0.616 -13.447 -30.037 1.00 0.00 H new ATOM 0 HA GLU B 8 -1.291 -11.193 -28.434 1.00 0.00 H new ATOM 0 HB2 GLU B 8 -0.629 -12.094 -26.167 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -1.998 -13.002 -26.779 1.00 0.00 H new ATOM 0 HG2 GLU B 8 -0.189 -14.654 -27.758 1.00 0.00 H new ATOM 0 HG3 GLU B 8 0.926 -13.857 -26.666 1.00 0.00 H new ATOM 325 N GLY B 9 1.043 -10.550 -28.314 1.00 0.00 N ATOM 326 CA GLY B 9 2.373 -10.074 -28.538 1.00 0.00 C ATOM 327 C GLY B 9 3.494 -10.348 -27.484 1.00 0.00 C ATOM 328 O GLY B 9 4.468 -9.553 -27.340 1.00 0.00 O ATOM 0 H GLY B 9 0.388 -9.857 -27.951 1.00 0.00 H new ATOM 0 HA2 GLY B 9 2.711 -10.493 -29.486 1.00 0.00 H new ATOM 0 HA3 GLY B 9 2.312 -8.994 -28.671 1.00 0.00 H new ATOM 332 N VAL B 10 3.338 -11.442 -26.756 1.00 0.00 N ATOM 333 CA VAL B 10 4.165 -11.776 -25.597 1.00 0.00 C ATOM 334 C VAL B 10 5.555 -12.366 -25.978 1.00 0.00 C ATOM 335 O VAL B 10 5.763 -13.533 -25.837 1.00 0.00 O ATOM 336 CB VAL B 10 3.387 -12.722 -24.651 1.00 0.00 C ATOM 337 CG1 VAL B 10 4.226 -13.188 -23.434 1.00 0.00 C ATOM 338 CG2 VAL B 10 2.242 -12.043 -23.996 1.00 0.00 C ATOM 0 H VAL B 10 2.620 -12.139 -26.954 1.00 0.00 H new ATOM 0 HA VAL B 10 4.380 -10.843 -25.076 1.00 0.00 H new ATOM 0 HB VAL B 10 3.096 -13.542 -25.308 1.00 0.00 H new ATOM 0 HG11 VAL B 10 3.625 -13.848 -22.809 1.00 0.00 H new ATOM 0 HG12 VAL B 10 5.108 -13.724 -23.784 1.00 0.00 H new ATOM 0 HG13 VAL B 10 4.536 -12.320 -22.852 1.00 0.00 H new ATOM 0 HG21 VAL B 10 1.727 -12.747 -23.342 1.00 0.00 H new ATOM 0 HG22 VAL B 10 2.607 -11.201 -23.407 1.00 0.00 H new ATOM 0 HG23 VAL B 10 1.550 -11.681 -24.757 1.00 0.00 H new ATOM 348 N LYS B 11 6.309 -11.565 -26.664 1.00 0.00 N ATOM 349 CA LYS B 11 7.606 -11.936 -27.313 1.00 0.00 C ATOM 350 C LYS B 11 8.540 -10.709 -27.458 1.00 0.00 C ATOM 351 O LYS B 11 8.003 -9.709 -27.884 1.00 0.00 O ATOM 352 CB LYS B 11 7.290 -12.587 -28.652 1.00 0.00 C ATOM 353 CG LYS B 11 8.493 -13.492 -29.102 1.00 0.00 C ATOM 354 CD LYS B 11 8.142 -14.201 -30.381 1.00 0.00 C ATOM 355 CE LYS B 11 9.189 -15.217 -30.841 1.00 0.00 C ATOM 356 NZ LYS B 11 9.052 -15.647 -32.259 1.00 0.00 N ATOM 0 H LYS B 11 6.061 -10.587 -26.815 1.00 0.00 H new ATOM 0 HA LYS B 11 8.151 -12.644 -26.689 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.383 -13.186 -28.570 1.00 0.00 H new ATOM 0 HB3 LYS B 11 7.099 -11.821 -29.403 1.00 0.00 H new ATOM 0 HG2 LYS B 11 9.385 -12.883 -29.246 1.00 0.00 H new ATOM 0 HG3 LYS B 11 8.725 -14.219 -28.324 1.00 0.00 H new ATOM 0 HD2 LYS B 11 7.188 -14.712 -30.250 1.00 0.00 H new ATOM 0 HD3 LYS B 11 8.001 -13.460 -31.168 1.00 0.00 H new ATOM 0 HE2 LYS B 11 10.181 -14.787 -30.699 1.00 0.00 H new ATOM 0 HE3 LYS B 11 9.129 -16.097 -30.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 9.799 -16.334 -32.487 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 8.121 -16.089 -32.399 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 9.140 -14.820 -32.883 1.00 0.00 H new ATOM 370 N THR B 12 9.872 -10.847 -27.352 1.00 0.00 N ATOM 371 CA THR B 12 10.924 -9.788 -27.534 1.00 0.00 C ATOM 372 C THR B 12 10.883 -9.043 -28.899 1.00 0.00 C ATOM 373 O THR B 12 11.218 -7.889 -29.074 1.00 0.00 O ATOM 374 CB THR B 12 12.404 -10.318 -27.228 1.00 0.00 C ATOM 375 OG1 THR B 12 12.425 -11.559 -28.061 1.00 0.00 O ATOM 376 CG2 THR B 12 12.697 -10.676 -25.719 1.00 0.00 C ATOM 0 H THR B 12 10.287 -11.750 -27.123 1.00 0.00 H new ATOM 0 HA THR B 12 10.660 -9.046 -26.780 1.00 0.00 H new ATOM 0 HB THR B 12 13.159 -9.562 -27.444 1.00 0.00 H new ATOM 0 HG1 THR B 12 12.520 -11.317 -29.006 1.00 0.00 H new ATOM 0 HG21 THR B 12 13.725 -11.024 -25.621 1.00 0.00 H new ATOM 0 HG22 THR B 12 12.553 -9.790 -25.100 1.00 0.00 H new ATOM 0 HG23 THR B 12 12.015 -11.461 -25.392 1.00 0.00 H new ATOM 384 N GLU B 13 10.439 -9.771 -29.959 1.00 0.00 N ATOM 385 CA GLU B 13 10.341 -9.374 -31.336 1.00 0.00 C ATOM 386 C GLU B 13 9.243 -8.357 -31.505 1.00 0.00 C ATOM 387 O GLU B 13 9.080 -7.741 -32.552 1.00 0.00 O ATOM 388 CB GLU B 13 10.131 -10.622 -32.172 1.00 0.00 C ATOM 389 CG GLU B 13 11.210 -11.709 -32.035 1.00 0.00 C ATOM 390 CD GLU B 13 12.630 -11.204 -31.811 1.00 0.00 C ATOM 391 OE1 GLU B 13 12.970 -10.832 -30.661 1.00 0.00 O ATOM 392 OE2 GLU B 13 13.501 -11.279 -32.756 1.00 0.00 O ATOM 0 H GLU B 13 10.119 -10.731 -29.829 1.00 0.00 H new ATOM 0 HA GLU B 13 11.256 -8.888 -31.674 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.168 -11.057 -31.905 1.00 0.00 H new ATOM 0 HB3 GLU B 13 10.069 -10.328 -33.220 1.00 0.00 H new ATOM 0 HG2 GLU B 13 10.940 -12.361 -31.204 1.00 0.00 H new ATOM 0 HG3 GLU B 13 11.200 -12.321 -32.937 1.00 0.00 H new ATOM 399 N ASN B 14 8.369 -8.211 -30.525 1.00 0.00 N ATOM 400 CA ASN B 14 7.305 -7.212 -30.588 1.00 0.00 C ATOM 401 C ASN B 14 7.566 -5.966 -29.671 1.00 0.00 C ATOM 402 O ASN B 14 6.860 -4.976 -29.799 1.00 0.00 O ATOM 403 CB ASN B 14 6.026 -7.922 -30.070 1.00 0.00 C ATOM 404 CG ASN B 14 5.643 -9.109 -30.943 1.00 0.00 C ATOM 405 OD1 ASN B 14 6.130 -10.202 -30.810 1.00 0.00 O ATOM 406 ND2 ASN B 14 4.812 -8.889 -31.889 1.00 0.00 N ATOM 0 H ASN B 14 8.371 -8.771 -29.672 1.00 0.00 H new ATOM 0 HA ASN B 14 7.230 -6.843 -31.611 1.00 0.00 H new ATOM 0 HB2 ASN B 14 6.188 -8.261 -29.047 1.00 0.00 H new ATOM 0 HB3 ASN B 14 5.201 -7.210 -30.043 1.00 0.00 H new ATOM 0 HD21 ASN B 14 4.561 -9.640 -32.532 1.00 0.00 H new ATOM 0 HD22 ASN B 14 4.400 -7.963 -32.001 1.00 0.00 H new ATOM 413 N ASN B 15 8.582 -5.910 -28.733 1.00 0.00 N ATOM 414 CA ASN B 15 8.734 -4.805 -27.824 1.00 0.00 C ATOM 415 C ASN B 15 9.114 -3.488 -28.515 1.00 0.00 C ATOM 416 O ASN B 15 9.631 -3.569 -29.650 1.00 0.00 O ATOM 417 CB ASN B 15 9.717 -5.293 -26.759 1.00 0.00 C ATOM 418 CG ASN B 15 10.012 -4.249 -25.723 1.00 0.00 C ATOM 419 OD1 ASN B 15 9.235 -3.464 -25.326 1.00 0.00 O ATOM 420 ND2 ASN B 15 11.149 -4.516 -25.065 1.00 0.00 N ATOM 0 H ASN B 15 9.286 -6.639 -28.621 1.00 0.00 H new ATOM 0 HA ASN B 15 7.788 -4.529 -27.359 1.00 0.00 H new ATOM 0 HB2 ASN B 15 9.308 -6.178 -26.271 1.00 0.00 H new ATOM 0 HB3 ASN B 15 10.647 -5.595 -27.240 1.00 0.00 H new ATOM 0 HD21 ASN B 15 11.359 -4.031 -24.193 1.00 0.00 H new ATOM 0 HD22 ASN B 15 11.804 -5.204 -25.437 1.00 0.00 H new ATOM 427 N ASP B 16 8.784 -2.327 -27.929 1.00 0.00 N ATOM 428 CA ASP B 16 8.923 -1.018 -28.567 1.00 0.00 C ATOM 429 C ASP B 16 10.406 -0.780 -28.782 1.00 0.00 C ATOM 430 O ASP B 16 11.178 -0.929 -27.831 1.00 0.00 O ATOM 431 CB ASP B 16 8.254 0.005 -27.647 1.00 0.00 C ATOM 432 CG ASP B 16 7.006 -0.249 -26.870 1.00 0.00 C ATOM 433 OD1 ASP B 16 6.498 -1.340 -26.684 1.00 0.00 O ATOM 434 OD2 ASP B 16 6.543 0.742 -26.260 1.00 0.00 O ATOM 0 H ASP B 16 8.407 -2.275 -26.983 1.00 0.00 H new ATOM 0 HA ASP B 16 8.439 -0.943 -29.541 1.00 0.00 H new ATOM 0 HB2 ASP B 16 9.010 0.296 -26.918 1.00 0.00 H new ATOM 0 HB3 ASP B 16 8.053 0.881 -28.264 1.00 0.00 H new ATOM 439 N HIS B 17 10.703 -0.289 -29.952 1.00 0.00 N ATOM 440 CA HIS B 17 11.939 0.456 -30.151 1.00 0.00 C ATOM 441 C HIS B 17 11.825 1.835 -29.325 1.00 0.00 C ATOM 442 O HIS B 17 10.809 2.258 -28.818 1.00 0.00 O ATOM 443 CB HIS B 17 12.252 0.749 -31.657 1.00 0.00 C ATOM 444 CG HIS B 17 12.322 -0.499 -32.609 1.00 0.00 C ATOM 445 ND1 HIS B 17 11.283 -1.400 -32.780 1.00 0.00 N ATOM 446 CD2 HIS B 17 13.496 -1.051 -33.022 1.00 0.00 C ATOM 447 CE1 HIS B 17 11.873 -2.522 -33.315 1.00 0.00 C ATOM 448 NE2 HIS B 17 13.182 -2.300 -33.520 1.00 0.00 N ATOM 0 H HIS B 17 10.120 -0.383 -30.783 1.00 0.00 H new ATOM 0 HA HIS B 17 12.767 -0.155 -29.791 1.00 0.00 H new ATOM 0 HB2 HIS B 17 11.490 1.428 -32.039 1.00 0.00 H new ATOM 0 HB3 HIS B 17 13.205 1.275 -31.712 1.00 0.00 H new ATOM 0 HD2 HIS B 17 14.477 -0.602 -32.970 1.00 0.00 H new ATOM 0 HE1 HIS B 17 11.359 -3.446 -33.537 1.00 0.00 H new ATOM 0 HE2 HIS B 17 13.833 -2.945 -33.968 1.00 0.00 H new ATOM 456 N ILE B 18 12.985 2.508 -29.242 1.00 0.00 N ATOM 457 CA ILE B 18 13.127 3.825 -28.481 1.00 0.00 C ATOM 458 C ILE B 18 13.281 5.008 -29.398 1.00 0.00 C ATOM 459 O ILE B 18 14.232 5.130 -30.234 1.00 0.00 O ATOM 460 CB ILE B 18 14.211 3.768 -27.339 1.00 0.00 C ATOM 461 CG1 ILE B 18 14.264 5.079 -26.533 1.00 0.00 C ATOM 462 CG2 ILE B 18 15.529 3.418 -27.875 1.00 0.00 C ATOM 463 CD1 ILE B 18 15.026 5.152 -25.233 1.00 0.00 C ATOM 0 H ILE B 18 13.850 2.189 -29.679 1.00 0.00 H new ATOM 0 HA ILE B 18 12.181 3.977 -27.962 1.00 0.00 H new ATOM 0 HB ILE B 18 13.912 2.979 -26.649 1.00 0.00 H new ATOM 0 HG12 ILE B 18 14.677 5.844 -27.191 1.00 0.00 H new ATOM 0 HG13 ILE B 18 13.235 5.366 -26.318 1.00 0.00 H new ATOM 0 HG21 ILE B 18 16.255 3.387 -27.063 1.00 0.00 H new ATOM 0 HG22 ILE B 18 15.479 2.441 -28.355 1.00 0.00 H new ATOM 0 HG23 ILE B 18 15.835 4.166 -28.607 1.00 0.00 H new ATOM 0 HD11 ILE B 18 14.944 6.157 -24.819 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.610 4.433 -24.527 1.00 0.00 H new ATOM 0 HD13 ILE B 18 16.075 4.919 -25.413 1.00 0.00 H new ATOM 475 N ASN B 19 12.445 6.023 -29.184 1.00 0.00 N ATOM 476 CA ASN B 19 12.310 7.140 -30.132 1.00 0.00 C ATOM 477 C ASN B 19 13.180 8.383 -29.912 1.00 0.00 C ATOM 478 O ASN B 19 12.737 9.320 -29.307 1.00 0.00 O ATOM 479 CB ASN B 19 10.879 7.601 -30.161 1.00 0.00 C ATOM 480 CG ASN B 19 9.956 6.373 -30.597 1.00 0.00 C ATOM 481 OD1 ASN B 19 9.488 6.351 -31.726 1.00 0.00 O ATOM 482 ND2 ASN B 19 9.684 5.353 -29.811 1.00 0.00 N ATOM 0 H ASN B 19 11.847 6.099 -28.361 1.00 0.00 H new ATOM 0 HA ASN B 19 12.665 6.705 -31.066 1.00 0.00 H new ATOM 0 HB2 ASN B 19 10.580 7.969 -29.179 1.00 0.00 H new ATOM 0 HB3 ASN B 19 10.762 8.429 -30.861 1.00 0.00 H new ATOM 0 HD21 ASN B 19 9.104 4.587 -30.152 1.00 0.00 H new ATOM 0 HD22 ASN B 19 10.053 5.329 -28.861 1.00 0.00 H new ATOM 489 N LEU B 20 14.405 8.362 -30.462 1.00 0.00 N ATOM 490 CA LEU B 20 15.389 9.490 -30.349 1.00 0.00 C ATOM 491 C LEU B 20 15.388 10.392 -31.648 1.00 0.00 C ATOM 492 O LEU B 20 15.022 9.901 -32.699 1.00 0.00 O ATOM 493 CB LEU B 20 16.800 8.964 -30.087 1.00 0.00 C ATOM 494 CG LEU B 20 16.954 8.248 -28.790 1.00 0.00 C ATOM 495 CD1 LEU B 20 18.401 8.050 -28.383 1.00 0.00 C ATOM 496 CD2 LEU B 20 16.218 8.892 -27.646 1.00 0.00 C ATOM 0 H LEU B 20 14.756 7.570 -31.001 1.00 0.00 H new ATOM 0 HA LEU B 20 15.078 10.103 -29.503 1.00 0.00 H new ATOM 0 HB2 LEU B 20 17.081 8.290 -30.897 1.00 0.00 H new ATOM 0 HB3 LEU B 20 17.498 9.801 -30.112 1.00 0.00 H new ATOM 0 HG LEU B 20 16.502 7.276 -28.987 1.00 0.00 H new ATOM 0 HD11 LEU B 20 18.442 7.523 -27.430 1.00 0.00 H new ATOM 0 HD12 LEU B 20 18.916 7.464 -29.144 1.00 0.00 H new ATOM 0 HD13 LEU B 20 18.887 9.021 -28.282 1.00 0.00 H new ATOM 0 HD21 LEU B 20 16.379 8.312 -26.737 1.00 0.00 H new ATOM 0 HD22 LEU B 20 16.589 9.906 -27.500 1.00 0.00 H new ATOM 0 HD23 LEU B 20 15.152 8.924 -27.871 1.00 0.00 H new ATOM 508 N LYS B 21 15.751 11.671 -31.503 1.00 0.00 N ATOM 509 CA LYS B 21 16.125 12.495 -32.679 1.00 0.00 C ATOM 510 C LYS B 21 17.551 13.026 -32.458 1.00 0.00 C ATOM 511 O LYS B 21 18.206 12.990 -31.354 1.00 0.00 O ATOM 512 CB LYS B 21 15.126 13.655 -32.898 1.00 0.00 C ATOM 513 CG LYS B 21 13.698 13.112 -33.072 1.00 0.00 C ATOM 514 CD LYS B 21 12.670 14.246 -33.380 1.00 0.00 C ATOM 515 CE LYS B 21 11.264 13.911 -32.860 1.00 0.00 C ATOM 516 NZ LYS B 21 11.171 14.407 -31.475 1.00 0.00 N ATOM 0 H LYS B 21 15.797 12.158 -30.608 1.00 0.00 H new ATOM 0 HA LYS B 21 16.092 11.883 -33.580 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.161 14.337 -32.049 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.413 14.228 -33.780 1.00 0.00 H new ATOM 0 HG2 LYS B 21 13.685 12.382 -33.881 1.00 0.00 H new ATOM 0 HG3 LYS B 21 13.397 12.588 -32.165 1.00 0.00 H new ATOM 0 HD2 LYS B 21 13.011 15.177 -32.926 1.00 0.00 H new ATOM 0 HD3 LYS B 21 12.627 14.413 -34.456 1.00 0.00 H new ATOM 0 HE2 LYS B 21 10.503 14.378 -33.486 1.00 0.00 H new ATOM 0 HE3 LYS B 21 11.089 12.836 -32.894 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 10.298 14.050 -31.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 11.993 14.075 -30.931 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 11.156 15.447 -31.479 1.00 0.00 H new ATOM 530 N VAL B 22 18.122 13.582 -33.563 1.00 0.00 N ATOM 531 CA VAL B 22 19.437 14.240 -33.514 1.00 0.00 C ATOM 532 C VAL B 22 19.297 15.588 -34.256 1.00 0.00 C ATOM 533 O VAL B 22 18.707 15.659 -35.337 1.00 0.00 O ATOM 534 CB VAL B 22 20.506 13.428 -34.297 1.00 0.00 C ATOM 535 CG1 VAL B 22 21.864 14.139 -34.561 1.00 0.00 C ATOM 536 CG2 VAL B 22 20.879 12.088 -33.686 1.00 0.00 C ATOM 0 H VAL B 22 17.688 13.582 -34.486 1.00 0.00 H new ATOM 0 HA VAL B 22 19.741 14.340 -32.472 1.00 0.00 H new ATOM 0 HB VAL B 22 19.959 13.304 -35.232 1.00 0.00 H new ATOM 0 HG11 VAL B 22 22.523 13.470 -35.114 1.00 0.00 H new ATOM 0 HG12 VAL B 22 21.693 15.044 -35.144 1.00 0.00 H new ATOM 0 HG13 VAL B 22 22.328 14.401 -33.610 1.00 0.00 H new ATOM 0 HG21 VAL B 22 21.631 11.601 -34.307 1.00 0.00 H new ATOM 0 HG22 VAL B 22 21.281 12.244 -32.685 1.00 0.00 H new ATOM 0 HG23 VAL B 22 19.993 11.456 -33.627 1.00 0.00 H new ATOM 546 N ALA B 23 19.760 16.659 -33.624 1.00 0.00 N ATOM 547 CA ALA B 23 19.584 18.016 -34.212 1.00 0.00 C ATOM 548 C ALA B 23 20.893 18.872 -34.138 1.00 0.00 C ATOM 549 O ALA B 23 21.692 18.838 -33.161 1.00 0.00 O ATOM 550 CB ALA B 23 18.378 18.647 -33.507 1.00 0.00 C ATOM 0 H ALA B 23 20.249 16.637 -32.729 1.00 0.00 H new ATOM 0 HA ALA B 23 19.385 17.960 -35.282 1.00 0.00 H new ATOM 0 HB1 ALA B 23 18.207 19.647 -33.904 1.00 0.00 H new ATOM 0 HB2 ALA B 23 17.494 18.032 -33.678 1.00 0.00 H new ATOM 0 HB3 ALA B 23 18.574 18.710 -32.437 1.00 0.00 H new ATOM 556 N GLY B 24 21.122 19.653 -35.193 1.00 0.00 N ATOM 557 CA GLY B 24 22.117 20.755 -35.244 1.00 0.00 C ATOM 558 C GLY B 24 21.673 22.139 -34.707 1.00 0.00 C ATOM 559 O GLY B 24 20.478 22.447 -34.509 1.00 0.00 O ATOM 0 H GLY B 24 20.611 19.543 -36.069 1.00 0.00 H new ATOM 0 HA2 GLY B 24 22.997 20.441 -34.682 1.00 0.00 H new ATOM 0 HA3 GLY B 24 22.429 20.880 -36.281 1.00 0.00 H new ATOM 563 N GLN B 25 22.631 23.043 -34.600 1.00 0.00 N ATOM 564 CA GLN B 25 22.364 24.434 -34.111 1.00 0.00 C ATOM 565 C GLN B 25 21.672 25.256 -35.191 1.00 0.00 C ATOM 566 O GLN B 25 21.168 26.371 -34.902 1.00 0.00 O ATOM 567 CB GLN B 25 23.662 25.171 -33.763 1.00 0.00 C ATOM 568 CG GLN B 25 24.458 24.500 -32.612 1.00 0.00 C ATOM 569 CD GLN B 25 23.632 23.867 -31.549 1.00 0.00 C ATOM 570 OE1 GLN B 25 22.737 24.356 -30.932 1.00 0.00 O ATOM 571 NE2 GLN B 25 23.838 22.557 -31.366 1.00 0.00 N ATOM 0 H GLN B 25 23.607 22.864 -34.838 1.00 0.00 H new ATOM 0 HA GLN B 25 21.738 24.333 -33.225 1.00 0.00 H new ATOM 0 HB2 GLN B 25 24.293 25.221 -34.651 1.00 0.00 H new ATOM 0 HB3 GLN B 25 23.425 26.197 -33.482 1.00 0.00 H new ATOM 0 HG2 GLN B 25 25.113 23.741 -33.040 1.00 0.00 H new ATOM 0 HG3 GLN B 25 25.100 25.251 -32.151 1.00 0.00 H new ATOM 0 HE21 GLN B 25 24.590 22.084 -31.867 1.00 0.00 H new ATOM 0 HE22 GLN B 25 23.243 22.032 -30.725 1.00 0.00 H new ATOM 580 N ASP B 26 21.663 24.716 -36.444 1.00 0.00 N ATOM 581 CA ASP B 26 21.064 25.304 -37.639 1.00 0.00 C ATOM 582 C ASP B 26 19.557 25.099 -37.611 1.00 0.00 C ATOM 583 O ASP B 26 18.875 25.723 -38.420 1.00 0.00 O ATOM 584 CB ASP B 26 21.661 24.739 -38.948 1.00 0.00 C ATOM 585 CG ASP B 26 21.802 23.234 -39.026 1.00 0.00 C ATOM 586 OD1 ASP B 26 21.114 22.434 -38.323 1.00 0.00 O ATOM 587 OD2 ASP B 26 22.672 22.784 -39.772 1.00 0.00 O ATOM 0 H ASP B 26 22.099 23.815 -36.638 1.00 0.00 H new ATOM 0 HA ASP B 26 21.293 26.370 -37.627 1.00 0.00 H new ATOM 0 HB2 ASP B 26 21.036 25.068 -39.779 1.00 0.00 H new ATOM 0 HB3 ASP B 26 22.646 25.183 -39.095 1.00 0.00 H new ATOM 592 N GLY B 27 19.055 24.193 -36.782 1.00 0.00 N ATOM 593 CA GLY B 27 17.676 23.870 -36.546 1.00 0.00 C ATOM 594 C GLY B 27 17.153 22.680 -37.311 1.00 0.00 C ATOM 595 O GLY B 27 15.970 22.520 -37.409 1.00 0.00 O ATOM 0 H GLY B 27 19.672 23.618 -36.209 1.00 0.00 H new ATOM 0 HA2 GLY B 27 17.541 23.684 -35.481 1.00 0.00 H new ATOM 0 HA3 GLY B 27 17.068 24.739 -36.798 1.00 0.00 H new ATOM 599 N SER B 28 18.027 21.984 -38.075 1.00 0.00 N ATOM 600 CA SER B 28 17.649 20.771 -38.795 1.00 0.00 C ATOM 601 C SER B 28 17.328 19.621 -37.872 1.00 0.00 C ATOM 602 O SER B 28 18.060 19.437 -36.920 1.00 0.00 O ATOM 603 CB SER B 28 18.814 20.423 -39.736 1.00 0.00 C ATOM 604 OG SER B 28 20.086 20.126 -39.147 1.00 0.00 O ATOM 0 H SER B 28 19.002 22.254 -38.201 1.00 0.00 H new ATOM 0 HA SER B 28 16.732 20.951 -39.357 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.514 19.563 -40.336 1.00 0.00 H new ATOM 0 HB3 SER B 28 18.950 21.259 -40.423 1.00 0.00 H new ATOM 0 HG SER B 28 20.543 20.962 -38.917 1.00 0.00 H new ATOM 610 N VAL B 29 16.422 18.703 -38.320 1.00 0.00 N ATOM 611 CA VAL B 29 15.906 17.656 -37.444 1.00 0.00 C ATOM 612 C VAL B 29 15.645 16.360 -38.211 1.00 0.00 C ATOM 613 O VAL B 29 14.986 16.404 -39.238 1.00 0.00 O ATOM 614 CB VAL B 29 14.557 18.108 -36.801 1.00 0.00 C ATOM 615 CG1 VAL B 29 14.087 17.054 -35.759 1.00 0.00 C ATOM 616 CG2 VAL B 29 14.753 19.387 -35.976 1.00 0.00 C ATOM 0 H VAL B 29 16.051 18.682 -39.270 1.00 0.00 H new ATOM 0 HA VAL B 29 16.662 17.480 -36.678 1.00 0.00 H new ATOM 0 HB VAL B 29 13.849 18.246 -37.618 1.00 0.00 H new ATOM 0 HG11 VAL B 29 13.145 17.376 -35.315 1.00 0.00 H new ATOM 0 HG12 VAL B 29 13.945 16.093 -36.253 1.00 0.00 H new ATOM 0 HG13 VAL B 29 14.841 16.953 -34.978 1.00 0.00 H new ATOM 0 HG21 VAL B 29 13.801 19.686 -35.536 1.00 0.00 H new ATOM 0 HG22 VAL B 29 15.477 19.201 -35.183 1.00 0.00 H new ATOM 0 HG23 VAL B 29 15.120 20.184 -36.622 1.00 0.00 H new ATOM 626 N VAL B 30 16.070 15.192 -37.683 1.00 0.00 N ATOM 627 CA VAL B 30 15.824 13.819 -38.155 1.00 0.00 C ATOM 628 C VAL B 30 15.586 12.805 -36.990 1.00 0.00 C ATOM 629 O VAL B 30 16.159 12.947 -35.897 1.00 0.00 O ATOM 630 CB VAL B 30 16.874 13.186 -39.051 1.00 0.00 C ATOM 631 CG1 VAL B 30 17.087 13.711 -40.422 1.00 0.00 C ATOM 632 CG2 VAL B 30 18.271 13.155 -38.326 1.00 0.00 C ATOM 0 H VAL B 30 16.645 15.190 -36.841 1.00 0.00 H new ATOM 0 HA VAL B 30 14.931 13.988 -38.757 1.00 0.00 H new ATOM 0 HB VAL B 30 16.430 12.204 -39.216 1.00 0.00 H new ATOM 0 HG11 VAL B 30 17.874 13.138 -40.913 1.00 0.00 H new ATOM 0 HG12 VAL B 30 16.163 13.622 -40.993 1.00 0.00 H new ATOM 0 HG13 VAL B 30 17.381 14.759 -40.369 1.00 0.00 H new ATOM 0 HG21 VAL B 30 19.012 12.698 -38.982 1.00 0.00 H new ATOM 0 HG22 VAL B 30 18.578 14.173 -38.085 1.00 0.00 H new ATOM 0 HG23 VAL B 30 18.192 12.573 -37.408 1.00 0.00 H new ATOM 642 N GLN B 31 14.723 11.829 -37.301 1.00 0.00 N ATOM 643 CA GLN B 31 14.288 10.719 -36.366 1.00 0.00 C ATOM 644 C GLN B 31 15.109 9.400 -36.489 1.00 0.00 C ATOM 645 O GLN B 31 15.414 8.943 -37.633 1.00 0.00 O ATOM 646 CB GLN B 31 12.744 10.512 -36.441 1.00 0.00 C ATOM 647 CG GLN B 31 12.136 10.062 -35.150 1.00 0.00 C ATOM 648 CD GLN B 31 10.699 9.613 -35.379 1.00 0.00 C ATOM 649 OE1 GLN B 31 9.828 10.197 -35.958 1.00 0.00 O ATOM 650 NE2 GLN B 31 10.286 8.587 -34.677 1.00 0.00 N ATOM 0 H GLN B 31 14.285 11.765 -38.220 1.00 0.00 H new ATOM 0 HA GLN B 31 14.527 11.053 -35.356 1.00 0.00 H new ATOM 0 HB2 GLN B 31 12.275 11.447 -36.747 1.00 0.00 H new ATOM 0 HB3 GLN B 31 12.522 9.776 -37.214 1.00 0.00 H new ATOM 0 HG2 GLN B 31 12.719 9.242 -34.730 1.00 0.00 H new ATOM 0 HG3 GLN B 31 12.160 10.875 -34.424 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.956 8.027 -34.149 1.00 0.00 H new ATOM 0 HE22 GLN B 31 9.295 8.348 -34.658 1.00 0.00 H new ATOM 659 N PHE B 32 15.513 8.842 -35.329 1.00 0.00 N ATOM 660 CA PHE B 32 16.409 7.669 -35.263 1.00 0.00 C ATOM 661 C PHE B 32 15.683 6.594 -34.542 1.00 0.00 C ATOM 662 O PHE B 32 15.270 6.779 -33.371 1.00 0.00 O ATOM 663 CB PHE B 32 17.713 7.950 -34.569 1.00 0.00 C ATOM 664 CG PHE B 32 18.713 8.487 -35.486 1.00 0.00 C ATOM 665 CD1 PHE B 32 18.812 9.844 -35.719 1.00 0.00 C ATOM 666 CD2 PHE B 32 19.722 7.719 -35.977 1.00 0.00 C ATOM 667 CE1 PHE B 32 19.840 10.408 -36.498 1.00 0.00 C ATOM 668 CE2 PHE B 32 20.789 8.211 -36.718 1.00 0.00 C ATOM 669 CZ PHE B 32 20.898 9.586 -36.892 1.00 0.00 C ATOM 0 H PHE B 32 15.228 9.191 -34.414 1.00 0.00 H new ATOM 0 HA PHE B 32 16.667 7.380 -36.282 1.00 0.00 H new ATOM 0 HB2 PHE B 32 17.547 8.659 -33.758 1.00 0.00 H new ATOM 0 HB3 PHE B 32 18.090 7.032 -34.118 1.00 0.00 H new ATOM 0 HD1 PHE B 32 18.071 10.499 -35.286 1.00 0.00 H new ATOM 0 HD2 PHE B 32 19.692 6.658 -35.778 1.00 0.00 H new ATOM 0 HE1 PHE B 32 19.811 11.449 -36.783 1.00 0.00 H new ATOM 0 HE2 PHE B 32 21.518 7.540 -37.149 1.00 0.00 H new ATOM 0 HZ PHE B 32 21.790 10.013 -37.326 1.00 0.00 H new ATOM 679 N LYS B 33 15.431 5.441 -35.165 1.00 0.00 N ATOM 680 CA LYS B 33 14.633 4.261 -34.538 1.00 0.00 C ATOM 681 C LYS B 33 15.718 3.213 -34.124 1.00 0.00 C ATOM 682 O LYS B 33 16.399 2.685 -34.993 1.00 0.00 O ATOM 683 CB LYS B 33 13.566 3.811 -35.515 1.00 0.00 C ATOM 684 CG LYS B 33 12.840 2.594 -34.908 1.00 0.00 C ATOM 685 CD LYS B 33 11.633 2.266 -35.773 1.00 0.00 C ATOM 686 CE LYS B 33 11.098 0.939 -35.353 1.00 0.00 C ATOM 687 NZ LYS B 33 10.024 0.469 -36.244 1.00 0.00 N ATOM 0 H LYS B 33 15.750 5.249 -36.115 1.00 0.00 H new ATOM 0 HA LYS B 33 14.059 4.500 -33.643 1.00 0.00 H new ATOM 0 HB2 LYS B 33 12.860 4.619 -35.705 1.00 0.00 H new ATOM 0 HB3 LYS B 33 14.014 3.547 -36.473 1.00 0.00 H new ATOM 0 HG2 LYS B 33 13.513 1.738 -34.858 1.00 0.00 H new ATOM 0 HG3 LYS B 33 12.526 2.812 -33.887 1.00 0.00 H new ATOM 0 HD2 LYS B 33 10.868 3.035 -35.664 1.00 0.00 H new ATOM 0 HD3 LYS B 33 11.916 2.245 -36.826 1.00 0.00 H new ATOM 0 HE2 LYS B 33 11.907 0.209 -35.344 1.00 0.00 H new ATOM 0 HE3 LYS B 33 10.719 1.007 -34.333 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 9.681 -0.456 -35.916 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 9.240 1.153 -36.234 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 10.391 0.378 -37.213 1.00 0.00 H new ATOM 701 N ILE B 34 15.820 3.019 -32.830 1.00 0.00 N ATOM 702 CA ILE B 34 16.813 2.150 -32.230 1.00 0.00 C ATOM 703 C ILE B 34 16.233 1.356 -31.063 1.00 0.00 C ATOM 704 O ILE B 34 15.083 1.490 -30.642 1.00 0.00 O ATOM 705 CB ILE B 34 17.997 3.045 -31.729 1.00 0.00 C ATOM 706 CG1 ILE B 34 17.515 3.803 -30.485 1.00 0.00 C ATOM 707 CG2 ILE B 34 18.462 4.059 -32.826 1.00 0.00 C ATOM 708 CD1 ILE B 34 18.537 4.892 -30.038 1.00 0.00 C ATOM 0 H ILE B 34 15.206 3.467 -32.150 1.00 0.00 H new ATOM 0 HA ILE B 34 17.156 1.430 -32.973 1.00 0.00 H new ATOM 0 HB ILE B 34 18.853 2.412 -31.496 1.00 0.00 H new ATOM 0 HG12 ILE B 34 16.553 4.271 -30.695 1.00 0.00 H new ATOM 0 HG13 ILE B 34 17.355 3.098 -29.669 1.00 0.00 H new ATOM 0 HG21 ILE B 34 19.284 4.661 -32.440 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.795 3.513 -33.708 1.00 0.00 H new ATOM 0 HG23 ILE B 34 17.631 4.710 -33.095 1.00 0.00 H new ATOM 0 HD11 ILE B 34 18.158 5.406 -29.154 1.00 0.00 H new ATOM 0 HD12 ILE B 34 19.491 4.421 -29.803 1.00 0.00 H new ATOM 0 HD13 ILE B 34 18.677 5.612 -30.844 1.00 0.00 H new ATOM 720 N LYS B 35 17.027 0.427 -30.548 1.00 0.00 N ATOM 721 CA LYS B 35 16.625 -0.314 -29.337 1.00 0.00 C ATOM 722 C LYS B 35 17.457 0.182 -28.131 1.00 0.00 C ATOM 723 O LYS B 35 18.448 0.887 -28.294 1.00 0.00 O ATOM 724 CB LYS B 35 16.775 -1.827 -29.494 1.00 0.00 C ATOM 725 CG LYS B 35 16.079 -2.487 -30.684 1.00 0.00 C ATOM 726 CD LYS B 35 15.980 -4.054 -30.580 1.00 0.00 C ATOM 727 CE LYS B 35 15.534 -4.519 -31.904 1.00 0.00 C ATOM 728 NZ LYS B 35 15.449 -6.003 -31.863 1.00 0.00 N ATOM 0 H LYS B 35 17.935 0.165 -30.931 1.00 0.00 H new ATOM 0 HA LYS B 35 15.566 -0.119 -29.169 1.00 0.00 H new ATOM 0 HB2 LYS B 35 17.839 -2.054 -29.559 1.00 0.00 H new ATOM 0 HB3 LYS B 35 16.403 -2.298 -28.584 1.00 0.00 H new ATOM 0 HG2 LYS B 35 15.074 -2.075 -30.778 1.00 0.00 H new ATOM 0 HG3 LYS B 35 16.617 -2.227 -31.596 1.00 0.00 H new ATOM 0 HD2 LYS B 35 16.944 -4.490 -30.317 1.00 0.00 H new ATOM 0 HD3 LYS B 35 15.274 -4.350 -29.804 1.00 0.00 H new ATOM 0 HE2 LYS B 35 14.564 -4.088 -32.153 1.00 0.00 H new ATOM 0 HE3 LYS B 35 16.233 -4.198 -32.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 16.226 -6.411 -32.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 15.522 -6.328 -30.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 14.539 -6.310 -32.262 1.00 0.00 H new ATOM 742 N ARG B 36 17.141 -0.192 -26.883 1.00 0.00 N ATOM 743 CA ARG B 36 17.633 0.387 -25.591 1.00 0.00 C ATOM 744 C ARG B 36 19.171 0.103 -25.334 1.00 0.00 C ATOM 745 O ARG B 36 19.815 0.910 -24.701 1.00 0.00 O ATOM 746 CB ARG B 36 16.864 -0.266 -24.456 1.00 0.00 C ATOM 747 CG ARG B 36 15.531 0.445 -24.280 1.00 0.00 C ATOM 748 CD ARG B 36 14.706 -0.084 -23.141 1.00 0.00 C ATOM 749 NE ARG B 36 15.407 0.018 -21.915 1.00 0.00 N ATOM 750 CZ ARG B 36 15.544 1.049 -21.103 1.00 0.00 C ATOM 751 NH1 ARG B 36 14.725 2.027 -21.125 1.00 0.00 N ATOM 752 NH2 ARG B 36 16.486 0.903 -20.266 1.00 0.00 N ATOM 0 H ARG B 36 16.490 -0.960 -26.721 1.00 0.00 H new ATOM 0 HA ARG B 36 17.486 1.466 -25.643 1.00 0.00 H new ATOM 0 HB2 ARG B 36 16.701 -1.322 -24.672 1.00 0.00 H new ATOM 0 HB3 ARG B 36 17.442 -0.215 -23.533 1.00 0.00 H new ATOM 0 HG2 ARG B 36 15.715 1.507 -24.120 1.00 0.00 H new ATOM 0 HG3 ARG B 36 14.958 0.356 -25.203 1.00 0.00 H new ATOM 0 HD2 ARG B 36 13.771 0.472 -23.076 1.00 0.00 H new ATOM 0 HD3 ARG B 36 14.446 -1.126 -23.329 1.00 0.00 H new ATOM 0 HE ARG B 36 15.878 -0.835 -21.614 1.00 0.00 H new ATOM 0 HH11 ARG B 36 13.943 2.023 -21.780 1.00 0.00 H new ATOM 0 HH12 ARG B 36 14.852 2.813 -20.487 1.00 0.00 H new ATOM 0 HH21 ARG B 36 17.045 0.050 -20.271 1.00 0.00 H new ATOM 0 HH22 ARG B 36 16.684 1.638 -19.588 1.00 0.00 H new ATOM 766 N HIS B 37 19.653 -0.975 -25.900 1.00 0.00 N ATOM 767 CA HIS B 37 21.024 -1.487 -25.893 1.00 0.00 C ATOM 768 C HIS B 37 21.856 -1.015 -27.110 1.00 0.00 C ATOM 769 O HIS B 37 23.047 -1.365 -27.220 1.00 0.00 O ATOM 770 CB HIS B 37 21.095 -3.029 -25.640 1.00 0.00 C ATOM 771 CG HIS B 37 20.117 -3.807 -26.455 1.00 0.00 C ATOM 772 ND1 HIS B 37 18.688 -3.652 -26.469 1.00 0.00 N ATOM 773 CD2 HIS B 37 20.454 -4.930 -27.252 1.00 0.00 C ATOM 774 CE1 HIS B 37 18.229 -4.626 -27.214 1.00 0.00 C ATOM 775 NE2 HIS B 37 19.258 -5.427 -27.718 1.00 0.00 N ATOM 0 H HIS B 37 19.040 -1.588 -26.436 1.00 0.00 H new ATOM 0 HA HIS B 37 21.510 -1.033 -25.029 1.00 0.00 H new ATOM 0 HB2 HIS B 37 22.103 -3.380 -25.862 1.00 0.00 H new ATOM 0 HB3 HIS B 37 20.914 -3.225 -24.583 1.00 0.00 H new ATOM 0 HD2 HIS B 37 21.443 -5.315 -27.452 1.00 0.00 H new ATOM 0 HE1 HIS B 37 17.181 -4.791 -27.415 1.00 0.00 H new ATOM 0 HE2 HIS B 37 19.143 -6.238 -28.325 1.00 0.00 H new ATOM 783 N THR B 38 21.250 -0.287 -28.092 1.00 0.00 N ATOM 784 CA THR B 38 21.906 0.083 -29.347 1.00 0.00 C ATOM 785 C THR B 38 23.131 0.912 -29.114 1.00 0.00 C ATOM 786 O THR B 38 23.034 2.079 -28.693 1.00 0.00 O ATOM 787 CB THR B 38 20.926 0.588 -30.372 1.00 0.00 C ATOM 788 OG1 THR B 38 19.937 -0.310 -30.804 1.00 0.00 O ATOM 789 CG2 THR B 38 21.499 1.147 -31.691 1.00 0.00 C ATOM 0 H THR B 38 20.291 0.052 -28.019 1.00 0.00 H new ATOM 0 HA THR B 38 22.303 -0.817 -29.817 1.00 0.00 H new ATOM 0 HB THR B 38 20.514 1.381 -29.748 1.00 0.00 H new ATOM 0 HG1 THR B 38 20.362 -1.093 -31.212 1.00 0.00 H new ATOM 0 HG21 THR B 38 20.681 1.474 -32.333 1.00 0.00 H new ATOM 0 HG22 THR B 38 22.151 1.993 -31.475 1.00 0.00 H new ATOM 0 HG23 THR B 38 22.070 0.369 -32.198 1.00 0.00 H new ATOM 797 N PRO B 39 24.332 0.458 -29.479 1.00 0.00 N ATOM 798 CA PRO B 39 25.535 1.317 -29.254 1.00 0.00 C ATOM 799 C PRO B 39 25.450 2.628 -30.076 1.00 0.00 C ATOM 800 O PRO B 39 25.348 2.523 -31.339 1.00 0.00 O ATOM 801 CB PRO B 39 26.795 0.394 -29.516 1.00 0.00 C ATOM 802 CG PRO B 39 26.238 -0.683 -30.456 1.00 0.00 C ATOM 803 CD PRO B 39 24.709 -0.753 -30.157 1.00 0.00 C ATOM 0 HA PRO B 39 25.612 1.692 -28.234 1.00 0.00 H new ATOM 0 HB2 PRO B 39 27.614 0.948 -29.976 1.00 0.00 H new ATOM 0 HB3 PRO B 39 27.181 -0.036 -28.592 1.00 0.00 H new ATOM 0 HG2 PRO B 39 26.422 -0.426 -31.499 1.00 0.00 H new ATOM 0 HG3 PRO B 39 26.717 -1.646 -30.276 1.00 0.00 H new ATOM 0 HD2 PRO B 39 24.144 -0.863 -31.083 1.00 0.00 H new ATOM 0 HD3 PRO B 39 24.481 -1.622 -29.540 1.00 0.00 H new ATOM 811 N LEU B 40 25.516 3.751 -29.414 1.00 0.00 N ATOM 812 CA LEU B 40 25.350 5.080 -30.037 1.00 0.00 C ATOM 813 C LEU B 40 26.361 5.458 -31.123 1.00 0.00 C ATOM 814 O LEU B 40 26.138 6.405 -31.871 1.00 0.00 O ATOM 815 CB LEU B 40 25.137 6.177 -28.926 1.00 0.00 C ATOM 816 CG LEU B 40 23.752 5.991 -28.229 1.00 0.00 C ATOM 817 CD1 LEU B 40 23.465 6.911 -27.100 1.00 0.00 C ATOM 818 CD2 LEU B 40 22.621 6.366 -29.134 1.00 0.00 C ATOM 0 H LEU B 40 25.689 3.793 -28.410 1.00 0.00 H new ATOM 0 HA LEU B 40 24.440 5.018 -30.633 1.00 0.00 H new ATOM 0 HB2 LEU B 40 25.934 6.112 -28.186 1.00 0.00 H new ATOM 0 HB3 LEU B 40 25.196 7.170 -29.372 1.00 0.00 H new ATOM 0 HG LEU B 40 23.818 4.947 -27.922 1.00 0.00 H new ATOM 0 HD11 LEU B 40 22.478 6.691 -26.693 1.00 0.00 H new ATOM 0 HD12 LEU B 40 24.216 6.777 -26.322 1.00 0.00 H new ATOM 0 HD13 LEU B 40 23.490 7.941 -27.455 1.00 0.00 H new ATOM 0 HD21 LEU B 40 21.675 6.223 -28.612 1.00 0.00 H new ATOM 0 HD22 LEU B 40 22.720 7.412 -29.426 1.00 0.00 H new ATOM 0 HD23 LEU B 40 22.643 5.737 -30.024 1.00 0.00 H new ATOM 830 N SER B 41 27.528 4.758 -31.222 1.00 0.00 N ATOM 831 CA SER B 41 28.507 4.912 -32.316 1.00 0.00 C ATOM 832 C SER B 41 27.924 4.594 -33.750 1.00 0.00 C ATOM 833 O SER B 41 28.337 5.178 -34.755 1.00 0.00 O ATOM 834 CB SER B 41 29.696 3.998 -32.026 1.00 0.00 C ATOM 835 OG SER B 41 29.134 2.661 -31.927 1.00 0.00 O ATOM 0 H SER B 41 27.810 4.064 -30.530 1.00 0.00 H new ATOM 0 HA SER B 41 28.801 5.961 -32.343 1.00 0.00 H new ATOM 0 HB2 SER B 41 30.439 4.055 -32.821 1.00 0.00 H new ATOM 0 HB3 SER B 41 30.196 4.284 -31.101 1.00 0.00 H new ATOM 0 HG SER B 41 29.850 2.018 -31.742 1.00 0.00 H new ATOM 841 N LYS B 42 26.976 3.626 -33.756 1.00 0.00 N ATOM 842 CA LYS B 42 26.216 3.316 -34.926 1.00 0.00 C ATOM 843 C LYS B 42 25.355 4.509 -35.445 1.00 0.00 C ATOM 844 O LYS B 42 25.216 4.548 -36.667 1.00 0.00 O ATOM 845 CB LYS B 42 25.202 2.131 -34.636 1.00 0.00 C ATOM 846 CG LYS B 42 25.870 0.755 -34.377 1.00 0.00 C ATOM 847 CD LYS B 42 24.857 -0.347 -34.702 1.00 0.00 C ATOM 848 CE LYS B 42 25.235 -1.663 -34.127 1.00 0.00 C ATOM 849 NZ LYS B 42 26.440 -2.200 -34.813 1.00 0.00 N ATOM 0 H LYS B 42 26.740 3.059 -32.942 1.00 0.00 H new ATOM 0 HA LYS B 42 26.958 3.052 -35.679 1.00 0.00 H new ATOM 0 HB2 LYS B 42 24.595 2.394 -33.769 1.00 0.00 H new ATOM 0 HB3 LYS B 42 24.523 2.036 -35.483 1.00 0.00 H new ATOM 0 HG2 LYS B 42 26.761 0.644 -34.995 1.00 0.00 H new ATOM 0 HG3 LYS B 42 26.191 0.680 -33.338 1.00 0.00 H new ATOM 0 HD2 LYS B 42 23.877 -0.057 -34.322 1.00 0.00 H new ATOM 0 HD3 LYS B 42 24.764 -0.441 -35.784 1.00 0.00 H new ATOM 0 HE2 LYS B 42 25.432 -1.558 -33.060 1.00 0.00 H new ATOM 0 HE3 LYS B 42 24.407 -2.364 -34.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 26.683 -3.128 -34.412 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 26.244 -2.302 -35.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 27.237 -1.546 -34.678 1.00 0.00 H new ATOM 863 N LEU B 43 24.920 5.433 -34.513 1.00 0.00 N ATOM 864 CA LEU B 43 24.287 6.677 -34.872 1.00 0.00 C ATOM 865 C LEU B 43 25.263 7.740 -35.319 1.00 0.00 C ATOM 866 O LEU B 43 25.075 8.415 -36.384 1.00 0.00 O ATOM 867 CB LEU B 43 23.361 7.113 -33.799 1.00 0.00 C ATOM 868 CG LEU B 43 22.054 6.219 -33.592 1.00 0.00 C ATOM 869 CD1 LEU B 43 22.315 4.893 -32.864 1.00 0.00 C ATOM 870 CD2 LEU B 43 21.052 6.961 -32.806 1.00 0.00 C ATOM 0 H LEU B 43 25.017 5.298 -33.507 1.00 0.00 H new ATOM 0 HA LEU B 43 23.682 6.500 -35.761 1.00 0.00 H new ATOM 0 HB2 LEU B 43 23.912 7.137 -32.859 1.00 0.00 H new ATOM 0 HB3 LEU B 43 23.047 8.135 -34.011 1.00 0.00 H new ATOM 0 HG LEU B 43 21.701 5.991 -34.597 1.00 0.00 H new ATOM 0 HD11 LEU B 43 21.379 4.344 -32.762 1.00 0.00 H new ATOM 0 HD12 LEU B 43 23.025 4.297 -33.437 1.00 0.00 H new ATOM 0 HD13 LEU B 43 22.726 5.096 -31.875 1.00 0.00 H new ATOM 0 HD21 LEU B 43 20.165 6.342 -32.671 1.00 0.00 H new ATOM 0 HD22 LEU B 43 21.469 7.215 -31.832 1.00 0.00 H new ATOM 0 HD23 LEU B 43 20.780 7.875 -33.334 1.00 0.00 H new ATOM 882 N MET B 44 26.348 7.906 -34.532 1.00 0.00 N ATOM 883 CA MET B 44 27.255 8.975 -34.782 1.00 0.00 C ATOM 884 C MET B 44 27.935 8.973 -36.132 1.00 0.00 C ATOM 885 O MET B 44 27.926 9.883 -36.945 1.00 0.00 O ATOM 886 CB MET B 44 28.308 9.058 -33.665 1.00 0.00 C ATOM 887 CG MET B 44 27.616 9.474 -32.372 1.00 0.00 C ATOM 888 SD MET B 44 28.726 9.895 -30.989 1.00 0.00 S ATOM 889 CE MET B 44 29.348 8.294 -30.230 1.00 0.00 C ATOM 0 H MET B 44 26.588 7.310 -33.740 1.00 0.00 H new ATOM 0 HA MET B 44 26.622 9.862 -34.793 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.800 8.094 -33.537 1.00 0.00 H new ATOM 0 HB3 MET B 44 29.082 9.779 -33.928 1.00 0.00 H new ATOM 0 HG2 MET B 44 26.981 10.335 -32.581 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.960 8.664 -32.055 1.00 0.00 H new ATOM 0 HE1 MET B 44 30.043 8.521 -29.422 1.00 0.00 H new ATOM 0 HE2 MET B 44 28.505 7.727 -29.836 1.00 0.00 H new ATOM 0 HE3 MET B 44 29.858 7.704 -30.992 1.00 0.00 H new ATOM 899 N LYS B 45 28.535 7.833 -36.516 1.00 0.00 N ATOM 900 CA LYS B 45 29.092 7.533 -37.848 1.00 0.00 C ATOM 901 C LYS B 45 27.983 7.586 -38.978 1.00 0.00 C ATOM 902 O LYS B 45 28.393 7.718 -40.089 1.00 0.00 O ATOM 903 CB LYS B 45 29.764 6.167 -37.784 1.00 0.00 C ATOM 904 CG LYS B 45 30.937 5.989 -36.808 1.00 0.00 C ATOM 905 CD LYS B 45 31.512 4.541 -36.882 1.00 0.00 C ATOM 906 CE LYS B 45 30.526 3.363 -36.889 1.00 0.00 C ATOM 907 NZ LYS B 45 31.180 2.069 -37.155 1.00 0.00 N ATOM 0 H LYS B 45 28.651 7.052 -35.870 1.00 0.00 H new ATOM 0 HA LYS B 45 29.826 8.293 -38.115 1.00 0.00 H new ATOM 0 HB2 LYS B 45 29.002 5.431 -37.529 1.00 0.00 H new ATOM 0 HB3 LYS B 45 30.121 5.923 -38.784 1.00 0.00 H new ATOM 0 HG2 LYS B 45 31.722 6.708 -37.042 1.00 0.00 H new ATOM 0 HG3 LYS B 45 30.604 6.200 -35.792 1.00 0.00 H new ATOM 0 HD2 LYS B 45 32.120 4.471 -37.784 1.00 0.00 H new ATOM 0 HD3 LYS B 45 32.184 4.407 -36.034 1.00 0.00 H new ATOM 0 HE2 LYS B 45 30.017 3.316 -35.926 1.00 0.00 H new ATOM 0 HE3 LYS B 45 29.761 3.540 -37.645 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 30.467 1.312 -37.148 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 31.644 2.099 -38.085 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 31.891 1.882 -36.420 1.00 0.00 H new ATOM 921 N ALA B 46 26.690 7.459 -38.665 1.00 0.00 N ATOM 922 CA ALA B 46 25.678 7.545 -39.676 1.00 0.00 C ATOM 923 C ALA B 46 25.294 8.991 -39.953 1.00 0.00 C ATOM 924 O ALA B 46 25.154 9.361 -41.103 1.00 0.00 O ATOM 925 CB ALA B 46 24.436 6.684 -39.279 1.00 0.00 C ATOM 0 H ALA B 46 26.339 7.298 -37.721 1.00 0.00 H new ATOM 0 HA ALA B 46 26.085 7.140 -40.603 1.00 0.00 H new ATOM 0 HB1 ALA B 46 23.677 6.760 -40.057 1.00 0.00 H new ATOM 0 HB2 ALA B 46 24.737 5.642 -39.166 1.00 0.00 H new ATOM 0 HB3 ALA B 46 24.027 7.048 -38.336 1.00 0.00 H new ATOM 931 N TYR B 47 25.290 9.772 -38.927 1.00 0.00 N ATOM 932 CA TYR B 47 25.145 11.168 -39.127 1.00 0.00 C ATOM 933 C TYR B 47 26.302 11.834 -39.976 1.00 0.00 C ATOM 934 O TYR B 47 26.039 12.685 -40.772 1.00 0.00 O ATOM 935 CB TYR B 47 24.798 11.752 -37.777 1.00 0.00 C ATOM 936 CG TYR B 47 24.185 13.101 -37.839 1.00 0.00 C ATOM 937 CD1 TYR B 47 22.781 13.240 -37.984 1.00 0.00 C ATOM 938 CD2 TYR B 47 24.908 14.236 -37.590 1.00 0.00 C ATOM 939 CE1 TYR B 47 22.114 14.459 -37.817 1.00 0.00 C ATOM 940 CE2 TYR B 47 24.289 15.506 -37.451 1.00 0.00 C ATOM 941 CZ TYR B 47 22.890 15.640 -37.570 1.00 0.00 C ATOM 942 OH TYR B 47 22.233 16.763 -37.250 1.00 0.00 O ATOM 0 H TYR B 47 25.384 9.472 -37.957 1.00 0.00 H new ATOM 0 HA TYR B 47 24.325 11.409 -39.803 1.00 0.00 H new ATOM 0 HB2 TYR B 47 24.112 11.076 -37.267 1.00 0.00 H new ATOM 0 HB3 TYR B 47 25.703 11.804 -37.172 1.00 0.00 H new ATOM 0 HD1 TYR B 47 22.200 12.365 -38.235 1.00 0.00 H new ATOM 0 HD2 TYR B 47 25.981 14.163 -37.496 1.00 0.00 H new ATOM 0 HE1 TYR B 47 21.037 14.510 -37.873 1.00 0.00 H new ATOM 0 HE2 TYR B 47 24.895 16.378 -37.252 1.00 0.00 H new ATOM 0 HH TYR B 47 22.876 17.489 -37.107 1.00 0.00 H new ATOM 952 N CYS B 48 27.546 11.394 -39.709 1.00 0.00 N ATOM 953 CA CYS B 48 28.671 11.767 -40.545 1.00 0.00 C ATOM 954 C CYS B 48 28.375 11.776 -42.066 1.00 0.00 C ATOM 955 O CYS B 48 28.534 12.753 -42.828 1.00 0.00 O ATOM 956 CB CYS B 48 29.872 10.919 -40.098 1.00 0.00 C ATOM 957 SG CYS B 48 31.328 11.497 -41.136 1.00 0.00 S ATOM 0 H CYS B 48 27.783 10.786 -38.925 1.00 0.00 H new ATOM 0 HA CYS B 48 28.913 12.819 -40.395 1.00 0.00 H new ATOM 0 HB2 CYS B 48 30.072 11.055 -39.035 1.00 0.00 H new ATOM 0 HB3 CYS B 48 29.679 9.857 -40.253 1.00 0.00 H new ATOM 0 HG CYS B 48 31.332 12.796 -41.193 1.00 0.00 H new ATOM 963 N GLU B 49 27.960 10.578 -42.581 1.00 0.00 N ATOM 964 CA GLU B 49 27.604 10.364 -44.001 1.00 0.00 C ATOM 965 C GLU B 49 26.437 11.242 -44.455 1.00 0.00 C ATOM 966 O GLU B 49 26.503 11.714 -45.611 1.00 0.00 O ATOM 967 CB GLU B 49 27.367 8.875 -44.366 1.00 0.00 C ATOM 968 CG GLU B 49 28.623 8.048 -43.924 1.00 0.00 C ATOM 969 CD GLU B 49 29.883 8.625 -44.542 1.00 0.00 C ATOM 970 OE1 GLU B 49 29.927 9.244 -45.656 1.00 0.00 O ATOM 971 OE2 GLU B 49 30.957 8.470 -43.887 1.00 0.00 O ATOM 0 H GLU B 49 27.866 9.737 -42.012 1.00 0.00 H new ATOM 0 HA GLU B 49 28.486 10.679 -44.559 1.00 0.00 H new ATOM 0 HB2 GLU B 49 26.473 8.501 -43.868 1.00 0.00 H new ATOM 0 HB3 GLU B 49 27.202 8.770 -45.438 1.00 0.00 H new ATOM 0 HG2 GLU B 49 28.707 8.056 -42.837 1.00 0.00 H new ATOM 0 HG3 GLU B 49 28.506 7.008 -44.227 1.00 0.00 H new ATOM 978 N ARG B 50 25.441 11.442 -43.584 1.00 0.00 N ATOM 979 CA ARG B 50 24.329 12.376 -43.910 1.00 0.00 C ATOM 980 C ARG B 50 24.750 13.862 -43.867 1.00 0.00 C ATOM 981 O ARG B 50 24.120 14.663 -44.586 1.00 0.00 O ATOM 982 CB ARG B 50 23.069 12.134 -43.025 1.00 0.00 C ATOM 983 CG ARG B 50 22.326 10.899 -43.489 1.00 0.00 C ATOM 984 CD ARG B 50 21.003 10.728 -42.796 1.00 0.00 C ATOM 985 NE ARG B 50 20.313 9.537 -43.411 1.00 0.00 N ATOM 986 CZ ARG B 50 19.405 9.589 -44.347 1.00 0.00 C ATOM 987 NH1 ARG B 50 19.155 10.712 -45.007 1.00 0.00 N ATOM 988 NH2 ARG B 50 18.763 8.457 -44.691 1.00 0.00 N ATOM 0 H ARG B 50 25.371 10.991 -42.672 1.00 0.00 H new ATOM 0 HA ARG B 50 24.061 12.149 -44.942 1.00 0.00 H new ATOM 0 HB2 ARG B 50 23.366 12.017 -41.983 1.00 0.00 H new ATOM 0 HB3 ARG B 50 22.411 13.002 -43.073 1.00 0.00 H new ATOM 0 HG2 ARG B 50 22.163 10.960 -44.565 1.00 0.00 H new ATOM 0 HG3 ARG B 50 22.943 10.019 -43.309 1.00 0.00 H new ATOM 0 HD2 ARG B 50 21.149 10.575 -41.727 1.00 0.00 H new ATOM 0 HD3 ARG B 50 20.393 11.624 -42.910 1.00 0.00 H new ATOM 0 HE ARG B 50 20.578 8.614 -43.067 1.00 0.00 H new ATOM 0 HH11 ARG B 50 19.677 11.560 -44.787 1.00 0.00 H new ATOM 0 HH12 ARG B 50 18.440 10.728 -45.735 1.00 0.00 H new ATOM 0 HH21 ARG B 50 18.989 7.580 -44.222 1.00 0.00 H new ATOM 0 HH22 ARG B 50 18.050 8.477 -45.420 1.00 0.00 H new ATOM 1002 N GLN B 51 25.696 14.304 -43.041 1.00 0.00 N ATOM 1003 CA GLN B 51 26.225 15.704 -43.048 1.00 0.00 C ATOM 1004 C GLN B 51 27.118 16.017 -44.216 1.00 0.00 C ATOM 1005 O GLN B 51 27.037 17.096 -44.799 1.00 0.00 O ATOM 1006 CB GLN B 51 27.079 15.936 -41.777 1.00 0.00 C ATOM 1007 CG GLN B 51 26.541 15.802 -40.353 1.00 0.00 C ATOM 1008 CD GLN B 51 26.292 17.236 -39.691 1.00 0.00 C ATOM 1009 OE1 GLN B 51 27.067 17.768 -38.934 1.00 0.00 O ATOM 1010 NE2 GLN B 51 25.137 17.846 -39.906 1.00 0.00 N ATOM 0 H GLN B 51 26.133 13.711 -42.335 1.00 0.00 H new ATOM 0 HA GLN B 51 25.345 16.345 -43.102 1.00 0.00 H new ATOM 0 HB2 GLN B 51 27.925 15.252 -41.849 1.00 0.00 H new ATOM 0 HB3 GLN B 51 27.478 16.947 -41.858 1.00 0.00 H new ATOM 0 HG2 GLN B 51 25.609 15.238 -40.365 1.00 0.00 H new ATOM 0 HG3 GLN B 51 27.248 15.236 -39.746 1.00 0.00 H new ATOM 0 HE21 GLN B 51 24.452 17.432 -40.538 1.00 0.00 H new ATOM 0 HE22 GLN B 51 24.932 18.730 -39.439 1.00 0.00 H new ATOM 1019 N GLY B 52 28.079 15.135 -44.517 1.00 0.00 N ATOM 1020 CA GLY B 52 29.268 15.437 -45.363 1.00 0.00 C ATOM 1021 C GLY B 52 30.299 16.233 -44.531 1.00 0.00 C ATOM 1022 O GLY B 52 31.297 16.694 -45.126 1.00 0.00 O ATOM 0 H GLY B 52 28.063 14.172 -44.180 1.00 0.00 H new ATOM 0 HA2 GLY B 52 29.714 14.511 -45.727 1.00 0.00 H new ATOM 0 HA3 GLY B 52 28.969 16.012 -46.239 1.00 0.00 H new ATOM 1026 N LEU B 53 30.136 16.387 -43.221 1.00 0.00 N ATOM 1027 CA LEU B 53 31.129 16.803 -42.246 1.00 0.00 C ATOM 1028 C LEU B 53 31.844 15.705 -41.468 1.00 0.00 C ATOM 1029 O LEU B 53 31.221 14.645 -41.252 1.00 0.00 O ATOM 1030 CB LEU B 53 30.499 17.810 -41.224 1.00 0.00 C ATOM 1031 CG LEU B 53 30.026 19.147 -41.813 1.00 0.00 C ATOM 1032 CD1 LEU B 53 29.380 19.884 -40.654 1.00 0.00 C ATOM 1033 CD2 LEU B 53 31.089 20.072 -42.405 1.00 0.00 C ATOM 0 H LEU B 53 29.233 16.209 -42.782 1.00 0.00 H new ATOM 0 HA LEU B 53 31.903 17.260 -42.863 1.00 0.00 H new ATOM 0 HB2 LEU B 53 29.650 17.326 -40.741 1.00 0.00 H new ATOM 0 HB3 LEU B 53 31.233 18.016 -40.445 1.00 0.00 H new ATOM 0 HG LEU B 53 29.383 18.902 -42.658 1.00 0.00 H new ATOM 0 HD11 LEU B 53 29.016 20.852 -40.997 1.00 0.00 H new ATOM 0 HD12 LEU B 53 28.546 19.297 -40.270 1.00 0.00 H new ATOM 0 HD13 LEU B 53 30.114 20.032 -39.862 1.00 0.00 H new ATOM 0 HD21 LEU B 53 30.614 20.977 -42.783 1.00 0.00 H new ATOM 0 HD22 LEU B 53 31.812 20.337 -41.633 1.00 0.00 H new ATOM 0 HD23 LEU B 53 31.601 19.563 -43.222 1.00 0.00 H new ATOM 1045 N SER B 54 33.026 16.025 -40.911 1.00 0.00 N ATOM 1046 CA SER B 54 33.929 15.126 -40.285 1.00 0.00 C ATOM 1047 C SER B 54 33.639 14.858 -38.770 1.00 0.00 C ATOM 1048 O SER B 54 33.450 15.822 -38.053 1.00 0.00 O ATOM 1049 CB SER B 54 35.312 15.723 -40.475 1.00 0.00 C ATOM 1050 OG SER B 54 36.289 14.904 -39.841 1.00 0.00 O ATOM 0 H SER B 54 33.369 16.985 -40.901 1.00 0.00 H new ATOM 0 HA SER B 54 33.826 14.144 -40.746 1.00 0.00 H new ATOM 0 HB2 SER B 54 35.535 15.812 -41.538 1.00 0.00 H new ATOM 0 HB3 SER B 54 35.343 16.729 -40.057 1.00 0.00 H new ATOM 0 HG SER B 54 37.178 15.296 -39.970 1.00 0.00 H new ATOM 1056 N MET B 55 33.627 13.680 -38.238 1.00 0.00 N ATOM 1057 CA MET B 55 33.611 13.358 -36.768 1.00 0.00 C ATOM 1058 C MET B 55 34.762 13.956 -36.059 1.00 0.00 C ATOM 1059 O MET B 55 34.683 14.131 -34.803 1.00 0.00 O ATOM 1060 CB MET B 55 33.543 11.868 -36.611 1.00 0.00 C ATOM 1061 CG MET B 55 31.996 11.600 -36.562 1.00 0.00 C ATOM 1062 SD MET B 55 31.573 9.836 -36.571 1.00 0.00 S ATOM 1063 CE MET B 55 31.995 9.216 -34.833 1.00 0.00 C ATOM 0 H MET B 55 33.628 12.838 -38.814 1.00 0.00 H new ATOM 0 HA MET B 55 32.730 13.802 -36.303 1.00 0.00 H new ATOM 0 HB2 MET B 55 34.018 11.350 -37.444 1.00 0.00 H new ATOM 0 HB3 MET B 55 34.042 11.533 -35.702 1.00 0.00 H new ATOM 0 HG2 MET B 55 31.583 12.061 -35.665 1.00 0.00 H new ATOM 0 HG3 MET B 55 31.523 12.084 -37.416 1.00 0.00 H new ATOM 0 HE1 MET B 55 31.766 8.153 -34.760 1.00 0.00 H new ATOM 0 HE2 MET B 55 33.056 9.372 -34.639 1.00 0.00 H new ATOM 0 HE3 MET B 55 31.407 9.765 -34.098 1.00 0.00 H new ATOM 1073 N ARG B 56 35.928 14.246 -36.654 1.00 0.00 N ATOM 1074 CA ARG B 56 37.069 14.842 -35.925 1.00 0.00 C ATOM 1075 C ARG B 56 36.802 16.308 -35.465 1.00 0.00 C ATOM 1076 O ARG B 56 37.405 16.927 -34.606 1.00 0.00 O ATOM 1077 CB ARG B 56 38.290 14.745 -36.900 1.00 0.00 C ATOM 1078 CG ARG B 56 39.665 14.826 -36.107 1.00 0.00 C ATOM 1079 CD ARG B 56 40.761 14.927 -37.135 1.00 0.00 C ATOM 1080 NE ARG B 56 42.105 15.292 -36.531 1.00 0.00 N ATOM 1081 CZ ARG B 56 43.193 15.477 -37.273 1.00 0.00 C ATOM 1082 NH1 ARG B 56 43.041 15.550 -38.577 1.00 0.00 N ATOM 1083 NH2 ARG B 56 44.419 15.464 -36.818 1.00 0.00 N ATOM 0 H ARG B 56 36.111 14.078 -37.643 1.00 0.00 H new ATOM 0 HA ARG B 56 37.253 14.304 -34.995 1.00 0.00 H new ATOM 0 HB2 ARG B 56 38.242 13.808 -37.455 1.00 0.00 H new ATOM 0 HB3 ARG B 56 38.240 15.552 -37.631 1.00 0.00 H new ATOM 0 HG2 ARG B 56 39.677 15.691 -35.444 1.00 0.00 H new ATOM 0 HG3 ARG B 56 39.802 13.943 -35.482 1.00 0.00 H new ATOM 0 HD2 ARG B 56 40.850 13.975 -37.659 1.00 0.00 H new ATOM 0 HD3 ARG B 56 40.487 15.675 -37.879 1.00 0.00 H new ATOM 0 HE ARG B 56 42.176 15.399 -35.519 1.00 0.00 H new ATOM 0 HH11 ARG B 56 42.111 15.465 -38.988 1.00 0.00 H new ATOM 0 HH12 ARG B 56 43.853 15.691 -39.178 1.00 0.00 H new ATOM 0 HH21 ARG B 56 44.593 15.303 -35.826 1.00 0.00 H new ATOM 0 HH22 ARG B 56 45.201 15.615 -37.455 1.00 0.00 H new ATOM 1097 N GLN B 57 35.750 16.934 -36.073 1.00 0.00 N ATOM 1098 CA GLN B 57 35.252 18.318 -36.056 1.00 0.00 C ATOM 1099 C GLN B 57 33.954 18.381 -35.339 1.00 0.00 C ATOM 1100 O GLN B 57 33.764 19.249 -34.480 1.00 0.00 O ATOM 1101 CB GLN B 57 34.984 18.902 -37.425 1.00 0.00 C ATOM 1102 CG GLN B 57 34.492 20.363 -37.557 1.00 0.00 C ATOM 1103 CD GLN B 57 34.120 20.673 -39.023 1.00 0.00 C ATOM 1104 OE1 GLN B 57 34.796 20.258 -39.944 1.00 0.00 O ATOM 1105 NE2 GLN B 57 32.990 21.218 -39.244 1.00 0.00 N ATOM 0 H GLN B 57 35.148 16.376 -36.678 1.00 0.00 H new ATOM 0 HA GLN B 57 36.046 18.888 -35.573 1.00 0.00 H new ATOM 0 HB2 GLN B 57 35.906 18.816 -38.001 1.00 0.00 H new ATOM 0 HB3 GLN B 57 34.245 18.265 -37.911 1.00 0.00 H new ATOM 0 HG2 GLN B 57 33.627 20.522 -36.914 1.00 0.00 H new ATOM 0 HG3 GLN B 57 35.270 21.048 -37.220 1.00 0.00 H new ATOM 0 HE21 GLN B 57 32.429 21.563 -38.465 1.00 0.00 H new ATOM 0 HE22 GLN B 57 32.646 21.309 -40.200 1.00 0.00 H new ATOM 1114 N ILE B 58 32.915 17.527 -35.598 1.00 0.00 N ATOM 1115 CA ILE B 58 31.587 17.502 -34.881 1.00 0.00 C ATOM 1116 C ILE B 58 31.695 16.781 -33.527 1.00 0.00 C ATOM 1117 O ILE B 58 32.475 15.898 -33.301 1.00 0.00 O ATOM 1118 CB ILE B 58 30.327 17.139 -35.782 1.00 0.00 C ATOM 1119 CG1 ILE B 58 30.165 15.630 -36.098 1.00 0.00 C ATOM 1120 CG2 ILE B 58 30.377 17.865 -37.120 1.00 0.00 C ATOM 1121 CD1 ILE B 58 28.811 15.418 -36.764 1.00 0.00 C ATOM 0 H ILE B 58 32.974 16.817 -36.328 1.00 0.00 H new ATOM 0 HA ILE B 58 31.347 18.537 -34.636 1.00 0.00 H new ATOM 0 HB ILE B 58 29.479 17.455 -35.175 1.00 0.00 H new ATOM 0 HG12 ILE B 58 30.967 15.292 -36.754 1.00 0.00 H new ATOM 0 HG13 ILE B 58 30.233 15.042 -35.183 1.00 0.00 H new ATOM 0 HG21 ILE B 58 29.503 17.596 -37.713 1.00 0.00 H new ATOM 0 HG22 ILE B 58 30.383 18.942 -36.950 1.00 0.00 H new ATOM 0 HG23 ILE B 58 31.281 17.577 -37.656 1.00 0.00 H new ATOM 0 HD11 ILE B 58 28.680 14.361 -36.994 1.00 0.00 H new ATOM 0 HD12 ILE B 58 28.019 15.744 -36.090 1.00 0.00 H new ATOM 0 HD13 ILE B 58 28.764 15.998 -37.686 1.00 0.00 H new ATOM 1133 N ARG B 59 30.797 17.142 -32.568 1.00 0.00 N ATOM 1134 CA ARG B 59 30.682 16.637 -31.141 1.00 0.00 C ATOM 1135 C ARG B 59 29.229 16.399 -30.781 1.00 0.00 C ATOM 1136 O ARG B 59 28.475 17.357 -31.093 1.00 0.00 O ATOM 1137 CB ARG B 59 31.389 17.567 -30.119 1.00 0.00 C ATOM 1138 CG ARG B 59 32.894 17.807 -30.322 1.00 0.00 C ATOM 1139 CD ARG B 59 33.732 16.554 -29.932 1.00 0.00 C ATOM 1140 NE ARG B 59 35.104 16.908 -30.426 1.00 0.00 N ATOM 1141 CZ ARG B 59 35.643 16.777 -31.594 1.00 0.00 C ATOM 1142 NH1 ARG B 59 35.077 16.253 -32.660 1.00 0.00 N ATOM 1143 NH2 ARG B 59 36.874 17.094 -31.770 1.00 0.00 N ATOM 0 H ARG B 59 30.080 17.839 -32.770 1.00 0.00 H new ATOM 0 HA ARG B 59 31.208 15.684 -31.087 1.00 0.00 H new ATOM 0 HB2 ARG B 59 30.886 18.534 -30.136 1.00 0.00 H new ATOM 0 HB3 ARG B 59 31.243 17.149 -29.123 1.00 0.00 H new ATOM 0 HG2 ARG B 59 33.085 18.063 -31.364 1.00 0.00 H new ATOM 0 HG3 ARG B 59 33.211 18.659 -29.721 1.00 0.00 H new ATOM 0 HD2 ARG B 59 33.722 16.379 -28.856 1.00 0.00 H new ATOM 0 HD3 ARG B 59 33.352 15.649 -30.406 1.00 0.00 H new ATOM 0 HE ARG B 59 35.715 17.322 -29.721 1.00 0.00 H new ATOM 0 HH11 ARG B 59 34.121 15.902 -32.609 1.00 0.00 H new ATOM 0 HH12 ARG B 59 35.595 16.198 -33.537 1.00 0.00 H new ATOM 0 HH21 ARG B 59 37.426 17.449 -30.989 1.00 0.00 H new ATOM 0 HH22 ARG B 59 37.300 16.991 -32.691 1.00 0.00 H new ATOM 1157 N PHE B 60 28.884 15.275 -30.288 1.00 0.00 N ATOM 1158 CA PHE B 60 27.501 14.949 -29.796 1.00 0.00 C ATOM 1159 C PHE B 60 27.388 14.912 -28.264 1.00 0.00 C ATOM 1160 O PHE B 60 28.272 14.350 -27.586 1.00 0.00 O ATOM 1161 CB PHE B 60 27.158 13.604 -30.292 1.00 0.00 C ATOM 1162 CG PHE B 60 27.071 13.456 -31.822 1.00 0.00 C ATOM 1163 CD1 PHE B 60 28.272 13.209 -32.577 1.00 0.00 C ATOM 1164 CD2 PHE B 60 25.839 13.462 -32.446 1.00 0.00 C ATOM 1165 CE1 PHE B 60 28.242 13.024 -33.947 1.00 0.00 C ATOM 1166 CE2 PHE B 60 25.772 13.297 -33.903 1.00 0.00 C ATOM 1167 CZ PHE B 60 26.945 13.113 -34.577 1.00 0.00 C ATOM 0 H PHE B 60 29.536 14.497 -30.189 1.00 0.00 H new ATOM 0 HA PHE B 60 26.834 15.731 -30.158 1.00 0.00 H new ATOM 0 HB2 PHE B 60 27.902 12.899 -29.919 1.00 0.00 H new ATOM 0 HB3 PHE B 60 26.199 13.313 -29.863 1.00 0.00 H new ATOM 0 HD1 PHE B 60 29.220 13.167 -32.061 1.00 0.00 H new ATOM 0 HD2 PHE B 60 24.935 13.587 -31.868 1.00 0.00 H new ATOM 0 HE1 PHE B 60 29.139 12.824 -34.515 1.00 0.00 H new ATOM 0 HE2 PHE B 60 24.826 13.320 -34.424 1.00 0.00 H new ATOM 0 HZ PHE B 60 26.900 13.028 -35.653 1.00 0.00 H new ATOM 1177 N ARG B 61 26.361 15.604 -27.711 1.00 0.00 N ATOM 1178 CA ARG B 61 26.112 15.637 -26.261 1.00 0.00 C ATOM 1179 C ARG B 61 24.718 15.235 -25.881 1.00 0.00 C ATOM 1180 O ARG B 61 23.809 15.209 -26.705 1.00 0.00 O ATOM 1181 CB ARG B 61 26.459 17.042 -25.696 1.00 0.00 C ATOM 1182 CG ARG B 61 27.865 17.496 -26.067 1.00 0.00 C ATOM 1183 CD ARG B 61 28.069 18.915 -25.582 1.00 0.00 C ATOM 1184 NE ARG B 61 29.456 19.275 -25.768 1.00 0.00 N ATOM 1185 CZ ARG B 61 29.970 20.206 -26.517 1.00 0.00 C ATOM 1186 NH1 ARG B 61 29.198 21.196 -27.000 1.00 0.00 N ATOM 1187 NH2 ARG B 61 31.223 20.358 -26.796 1.00 0.00 N ATOM 0 H ARG B 61 25.692 16.147 -28.257 1.00 0.00 H new ATOM 0 HA ARG B 61 26.766 14.889 -25.812 1.00 0.00 H new ATOM 0 HB2 ARG B 61 25.737 17.768 -26.070 1.00 0.00 H new ATOM 0 HB3 ARG B 61 26.362 17.026 -24.610 1.00 0.00 H new ATOM 0 HG2 ARG B 61 28.605 16.834 -25.617 1.00 0.00 H new ATOM 0 HG3 ARG B 61 28.005 17.443 -27.147 1.00 0.00 H new ATOM 0 HD2 ARG B 61 27.424 19.599 -26.134 1.00 0.00 H new ATOM 0 HD3 ARG B 61 27.795 18.998 -24.530 1.00 0.00 H new ATOM 0 HE ARG B 61 30.127 18.720 -25.237 1.00 0.00 H new ATOM 0 HH11 ARG B 61 28.202 21.220 -26.780 1.00 0.00 H new ATOM 0 HH12 ARG B 61 29.608 21.923 -27.587 1.00 0.00 H new ATOM 0 HH21 ARG B 61 31.913 19.710 -26.415 1.00 0.00 H new ATOM 0 HH22 ARG B 61 31.522 21.126 -27.397 1.00 0.00 H new ATOM 1201 N PHE B 62 24.401 15.064 -24.592 1.00 0.00 N ATOM 1202 CA PHE B 62 23.045 14.910 -24.091 1.00 0.00 C ATOM 1203 C PHE B 62 22.980 15.264 -22.609 1.00 0.00 C ATOM 1204 O PHE B 62 23.934 15.017 -21.892 1.00 0.00 O ATOM 1205 CB PHE B 62 22.495 13.541 -24.324 1.00 0.00 C ATOM 1206 CG PHE B 62 21.220 13.256 -23.578 1.00 0.00 C ATOM 1207 CD1 PHE B 62 20.105 13.976 -23.788 1.00 0.00 C ATOM 1208 CD2 PHE B 62 21.211 12.141 -22.681 1.00 0.00 C ATOM 1209 CE1 PHE B 62 18.992 13.745 -22.948 1.00 0.00 C ATOM 1210 CE2 PHE B 62 20.140 11.940 -21.788 1.00 0.00 C ATOM 1211 CZ PHE B 62 18.995 12.778 -21.985 1.00 0.00 C ATOM 0 H PHE B 62 25.105 15.029 -23.855 1.00 0.00 H new ATOM 0 HA PHE B 62 22.420 15.603 -24.655 1.00 0.00 H new ATOM 0 HB2 PHE B 62 22.316 13.410 -25.391 1.00 0.00 H new ATOM 0 HB3 PHE B 62 23.245 12.805 -24.034 1.00 0.00 H new ATOM 0 HD1 PHE B 62 20.061 14.712 -24.578 1.00 0.00 H new ATOM 0 HD2 PHE B 62 22.036 11.444 -22.689 1.00 0.00 H new ATOM 0 HE1 PHE B 62 18.109 14.354 -23.072 1.00 0.00 H new ATOM 0 HE2 PHE B 62 20.180 11.199 -21.003 1.00 0.00 H new ATOM 0 HZ PHE B 62 18.122 12.643 -21.363 1.00 0.00 H new ATOM 1221 N ASP B 63 21.921 15.873 -22.040 1.00 0.00 N ATOM 1222 CA ASP B 63 21.900 16.301 -20.652 1.00 0.00 C ATOM 1223 C ASP B 63 23.025 17.225 -20.190 1.00 0.00 C ATOM 1224 O ASP B 63 23.409 17.038 -19.033 1.00 0.00 O ATOM 1225 CB ASP B 63 21.615 15.049 -19.725 1.00 0.00 C ATOM 1226 CG ASP B 63 20.778 15.276 -18.510 1.00 0.00 C ATOM 1227 OD1 ASP B 63 20.040 16.285 -18.538 1.00 0.00 O ATOM 1228 OD2 ASP B 63 20.867 14.415 -17.563 1.00 0.00 O ATOM 0 H ASP B 63 21.058 16.077 -22.544 1.00 0.00 H new ATOM 0 HA ASP B 63 21.069 17.000 -20.554 1.00 0.00 H new ATOM 0 HB2 ASP B 63 21.130 14.283 -20.331 1.00 0.00 H new ATOM 0 HB3 ASP B 63 22.574 14.642 -19.404 1.00 0.00 H new ATOM 1233 N GLY B 64 23.669 17.976 -21.064 1.00 0.00 N ATOM 1234 CA GLY B 64 24.919 18.719 -20.864 1.00 0.00 C ATOM 1235 C GLY B 64 26.249 17.870 -21.073 1.00 0.00 C ATOM 1236 O GLY B 64 27.294 18.455 -21.316 1.00 0.00 O ATOM 0 H GLY B 64 23.310 18.098 -22.011 1.00 0.00 H new ATOM 0 HA2 GLY B 64 24.935 19.565 -21.551 1.00 0.00 H new ATOM 0 HA3 GLY B 64 24.923 19.129 -19.854 1.00 0.00 H new ATOM 1240 N GLN B 65 26.184 16.549 -20.937 1.00 0.00 N ATOM 1241 CA GLN B 65 27.275 15.647 -21.051 1.00 0.00 C ATOM 1242 C GLN B 65 27.667 15.206 -22.487 1.00 0.00 C ATOM 1243 O GLN B 65 26.803 14.858 -23.279 1.00 0.00 O ATOM 1244 CB GLN B 65 27.027 14.347 -20.209 1.00 0.00 C ATOM 1245 CG GLN B 65 26.403 14.619 -18.830 1.00 0.00 C ATOM 1246 CD GLN B 65 27.347 15.308 -17.831 1.00 0.00 C ATOM 1247 OE1 GLN B 65 28.584 15.168 -17.946 1.00 0.00 O ATOM 1248 NE2 GLN B 65 26.829 15.887 -16.783 1.00 0.00 N ATOM 0 H GLN B 65 25.306 16.073 -20.732 1.00 0.00 H new ATOM 0 HA GLN B 65 28.108 16.238 -20.670 1.00 0.00 H new ATOM 0 HB2 GLN B 65 26.373 13.680 -20.770 1.00 0.00 H new ATOM 0 HB3 GLN B 65 27.974 13.825 -20.074 1.00 0.00 H new ATOM 0 HG2 GLN B 65 25.517 15.240 -18.962 1.00 0.00 H new ATOM 0 HG3 GLN B 65 26.069 13.673 -18.403 1.00 0.00 H new ATOM 0 HE21 GLN B 65 25.817 15.992 -16.706 1.00 0.00 H new ATOM 0 HE22 GLN B 65 27.436 16.234 -16.040 1.00 0.00 H new ATOM 1257 N PRO B 66 29.014 15.186 -22.802 1.00 0.00 N ATOM 1258 CA PRO B 66 29.564 14.534 -23.947 1.00 0.00 C ATOM 1259 C PRO B 66 29.218 13.055 -23.892 1.00 0.00 C ATOM 1260 O PRO B 66 29.278 12.350 -22.858 1.00 0.00 O ATOM 1261 CB PRO B 66 31.084 14.871 -23.905 1.00 0.00 C ATOM 1262 CG PRO B 66 31.353 15.069 -22.409 1.00 0.00 C ATOM 1263 CD PRO B 66 30.033 15.443 -21.869 1.00 0.00 C ATOM 0 HA PRO B 66 29.162 14.866 -24.904 1.00 0.00 H new ATOM 0 HB2 PRO B 66 31.688 14.064 -24.320 1.00 0.00 H new ATOM 0 HB3 PRO B 66 31.314 15.769 -24.479 1.00 0.00 H new ATOM 0 HG2 PRO B 66 31.733 14.159 -21.946 1.00 0.00 H new ATOM 0 HG3 PRO B 66 32.094 15.849 -22.234 1.00 0.00 H new ATOM 0 HD2 PRO B 66 29.840 14.886 -20.952 1.00 0.00 H new ATOM 0 HD3 PRO B 66 30.031 16.501 -21.605 1.00 0.00 H new ATOM 1271 N ILE B 67 28.942 12.469 -25.079 1.00 0.00 N ATOM 1272 CA ILE B 67 28.613 11.106 -25.289 1.00 0.00 C ATOM 1273 C ILE B 67 29.752 10.246 -25.790 1.00 0.00 C ATOM 1274 O ILE B 67 30.520 10.806 -26.608 1.00 0.00 O ATOM 1275 CB ILE B 67 27.454 11.021 -26.287 1.00 0.00 C ATOM 1276 CG1 ILE B 67 26.185 11.650 -25.693 1.00 0.00 C ATOM 1277 CG2 ILE B 67 27.047 9.618 -26.875 1.00 0.00 C ATOM 1278 CD1 ILE B 67 24.961 11.785 -26.587 1.00 0.00 C ATOM 0 H ILE B 67 28.953 13.000 -25.950 1.00 0.00 H new ATOM 0 HA ILE B 67 28.345 10.710 -24.309 1.00 0.00 H new ATOM 0 HB ILE B 67 27.872 11.564 -27.135 1.00 0.00 H new ATOM 0 HG12 ILE B 67 25.898 11.060 -24.823 1.00 0.00 H new ATOM 0 HG13 ILE B 67 26.445 12.645 -25.332 1.00 0.00 H new ATOM 0 HG21 ILE B 67 26.211 9.741 -27.563 1.00 0.00 H new ATOM 0 HG22 ILE B 67 27.895 9.187 -27.407 1.00 0.00 H new ATOM 0 HG23 ILE B 67 26.753 8.954 -26.062 1.00 0.00 H new ATOM 0 HD11 ILE B 67 24.149 12.246 -26.025 1.00 0.00 H new ATOM 0 HD12 ILE B 67 25.206 12.408 -27.448 1.00 0.00 H new ATOM 0 HD13 ILE B 67 24.650 10.798 -26.930 1.00 0.00 H new ATOM 1290 N ASN B 68 29.966 9.055 -25.338 1.00 0.00 N ATOM 1291 CA ASN B 68 31.088 8.172 -25.729 1.00 0.00 C ATOM 1292 C ASN B 68 30.629 7.299 -26.888 1.00 0.00 C ATOM 1293 O ASN B 68 29.428 7.156 -27.044 1.00 0.00 O ATOM 1294 CB ASN B 68 31.506 7.319 -24.533 1.00 0.00 C ATOM 1295 CG ASN B 68 31.989 8.233 -23.394 1.00 0.00 C ATOM 1296 OD1 ASN B 68 33.141 8.615 -23.241 1.00 0.00 O ATOM 1297 ND2 ASN B 68 31.182 8.386 -22.376 1.00 0.00 N ATOM 0 H ASN B 68 29.350 8.621 -24.650 1.00 0.00 H new ATOM 0 HA ASN B 68 31.951 8.760 -26.043 1.00 0.00 H new ATOM 0 HB2 ASN B 68 30.666 6.712 -24.195 1.00 0.00 H new ATOM 0 HB3 ASN B 68 32.300 6.631 -24.823 1.00 0.00 H new ATOM 0 HD21 ASN B 68 31.525 8.806 -21.512 1.00 0.00 H new ATOM 0 HD22 ASN B 68 30.210 8.086 -22.446 1.00 0.00 H new ATOM 1304 N GLU B 69 31.502 6.608 -27.640 1.00 0.00 N ATOM 1305 CA GLU B 69 31.199 5.558 -28.690 1.00 0.00 C ATOM 1306 C GLU B 69 30.576 4.263 -28.046 1.00 0.00 C ATOM 1307 O GLU B 69 29.790 3.574 -28.758 1.00 0.00 O ATOM 1308 CB GLU B 69 32.452 5.262 -29.421 1.00 0.00 C ATOM 1309 CG GLU B 69 32.854 6.460 -30.336 1.00 0.00 C ATOM 1310 CD GLU B 69 34.162 6.310 -31.078 1.00 0.00 C ATOM 1311 OE1 GLU B 69 34.380 5.193 -31.616 1.00 0.00 O ATOM 1312 OE2 GLU B 69 34.962 7.213 -31.104 1.00 0.00 O ATOM 0 H GLU B 69 32.506 6.759 -27.544 1.00 0.00 H new ATOM 0 HA GLU B 69 30.452 5.936 -29.388 1.00 0.00 H new ATOM 0 HB2 GLU B 69 33.253 5.056 -28.711 1.00 0.00 H new ATOM 0 HB3 GLU B 69 32.323 4.364 -30.025 1.00 0.00 H new ATOM 0 HG2 GLU B 69 32.060 6.618 -31.066 1.00 0.00 H new ATOM 0 HG3 GLU B 69 32.907 7.360 -29.723 1.00 0.00 H new ATOM 1319 N THR B 70 30.899 3.882 -26.785 1.00 0.00 N ATOM 1320 CA THR B 70 30.437 2.709 -26.100 1.00 0.00 C ATOM 1321 C THR B 70 29.095 2.943 -25.350 1.00 0.00 C ATOM 1322 O THR B 70 28.504 2.003 -24.834 1.00 0.00 O ATOM 1323 CB THR B 70 31.463 2.199 -25.097 1.00 0.00 C ATOM 1324 OG1 THR B 70 31.817 3.294 -24.219 1.00 0.00 O ATOM 1325 CG2 THR B 70 32.778 1.757 -25.762 1.00 0.00 C ATOM 0 H THR B 70 31.529 4.439 -26.208 1.00 0.00 H new ATOM 0 HA THR B 70 30.281 1.964 -26.880 1.00 0.00 H new ATOM 0 HB THR B 70 31.013 1.349 -24.585 1.00 0.00 H new ATOM 0 HG1 THR B 70 32.477 2.987 -23.563 1.00 0.00 H new ATOM 0 HG21 THR B 70 33.471 1.403 -24.999 1.00 0.00 H new ATOM 0 HG22 THR B 70 32.576 0.953 -26.469 1.00 0.00 H new ATOM 0 HG23 THR B 70 33.220 2.602 -26.290 1.00 0.00 H new ATOM 1333 N ASP B 71 28.686 4.207 -25.243 1.00 0.00 N ATOM 1334 CA ASP B 71 27.445 4.645 -24.591 1.00 0.00 C ATOM 1335 C ASP B 71 26.145 4.071 -25.349 1.00 0.00 C ATOM 1336 O ASP B 71 26.080 3.804 -26.521 1.00 0.00 O ATOM 1337 CB ASP B 71 27.305 6.142 -24.360 1.00 0.00 C ATOM 1338 CG ASP B 71 28.254 6.654 -23.309 1.00 0.00 C ATOM 1339 OD1 ASP B 71 28.817 5.865 -22.539 1.00 0.00 O ATOM 1340 OD2 ASP B 71 28.519 7.839 -23.147 1.00 0.00 O ATOM 0 H ASP B 71 29.227 4.985 -25.621 1.00 0.00 H new ATOM 0 HA ASP B 71 27.516 4.214 -23.593 1.00 0.00 H new ATOM 0 HB2 ASP B 71 27.486 6.669 -25.297 1.00 0.00 H new ATOM 0 HB3 ASP B 71 26.281 6.366 -24.061 1.00 0.00 H new ATOM 1345 N THR B 72 25.048 3.843 -24.623 1.00 0.00 N ATOM 1346 CA THR B 72 23.745 3.367 -25.167 1.00 0.00 C ATOM 1347 C THR B 72 22.613 4.080 -24.491 1.00 0.00 C ATOM 1348 O THR B 72 22.857 4.851 -23.546 1.00 0.00 O ATOM 1349 CB THR B 72 23.569 1.867 -24.747 1.00 0.00 C ATOM 1350 OG1 THR B 72 23.421 1.714 -23.388 1.00 0.00 O ATOM 1351 CG2 THR B 72 24.587 0.818 -25.317 1.00 0.00 C ATOM 0 H THR B 72 25.026 3.984 -23.613 1.00 0.00 H new ATOM 0 HA THR B 72 23.738 3.528 -26.245 1.00 0.00 H new ATOM 0 HB THR B 72 22.638 1.615 -25.255 1.00 0.00 H new ATOM 0 HG1 THR B 72 23.313 0.763 -23.176 1.00 0.00 H new ATOM 0 HG21 THR B 72 24.338 -0.173 -24.939 1.00 0.00 H new ATOM 0 HG22 THR B 72 24.535 0.815 -26.406 1.00 0.00 H new ATOM 0 HG23 THR B 72 25.597 1.083 -25.003 1.00 0.00 H new ATOM 1359 N PRO B 73 21.397 3.918 -25.029 1.00 0.00 N ATOM 1360 CA PRO B 73 20.346 4.605 -24.285 1.00 0.00 C ATOM 1361 C PRO B 73 20.220 4.176 -22.798 1.00 0.00 C ATOM 1362 O PRO B 73 19.988 4.985 -21.914 1.00 0.00 O ATOM 1363 CB PRO B 73 18.964 4.358 -25.063 1.00 0.00 C ATOM 1364 CG PRO B 73 19.479 3.888 -26.455 1.00 0.00 C ATOM 1365 CD PRO B 73 20.889 3.368 -26.292 1.00 0.00 C ATOM 0 HA PRO B 73 20.607 5.662 -24.242 1.00 0.00 H new ATOM 0 HB2 PRO B 73 18.347 3.603 -24.576 1.00 0.00 H new ATOM 0 HB3 PRO B 73 18.363 5.265 -25.132 1.00 0.00 H new ATOM 0 HG2 PRO B 73 18.831 3.108 -26.855 1.00 0.00 H new ATOM 0 HG3 PRO B 73 19.459 4.714 -27.165 1.00 0.00 H new ATOM 0 HD2 PRO B 73 20.900 2.278 -26.272 1.00 0.00 H new ATOM 0 HD3 PRO B 73 21.515 3.678 -27.129 1.00 0.00 H new ATOM 1373 N ALA B 74 20.455 2.905 -22.519 1.00 0.00 N ATOM 1374 CA ALA B 74 20.390 2.394 -21.139 1.00 0.00 C ATOM 1375 C ALA B 74 21.416 2.946 -20.138 1.00 0.00 C ATOM 1376 O ALA B 74 21.008 3.371 -19.068 1.00 0.00 O ATOM 1377 CB ALA B 74 20.530 0.888 -21.449 1.00 0.00 C ATOM 0 H ALA B 74 20.692 2.202 -23.219 1.00 0.00 H new ATOM 0 HA ALA B 74 19.494 2.695 -20.596 1.00 0.00 H new ATOM 0 HB1 ALA B 74 20.503 0.321 -20.518 1.00 0.00 H new ATOM 0 HB2 ALA B 74 19.708 0.571 -22.091 1.00 0.00 H new ATOM 0 HB3 ALA B 74 21.477 0.708 -21.957 1.00 0.00 H new ATOM 1383 N GLN B 75 22.607 3.154 -20.610 1.00 0.00 N ATOM 1384 CA GLN B 75 23.625 3.914 -19.868 1.00 0.00 C ATOM 1385 C GLN B 75 23.219 5.337 -19.633 1.00 0.00 C ATOM 1386 O GLN B 75 23.600 5.845 -18.549 1.00 0.00 O ATOM 1387 CB GLN B 75 24.939 3.864 -20.682 1.00 0.00 C ATOM 1388 CG GLN B 75 26.125 4.653 -20.143 1.00 0.00 C ATOM 1389 CD GLN B 75 26.200 4.724 -18.641 1.00 0.00 C ATOM 1390 OE1 GLN B 75 25.986 3.767 -17.915 1.00 0.00 O ATOM 1391 NE2 GLN B 75 26.671 5.854 -18.150 1.00 0.00 N ATOM 0 H GLN B 75 22.922 2.811 -21.517 1.00 0.00 H new ATOM 0 HA GLN B 75 23.753 3.463 -18.884 1.00 0.00 H new ATOM 0 HB2 GLN B 75 25.241 2.820 -20.772 1.00 0.00 H new ATOM 0 HB3 GLN B 75 24.726 4.222 -21.689 1.00 0.00 H new ATOM 0 HG2 GLN B 75 27.044 4.204 -20.519 1.00 0.00 H new ATOM 0 HG3 GLN B 75 26.080 5.667 -20.540 1.00 0.00 H new ATOM 0 HE21 GLN B 75 26.845 6.646 -18.769 1.00 0.00 H new ATOM 0 HE22 GLN B 75 26.861 5.936 -17.151 1.00 0.00 H new ATOM 1400 N LEU B 76 22.535 6.039 -20.516 1.00 0.00 N ATOM 1401 CA LEU B 76 22.314 7.490 -20.310 1.00 0.00 C ATOM 1402 C LEU B 76 20.929 7.901 -19.840 1.00 0.00 C ATOM 1403 O LEU B 76 20.691 9.085 -19.777 1.00 0.00 O ATOM 1404 CB LEU B 76 22.618 8.257 -21.564 1.00 0.00 C ATOM 1405 CG LEU B 76 23.848 8.066 -22.418 1.00 0.00 C ATOM 1406 CD1 LEU B 76 23.898 9.052 -23.570 1.00 0.00 C ATOM 1407 CD2 LEU B 76 25.052 8.370 -21.544 1.00 0.00 C ATOM 0 H LEU B 76 22.125 5.657 -21.368 1.00 0.00 H new ATOM 0 HA LEU B 76 22.999 7.731 -19.497 1.00 0.00 H new ATOM 0 HB2 LEU B 76 21.766 8.099 -22.226 1.00 0.00 H new ATOM 0 HB3 LEU B 76 22.610 9.310 -21.281 1.00 0.00 H new ATOM 0 HG LEU B 76 23.837 7.051 -22.815 1.00 0.00 H new ATOM 0 HD11 LEU B 76 24.799 8.879 -24.158 1.00 0.00 H new ATOM 0 HD12 LEU B 76 23.020 8.918 -24.202 1.00 0.00 H new ATOM 0 HD13 LEU B 76 23.910 10.069 -23.178 1.00 0.00 H new ATOM 0 HD21 LEU B 76 25.965 8.243 -22.126 1.00 0.00 H new ATOM 0 HD22 LEU B 76 24.990 9.397 -21.184 1.00 0.00 H new ATOM 0 HD23 LEU B 76 25.066 7.688 -20.694 1.00 0.00 H new ATOM 1419 N GLU B 77 20.062 7.018 -19.299 1.00 0.00 N ATOM 1420 CA GLU B 77 18.817 7.498 -18.598 1.00 0.00 C ATOM 1421 C GLU B 77 17.846 8.260 -19.559 1.00 0.00 C ATOM 1422 O GLU B 77 17.023 9.124 -19.178 1.00 0.00 O ATOM 1423 CB GLU B 77 19.193 8.014 -17.157 1.00 0.00 C ATOM 1424 CG GLU B 77 20.058 7.033 -16.320 1.00 0.00 C ATOM 1425 CD GLU B 77 19.414 5.782 -15.898 1.00 0.00 C ATOM 1426 OE1 GLU B 77 18.162 5.773 -15.685 1.00 0.00 O ATOM 1427 OE2 GLU B 77 20.164 4.787 -15.635 1.00 0.00 O ATOM 0 H GLU B 77 20.179 6.005 -19.323 1.00 0.00 H new ATOM 0 HA GLU B 77 18.112 6.710 -18.336 1.00 0.00 H new ATOM 0 HB2 GLU B 77 19.729 8.958 -17.253 1.00 0.00 H new ATOM 0 HB3 GLU B 77 18.274 8.223 -16.610 1.00 0.00 H new ATOM 0 HG2 GLU B 77 20.945 6.780 -16.901 1.00 0.00 H new ATOM 0 HG3 GLU B 77 20.401 7.557 -15.428 1.00 0.00 H new ATOM 1434 N MET B 78 17.748 7.869 -20.829 1.00 0.00 N ATOM 1435 CA MET B 78 16.926 8.372 -21.958 1.00 0.00 C ATOM 1436 C MET B 78 15.552 7.737 -22.039 1.00 0.00 C ATOM 1437 O MET B 78 15.369 6.581 -21.765 1.00 0.00 O ATOM 1438 CB MET B 78 17.734 8.111 -23.194 1.00 0.00 C ATOM 1439 CG MET B 78 19.169 8.693 -23.172 1.00 0.00 C ATOM 1440 SD MET B 78 20.045 9.049 -24.760 1.00 0.00 S ATOM 1441 CE MET B 78 19.159 10.593 -25.256 1.00 0.00 C ATOM 0 H MET B 78 18.318 7.084 -21.145 1.00 0.00 H new ATOM 0 HA MET B 78 16.714 9.433 -21.825 1.00 0.00 H new ATOM 0 HB2 MET B 78 17.797 7.034 -23.348 1.00 0.00 H new ATOM 0 HB3 MET B 78 17.203 8.525 -24.051 1.00 0.00 H new ATOM 0 HG2 MET B 78 19.133 9.624 -22.606 1.00 0.00 H new ATOM 0 HG3 MET B 78 19.792 8.000 -22.606 1.00 0.00 H new ATOM 0 HE1 MET B 78 19.845 11.251 -25.789 1.00 0.00 H new ATOM 0 HE2 MET B 78 18.322 10.339 -25.906 1.00 0.00 H new ATOM 0 HE3 MET B 78 18.787 11.101 -24.366 1.00 0.00 H new ATOM 1451 N GLU B 79 14.491 8.511 -22.447 1.00 0.00 N ATOM 1452 CA GLU B 79 13.182 8.004 -22.916 1.00 0.00 C ATOM 1453 C GLU B 79 12.926 8.410 -24.359 1.00 0.00 C ATOM 1454 O GLU B 79 13.612 9.166 -24.980 1.00 0.00 O ATOM 1455 CB GLU B 79 12.037 8.487 -21.983 1.00 0.00 C ATOM 1456 CG GLU B 79 11.484 7.486 -20.974 1.00 0.00 C ATOM 1457 CD GLU B 79 10.753 6.366 -21.585 1.00 0.00 C ATOM 1458 OE1 GLU B 79 10.443 6.413 -22.822 1.00 0.00 O ATOM 1459 OE2 GLU B 79 10.400 5.436 -20.902 1.00 0.00 O ATOM 0 H GLU B 79 14.539 9.530 -22.453 1.00 0.00 H new ATOM 0 HA GLU B 79 13.207 6.915 -22.879 1.00 0.00 H new ATOM 0 HB2 GLU B 79 12.395 9.357 -21.433 1.00 0.00 H new ATOM 0 HB3 GLU B 79 11.212 8.824 -22.610 1.00 0.00 H new ATOM 0 HG2 GLU B 79 12.308 7.089 -20.382 1.00 0.00 H new ATOM 0 HG3 GLU B 79 10.820 8.008 -20.286 1.00 0.00 H new ATOM 1466 N ASP B 80 11.710 7.948 -24.898 1.00 0.00 N ATOM 1467 CA ASP B 80 11.141 8.428 -26.173 1.00 0.00 C ATOM 1468 C ASP B 80 11.103 9.969 -26.083 1.00 0.00 C ATOM 1469 O ASP B 80 10.773 10.552 -25.023 1.00 0.00 O ATOM 1470 CB ASP B 80 9.745 7.906 -26.286 1.00 0.00 C ATOM 1471 CG ASP B 80 9.588 6.465 -26.647 1.00 0.00 C ATOM 1472 OD1 ASP B 80 10.528 5.873 -27.185 1.00 0.00 O ATOM 1473 OD2 ASP B 80 8.522 5.843 -26.341 1.00 0.00 O ATOM 0 H ASP B 80 11.134 7.243 -24.438 1.00 0.00 H new ATOM 0 HA ASP B 80 11.724 8.099 -27.033 1.00 0.00 H new ATOM 0 HB2 ASP B 80 9.242 8.073 -25.333 1.00 0.00 H new ATOM 0 HB3 ASP B 80 9.220 8.502 -27.033 1.00 0.00 H new ATOM 1478 N GLU B 81 11.404 10.584 -27.158 1.00 0.00 N ATOM 1479 CA GLU B 81 11.428 12.066 -27.457 1.00 0.00 C ATOM 1480 C GLU B 81 12.523 12.803 -26.658 1.00 0.00 C ATOM 1481 O GLU B 81 12.537 13.966 -26.712 1.00 0.00 O ATOM 1482 CB GLU B 81 10.084 12.761 -27.297 1.00 0.00 C ATOM 1483 CG GLU B 81 8.885 12.163 -28.020 1.00 0.00 C ATOM 1484 CD GLU B 81 9.105 12.098 -29.541 1.00 0.00 C ATOM 1485 OE1 GLU B 81 9.089 13.197 -30.182 1.00 0.00 O ATOM 1486 OE2 GLU B 81 9.247 11.014 -30.143 1.00 0.00 O ATOM 0 H GLU B 81 11.681 10.051 -27.982 1.00 0.00 H new ATOM 0 HA GLU B 81 11.673 12.125 -28.517 1.00 0.00 H new ATOM 0 HB2 GLU B 81 9.850 12.797 -26.233 1.00 0.00 H new ATOM 0 HB3 GLU B 81 10.198 13.792 -27.633 1.00 0.00 H new ATOM 0 HG2 GLU B 81 8.694 11.160 -27.638 1.00 0.00 H new ATOM 0 HG3 GLU B 81 7.998 12.760 -27.807 1.00 0.00 H new ATOM 1493 N ASP B 82 13.541 12.145 -26.117 1.00 0.00 N ATOM 1494 CA ASP B 82 14.861 12.703 -25.990 1.00 0.00 C ATOM 1495 C ASP B 82 15.600 12.977 -27.282 1.00 0.00 C ATOM 1496 O ASP B 82 15.318 12.404 -28.293 1.00 0.00 O ATOM 1497 CB ASP B 82 15.699 11.909 -25.021 1.00 0.00 C ATOM 1498 CG ASP B 82 15.297 12.234 -23.540 1.00 0.00 C ATOM 1499 OD1 ASP B 82 15.256 13.415 -23.184 1.00 0.00 O ATOM 1500 OD2 ASP B 82 15.378 11.245 -22.709 1.00 0.00 O ATOM 0 H ASP B 82 13.461 11.196 -25.752 1.00 0.00 H new ATOM 0 HA ASP B 82 14.689 13.700 -25.584 1.00 0.00 H new ATOM 0 HB2 ASP B 82 15.572 10.843 -25.212 1.00 0.00 H new ATOM 0 HB3 ASP B 82 16.754 12.136 -25.174 1.00 0.00 H new ATOM 1505 N THR B 83 16.397 14.052 -27.226 1.00 0.00 N ATOM 1506 CA THR B 83 17.043 14.597 -28.418 1.00 0.00 C ATOM 1507 C THR B 83 18.550 14.722 -28.142 1.00 0.00 C ATOM 1508 O THR B 83 19.008 15.321 -27.161 1.00 0.00 O ATOM 1509 CB THR B 83 16.412 15.947 -28.961 1.00 0.00 C ATOM 1510 OG1 THR B 83 14.998 15.836 -29.151 1.00 0.00 O ATOM 1511 CG2 THR B 83 17.027 16.492 -30.305 1.00 0.00 C ATOM 0 H THR B 83 16.607 14.559 -26.366 1.00 0.00 H new ATOM 0 HA THR B 83 16.867 13.897 -29.235 1.00 0.00 H new ATOM 0 HB THR B 83 16.657 16.660 -28.174 1.00 0.00 H new ATOM 0 HG1 THR B 83 14.645 16.687 -29.484 1.00 0.00 H new ATOM 0 HG21 THR B 83 16.524 17.417 -30.586 1.00 0.00 H new ATOM 0 HG22 THR B 83 18.091 16.685 -30.167 1.00 0.00 H new ATOM 0 HG23 THR B 83 16.892 15.752 -31.093 1.00 0.00 H new ATOM 1519 N ILE B 84 19.373 13.958 -28.855 1.00 0.00 N ATOM 1520 CA ILE B 84 20.851 14.262 -28.944 1.00 0.00 C ATOM 1521 C ILE B 84 21.189 15.531 -29.758 1.00 0.00 C ATOM 1522 O ILE B 84 20.771 15.853 -30.940 1.00 0.00 O ATOM 1523 CB ILE B 84 21.585 12.965 -29.386 1.00 0.00 C ATOM 1524 CG1 ILE B 84 21.358 11.820 -28.375 1.00 0.00 C ATOM 1525 CG2 ILE B 84 23.070 13.237 -29.550 1.00 0.00 C ATOM 1526 CD1 ILE B 84 21.746 10.398 -28.919 1.00 0.00 C ATOM 0 H ILE B 84 19.078 13.134 -29.379 1.00 0.00 H new ATOM 0 HA ILE B 84 21.226 14.542 -27.960 1.00 0.00 H new ATOM 0 HB ILE B 84 21.171 12.651 -30.344 1.00 0.00 H new ATOM 0 HG12 ILE B 84 21.938 12.024 -27.475 1.00 0.00 H new ATOM 0 HG13 ILE B 84 20.308 11.811 -28.082 1.00 0.00 H new ATOM 0 HG21 ILE B 84 23.575 12.322 -29.860 1.00 0.00 H new ATOM 0 HG22 ILE B 84 23.217 14.007 -30.307 1.00 0.00 H new ATOM 0 HG23 ILE B 84 23.485 13.577 -28.601 1.00 0.00 H new ATOM 0 HD11 ILE B 84 21.557 9.650 -28.149 1.00 0.00 H new ATOM 0 HD12 ILE B 84 21.148 10.170 -29.801 1.00 0.00 H new ATOM 0 HD13 ILE B 84 22.803 10.386 -29.185 1.00 0.00 H new ATOM 1538 N ASP B 85 21.984 16.278 -29.040 1.00 0.00 N ATOM 1539 CA ASP B 85 22.471 17.585 -29.459 1.00 0.00 C ATOM 1540 C ASP B 85 23.824 17.540 -30.239 1.00 0.00 C ATOM 1541 O ASP B 85 24.872 17.214 -29.616 1.00 0.00 O ATOM 1542 CB ASP B 85 22.471 18.524 -28.280 1.00 0.00 C ATOM 1543 CG ASP B 85 21.084 18.989 -27.770 1.00 0.00 C ATOM 1544 OD1 ASP B 85 20.353 19.734 -28.407 1.00 0.00 O ATOM 1545 OD2 ASP B 85 20.837 18.656 -26.586 1.00 0.00 O ATOM 0 H ASP B 85 22.326 15.996 -28.121 1.00 0.00 H new ATOM 0 HA ASP B 85 21.779 17.980 -30.202 1.00 0.00 H new ATOM 0 HB2 ASP B 85 22.993 18.038 -27.456 1.00 0.00 H new ATOM 0 HB3 ASP B 85 23.051 19.408 -28.547 1.00 0.00 H new ATOM 1550 N VAL B 86 23.907 18.058 -31.513 1.00 0.00 N ATOM 1551 CA VAL B 86 25.185 18.185 -32.377 1.00 0.00 C ATOM 1552 C VAL B 86 25.671 19.586 -32.309 1.00 0.00 C ATOM 1553 O VAL B 86 25.100 20.533 -32.871 1.00 0.00 O ATOM 1554 CB VAL B 86 24.925 17.775 -33.848 1.00 0.00 C ATOM 1555 CG1 VAL B 86 26.239 17.711 -34.588 1.00 0.00 C ATOM 1556 CG2 VAL B 86 24.199 16.436 -33.950 1.00 0.00 C ATOM 0 H VAL B 86 23.082 18.412 -31.997 1.00 0.00 H new ATOM 0 HA VAL B 86 25.942 17.506 -31.984 1.00 0.00 H new ATOM 0 HB VAL B 86 24.278 18.528 -34.299 1.00 0.00 H new ATOM 0 HG11 VAL B 86 26.060 17.423 -35.624 1.00 0.00 H new ATOM 0 HG12 VAL B 86 26.719 18.689 -34.562 1.00 0.00 H new ATOM 0 HG13 VAL B 86 26.888 16.975 -34.114 1.00 0.00 H new ATOM 0 HG21 VAL B 86 24.038 16.189 -34.999 1.00 0.00 H new ATOM 0 HG22 VAL B 86 24.803 15.658 -33.482 1.00 0.00 H new ATOM 0 HG23 VAL B 86 23.237 16.504 -33.441 1.00 0.00 H new ATOM 1566 N PHE B 87 26.878 19.689 -31.778 1.00 0.00 N ATOM 1567 CA PHE B 87 27.811 20.851 -31.736 1.00 0.00 C ATOM 1568 C PHE B 87 29.026 20.508 -32.654 1.00 0.00 C ATOM 1569 O PHE B 87 29.092 19.414 -33.275 1.00 0.00 O ATOM 1570 CB PHE B 87 28.326 21.024 -30.286 1.00 0.00 C ATOM 1571 CG PHE B 87 27.232 21.329 -29.214 1.00 0.00 C ATOM 1572 CD1 PHE B 87 26.630 20.194 -28.605 1.00 0.00 C ATOM 1573 CD2 PHE B 87 26.767 22.585 -28.968 1.00 0.00 C ATOM 1574 CE1 PHE B 87 25.347 20.362 -28.010 1.00 0.00 C ATOM 1575 CE2 PHE B 87 25.544 22.809 -28.202 1.00 0.00 C ATOM 1576 CZ PHE B 87 24.819 21.664 -27.765 1.00 0.00 C ATOM 0 H PHE B 87 27.292 18.883 -31.309 1.00 0.00 H new ATOM 0 HA PHE B 87 27.313 21.763 -32.065 1.00 0.00 H new ATOM 0 HB2 PHE B 87 28.851 20.114 -29.995 1.00 0.00 H new ATOM 0 HB3 PHE B 87 29.057 21.832 -30.273 1.00 0.00 H new ATOM 0 HD1 PHE B 87 27.129 19.236 -28.594 1.00 0.00 H new ATOM 0 HD2 PHE B 87 27.315 23.435 -29.348 1.00 0.00 H new ATOM 0 HE1 PHE B 87 24.766 19.492 -27.741 1.00 0.00 H new ATOM 0 HE2 PHE B 87 25.202 23.808 -27.975 1.00 0.00 H new ATOM 0 HZ PHE B 87 23.876 21.781 -27.252 1.00 0.00 H new ATOM 1586 N GLN B 88 30.012 21.375 -32.664 1.00 0.00 N ATOM 1587 CA GLN B 88 31.344 21.191 -33.217 1.00 0.00 C ATOM 1588 C GLN B 88 32.548 21.666 -32.323 1.00 0.00 C ATOM 1589 O GLN B 88 32.319 22.341 -31.362 1.00 0.00 O ATOM 1590 CB GLN B 88 31.293 21.929 -34.576 1.00 0.00 C ATOM 1591 CG GLN B 88 30.078 21.534 -35.514 1.00 0.00 C ATOM 1592 CD GLN B 88 30.260 21.955 -36.958 1.00 0.00 C ATOM 1593 OE1 GLN B 88 31.280 22.522 -37.392 1.00 0.00 O ATOM 1594 NE2 GLN B 88 29.233 21.783 -37.781 1.00 0.00 N ATOM 0 H GLN B 88 29.899 22.302 -32.254 1.00 0.00 H new ATOM 0 HA GLN B 88 31.560 20.126 -33.300 1.00 0.00 H new ATOM 0 HB2 GLN B 88 31.252 23.002 -34.387 1.00 0.00 H new ATOM 0 HB3 GLN B 88 32.222 21.735 -35.111 1.00 0.00 H new ATOM 0 HG2 GLN B 88 29.937 20.454 -35.475 1.00 0.00 H new ATOM 0 HG3 GLN B 88 29.167 21.989 -35.124 1.00 0.00 H new ATOM 0 HE21 GLN B 88 28.386 21.321 -37.450 1.00 0.00 H new ATOM 0 HE22 GLN B 88 29.291 22.112 -38.745 1.00 0.00 H new ATOM 1603 N GLN B 89 33.792 21.308 -32.597 1.00 0.00 N ATOM 1604 CA GLN B 89 34.995 22.025 -32.019 1.00 0.00 C ATOM 1605 C GLN B 89 35.869 22.478 -33.127 1.00 0.00 C ATOM 1606 O GLN B 89 36.002 21.683 -34.074 1.00 0.00 O ATOM 1607 CB GLN B 89 35.730 21.095 -31.042 1.00 0.00 C ATOM 1608 CG GLN B 89 35.070 21.011 -29.720 1.00 0.00 C ATOM 1609 CD GLN B 89 35.766 20.041 -28.869 1.00 0.00 C ATOM 1610 OE1 GLN B 89 36.612 19.265 -29.214 1.00 0.00 O ATOM 1611 NE2 GLN B 89 35.372 19.940 -27.618 1.00 0.00 N ATOM 0 H GLN B 89 34.030 20.530 -33.212 1.00 0.00 H new ATOM 0 HA GLN B 89 34.683 22.905 -31.457 1.00 0.00 H new ATOM 0 HB2 GLN B 89 35.792 20.097 -31.476 1.00 0.00 H new ATOM 0 HB3 GLN B 89 36.752 21.449 -30.910 1.00 0.00 H new ATOM 0 HG2 GLN B 89 35.070 21.991 -29.242 1.00 0.00 H new ATOM 0 HG3 GLN B 89 34.028 20.716 -29.843 1.00 0.00 H new ATOM 0 HE21 GLN B 89 34.655 20.569 -27.257 1.00 0.00 H new ATOM 0 HE22 GLN B 89 35.784 19.233 -27.009 1.00 0.00 H new ATOM 1620 N GLN B 90 36.361 23.667 -33.016 1.00 0.00 N ATOM 1621 CA GLN B 90 37.281 24.365 -33.897 1.00 0.00 C ATOM 1622 C GLN B 90 38.716 24.139 -33.365 1.00 0.00 C ATOM 1623 O GLN B 90 38.870 23.841 -32.134 1.00 0.00 O ATOM 1624 CB GLN B 90 36.966 25.859 -33.968 1.00 0.00 C ATOM 1625 CG GLN B 90 35.822 26.200 -34.977 1.00 0.00 C ATOM 1626 CD GLN B 90 34.353 26.010 -34.518 1.00 0.00 C ATOM 1627 OE1 GLN B 90 34.022 26.248 -33.362 1.00 0.00 O ATOM 1628 NE2 GLN B 90 33.518 25.601 -35.436 1.00 0.00 N ATOM 0 H GLN B 90 36.108 24.252 -32.220 1.00 0.00 H new ATOM 0 HA GLN B 90 37.182 23.972 -34.909 1.00 0.00 H new ATOM 0 HB2 GLN B 90 36.684 26.212 -32.976 1.00 0.00 H new ATOM 0 HB3 GLN B 90 37.868 26.401 -34.254 1.00 0.00 H new ATOM 0 HG2 GLN B 90 35.944 27.241 -35.278 1.00 0.00 H new ATOM 0 HG3 GLN B 90 35.973 25.591 -35.868 1.00 0.00 H new ATOM 0 HE21 GLN B 90 33.850 25.418 -36.383 1.00 0.00 H new ATOM 0 HE22 GLN B 90 32.534 25.464 -35.206 1.00 0.00 H new ATOM 1637 N THR B 91 39.744 24.297 -34.208 1.00 0.00 N ATOM 1638 CA THR B 91 41.149 24.012 -33.805 1.00 0.00 C ATOM 1639 C THR B 91 41.896 25.339 -33.417 1.00 0.00 C ATOM 1640 O THR B 91 43.144 25.344 -33.435 1.00 0.00 O ATOM 1641 CB THR B 91 41.909 23.178 -34.892 1.00 0.00 C ATOM 1642 OG1 THR B 91 41.974 24.009 -36.034 1.00 0.00 O ATOM 1643 CG2 THR B 91 41.287 21.848 -35.276 1.00 0.00 C ATOM 0 H THR B 91 39.642 24.618 -35.171 1.00 0.00 H new ATOM 0 HA THR B 91 41.128 23.386 -32.913 1.00 0.00 H new ATOM 0 HB THR B 91 42.877 22.900 -34.474 1.00 0.00 H new ATOM 0 HG1 THR B 91 42.444 23.539 -36.754 1.00 0.00 H new ATOM 0 HG21 THR B 91 41.902 21.364 -36.035 1.00 0.00 H new ATOM 0 HG22 THR B 91 41.226 21.208 -34.396 1.00 0.00 H new ATOM 0 HG23 THR B 91 40.286 22.016 -35.673 1.00 0.00 H new ATOM 1651 N GLY B 92 41.181 26.442 -33.103 1.00 0.00 N ATOM 1652 CA GLY B 92 41.824 27.664 -32.598 1.00 0.00 C ATOM 1653 C GLY B 92 42.011 28.743 -33.678 1.00 0.00 C ATOM 1654 O GLY B 92 41.279 28.637 -34.667 1.00 0.00 O ATOM 0 H GLY B 92 40.167 26.506 -33.191 1.00 0.00 H new ATOM 0 HA2 GLY B 92 41.224 28.073 -31.785 1.00 0.00 H new ATOM 0 HA3 GLY B 92 42.797 27.408 -32.178 1.00 0.00 H new ATOM 1658 N GLY B 93 42.770 29.763 -33.371 1.00 0.00 N ATOM 1659 CA GLY B 93 42.769 30.981 -34.096 1.00 0.00 C ATOM 1660 C GLY B 93 44.061 31.150 -34.874 1.00 0.00 C ATOM 1661 O GLY B 93 45.043 30.521 -34.486 1.00 0.00 O ATOM 0 H GLY B 93 43.420 29.756 -32.585 1.00 0.00 H new ATOM 0 HA2 GLY B 93 41.922 31.000 -34.782 1.00 0.00 H new ATOM 0 HA3 GLY B 93 42.642 31.818 -33.409 1.00 0.00 H new ATOM 1665 N VAL B 94 44.089 32.090 -35.813 1.00 0.00 N ATOM 1666 CA VAL B 94 45.308 32.562 -36.495 1.00 0.00 C ATOM 1667 C VAL B 94 46.137 33.509 -35.527 1.00 0.00 C ATOM 1668 O VAL B 94 45.668 34.578 -35.149 1.00 0.00 O ATOM 1669 CB VAL B 94 45.156 33.305 -37.839 1.00 0.00 C ATOM 1670 CG1 VAL B 94 46.398 33.471 -38.764 1.00 0.00 C ATOM 1671 CG2 VAL B 94 44.134 32.490 -38.638 1.00 0.00 C ATOM 0 H VAL B 94 43.245 32.563 -36.136 1.00 0.00 H new ATOM 0 HA VAL B 94 45.806 31.625 -36.744 1.00 0.00 H new ATOM 0 HB VAL B 94 44.898 34.327 -37.563 1.00 0.00 H new ATOM 0 HG11 VAL B 94 46.111 34.016 -39.664 1.00 0.00 H new ATOM 0 HG12 VAL B 94 47.174 34.025 -38.236 1.00 0.00 H new ATOM 0 HG13 VAL B 94 46.779 32.488 -39.041 1.00 0.00 H new ATOM 0 HG21 VAL B 94 43.974 32.959 -39.609 1.00 0.00 H new ATOM 0 HG22 VAL B 94 44.509 31.477 -38.782 1.00 0.00 H new ATOM 0 HG23 VAL B 94 43.191 32.454 -38.093 1.00 0.00 H new ATOM 1681 N TYR B 95 47.277 33.019 -35.168 1.00 0.00 N ATOM 1682 CA TYR B 95 48.229 33.636 -34.176 1.00 0.00 C ATOM 1683 C TYR B 95 49.393 34.366 -34.871 1.00 0.00 C ATOM 1684 O TYR B 95 50.045 33.683 -35.620 1.00 0.00 O ATOM 1685 CB TYR B 95 48.673 32.548 -33.161 1.00 0.00 C ATOM 1686 CG TYR B 95 47.630 31.597 -32.516 1.00 0.00 C ATOM 1687 CD1 TYR B 95 46.436 32.046 -31.985 1.00 0.00 C ATOM 1688 CD2 TYR B 95 47.840 30.151 -32.439 1.00 0.00 C ATOM 1689 CE1 TYR B 95 45.438 31.081 -31.511 1.00 0.00 C ATOM 1690 CE2 TYR B 95 46.919 29.272 -31.823 1.00 0.00 C ATOM 1691 CZ TYR B 95 45.700 29.721 -31.357 1.00 0.00 C ATOM 1692 OH TYR B 95 44.702 28.812 -31.067 1.00 0.00 O ATOM 1693 OXT TYR B 95 49.702 35.541 -34.652 1.00 0.00 O ATOM 0 H TYR B 95 47.628 32.140 -35.549 1.00 0.00 H new ATOM 0 HA TYR B 95 47.723 34.421 -33.613 1.00 0.00 H new ATOM 0 HB2 TYR B 95 49.411 31.922 -33.663 1.00 0.00 H new ATOM 0 HB3 TYR B 95 49.188 33.059 -32.348 1.00 0.00 H new ATOM 0 HD1 TYR B 95 46.238 33.106 -31.919 1.00 0.00 H new ATOM 0 HD2 TYR B 95 48.738 29.736 -32.872 1.00 0.00 H new ATOM 0 HE1 TYR B 95 44.450 31.443 -31.269 1.00 0.00 H new ATOM 0 HE2 TYR B 95 47.175 28.228 -31.715 1.00 0.00 H new ATOM 0 HH TYR B 95 45.087 27.913 -31.000 1.00 0.00 H new TER 1703 TYR B 95