USER MOD reduce.3.24.130724 H: found=0, std=0, add=829, rem=0, adj=19 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 NoAdj-H: A 46 SEP H : A 46 SEP N : A 45 ASP C :(H bumps) USER MOD Set 1.1: B 57 GLN : amide:sc= 0.113 K(o=0.3,f=-1.6) USER MOD Set 1.2: B 88 GLN : amide:sc= 0.185 K(o=0.3,f=-2!) USER MOD Set 2.1: B 19 ASN : amide:sc= 1.01 K(o=1.5,f=-2.4) USER MOD Set 2.2: B 31 GLN : amide:sc= 0.472 K(o=1.5,f=-2.1!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 142:sc= 0.0668 (180deg=0) USER MOD Single : B 5 LYS NZ :NH3+ -163:sc= -0.0574 (180deg=-0.475) 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 180:sc= 0 USER MOD Single : B 14 ASN : amide:sc= 0.399 X(o=0.4,f=0) USER MOD Single : B 15 ASN : amide:sc=-0.00159 X(o=-0.0016,f=-0.0016) USER MOD Single : B 17 HIS : no HD1:sc= -4.28! C(o=-4.3!,f=-4.2!) USER MOD Single : B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 GLN : amide:sc= 0.132 K(o=0.13,f=-0.5) USER MOD Single : B 28 SER OG : rot -97:sc= 1.33 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ -110:sc= 0.275 (180deg=0.142) USER MOD Single : B 37 HIS : no HD1:sc= 0.111 K(o=0.11,f=-1.5!) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 41 SER OG : rot 180:sc= -0.602 USER MOD Single : B 42 LYS NZ :NH3+ 165:sc= 1.24 (180deg=1.21) USER MOD Single : B 44 MET CE :methyl -176:sc= -2.5 (180deg=-2.59) 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 -57:sc= -2.95 USER MOD Single : B 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 55 MET CE :methyl -175:sc= -0.0435 (180deg=-0.125) USER MOD Single : B 65 GLN : amide:sc= 0.56 K(o=0.56,f=-0.058) USER MOD Single : B 68 ASN : amide:sc= -0.129 X(o=-0.13,f=0) USER MOD Single : B 70 THR OG1 : rot 79:sc= 1.23 USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 GLN : amide:sc= -0.0126 K(o=-0.013,f=-0.71) USER MOD Single : B 78 MET CE :methyl 177:sc= -0.187 (180deg=-0.193) USER MOD Single : B 83 THR OG1 : rot 180:sc= 0 USER MOD Single : B 89 GLN : amide:sc= 0.747 K(o=0.75,f=-0.011) USER MOD Single : B 90 GLN : amide:sc= 0.885 K(o=0.88,f=-6.1!) USER MOD Single : B 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 95 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- HETATM 1 C ACE A 36 11.496 14.362 -46.183 1.00 0.00 C HETATM 2 O ACE A 36 10.955 13.308 -45.815 1.00 0.00 O HETATM 3 CH3 ACE A 36 11.145 15.731 -45.560 1.00 0.00 C HETATM 0 H1 ACE A 36 12.039 16.168 -45.114 1.00 0.00 H new HETATM 0 H2 ACE A 36 10.764 16.396 -46.335 1.00 0.00 H new HETATM 0 H3 ACE A 36 10.385 15.596 -44.791 1.00 0.00 H new ATOM 7 N GLU A 37 12.374 14.389 -47.158 1.00 0.00 N ATOM 8 CA GLU A 37 12.616 13.322 -48.151 1.00 0.00 C ATOM 9 C GLU A 37 13.149 11.986 -47.573 1.00 0.00 C ATOM 10 O GLU A 37 12.985 10.943 -48.199 1.00 0.00 O ATOM 11 CB GLU A 37 13.656 13.910 -49.152 1.00 0.00 C ATOM 12 CG GLU A 37 13.864 13.103 -50.439 1.00 0.00 C ATOM 13 CD GLU A 37 12.553 12.741 -51.165 1.00 0.00 C ATOM 14 OE1 GLU A 37 11.500 13.359 -50.924 1.00 0.00 O ATOM 15 OE2 GLU A 37 12.622 11.899 -52.113 1.00 0.00 O ATOM 0 H GLU A 37 12.983 15.194 -47.304 1.00 0.00 H new ATOM 0 HA GLU A 37 11.662 13.054 -48.605 1.00 0.00 H new ATOM 0 HB2 GLU A 37 13.343 14.918 -49.423 1.00 0.00 H new ATOM 0 HB3 GLU A 37 14.615 14.000 -48.641 1.00 0.00 H new ATOM 0 HG2 GLU A 37 14.498 13.675 -51.117 1.00 0.00 H new ATOM 0 HG3 GLU A 37 14.401 12.185 -50.199 1.00 0.00 H new ATOM 22 N ASP A 38 13.899 12.117 -46.489 1.00 0.00 N ATOM 23 CA ASP A 38 14.750 11.023 -45.852 1.00 0.00 C ATOM 24 C ASP A 38 14.788 11.139 -44.310 1.00 0.00 C ATOM 25 O ASP A 38 15.690 10.532 -43.707 1.00 0.00 O ATOM 26 CB ASP A 38 16.203 11.125 -46.398 1.00 0.00 C ATOM 27 CG ASP A 38 17.034 9.905 -46.343 1.00 0.00 C ATOM 28 OD1 ASP A 38 16.528 8.834 -45.978 1.00 0.00 O ATOM 29 OD2 ASP A 38 18.259 9.916 -46.602 1.00 0.00 O ATOM 0 H ASP A 38 13.961 13.001 -45.983 1.00 0.00 H new ATOM 0 HA ASP A 38 14.301 10.063 -46.107 1.00 0.00 H new ATOM 0 HB2 ASP A 38 16.151 11.451 -47.437 1.00 0.00 H new ATOM 0 HB3 ASP A 38 16.718 11.909 -45.843 1.00 0.00 H new ATOM 34 N ALA A 39 13.853 11.772 -43.577 1.00 0.00 N ATOM 35 CA ALA A 39 13.942 12.143 -42.180 1.00 0.00 C ATOM 36 C ALA A 39 13.652 11.028 -41.100 1.00 0.00 C ATOM 37 O ALA A 39 13.268 11.344 -39.971 1.00 0.00 O ATOM 38 CB ALA A 39 13.178 13.445 -41.923 1.00 0.00 C ATOM 0 H ALA A 39 12.961 12.050 -43.987 1.00 0.00 H new ATOM 0 HA ALA A 39 15.008 12.303 -42.018 1.00 0.00 H new ATOM 0 HB1 ALA A 39 13.255 13.710 -40.868 1.00 0.00 H new ATOM 0 HB2 ALA A 39 13.605 14.243 -42.530 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.129 13.310 -42.188 1.00 0.00 H new ATOM 44 N PHE A 40 13.964 9.766 -41.445 1.00 0.00 N ATOM 45 CA PHE A 40 13.791 8.520 -40.661 1.00 0.00 C ATOM 46 C PHE A 40 15.082 7.614 -40.670 1.00 0.00 C ATOM 47 O PHE A 40 15.640 7.478 -41.766 1.00 0.00 O ATOM 48 CB PHE A 40 12.527 7.710 -41.000 1.00 0.00 C ATOM 49 CG PHE A 40 11.821 7.220 -39.769 1.00 0.00 C ATOM 50 CD1 PHE A 40 11.106 8.073 -38.988 1.00 0.00 C ATOM 51 CD2 PHE A 40 12.116 5.924 -39.246 1.00 0.00 C ATOM 52 CE1 PHE A 40 10.556 7.670 -37.789 1.00 0.00 C ATOM 53 CE2 PHE A 40 11.530 5.542 -38.064 1.00 0.00 C ATOM 54 CZ PHE A 40 10.727 6.382 -37.278 1.00 0.00 C ATOM 0 H PHE A 40 14.379 9.570 -42.356 1.00 0.00 H new ATOM 0 HA PHE A 40 13.637 8.872 -39.641 1.00 0.00 H new ATOM 0 HB2 PHE A 40 11.847 8.329 -41.585 1.00 0.00 H new ATOM 0 HB3 PHE A 40 12.799 6.859 -41.624 1.00 0.00 H new ATOM 0 HD1 PHE A 40 10.965 9.093 -39.315 1.00 0.00 H new ATOM 0 HD2 PHE A 40 12.786 5.258 -39.769 1.00 0.00 H new ATOM 0 HE1 PHE A 40 9.970 8.379 -37.223 1.00 0.00 H new ATOM 0 HE2 PHE A 40 11.698 4.533 -37.718 1.00 0.00 H new ATOM 0 HZ PHE A 40 10.277 6.058 -36.351 1.00 0.00 H new ATOM 64 N ILE A 41 15.639 7.187 -39.554 1.00 0.00 N ATOM 65 CA ILE A 41 16.799 6.364 -39.522 1.00 0.00 C ATOM 66 C ILE A 41 16.504 5.308 -38.474 1.00 0.00 C ATOM 67 O ILE A 41 16.030 5.539 -37.414 1.00 0.00 O ATOM 68 CB ILE A 41 18.151 7.010 -39.290 1.00 0.00 C ATOM 69 CG1 ILE A 41 18.553 8.195 -40.024 1.00 0.00 C ATOM 70 CG2 ILE A 41 19.181 5.889 -39.620 1.00 0.00 C ATOM 71 CD1 ILE A 41 17.934 9.490 -39.454 1.00 0.00 C ATOM 0 H ILE A 41 15.277 7.417 -38.629 1.00 0.00 H new ATOM 0 HA ILE A 41 16.945 5.984 -40.533 1.00 0.00 H new ATOM 0 HB ILE A 41 18.096 7.395 -38.272 1.00 0.00 H new ATOM 0 HG12 ILE A 41 19.640 8.278 -40.004 1.00 0.00 H new ATOM 0 HG13 ILE A 41 18.260 8.087 -41.068 1.00 0.00 H new ATOM 0 HG21 ILE A 41 20.192 6.271 -39.478 1.00 0.00 H new ATOM 0 HG22 ILE A 41 19.018 5.039 -38.958 1.00 0.00 H new ATOM 0 HG23 ILE A 41 19.055 5.572 -40.655 1.00 0.00 H new ATOM 0 HD11 ILE A 41 18.270 10.344 -40.043 1.00 0.00 H new ATOM 0 HD12 ILE A 41 16.847 9.424 -39.498 1.00 0.00 H new ATOM 0 HD13 ILE A 41 18.248 9.618 -38.418 1.00 0.00 H new ATOM 83 N VAL A 42 16.728 4.047 -38.792 1.00 0.00 N ATOM 84 CA VAL A 42 16.287 2.890 -38.037 1.00 0.00 C ATOM 85 C VAL A 42 17.494 1.877 -37.931 1.00 0.00 C ATOM 86 O VAL A 42 17.900 1.258 -38.902 1.00 0.00 O ATOM 87 CB VAL A 42 15.003 2.275 -38.668 1.00 0.00 C ATOM 88 CG1 VAL A 42 14.428 1.244 -37.734 1.00 0.00 C ATOM 89 CG2 VAL A 42 13.919 3.308 -39.124 1.00 0.00 C ATOM 0 H VAL A 42 17.251 3.789 -39.629 1.00 0.00 H new ATOM 0 HA VAL A 42 15.999 3.171 -37.024 1.00 0.00 H new ATOM 0 HB VAL A 42 15.320 1.806 -39.599 1.00 0.00 H new ATOM 0 HG11 VAL A 42 13.529 0.814 -38.176 1.00 0.00 H new ATOM 0 HG12 VAL A 42 15.162 0.456 -37.565 1.00 0.00 H new ATOM 0 HG13 VAL A 42 14.176 1.714 -36.784 1.00 0.00 H new ATOM 0 HG21 VAL A 42 13.067 2.778 -39.549 1.00 0.00 H new ATOM 0 HG22 VAL A 42 13.591 3.894 -38.265 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.344 3.973 -39.876 1.00 0.00 H new ATOM 99 N ILE A 43 18.041 1.637 -36.800 1.00 0.00 N ATOM 100 CA ILE A 43 19.204 0.828 -36.579 1.00 0.00 C ATOM 101 C ILE A 43 19.071 -0.181 -35.399 1.00 0.00 C ATOM 102 O ILE A 43 18.443 0.183 -34.359 1.00 0.00 O ATOM 103 CB ILE A 43 20.499 1.657 -36.573 1.00 0.00 C ATOM 104 CG1 ILE A 43 20.737 2.313 -37.957 1.00 0.00 C ATOM 105 CG2 ILE A 43 21.708 0.932 -36.053 1.00 0.00 C ATOM 106 CD1 ILE A 43 21.711 3.538 -38.054 1.00 0.00 C ATOM 0 H ILE A 43 17.669 2.024 -35.933 1.00 0.00 H new ATOM 0 HA ILE A 43 19.282 0.175 -37.448 1.00 0.00 H new ATOM 0 HB ILE A 43 20.345 2.451 -35.842 1.00 0.00 H new ATOM 0 HG12 ILE A 43 21.111 1.540 -38.629 1.00 0.00 H new ATOM 0 HG13 ILE A 43 19.768 2.630 -38.343 1.00 0.00 H new ATOM 0 HG21 ILE A 43 22.572 1.595 -36.087 1.00 0.00 H new ATOM 0 HG22 ILE A 43 21.530 0.620 -35.024 1.00 0.00 H new ATOM 0 HG23 ILE A 43 21.900 0.055 -36.671 1.00 0.00 H new ATOM 0 HD11 ILE A 43 21.767 3.878 -39.088 1.00 0.00 H new ATOM 0 HD12 ILE A 43 21.341 4.348 -37.426 1.00 0.00 H new ATOM 0 HD13 ILE A 43 22.704 3.241 -37.716 1.00 0.00 H new HETATM 118 N SEP A 44 19.658 -1.348 -35.520 1.00 0.00 N HETATM 119 CA SEP A 44 19.998 -2.262 -34.369 1.00 0.00 C HETATM 120 CB SEP A 44 18.850 -3.223 -34.164 1.00 0.00 C HETATM 121 OG SEP A 44 18.793 -4.221 -35.134 1.00 0.00 O HETATM 122 C SEP A 44 21.371 -2.877 -34.637 1.00 0.00 C HETATM 123 O SEP A 44 22.016 -2.557 -35.637 1.00 0.00 O HETATM 124 P SEP A 44 17.648 -5.242 -35.095 1.00 0.00 P HETATM 125 O1P SEP A 44 17.945 -6.221 -36.077 1.00 0.00 O HETATM 126 O2P SEP A 44 17.650 -5.824 -33.775 1.00 0.00 O HETATM 127 O3P SEP A 44 16.427 -4.434 -35.323 1.00 0.00 O HETATM 0 HB3 SEP A 44 18.942 -3.685 -33.181 1.00 0.00 H new HETATM 0 HB2 SEP A 44 17.913 -2.666 -34.168 1.00 0.00 H new HETATM 0 HA SEP A 44 20.101 -1.747 -33.414 1.00 0.00 H new ATOM 132 N ASP A 45 21.859 -3.749 -33.771 1.00 0.00 N ATOM 133 CA ASP A 45 23.228 -4.171 -33.760 1.00 0.00 C ATOM 134 C ASP A 45 23.263 -5.647 -34.264 1.00 0.00 C ATOM 135 O ASP A 45 24.318 -6.092 -34.654 1.00 0.00 O ATOM 136 CB ASP A 45 23.709 -4.115 -32.258 1.00 0.00 C ATOM 137 CG ASP A 45 25.197 -4.055 -32.039 1.00 0.00 C ATOM 138 OD1 ASP A 45 26.024 -3.678 -32.887 1.00 0.00 O ATOM 139 OD2 ASP A 45 25.527 -4.196 -30.878 1.00 0.00 O ATOM 0 H ASP A 45 21.292 -4.186 -33.044 1.00 0.00 H new ATOM 0 HA ASP A 45 23.864 -3.548 -34.388 1.00 0.00 H new ATOM 0 HB2 ASP A 45 23.258 -3.242 -31.786 1.00 0.00 H new ATOM 0 HB3 ASP A 45 23.322 -4.993 -31.741 1.00 0.00 H new HETATM 144 N SEP A 46 22.106 -6.433 -34.284 1.00 0.00 N HETATM 145 CA SEP A 46 21.900 -7.816 -34.677 1.00 0.00 C HETATM 146 CB SEP A 46 21.450 -8.844 -33.627 1.00 0.00 C HETATM 147 OG SEP A 46 20.181 -8.408 -33.213 1.00 0.00 O HETATM 148 C SEP A 46 21.205 -7.969 -35.995 1.00 0.00 C HETATM 149 O SEP A 46 20.073 -8.449 -36.044 1.00 0.00 O HETATM 150 P SEP A 46 19.429 -9.126 -32.003 1.00 0.00 P HETATM 151 O1P SEP A 46 18.030 -9.090 -32.437 1.00 0.00 O HETATM 152 O2P SEP A 46 19.838 -10.522 -31.920 1.00 0.00 O HETATM 153 O3P SEP A 46 19.733 -8.299 -30.806 1.00 0.00 O HETATM 0 HB3 SEP A 46 21.404 -9.847 -34.051 1.00 0.00 H new HETATM 0 HB2 SEP A 46 22.146 -8.884 -32.789 1.00 0.00 H new HETATM 0 HA SEP A 46 22.939 -8.122 -34.802 1.00 0.00 H new ATOM 158 N ASP A 47 21.925 -7.602 -37.074 1.00 0.00 N ATOM 159 CA ASP A 47 21.280 -7.870 -38.390 1.00 0.00 C ATOM 160 C ASP A 47 21.030 -9.389 -38.683 1.00 0.00 C ATOM 161 O ASP A 47 21.921 -10.111 -39.245 1.00 0.00 O ATOM 162 CB ASP A 47 22.208 -7.235 -39.521 1.00 0.00 C ATOM 163 CG ASP A 47 21.653 -7.202 -40.910 1.00 0.00 C ATOM 164 OD1 ASP A 47 20.600 -7.786 -41.083 1.00 0.00 O ATOM 165 OD2 ASP A 47 22.170 -6.376 -41.683 1.00 0.00 O ATOM 0 H ASP A 47 22.848 -7.168 -37.082 1.00 0.00 H new ATOM 0 HA ASP A 47 20.289 -7.417 -38.375 1.00 0.00 H new ATOM 0 HB2 ASP A 47 22.450 -6.213 -39.228 1.00 0.00 H new ATOM 0 HB3 ASP A 47 23.145 -7.791 -39.543 1.00 0.00 H new ATOM 170 N GLY A 48 19.779 -9.830 -38.371 1.00 0.00 N ATOM 171 CA GLY A 48 19.150 -11.099 -38.853 1.00 0.00 C ATOM 172 C GLY A 48 19.284 -12.127 -37.711 1.00 0.00 C ATOM 173 O GLY A 48 20.261 -12.126 -36.930 1.00 0.00 O ATOM 0 H GLY A 48 19.160 -9.298 -37.759 1.00 0.00 H new ATOM 0 HA2 GLY A 48 18.102 -10.938 -39.107 1.00 0.00 H new ATOM 0 HA3 GLY A 48 19.646 -11.457 -39.755 1.00 0.00 H new ATOM 177 N GLU A 49 18.403 -13.134 -37.625 1.00 0.00 N ATOM 178 CA GLU A 49 18.448 -14.336 -36.727 1.00 0.00 C ATOM 179 C GLU A 49 19.537 -15.194 -37.116 1.00 0.00 C ATOM 180 O GLU A 49 20.246 -15.759 -36.297 1.00 0.00 O ATOM 181 CB GLU A 49 17.102 -15.117 -37.081 1.00 0.00 C ATOM 182 CG GLU A 49 16.928 -16.429 -36.347 1.00 0.00 C ATOM 183 CD GLU A 49 16.872 -16.424 -34.786 1.00 0.00 C ATOM 184 OE1 GLU A 49 17.698 -15.808 -34.115 1.00 0.00 O ATOM 185 OE2 GLU A 49 15.925 -16.977 -34.153 1.00 0.00 O ATOM 0 H GLU A 49 17.573 -13.147 -38.218 1.00 0.00 H new ATOM 0 HA GLU A 49 18.561 -14.062 -35.678 1.00 0.00 H new ATOM 0 HB2 GLU A 49 16.252 -14.473 -36.855 1.00 0.00 H new ATOM 0 HB3 GLU A 49 17.079 -15.309 -38.154 1.00 0.00 H new ATOM 0 HG2 GLU A 49 16.007 -16.888 -36.707 1.00 0.00 H new ATOM 0 HG3 GLU A 49 17.748 -17.083 -36.644 1.00 0.00 H new HETATM 192 N NH2 A 50 19.800 -15.311 -38.435 1.00 0.00 N TER 195 NH2 A 50 ATOM 196 N MET B 1 -13.361 -30.328 -39.325 1.00 0.00 N ATOM 197 CA MET B 1 -13.534 -28.835 -39.604 1.00 0.00 C ATOM 198 C MET B 1 -12.286 -28.080 -39.300 1.00 0.00 C ATOM 199 O MET B 1 -11.565 -28.500 -38.398 1.00 0.00 O ATOM 200 CB MET B 1 -14.860 -28.316 -38.963 1.00 0.00 C ATOM 201 CG MET B 1 -15.274 -26.941 -39.267 1.00 0.00 C ATOM 202 SD MET B 1 -15.400 -26.552 -41.101 1.00 0.00 S ATOM 203 CE MET B 1 -16.736 -27.642 -41.718 1.00 0.00 C ATOM 0 H1 MET B 1 -14.239 -30.709 -38.919 1.00 0.00 H new ATOM 0 H2 MET B 1 -13.146 -30.825 -40.213 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.580 -30.467 -38.653 1.00 0.00 H new ATOM 0 HA MET B 1 -13.670 -28.651 -40.670 1.00 0.00 H new ATOM 0 HB2 MET B 1 -15.665 -28.984 -39.271 1.00 0.00 H new ATOM 0 HB3 MET B 1 -14.767 -28.406 -37.881 1.00 0.00 H new ATOM 0 HG2 MET B 1 -16.242 -26.755 -38.802 1.00 0.00 H new ATOM 0 HG3 MET B 1 -14.564 -26.252 -38.810 1.00 0.00 H new ATOM 0 HE1 MET B 1 -16.875 -27.478 -42.786 1.00 0.00 H new ATOM 0 HE2 MET B 1 -16.466 -28.683 -41.543 1.00 0.00 H new ATOM 0 HE3 MET B 1 -17.663 -27.415 -41.192 1.00 0.00 H new ATOM 215 N ALA B 2 -11.908 -27.039 -40.071 1.00 0.00 N ATOM 216 CA ALA B 2 -10.654 -26.284 -39.791 1.00 0.00 C ATOM 217 C ALA B 2 -10.610 -25.629 -38.444 1.00 0.00 C ATOM 218 O ALA B 2 -11.646 -25.161 -38.024 1.00 0.00 O ATOM 219 CB ALA B 2 -10.437 -25.268 -40.914 1.00 0.00 C ATOM 0 H ALA B 2 -12.435 -26.702 -40.877 1.00 0.00 H new ATOM 0 HA ALA B 2 -9.839 -27.007 -39.763 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -9.522 -24.706 -40.725 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -10.351 -25.791 -41.866 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -11.283 -24.582 -40.952 1.00 0.00 H new ATOM 225 N ASP B 3 -9.439 -25.503 -37.850 1.00 0.00 N ATOM 226 CA ASP B 3 -9.131 -24.779 -36.625 1.00 0.00 C ATOM 227 C ASP B 3 -7.787 -24.108 -36.830 1.00 0.00 C ATOM 228 O ASP B 3 -7.070 -24.394 -37.822 1.00 0.00 O ATOM 229 CB ASP B 3 -9.141 -25.703 -35.380 1.00 0.00 C ATOM 230 CG ASP B 3 -9.163 -25.058 -34.015 1.00 0.00 C ATOM 231 OD1 ASP B 3 -9.537 -23.854 -33.910 1.00 0.00 O ATOM 232 OD2 ASP B 3 -8.662 -25.729 -33.093 1.00 0.00 O ATOM 0 H ASP B 3 -8.606 -25.941 -38.243 1.00 0.00 H new ATOM 0 HA ASP B 3 -9.899 -24.032 -36.426 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -10.012 -26.354 -35.455 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -8.260 -26.342 -35.432 1.00 0.00 H new ATOM 237 N GLU B 4 -7.438 -23.108 -36.038 1.00 0.00 N ATOM 238 CA GLU B 4 -6.148 -22.324 -36.099 1.00 0.00 C ATOM 239 C GLU B 4 -5.086 -22.674 -35.040 1.00 0.00 C ATOM 240 O GLU B 4 -5.460 -23.049 -33.923 1.00 0.00 O ATOM 241 CB GLU B 4 -6.608 -20.827 -36.000 1.00 0.00 C ATOM 242 CG GLU B 4 -5.457 -19.921 -36.461 1.00 0.00 C ATOM 243 CD GLU B 4 -5.848 -18.474 -36.425 1.00 0.00 C ATOM 244 OE1 GLU B 4 -5.901 -17.837 -35.348 1.00 0.00 O ATOM 245 OE2 GLU B 4 -6.223 -17.892 -37.442 1.00 0.00 O ATOM 0 H GLU B 4 -8.051 -22.781 -35.291 1.00 0.00 H new ATOM 0 HA GLU B 4 -5.616 -22.566 -37.019 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -7.489 -20.662 -36.620 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -6.890 -20.586 -34.975 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -4.589 -20.080 -35.822 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -5.161 -20.194 -37.474 1.00 0.00 H new ATOM 252 N LYS B 5 -3.748 -22.440 -35.292 1.00 0.00 N ATOM 253 CA LYS B 5 -2.623 -22.554 -34.326 1.00 0.00 C ATOM 254 C LYS B 5 -2.610 -21.456 -33.319 1.00 0.00 C ATOM 255 O LYS B 5 -2.437 -20.289 -33.741 1.00 0.00 O ATOM 256 CB LYS B 5 -1.299 -22.809 -35.122 1.00 0.00 C ATOM 257 CG LYS B 5 0.041 -22.652 -34.379 1.00 0.00 C ATOM 258 CD LYS B 5 1.151 -22.926 -35.450 1.00 0.00 C ATOM 259 CE LYS B 5 2.553 -22.874 -34.859 1.00 0.00 C ATOM 260 NZ LYS B 5 2.680 -21.769 -33.906 1.00 0.00 N ATOM 0 H LYS B 5 -3.427 -22.156 -36.217 1.00 0.00 H new ATOM 0 HA LYS B 5 -2.754 -23.424 -33.682 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -1.341 -23.822 -35.521 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -1.288 -22.130 -35.975 1.00 0.00 H new ATOM 0 HG2 LYS B 5 0.141 -21.652 -33.958 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.114 -23.356 -33.550 1.00 0.00 H new ATOM 0 HD2 LYS B 5 0.985 -23.905 -35.899 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.069 -22.190 -36.250 1.00 0.00 H new ATOM 0 HE2 LYS B 5 2.776 -23.817 -34.360 1.00 0.00 H new ATOM 0 HE3 LYS B 5 3.284 -22.755 -35.658 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 3.687 -21.570 -33.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 2.220 -20.921 -34.295 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.223 -22.030 -33.009 1.00 0.00 H new ATOM 274 N PRO B 6 -2.716 -21.722 -31.977 1.00 0.00 N ATOM 275 CA PRO B 6 -2.894 -20.591 -31.017 1.00 0.00 C ATOM 276 C PRO B 6 -1.612 -19.746 -30.814 1.00 0.00 C ATOM 277 O PRO B 6 -0.512 -20.266 -30.767 1.00 0.00 O ATOM 278 CB PRO B 6 -3.266 -21.331 -29.685 1.00 0.00 C ATOM 279 CG PRO B 6 -2.589 -22.747 -29.809 1.00 0.00 C ATOM 280 CD PRO B 6 -2.760 -23.048 -31.324 1.00 0.00 C ATOM 0 HA PRO B 6 -3.637 -19.876 -31.371 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -2.895 -20.790 -28.815 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -4.346 -21.418 -29.569 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -1.541 -22.727 -29.512 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -3.083 -23.492 -29.186 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -1.965 -23.697 -31.691 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -3.703 -23.556 -31.523 1.00 0.00 H new ATOM 288 N LYS B 7 -1.907 -18.430 -30.693 1.00 0.00 N ATOM 289 CA LYS B 7 -0.835 -17.478 -30.770 1.00 0.00 C ATOM 290 C LYS B 7 0.035 -17.360 -29.495 1.00 0.00 C ATOM 291 O LYS B 7 -0.603 -17.473 -28.403 1.00 0.00 O ATOM 292 CB LYS B 7 -1.532 -16.192 -31.085 1.00 0.00 C ATOM 293 CG LYS B 7 -0.647 -15.013 -31.634 1.00 0.00 C ATOM 294 CD LYS B 7 -1.625 -13.884 -31.865 1.00 0.00 C ATOM 295 CE LYS B 7 -0.642 -12.834 -32.586 1.00 0.00 C ATOM 296 NZ LYS B 7 -1.505 -11.643 -32.950 1.00 0.00 N ATOM 0 H LYS B 7 -2.839 -18.041 -30.549 1.00 0.00 H new ATOM 0 HA LYS B 7 -0.104 -17.784 -31.519 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -2.311 -16.400 -31.819 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -2.031 -15.847 -30.179 1.00 0.00 H new ATOM 0 HG2 LYS B 7 0.125 -14.730 -30.919 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -0.139 -15.294 -32.557 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -2.463 -14.177 -32.497 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -2.046 -13.496 -30.937 1.00 0.00 H new ATOM 0 HE2 LYS B 7 0.171 -12.540 -31.922 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -0.185 -13.272 -33.474 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -0.922 -10.924 -33.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -2.266 -11.948 -33.590 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -1.921 -11.239 -32.087 1.00 0.00 H new ATOM 310 N GLU B 8 1.366 -17.214 -29.629 1.00 0.00 N ATOM 311 CA GLU B 8 2.267 -17.618 -28.588 1.00 0.00 C ATOM 312 C GLU B 8 3.493 -16.637 -28.540 1.00 0.00 C ATOM 313 O GLU B 8 4.404 -16.954 -27.841 1.00 0.00 O ATOM 314 CB GLU B 8 2.641 -19.138 -28.741 1.00 0.00 C ATOM 315 CG GLU B 8 3.313 -19.583 -29.961 1.00 0.00 C ATOM 316 CD GLU B 8 4.834 -19.552 -29.825 1.00 0.00 C ATOM 317 OE1 GLU B 8 5.348 -20.214 -28.881 1.00 0.00 O ATOM 318 OE2 GLU B 8 5.524 -18.846 -30.572 1.00 0.00 O ATOM 0 H GLU B 8 1.819 -16.818 -30.453 1.00 0.00 H new ATOM 0 HA GLU B 8 1.786 -17.544 -27.612 1.00 0.00 H new ATOM 0 HB2 GLU B 8 3.277 -19.407 -27.898 1.00 0.00 H new ATOM 0 HB3 GLU B 8 1.721 -19.715 -28.643 1.00 0.00 H new ATOM 0 HG2 GLU B 8 2.992 -20.596 -30.202 1.00 0.00 H new ATOM 0 HG3 GLU B 8 3.011 -18.947 -30.793 1.00 0.00 H new ATOM 325 N GLY B 9 3.571 -15.570 -29.345 1.00 0.00 N ATOM 326 CA GLY B 9 4.742 -14.720 -29.472 1.00 0.00 C ATOM 327 C GLY B 9 5.262 -13.923 -28.254 1.00 0.00 C ATOM 328 O GLY B 9 5.395 -12.691 -28.289 1.00 0.00 O ATOM 0 H GLY B 9 2.796 -15.274 -29.938 1.00 0.00 H new ATOM 0 HA2 GLY B 9 5.561 -15.349 -29.820 1.00 0.00 H new ATOM 0 HA3 GLY B 9 4.534 -14.000 -30.264 1.00 0.00 H new ATOM 332 N VAL B 10 5.512 -14.557 -27.114 1.00 0.00 N ATOM 333 CA VAL B 10 6.469 -14.121 -26.007 1.00 0.00 C ATOM 334 C VAL B 10 7.837 -14.266 -26.606 1.00 0.00 C ATOM 335 O VAL B 10 8.251 -15.371 -26.763 1.00 0.00 O ATOM 336 CB VAL B 10 6.218 -14.893 -24.707 1.00 0.00 C ATOM 337 CG1 VAL B 10 7.103 -14.487 -23.538 1.00 0.00 C ATOM 338 CG2 VAL B 10 4.826 -14.930 -24.198 1.00 0.00 C ATOM 0 H VAL B 10 5.049 -15.437 -26.888 1.00 0.00 H new ATOM 0 HA VAL B 10 6.328 -13.089 -25.685 1.00 0.00 H new ATOM 0 HB VAL B 10 6.477 -15.891 -25.060 1.00 0.00 H new ATOM 0 HG11 VAL B 10 6.851 -15.088 -22.665 1.00 0.00 H new ATOM 0 HG12 VAL B 10 8.149 -14.648 -23.800 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.945 -13.433 -23.311 1.00 0.00 H new ATOM 0 HG21 VAL B 10 4.792 -15.508 -23.274 1.00 0.00 H new ATOM 0 HG22 VAL B 10 4.483 -13.914 -24.003 1.00 0.00 H new ATOM 0 HG23 VAL B 10 4.179 -15.395 -24.942 1.00 0.00 H new ATOM 348 N LYS B 11 8.491 -13.176 -27.091 1.00 0.00 N ATOM 349 CA LYS B 11 9.724 -13.332 -27.893 1.00 0.00 C ATOM 350 C LYS B 11 10.488 -12.026 -27.926 1.00 0.00 C ATOM 351 O LYS B 11 9.820 -10.943 -28.063 1.00 0.00 O ATOM 352 CB LYS B 11 9.321 -13.802 -29.316 1.00 0.00 C ATOM 353 CG LYS B 11 10.582 -13.936 -30.208 1.00 0.00 C ATOM 354 CD LYS B 11 10.174 -14.532 -31.500 1.00 0.00 C ATOM 355 CE LYS B 11 11.307 -15.036 -32.296 1.00 0.00 C ATOM 356 NZ LYS B 11 10.820 -15.643 -33.536 1.00 0.00 N ATOM 0 H LYS B 11 8.193 -12.211 -26.944 1.00 0.00 H new ATOM 0 HA LYS B 11 10.383 -14.078 -27.449 1.00 0.00 H new ATOM 0 HB2 LYS B 11 8.803 -14.759 -29.258 1.00 0.00 H new ATOM 0 HB3 LYS B 11 8.626 -13.089 -29.760 1.00 0.00 H new ATOM 0 HG2 LYS B 11 11.040 -12.960 -30.368 1.00 0.00 H new ATOM 0 HG3 LYS B 11 11.328 -14.562 -29.719 1.00 0.00 H new ATOM 0 HD2 LYS B 11 9.480 -15.351 -31.311 1.00 0.00 H new ATOM 0 HD3 LYS B 11 9.635 -13.785 -32.082 1.00 0.00 H new ATOM 0 HE2 LYS B 11 11.992 -14.220 -32.526 1.00 0.00 H new ATOM 0 HE3 LYS B 11 11.869 -15.770 -31.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 11.626 -15.995 -34.090 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 10.184 -16.434 -33.309 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 10.303 -14.932 -34.091 1.00 0.00 H new ATOM 370 N THR B 12 11.789 -12.017 -27.911 1.00 0.00 N ATOM 371 CA THR B 12 12.611 -10.766 -27.829 1.00 0.00 C ATOM 372 C THR B 12 12.589 -9.991 -29.164 1.00 0.00 C ATOM 373 O THR B 12 12.896 -8.817 -29.273 1.00 0.00 O ATOM 374 CB THR B 12 14.064 -11.013 -27.458 1.00 0.00 C ATOM 375 OG1 THR B 12 14.787 -11.636 -28.507 1.00 0.00 O ATOM 376 CG2 THR B 12 14.283 -12.000 -26.346 1.00 0.00 C ATOM 0 H THR B 12 12.349 -12.868 -27.954 1.00 0.00 H new ATOM 0 HA THR B 12 12.147 -10.183 -27.033 1.00 0.00 H new ATOM 0 HB THR B 12 14.388 -10.006 -27.195 1.00 0.00 H new ATOM 0 HG1 THR B 12 15.716 -11.775 -28.227 1.00 0.00 H new ATOM 0 HG21 THR B 12 15.352 -12.105 -26.158 1.00 0.00 H new ATOM 0 HG22 THR B 12 13.789 -11.645 -25.442 1.00 0.00 H new ATOM 0 HG23 THR B 12 13.868 -12.967 -26.631 1.00 0.00 H new ATOM 384 N GLU B 13 12.168 -10.606 -30.298 1.00 0.00 N ATOM 385 CA GLU B 13 12.057 -9.846 -31.565 1.00 0.00 C ATOM 386 C GLU B 13 10.759 -8.858 -31.502 1.00 0.00 C ATOM 387 O GLU B 13 10.728 -7.849 -32.135 1.00 0.00 O ATOM 388 CB GLU B 13 11.885 -10.823 -32.794 1.00 0.00 C ATOM 389 CG GLU B 13 13.049 -11.813 -33.026 1.00 0.00 C ATOM 390 CD GLU B 13 14.386 -11.076 -33.409 1.00 0.00 C ATOM 391 OE1 GLU B 13 14.425 -10.368 -34.396 1.00 0.00 O ATOM 392 OE2 GLU B 13 15.430 -11.203 -32.736 1.00 0.00 O ATOM 0 H GLU B 13 11.909 -11.590 -30.361 1.00 0.00 H new ATOM 0 HA GLU B 13 12.971 -9.266 -31.692 1.00 0.00 H new ATOM 0 HB2 GLU B 13 10.967 -11.395 -32.656 1.00 0.00 H new ATOM 0 HB3 GLU B 13 11.755 -10.225 -33.696 1.00 0.00 H new ATOM 0 HG2 GLU B 13 13.207 -12.404 -32.124 1.00 0.00 H new ATOM 0 HG3 GLU B 13 12.779 -12.509 -33.820 1.00 0.00 H new ATOM 399 N ASN B 14 9.818 -9.218 -30.685 1.00 0.00 N ATOM 400 CA ASN B 14 8.639 -8.342 -30.504 1.00 0.00 C ATOM 401 C ASN B 14 8.708 -7.115 -29.568 1.00 0.00 C ATOM 402 O ASN B 14 7.727 -6.419 -29.362 1.00 0.00 O ATOM 403 CB ASN B 14 7.366 -9.145 -30.185 1.00 0.00 C ATOM 404 CG ASN B 14 6.895 -10.270 -31.155 1.00 0.00 C ATOM 405 OD1 ASN B 14 6.975 -10.209 -32.372 1.00 0.00 O ATOM 406 ND2 ASN B 14 6.539 -11.453 -30.661 1.00 0.00 N ATOM 0 H ASN B 14 9.814 -10.078 -30.137 1.00 0.00 H new ATOM 0 HA ASN B 14 8.619 -7.885 -31.493 1.00 0.00 H new ATOM 0 HB2 ASN B 14 7.506 -9.599 -29.204 1.00 0.00 H new ATOM 0 HB3 ASN B 14 6.547 -8.432 -30.092 1.00 0.00 H new ATOM 0 HD21 ASN B 14 6.354 -12.234 -31.291 1.00 0.00 H new ATOM 0 HD22 ASN B 14 6.452 -11.579 -29.653 1.00 0.00 H new ATOM 413 N ASN B 15 9.915 -6.906 -28.995 1.00 0.00 N ATOM 414 CA ASN B 15 10.148 -5.865 -28.011 1.00 0.00 C ATOM 415 C ASN B 15 10.171 -4.541 -28.719 1.00 0.00 C ATOM 416 O ASN B 15 10.502 -4.491 -29.950 1.00 0.00 O ATOM 417 CB ASN B 15 11.393 -6.212 -27.166 1.00 0.00 C ATOM 418 CG ASN B 15 11.850 -5.073 -26.283 1.00 0.00 C ATOM 419 OD1 ASN B 15 12.732 -4.301 -26.586 1.00 0.00 O ATOM 420 ND2 ASN B 15 11.337 -5.056 -25.116 1.00 0.00 N ATOM 0 H ASN B 15 10.743 -7.461 -29.212 1.00 0.00 H new ATOM 0 HA ASN B 15 9.344 -5.792 -27.279 1.00 0.00 H new ATOM 0 HB2 ASN B 15 11.172 -7.079 -26.544 1.00 0.00 H new ATOM 0 HB3 ASN B 15 12.208 -6.497 -27.831 1.00 0.00 H new ATOM 0 HD21 ASN B 15 11.669 -4.386 -24.423 1.00 0.00 H new ATOM 0 HD22 ASN B 15 10.595 -5.713 -24.876 1.00 0.00 H new ATOM 427 N ASP B 16 9.688 -3.462 -28.053 1.00 0.00 N ATOM 428 CA ASP B 16 9.528 -2.195 -28.784 1.00 0.00 C ATOM 429 C ASP B 16 10.750 -1.273 -28.625 1.00 0.00 C ATOM 430 O ASP B 16 11.392 -1.292 -27.562 1.00 0.00 O ATOM 431 CB ASP B 16 8.360 -1.543 -28.057 1.00 0.00 C ATOM 432 CG ASP B 16 7.001 -2.099 -28.458 1.00 0.00 C ATOM 433 OD1 ASP B 16 6.890 -2.241 -29.646 1.00 0.00 O ATOM 434 OD2 ASP B 16 6.121 -2.314 -27.617 1.00 0.00 O ATOM 0 H ASP B 16 9.419 -3.445 -27.069 1.00 0.00 H new ATOM 0 HA ASP B 16 9.394 -2.360 -29.853 1.00 0.00 H new ATOM 0 HB2 ASP B 16 8.494 -1.674 -26.983 1.00 0.00 H new ATOM 0 HB3 ASP B 16 8.376 -0.471 -28.252 1.00 0.00 H new ATOM 439 N HIS B 17 10.858 -0.356 -29.640 1.00 0.00 N ATOM 440 CA HIS B 17 12.065 0.518 -30.061 1.00 0.00 C ATOM 441 C HIS B 17 12.250 1.699 -29.115 1.00 0.00 C ATOM 442 O HIS B 17 11.323 2.070 -28.320 1.00 0.00 O ATOM 443 CB HIS B 17 11.919 1.111 -31.507 1.00 0.00 C ATOM 444 CG HIS B 17 11.746 0.075 -32.586 1.00 0.00 C ATOM 445 ND1 HIS B 17 10.623 -0.763 -32.752 1.00 0.00 N ATOM 446 CD2 HIS B 17 12.685 -0.218 -33.497 1.00 0.00 C ATOM 447 CE1 HIS B 17 11.083 -1.596 -33.642 1.00 0.00 C ATOM 448 NE2 HIS B 17 12.295 -1.303 -34.201 1.00 0.00 N ATOM 0 H HIS B 17 10.058 -0.176 -30.246 1.00 0.00 H new ATOM 0 HA HIS B 17 12.923 -0.154 -30.028 1.00 0.00 H new ATOM 0 HB2 HIS B 17 11.063 1.785 -31.526 1.00 0.00 H new ATOM 0 HB3 HIS B 17 12.801 1.710 -31.732 1.00 0.00 H new ATOM 0 HD2 HIS B 17 13.606 0.326 -33.644 1.00 0.00 H new ATOM 0 HE1 HIS B 17 10.530 -2.480 -33.926 1.00 0.00 H new ATOM 0 HE2 HIS B 17 12.782 -1.782 -34.958 1.00 0.00 H new ATOM 456 N ILE B 18 13.318 2.484 -29.263 1.00 0.00 N ATOM 457 CA ILE B 18 13.382 3.827 -28.705 1.00 0.00 C ATOM 458 C ILE B 18 13.670 4.934 -29.868 1.00 0.00 C ATOM 459 O ILE B 18 14.679 4.809 -30.611 1.00 0.00 O ATOM 460 CB ILE B 18 14.508 3.846 -27.526 1.00 0.00 C ATOM 461 CG1 ILE B 18 14.794 5.238 -26.970 1.00 0.00 C ATOM 462 CG2 ILE B 18 15.872 3.167 -27.939 1.00 0.00 C ATOM 463 CD1 ILE B 18 15.467 5.435 -25.615 1.00 0.00 C ATOM 0 H ILE B 18 14.157 2.205 -29.771 1.00 0.00 H new ATOM 0 HA ILE B 18 12.420 4.098 -28.269 1.00 0.00 H new ATOM 0 HB ILE B 18 14.050 3.248 -26.738 1.00 0.00 H new ATOM 0 HG12 ILE B 18 15.411 5.752 -27.707 1.00 0.00 H new ATOM 0 HG13 ILE B 18 13.840 5.764 -26.929 1.00 0.00 H new ATOM 0 HG21 ILE B 18 16.571 3.218 -27.104 1.00 0.00 H new ATOM 0 HG22 ILE B 18 15.695 2.124 -28.201 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.293 3.690 -28.798 1.00 0.00 H new ATOM 0 HD11 ILE B 18 15.575 6.501 -25.414 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.857 4.978 -24.836 1.00 0.00 H new ATOM 0 HD13 ILE B 18 16.451 4.967 -25.626 1.00 0.00 H new ATOM 475 N ASN B 19 12.712 5.906 -29.990 1.00 0.00 N ATOM 476 CA ASN B 19 12.835 7.022 -30.964 1.00 0.00 C ATOM 477 C ASN B 19 13.573 8.240 -30.360 1.00 0.00 C ATOM 478 O ASN B 19 12.936 9.097 -29.808 1.00 0.00 O ATOM 479 CB ASN B 19 11.451 7.309 -31.485 1.00 0.00 C ATOM 480 CG ASN B 19 10.883 6.233 -32.363 1.00 0.00 C ATOM 481 OD1 ASN B 19 10.978 6.454 -33.564 1.00 0.00 O ATOM 482 ND2 ASN B 19 10.194 5.264 -31.860 1.00 0.00 N ATOM 0 H ASN B 19 11.860 5.933 -29.430 1.00 0.00 H new ATOM 0 HA ASN B 19 13.468 6.748 -31.808 1.00 0.00 H new ATOM 0 HB2 ASN B 19 10.782 7.461 -30.638 1.00 0.00 H new ATOM 0 HB3 ASN B 19 11.474 8.244 -32.045 1.00 0.00 H new ATOM 0 HD21 ASN B 19 9.687 4.627 -32.474 1.00 0.00 H new ATOM 0 HD22 ASN B 19 10.157 5.136 -30.849 1.00 0.00 H new ATOM 489 N LEU B 20 14.924 8.285 -30.434 1.00 0.00 N ATOM 490 CA LEU B 20 15.666 9.582 -30.147 1.00 0.00 C ATOM 491 C LEU B 20 15.561 10.642 -31.203 1.00 0.00 C ATOM 492 O LEU B 20 15.200 10.303 -32.338 1.00 0.00 O ATOM 493 CB LEU B 20 17.167 9.309 -29.871 1.00 0.00 C ATOM 494 CG LEU B 20 17.500 8.151 -28.887 1.00 0.00 C ATOM 495 CD1 LEU B 20 19.029 7.931 -28.731 1.00 0.00 C ATOM 496 CD2 LEU B 20 16.880 8.179 -27.466 1.00 0.00 C ATOM 0 H LEU B 20 15.518 7.492 -30.676 1.00 0.00 H new ATOM 0 HA LEU B 20 15.160 9.978 -29.267 1.00 0.00 H new ATOM 0 HB2 LEU B 20 17.654 9.097 -30.823 1.00 0.00 H new ATOM 0 HB3 LEU B 20 17.613 10.224 -29.482 1.00 0.00 H new ATOM 0 HG LEU B 20 17.006 7.325 -29.399 1.00 0.00 H new ATOM 0 HD11 LEU B 20 19.210 7.112 -28.034 1.00 0.00 H new ATOM 0 HD12 LEU B 20 19.462 7.684 -29.700 1.00 0.00 H new ATOM 0 HD13 LEU B 20 19.490 8.841 -28.349 1.00 0.00 H new ATOM 0 HD21 LEU B 20 17.210 7.303 -26.908 1.00 0.00 H new ATOM 0 HD22 LEU B 20 17.200 9.082 -26.947 1.00 0.00 H new ATOM 0 HD23 LEU B 20 15.793 8.171 -27.543 1.00 0.00 H new ATOM 508 N LYS B 21 16.119 11.838 -31.032 1.00 0.00 N ATOM 509 CA LYS B 21 16.339 12.873 -32.022 1.00 0.00 C ATOM 510 C LYS B 21 17.796 13.285 -32.022 1.00 0.00 C ATOM 511 O LYS B 21 18.454 13.292 -30.998 1.00 0.00 O ATOM 512 CB LYS B 21 15.425 14.122 -31.841 1.00 0.00 C ATOM 513 CG LYS B 21 13.967 13.713 -32.180 1.00 0.00 C ATOM 514 CD LYS B 21 13.079 14.928 -32.110 1.00 0.00 C ATOM 515 CE LYS B 21 11.613 14.516 -32.360 1.00 0.00 C ATOM 516 NZ LYS B 21 10.675 15.640 -32.385 1.00 0.00 N ATOM 0 H LYS B 21 16.456 12.126 -30.114 1.00 0.00 H new ATOM 0 HA LYS B 21 16.069 12.440 -32.985 1.00 0.00 H new ATOM 0 HB2 LYS B 21 15.487 14.493 -30.818 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.754 14.931 -32.494 1.00 0.00 H new ATOM 0 HG2 LYS B 21 13.923 13.273 -33.176 1.00 0.00 H new ATOM 0 HG3 LYS B 21 13.618 12.953 -31.481 1.00 0.00 H new ATOM 0 HD2 LYS B 21 13.172 15.402 -31.133 1.00 0.00 H new ATOM 0 HD3 LYS B 21 13.392 15.662 -32.852 1.00 0.00 H new ATOM 0 HE2 LYS B 21 11.553 13.984 -33.310 1.00 0.00 H new ATOM 0 HE3 LYS B 21 11.305 13.816 -31.583 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 9.713 15.285 -32.557 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 10.703 16.136 -31.471 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 10.942 16.298 -33.144 1.00 0.00 H new ATOM 530 N VAL B 22 18.284 13.639 -33.212 1.00 0.00 N ATOM 531 CA VAL B 22 19.572 14.381 -33.492 1.00 0.00 C ATOM 532 C VAL B 22 19.199 15.727 -34.154 1.00 0.00 C ATOM 533 O VAL B 22 18.464 15.871 -35.111 1.00 0.00 O ATOM 534 CB VAL B 22 20.584 13.575 -34.320 1.00 0.00 C ATOM 535 CG1 VAL B 22 21.944 14.287 -34.283 1.00 0.00 C ATOM 536 CG2 VAL B 22 20.705 12.156 -33.714 1.00 0.00 C ATOM 0 H VAL B 22 17.783 13.416 -34.072 1.00 0.00 H new ATOM 0 HA VAL B 22 20.094 14.555 -32.551 1.00 0.00 H new ATOM 0 HB VAL B 22 20.253 13.497 -35.356 1.00 0.00 H new ATOM 0 HG11 VAL B 22 22.668 13.720 -34.869 1.00 0.00 H new ATOM 0 HG12 VAL B 22 21.842 15.288 -34.702 1.00 0.00 H new ATOM 0 HG13 VAL B 22 22.289 14.359 -33.252 1.00 0.00 H new ATOM 0 HG21 VAL B 22 21.421 11.573 -34.293 1.00 0.00 H new ATOM 0 HG22 VAL B 22 21.047 12.229 -32.682 1.00 0.00 H new ATOM 0 HG23 VAL B 22 19.732 11.665 -33.740 1.00 0.00 H new ATOM 546 N ALA B 23 19.948 16.811 -33.722 1.00 0.00 N ATOM 547 CA ALA B 23 19.877 18.138 -34.345 1.00 0.00 C ATOM 548 C ALA B 23 21.155 19.000 -34.380 1.00 0.00 C ATOM 549 O ALA B 23 21.926 18.984 -33.437 1.00 0.00 O ATOM 550 CB ALA B 23 18.817 18.859 -33.476 1.00 0.00 C ATOM 0 H ALA B 23 20.601 16.761 -32.940 1.00 0.00 H new ATOM 0 HA ALA B 23 19.665 18.005 -35.406 1.00 0.00 H new ATOM 0 HB1 ALA B 23 18.673 19.874 -33.846 1.00 0.00 H new ATOM 0 HB2 ALA B 23 17.873 18.316 -33.528 1.00 0.00 H new ATOM 0 HB3 ALA B 23 19.158 18.895 -32.441 1.00 0.00 H new ATOM 556 N GLY B 24 21.190 19.900 -35.323 1.00 0.00 N ATOM 557 CA GLY B 24 22.140 20.992 -35.428 1.00 0.00 C ATOM 558 C GLY B 24 21.635 22.330 -34.944 1.00 0.00 C ATOM 559 O GLY B 24 20.460 22.580 -34.908 1.00 0.00 O ATOM 0 H GLY B 24 20.518 19.897 -36.090 1.00 0.00 H new ATOM 0 HA2 GLY B 24 23.033 20.731 -34.860 1.00 0.00 H new ATOM 0 HA3 GLY B 24 22.442 21.091 -36.471 1.00 0.00 H new ATOM 563 N GLN B 25 22.581 23.141 -34.578 1.00 0.00 N ATOM 564 CA GLN B 25 22.221 24.470 -33.906 1.00 0.00 C ATOM 565 C GLN B 25 21.313 25.283 -34.869 1.00 0.00 C ATOM 566 O GLN B 25 20.474 26.104 -34.420 1.00 0.00 O ATOM 567 CB GLN B 25 23.557 25.174 -33.604 1.00 0.00 C ATOM 568 CG GLN B 25 24.485 24.322 -32.713 1.00 0.00 C ATOM 569 CD GLN B 25 23.883 23.920 -31.387 1.00 0.00 C ATOM 570 OE1 GLN B 25 23.029 24.609 -30.850 1.00 0.00 O ATOM 571 NE2 GLN B 25 24.166 22.702 -30.967 1.00 0.00 N ATOM 0 H GLN B 25 23.579 22.969 -34.701 1.00 0.00 H new ATOM 0 HA GLN B 25 21.663 24.348 -32.977 1.00 0.00 H new ATOM 0 HB2 GLN B 25 24.065 25.400 -34.541 1.00 0.00 H new ATOM 0 HB3 GLN B 25 23.359 26.126 -33.111 1.00 0.00 H new ATOM 0 HG2 GLN B 25 24.765 23.421 -33.259 1.00 0.00 H new ATOM 0 HG3 GLN B 25 25.402 24.880 -32.527 1.00 0.00 H new ATOM 0 HE21 GLN B 25 24.885 22.154 -31.439 1.00 0.00 H new ATOM 0 HE22 GLN B 25 23.665 22.308 -30.170 1.00 0.00 H new ATOM 580 N ASP B 26 21.506 25.036 -36.186 1.00 0.00 N ATOM 581 CA ASP B 26 20.916 25.750 -37.331 1.00 0.00 C ATOM 582 C ASP B 26 19.332 25.482 -37.438 1.00 0.00 C ATOM 583 O ASP B 26 18.661 26.218 -38.206 1.00 0.00 O ATOM 584 CB ASP B 26 21.567 25.331 -38.640 1.00 0.00 C ATOM 585 CG ASP B 26 21.421 23.814 -38.885 1.00 0.00 C ATOM 586 OD1 ASP B 26 22.265 23.024 -38.407 1.00 0.00 O ATOM 587 OD2 ASP B 26 20.381 23.458 -39.531 1.00 0.00 O ATOM 0 H ASP B 26 22.120 24.281 -36.492 1.00 0.00 H new ATOM 0 HA ASP B 26 21.094 26.812 -37.159 1.00 0.00 H new ATOM 0 HB2 ASP B 26 21.113 25.879 -39.465 1.00 0.00 H new ATOM 0 HB3 ASP B 26 22.624 25.598 -38.624 1.00 0.00 H new ATOM 592 N GLY B 27 18.738 24.637 -36.670 1.00 0.00 N ATOM 593 CA GLY B 27 17.331 24.282 -36.665 1.00 0.00 C ATOM 594 C GLY B 27 16.899 23.174 -37.561 1.00 0.00 C ATOM 595 O GLY B 27 15.712 23.009 -37.858 1.00 0.00 O ATOM 0 H GLY B 27 19.257 24.121 -35.959 1.00 0.00 H new ATOM 0 HA2 GLY B 27 17.055 24.017 -35.645 1.00 0.00 H new ATOM 0 HA3 GLY B 27 16.759 25.171 -36.929 1.00 0.00 H new ATOM 599 N SER B 28 17.838 22.353 -38.073 1.00 0.00 N ATOM 600 CA SER B 28 17.485 21.119 -38.768 1.00 0.00 C ATOM 601 C SER B 28 17.636 19.945 -37.787 1.00 0.00 C ATOM 602 O SER B 28 18.514 19.929 -36.902 1.00 0.00 O ATOM 603 CB SER B 28 18.281 20.879 -40.118 1.00 0.00 C ATOM 604 OG SER B 28 19.627 20.953 -39.820 1.00 0.00 O ATOM 0 H SER B 28 18.841 22.530 -38.014 1.00 0.00 H new ATOM 0 HA SER B 28 16.448 21.205 -39.092 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.034 19.905 -40.542 1.00 0.00 H new ATOM 0 HB3 SER B 28 18.010 21.628 -40.862 1.00 0.00 H new ATOM 0 HG SER B 28 19.959 21.851 -40.028 1.00 0.00 H new ATOM 610 N VAL B 29 16.837 18.886 -37.942 1.00 0.00 N ATOM 611 CA VAL B 29 16.657 17.711 -37.062 1.00 0.00 C ATOM 612 C VAL B 29 16.561 16.484 -37.933 1.00 0.00 C ATOM 613 O VAL B 29 16.269 16.512 -39.152 1.00 0.00 O ATOM 614 CB VAL B 29 15.364 17.955 -36.218 1.00 0.00 C ATOM 615 CG1 VAL B 29 15.067 16.864 -35.121 1.00 0.00 C ATOM 616 CG2 VAL B 29 15.299 19.295 -35.447 1.00 0.00 C ATOM 0 H VAL B 29 16.238 18.816 -38.765 1.00 0.00 H new ATOM 0 HA VAL B 29 17.491 17.563 -36.376 1.00 0.00 H new ATOM 0 HB VAL B 29 14.630 17.934 -37.024 1.00 0.00 H new ATOM 0 HG11 VAL B 29 14.151 17.122 -34.590 1.00 0.00 H new ATOM 0 HG12 VAL B 29 14.948 15.891 -35.598 1.00 0.00 H new ATOM 0 HG13 VAL B 29 15.896 16.823 -34.415 1.00 0.00 H new ATOM 0 HG21 VAL B 29 14.359 19.354 -34.898 1.00 0.00 H new ATOM 0 HG22 VAL B 29 16.132 19.353 -34.747 1.00 0.00 H new ATOM 0 HG23 VAL B 29 15.360 20.124 -36.152 1.00 0.00 H new ATOM 626 N VAL B 30 16.805 15.289 -37.317 1.00 0.00 N ATOM 627 CA VAL B 30 16.212 13.980 -37.728 1.00 0.00 C ATOM 628 C VAL B 30 15.732 13.185 -36.490 1.00 0.00 C ATOM 629 O VAL B 30 16.401 13.160 -35.459 1.00 0.00 O ATOM 630 CB VAL B 30 17.110 13.098 -38.603 1.00 0.00 C ATOM 631 CG1 VAL B 30 17.225 13.554 -40.060 1.00 0.00 C ATOM 632 CG2 VAL B 30 18.511 12.989 -38.020 1.00 0.00 C ATOM 0 H VAL B 30 17.426 15.208 -36.512 1.00 0.00 H new ATOM 0 HA VAL B 30 15.367 14.248 -38.362 1.00 0.00 H new ATOM 0 HB VAL B 30 16.613 12.128 -38.606 1.00 0.00 H new ATOM 0 HG11 VAL B 30 17.879 12.872 -40.604 1.00 0.00 H new ATOM 0 HG12 VAL B 30 16.237 13.554 -40.520 1.00 0.00 H new ATOM 0 HG13 VAL B 30 17.641 14.561 -40.094 1.00 0.00 H new ATOM 0 HG21 VAL B 30 19.124 12.357 -38.663 1.00 0.00 H new ATOM 0 HG22 VAL B 30 18.956 13.982 -37.955 1.00 0.00 H new ATOM 0 HG23 VAL B 30 18.457 12.550 -37.024 1.00 0.00 H new ATOM 642 N GLN B 31 14.634 12.389 -36.692 1.00 0.00 N ATOM 643 CA GLN B 31 14.371 11.239 -35.824 1.00 0.00 C ATOM 644 C GLN B 31 15.209 9.967 -36.058 1.00 0.00 C ATOM 645 O GLN B 31 15.396 9.535 -37.172 1.00 0.00 O ATOM 646 CB GLN B 31 12.910 10.791 -35.881 1.00 0.00 C ATOM 647 CG GLN B 31 12.418 9.942 -34.775 1.00 0.00 C ATOM 648 CD GLN B 31 10.938 10.085 -34.881 1.00 0.00 C ATOM 649 OE1 GLN B 31 10.357 11.079 -35.291 1.00 0.00 O ATOM 650 NE2 GLN B 31 10.170 8.983 -34.661 1.00 0.00 N ATOM 0 H GLN B 31 13.947 12.533 -37.432 1.00 0.00 H new ATOM 0 HA GLN B 31 14.658 11.651 -34.857 1.00 0.00 H new ATOM 0 HB2 GLN B 31 12.285 11.683 -35.925 1.00 0.00 H new ATOM 0 HB3 GLN B 31 12.759 10.249 -36.815 1.00 0.00 H new ATOM 0 HG2 GLN B 31 12.733 8.905 -34.890 1.00 0.00 H new ATOM 0 HG3 GLN B 31 12.789 10.282 -33.808 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.598 8.123 -34.319 1.00 0.00 H new ATOM 0 HE22 GLN B 31 9.166 9.017 -34.839 1.00 0.00 H new ATOM 659 N PHE B 32 15.704 9.281 -35.031 1.00 0.00 N ATOM 660 CA PHE B 32 16.286 7.927 -35.021 1.00 0.00 C ATOM 661 C PHE B 32 15.358 6.951 -34.315 1.00 0.00 C ATOM 662 O PHE B 32 14.891 7.288 -33.213 1.00 0.00 O ATOM 663 CB PHE B 32 17.673 8.000 -34.377 1.00 0.00 C ATOM 664 CG PHE B 32 18.850 8.317 -35.377 1.00 0.00 C ATOM 665 CD1 PHE B 32 19.509 7.320 -36.084 1.00 0.00 C ATOM 666 CD2 PHE B 32 19.195 9.678 -35.547 1.00 0.00 C ATOM 667 CE1 PHE B 32 20.580 7.585 -36.942 1.00 0.00 C ATOM 668 CE2 PHE B 32 20.354 10.005 -36.367 1.00 0.00 C ATOM 669 CZ PHE B 32 20.939 8.937 -37.154 1.00 0.00 C ATOM 0 H PHE B 32 15.712 9.689 -34.096 1.00 0.00 H new ATOM 0 HA PHE B 32 16.401 7.551 -36.038 1.00 0.00 H new ATOM 0 HB2 PHE B 32 17.658 8.765 -33.601 1.00 0.00 H new ATOM 0 HB3 PHE B 32 17.880 7.050 -33.884 1.00 0.00 H new ATOM 0 HD1 PHE B 32 19.181 6.298 -35.966 1.00 0.00 H new ATOM 0 HD2 PHE B 32 18.612 10.458 -35.079 1.00 0.00 H new ATOM 0 HE1 PHE B 32 21.116 6.783 -37.428 1.00 0.00 H new ATOM 0 HE2 PHE B 32 20.762 11.005 -36.388 1.00 0.00 H new ATOM 0 HZ PHE B 32 21.664 9.178 -37.918 1.00 0.00 H new ATOM 679 N LYS B 33 15.005 5.770 -34.896 1.00 0.00 N ATOM 680 CA LYS B 33 14.308 4.658 -34.280 1.00 0.00 C ATOM 681 C LYS B 33 15.318 3.494 -33.993 1.00 0.00 C ATOM 682 O LYS B 33 15.397 2.550 -34.814 1.00 0.00 O ATOM 683 CB LYS B 33 13.173 4.190 -35.235 1.00 0.00 C ATOM 684 CG LYS B 33 12.234 3.125 -34.602 1.00 0.00 C ATOM 685 CD LYS B 33 10.935 2.809 -35.416 1.00 0.00 C ATOM 686 CE LYS B 33 10.011 1.803 -34.709 1.00 0.00 C ATOM 687 NZ LYS B 33 8.985 1.381 -35.669 1.00 0.00 N ATOM 0 H LYS B 33 15.225 5.580 -35.874 1.00 0.00 H new ATOM 0 HA LYS B 33 13.869 4.965 -33.330 1.00 0.00 H new ATOM 0 HB2 LYS B 33 12.580 5.055 -35.534 1.00 0.00 H new ATOM 0 HB3 LYS B 33 13.617 3.779 -36.142 1.00 0.00 H new ATOM 0 HG2 LYS B 33 12.796 2.200 -34.473 1.00 0.00 H new ATOM 0 HG3 LYS B 33 11.946 3.464 -33.607 1.00 0.00 H new ATOM 0 HD2 LYS B 33 10.388 3.736 -35.590 1.00 0.00 H new ATOM 0 HD3 LYS B 33 11.213 2.414 -36.393 1.00 0.00 H new ATOM 0 HE2 LYS B 33 10.581 0.943 -34.357 1.00 0.00 H new ATOM 0 HE3 LYS B 33 9.549 2.259 -33.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 8.345 0.698 -35.215 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 8.441 2.210 -35.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 9.441 0.935 -36.491 1.00 0.00 H new ATOM 701 N ILE B 34 16.175 3.639 -33.018 1.00 0.00 N ATOM 702 CA ILE B 34 17.125 2.652 -32.486 1.00 0.00 C ATOM 703 C ILE B 34 16.535 1.714 -31.404 1.00 0.00 C ATOM 704 O ILE B 34 15.308 1.754 -31.199 1.00 0.00 O ATOM 705 CB ILE B 34 18.482 3.353 -32.087 1.00 0.00 C ATOM 706 CG1 ILE B 34 18.328 4.426 -30.967 1.00 0.00 C ATOM 707 CG2 ILE B 34 19.150 3.875 -33.426 1.00 0.00 C ATOM 708 CD1 ILE B 34 19.554 5.019 -30.511 1.00 0.00 C ATOM 0 H ILE B 34 16.246 4.526 -32.519 1.00 0.00 H new ATOM 0 HA ILE B 34 17.354 1.955 -33.292 1.00 0.00 H new ATOM 0 HB ILE B 34 19.153 2.636 -31.613 1.00 0.00 H new ATOM 0 HG12 ILE B 34 17.675 5.218 -31.333 1.00 0.00 H new ATOM 0 HG13 ILE B 34 17.826 3.968 -30.115 1.00 0.00 H new ATOM 0 HG21 ILE B 34 20.094 4.368 -33.194 1.00 0.00 H new ATOM 0 HG22 ILE B 34 19.335 3.033 -34.093 1.00 0.00 H new ATOM 0 HG23 ILE B 34 18.481 4.584 -33.914 1.00 0.00 H new ATOM 0 HD11 ILE B 34 19.337 5.751 -29.733 1.00 0.00 H new ATOM 0 HD12 ILE B 34 20.205 4.244 -30.108 1.00 0.00 H new ATOM 0 HD13 ILE B 34 20.052 5.513 -31.345 1.00 0.00 H new ATOM 720 N LYS B 35 17.375 1.032 -30.585 1.00 0.00 N ATOM 721 CA LYS B 35 16.944 0.129 -29.536 1.00 0.00 C ATOM 722 C LYS B 35 17.729 0.421 -28.304 1.00 0.00 C ATOM 723 O LYS B 35 18.788 1.049 -28.286 1.00 0.00 O ATOM 724 CB LYS B 35 16.843 -1.359 -29.927 1.00 0.00 C ATOM 725 CG LYS B 35 16.070 -1.623 -31.262 1.00 0.00 C ATOM 726 CD LYS B 35 15.917 -3.147 -31.474 1.00 0.00 C ATOM 727 CE LYS B 35 14.996 -3.385 -32.673 1.00 0.00 C ATOM 728 NZ LYS B 35 14.753 -4.803 -32.861 1.00 0.00 N ATOM 0 H LYS B 35 18.390 1.110 -30.653 1.00 0.00 H new ATOM 0 HA LYS B 35 15.893 0.331 -29.328 1.00 0.00 H new ATOM 0 HB2 LYS B 35 17.849 -1.768 -30.016 1.00 0.00 H new ATOM 0 HB3 LYS B 35 16.349 -1.902 -29.121 1.00 0.00 H new ATOM 0 HG2 LYS B 35 15.089 -1.149 -31.227 1.00 0.00 H new ATOM 0 HG3 LYS B 35 16.608 -1.180 -32.100 1.00 0.00 H new ATOM 0 HD2 LYS B 35 16.891 -3.604 -31.649 1.00 0.00 H new ATOM 0 HD3 LYS B 35 15.502 -3.613 -30.580 1.00 0.00 H new ATOM 0 HE2 LYS B 35 14.050 -2.866 -32.519 1.00 0.00 H new ATOM 0 HE3 LYS B 35 15.447 -2.966 -33.573 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 15.235 -5.126 -33.724 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 15.119 -5.329 -32.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 13.731 -4.971 -32.952 1.00 0.00 H new ATOM 742 N ARG B 36 17.196 0.102 -27.100 1.00 0.00 N ATOM 743 CA ARG B 36 17.699 0.687 -25.810 1.00 0.00 C ATOM 744 C ARG B 36 19.122 0.187 -25.544 1.00 0.00 C ATOM 745 O ARG B 36 19.873 0.832 -24.871 1.00 0.00 O ATOM 746 CB ARG B 36 16.644 0.432 -24.742 1.00 0.00 C ATOM 747 CG ARG B 36 15.310 1.229 -25.017 1.00 0.00 C ATOM 748 CD ARG B 36 14.286 1.116 -23.858 1.00 0.00 C ATOM 749 NE ARG B 36 14.855 1.673 -22.632 1.00 0.00 N ATOM 750 CZ ARG B 36 14.621 2.889 -22.207 1.00 0.00 C ATOM 751 NH1 ARG B 36 13.898 3.761 -22.831 1.00 0.00 N ATOM 752 NH2 ARG B 36 15.231 3.346 -21.165 1.00 0.00 N ATOM 0 H ARG B 36 16.422 -0.552 -26.984 1.00 0.00 H new ATOM 0 HA ARG B 36 17.820 1.770 -25.831 1.00 0.00 H new ATOM 0 HB2 ARG B 36 16.425 -0.635 -24.698 1.00 0.00 H new ATOM 0 HB3 ARG B 36 17.040 0.716 -23.767 1.00 0.00 H new ATOM 0 HG2 ARG B 36 15.549 2.280 -25.182 1.00 0.00 H new ATOM 0 HG3 ARG B 36 14.854 0.857 -25.935 1.00 0.00 H new ATOM 0 HD2 ARG B 36 13.370 1.647 -24.118 1.00 0.00 H new ATOM 0 HD3 ARG B 36 14.015 0.072 -23.701 1.00 0.00 H new ATOM 0 HE ARG B 36 15.470 1.080 -22.075 1.00 0.00 H new ATOM 0 HH11 ARG B 36 13.463 3.519 -23.721 1.00 0.00 H new ATOM 0 HH12 ARG B 36 13.763 4.690 -22.433 1.00 0.00 H new ATOM 0 HH21 ARG B 36 15.900 2.759 -20.667 1.00 0.00 H new ATOM 0 HH22 ARG B 36 15.044 4.294 -20.839 1.00 0.00 H new ATOM 766 N HIS B 37 19.448 -1.016 -26.044 1.00 0.00 N ATOM 767 CA HIS B 37 20.787 -1.661 -26.053 1.00 0.00 C ATOM 768 C HIS B 37 21.628 -1.358 -27.347 1.00 0.00 C ATOM 769 O HIS B 37 22.683 -1.950 -27.509 1.00 0.00 O ATOM 770 CB HIS B 37 20.677 -3.116 -25.919 1.00 0.00 C ATOM 771 CG HIS B 37 19.652 -3.839 -26.871 1.00 0.00 C ATOM 772 ND1 HIS B 37 18.988 -3.324 -27.935 1.00 0.00 N ATOM 773 CD2 HIS B 37 19.250 -5.184 -26.748 1.00 0.00 C ATOM 774 CE1 HIS B 37 18.321 -4.315 -28.535 1.00 0.00 C ATOM 775 NE2 HIS B 37 18.399 -5.441 -27.781 1.00 0.00 N ATOM 0 H HIS B 37 18.743 -1.609 -26.483 1.00 0.00 H new ATOM 0 HA HIS B 37 21.307 -1.229 -25.198 1.00 0.00 H new ATOM 0 HB2 HIS B 37 21.663 -3.549 -26.089 1.00 0.00 H new ATOM 0 HB3 HIS B 37 20.403 -3.343 -24.889 1.00 0.00 H new ATOM 0 HD2 HIS B 37 19.558 -5.879 -25.981 1.00 0.00 H new ATOM 0 HE1 HIS B 37 17.799 -4.232 -29.477 1.00 0.00 H new ATOM 0 HE2 HIS B 37 17.910 -6.319 -27.956 1.00 0.00 H new ATOM 783 N THR B 38 21.123 -0.654 -28.365 1.00 0.00 N ATOM 784 CA THR B 38 21.999 -0.196 -29.575 1.00 0.00 C ATOM 785 C THR B 38 23.114 0.795 -29.229 1.00 0.00 C ATOM 786 O THR B 38 22.810 1.686 -28.504 1.00 0.00 O ATOM 787 CB THR B 38 21.087 0.294 -30.702 1.00 0.00 C ATOM 788 OG1 THR B 38 20.121 -0.642 -30.983 1.00 0.00 O ATOM 789 CG2 THR B 38 21.713 0.745 -32.015 1.00 0.00 C ATOM 0 H THR B 38 20.146 -0.369 -28.426 1.00 0.00 H new ATOM 0 HA THR B 38 22.554 -1.069 -29.917 1.00 0.00 H new ATOM 0 HB THR B 38 20.691 1.214 -30.271 1.00 0.00 H new ATOM 0 HG1 THR B 38 19.546 -0.312 -31.704 1.00 0.00 H new ATOM 0 HG21 THR B 38 20.928 1.060 -32.703 1.00 0.00 H new ATOM 0 HG22 THR B 38 22.389 1.580 -31.828 1.00 0.00 H new ATOM 0 HG23 THR B 38 22.271 -0.082 -32.455 1.00 0.00 H new ATOM 797 N PRO B 39 24.339 0.603 -29.790 1.00 0.00 N ATOM 798 CA PRO B 39 25.454 1.564 -29.596 1.00 0.00 C ATOM 799 C PRO B 39 25.159 2.893 -30.223 1.00 0.00 C ATOM 800 O PRO B 39 24.669 2.966 -31.341 1.00 0.00 O ATOM 801 CB PRO B 39 26.674 0.953 -30.104 1.00 0.00 C ATOM 802 CG PRO B 39 26.218 -0.198 -30.970 1.00 0.00 C ATOM 803 CD PRO B 39 24.787 -0.435 -30.741 1.00 0.00 C ATOM 0 HA PRO B 39 25.584 1.777 -28.535 1.00 0.00 H new ATOM 0 HB2 PRO B 39 27.261 1.669 -30.679 1.00 0.00 H new ATOM 0 HB3 PRO B 39 27.307 0.604 -29.288 1.00 0.00 H new ATOM 0 HG2 PRO B 39 26.398 0.028 -32.021 1.00 0.00 H new ATOM 0 HG3 PRO B 39 26.790 -1.095 -30.734 1.00 0.00 H new ATOM 0 HD2 PRO B 39 24.229 -0.373 -31.675 1.00 0.00 H new ATOM 0 HD3 PRO B 39 24.619 -1.432 -30.335 1.00 0.00 H new ATOM 811 N LEU B 40 25.493 3.961 -29.430 1.00 0.00 N ATOM 812 CA LEU B 40 25.373 5.328 -29.930 1.00 0.00 C ATOM 813 C LEU B 40 26.396 5.686 -30.944 1.00 0.00 C ATOM 814 O LEU B 40 26.214 6.582 -31.674 1.00 0.00 O ATOM 815 CB LEU B 40 25.456 6.286 -28.634 1.00 0.00 C ATOM 816 CG LEU B 40 24.073 6.340 -27.963 1.00 0.00 C ATOM 817 CD1 LEU B 40 24.120 6.862 -26.546 1.00 0.00 C ATOM 818 CD2 LEU B 40 23.052 7.033 -28.776 1.00 0.00 C ATOM 0 H LEU B 40 25.836 3.883 -28.472 1.00 0.00 H new ATOM 0 HA LEU B 40 24.428 5.444 -30.461 1.00 0.00 H new ATOM 0 HB2 LEU B 40 26.200 5.908 -27.933 1.00 0.00 H new ATOM 0 HB3 LEU B 40 25.773 7.287 -28.926 1.00 0.00 H new ATOM 0 HG LEU B 40 23.754 5.300 -27.898 1.00 0.00 H new ATOM 0 HD11 LEU B 40 23.113 6.875 -26.129 1.00 0.00 H new ATOM 0 HD12 LEU B 40 24.755 6.215 -25.941 1.00 0.00 H new ATOM 0 HD13 LEU B 40 24.527 7.873 -26.544 1.00 0.00 H new ATOM 0 HD21 LEU B 40 22.101 7.034 -28.243 1.00 0.00 H new ATOM 0 HD22 LEU B 40 23.367 8.060 -28.958 1.00 0.00 H new ATOM 0 HD23 LEU B 40 22.933 6.516 -29.728 1.00 0.00 H new ATOM 830 N SER B 41 27.441 4.886 -31.038 1.00 0.00 N ATOM 831 CA SER B 41 28.404 4.963 -32.105 1.00 0.00 C ATOM 832 C SER B 41 27.694 4.911 -33.415 1.00 0.00 C ATOM 833 O SER B 41 27.782 5.807 -34.268 1.00 0.00 O ATOM 834 CB SER B 41 29.394 3.841 -31.932 1.00 0.00 C ATOM 835 OG SER B 41 28.890 2.517 -32.258 1.00 0.00 O ATOM 0 H SER B 41 27.643 4.152 -30.359 1.00 0.00 H new ATOM 0 HA SER B 41 28.955 5.903 -32.080 1.00 0.00 H new ATOM 0 HB2 SER B 41 30.264 4.045 -32.556 1.00 0.00 H new ATOM 0 HB3 SER B 41 29.738 3.837 -30.898 1.00 0.00 H new ATOM 0 HG SER B 41 29.598 1.854 -32.119 1.00 0.00 H new ATOM 841 N LYS B 42 26.922 3.811 -33.588 1.00 0.00 N ATOM 842 CA LYS B 42 26.227 3.454 -34.832 1.00 0.00 C ATOM 843 C LYS B 42 25.205 4.501 -35.232 1.00 0.00 C ATOM 844 O LYS B 42 25.046 4.675 -36.439 1.00 0.00 O ATOM 845 CB LYS B 42 25.634 1.987 -34.577 1.00 0.00 C ATOM 846 CG LYS B 42 26.653 0.931 -35.090 1.00 0.00 C ATOM 847 CD LYS B 42 26.255 -0.489 -34.885 1.00 0.00 C ATOM 848 CE LYS B 42 27.267 -1.487 -35.575 1.00 0.00 C ATOM 849 NZ LYS B 42 26.519 -2.850 -35.491 1.00 0.00 N ATOM 0 H LYS B 42 26.766 3.134 -32.841 1.00 0.00 H new ATOM 0 HA LYS B 42 26.891 3.433 -35.696 1.00 0.00 H new ATOM 0 HB2 LYS B 42 25.441 1.839 -33.514 1.00 0.00 H new ATOM 0 HB3 LYS B 42 24.681 1.872 -35.093 1.00 0.00 H new ATOM 0 HG2 LYS B 42 26.816 1.095 -36.155 1.00 0.00 H new ATOM 0 HG3 LYS B 42 27.608 1.099 -34.591 1.00 0.00 H new ATOM 0 HD2 LYS B 42 26.205 -0.702 -33.817 1.00 0.00 H new ATOM 0 HD3 LYS B 42 25.255 -0.648 -35.289 1.00 0.00 H new ATOM 0 HE2 LYS B 42 27.475 -1.203 -36.606 1.00 0.00 H new ATOM 0 HE3 LYS B 42 28.224 -1.518 -35.053 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 26.969 -3.533 -36.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 26.562 -3.210 -34.516 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 25.525 -2.718 -35.768 1.00 0.00 H new ATOM 863 N LEU B 43 24.547 5.181 -34.229 1.00 0.00 N ATOM 864 CA LEU B 43 23.899 6.515 -34.410 1.00 0.00 C ATOM 865 C LEU B 43 24.849 7.683 -34.888 1.00 0.00 C ATOM 866 O LEU B 43 24.504 8.403 -35.889 1.00 0.00 O ATOM 867 CB LEU B 43 23.146 6.876 -33.122 1.00 0.00 C ATOM 868 CG LEU B 43 22.403 8.239 -33.137 1.00 0.00 C ATOM 869 CD1 LEU B 43 21.258 8.141 -32.208 1.00 0.00 C ATOM 870 CD2 LEU B 43 23.262 9.334 -32.543 1.00 0.00 C ATOM 0 H LEU B 43 24.457 4.814 -33.282 1.00 0.00 H new ATOM 0 HA LEU B 43 23.207 6.411 -35.246 1.00 0.00 H new ATOM 0 HB2 LEU B 43 22.420 6.090 -32.915 1.00 0.00 H new ATOM 0 HB3 LEU B 43 23.857 6.880 -32.296 1.00 0.00 H new ATOM 0 HG LEU B 43 22.131 8.460 -34.169 1.00 0.00 H new ATOM 0 HD11 LEU B 43 20.716 9.087 -32.198 1.00 0.00 H new ATOM 0 HD12 LEU B 43 20.591 7.344 -32.536 1.00 0.00 H new ATOM 0 HD13 LEU B 43 21.622 7.920 -31.204 1.00 0.00 H new ATOM 0 HD21 LEU B 43 22.717 10.277 -32.566 1.00 0.00 H new ATOM 0 HD22 LEU B 43 23.509 9.083 -31.511 1.00 0.00 H new ATOM 0 HD23 LEU B 43 24.180 9.431 -33.123 1.00 0.00 H new ATOM 882 N MET B 44 25.929 7.913 -34.185 1.00 0.00 N ATOM 883 CA MET B 44 26.772 9.079 -34.360 1.00 0.00 C ATOM 884 C MET B 44 27.462 9.110 -35.691 1.00 0.00 C ATOM 885 O MET B 44 27.723 10.135 -36.357 1.00 0.00 O ATOM 886 CB MET B 44 27.718 9.239 -33.168 1.00 0.00 C ATOM 887 CG MET B 44 26.981 9.768 -32.000 1.00 0.00 C ATOM 888 SD MET B 44 28.041 10.173 -30.531 1.00 0.00 S ATOM 889 CE MET B 44 28.241 8.404 -30.117 1.00 0.00 C ATOM 0 H MET B 44 26.259 7.281 -33.455 1.00 0.00 H new ATOM 0 HA MET B 44 26.129 9.959 -34.376 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.167 8.278 -32.919 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.533 9.914 -33.429 1.00 0.00 H new ATOM 0 HG2 MET B 44 26.445 10.667 -32.303 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.231 9.036 -31.699 1.00 0.00 H new ATOM 0 HE1 MET B 44 28.804 8.309 -29.189 1.00 0.00 H new ATOM 0 HE2 MET B 44 27.260 7.946 -29.994 1.00 0.00 H new ATOM 0 HE3 MET B 44 28.778 7.901 -30.921 1.00 0.00 H new ATOM 899 N LYS B 45 27.711 7.961 -36.319 1.00 0.00 N ATOM 900 CA LYS B 45 28.276 7.809 -37.735 1.00 0.00 C ATOM 901 C LYS B 45 27.240 7.965 -38.885 1.00 0.00 C ATOM 902 O LYS B 45 27.519 8.633 -39.885 1.00 0.00 O ATOM 903 CB LYS B 45 28.908 6.389 -37.871 1.00 0.00 C ATOM 904 CG LYS B 45 30.179 6.238 -37.037 1.00 0.00 C ATOM 905 CD LYS B 45 30.863 4.858 -37.239 1.00 0.00 C ATOM 906 CE LYS B 45 29.953 3.796 -36.571 1.00 0.00 C ATOM 907 NZ LYS B 45 30.344 2.456 -37.028 1.00 0.00 N ATOM 0 H LYS B 45 27.533 7.060 -35.876 1.00 0.00 H new ATOM 0 HA LYS B 45 28.995 8.621 -37.847 1.00 0.00 H new ATOM 0 HB2 LYS B 45 28.181 5.639 -37.560 1.00 0.00 H new ATOM 0 HB3 LYS B 45 29.138 6.195 -38.919 1.00 0.00 H new ATOM 0 HG2 LYS B 45 30.880 7.030 -37.302 1.00 0.00 H new ATOM 0 HG3 LYS B 45 29.935 6.368 -35.983 1.00 0.00 H new ATOM 0 HD2 LYS B 45 30.991 4.643 -38.300 1.00 0.00 H new ATOM 0 HD3 LYS B 45 31.856 4.851 -36.790 1.00 0.00 H new ATOM 0 HE2 LYS B 45 30.037 3.860 -35.486 1.00 0.00 H new ATOM 0 HE3 LYS B 45 28.909 3.987 -36.822 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 29.733 1.744 -36.579 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 30.242 2.398 -38.061 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 31.335 2.276 -36.767 1.00 0.00 H new ATOM 921 N ALA B 46 26.064 7.419 -38.649 1.00 0.00 N ATOM 922 CA ALA B 46 24.907 7.482 -39.562 1.00 0.00 C ATOM 923 C ALA B 46 24.462 8.929 -39.589 1.00 0.00 C ATOM 924 O ALA B 46 23.901 9.356 -40.613 1.00 0.00 O ATOM 925 CB ALA B 46 23.829 6.531 -39.102 1.00 0.00 C ATOM 0 H ALA B 46 25.866 6.900 -37.794 1.00 0.00 H new ATOM 0 HA ALA B 46 25.157 7.166 -40.575 1.00 0.00 H new ATOM 0 HB1 ALA B 46 22.980 6.586 -39.783 1.00 0.00 H new ATOM 0 HB2 ALA B 46 24.221 5.514 -39.092 1.00 0.00 H new ATOM 0 HB3 ALA B 46 23.506 6.805 -38.098 1.00 0.00 H new ATOM 931 N TYR B 47 24.601 9.749 -38.518 1.00 0.00 N ATOM 932 CA TYR B 47 24.388 11.226 -38.555 1.00 0.00 C ATOM 933 C TYR B 47 25.554 12.072 -39.073 1.00 0.00 C ATOM 934 O TYR B 47 25.385 13.032 -39.811 1.00 0.00 O ATOM 935 CB TYR B 47 23.891 11.801 -37.229 1.00 0.00 C ATOM 936 CG TYR B 47 23.581 13.294 -37.309 1.00 0.00 C ATOM 937 CD1 TYR B 47 22.312 13.772 -37.814 1.00 0.00 C ATOM 938 CD2 TYR B 47 24.518 14.280 -36.932 1.00 0.00 C ATOM 939 CE1 TYR B 47 22.032 15.129 -37.781 1.00 0.00 C ATOM 940 CE2 TYR B 47 24.221 15.644 -36.900 1.00 0.00 C ATOM 941 CZ TYR B 47 22.979 16.091 -37.395 1.00 0.00 C ATOM 942 OH TYR B 47 22.682 17.404 -37.171 1.00 0.00 O ATOM 0 H TYR B 47 24.866 9.406 -37.595 1.00 0.00 H new ATOM 0 HA TYR B 47 23.603 11.308 -39.306 1.00 0.00 H new ATOM 0 HB2 TYR B 47 22.994 11.265 -36.919 1.00 0.00 H new ATOM 0 HB3 TYR B 47 24.645 11.632 -36.460 1.00 0.00 H new ATOM 0 HD1 TYR B 47 21.589 13.077 -38.214 1.00 0.00 H new ATOM 0 HD2 TYR B 47 25.513 13.964 -36.655 1.00 0.00 H new ATOM 0 HE1 TYR B 47 21.044 15.460 -38.064 1.00 0.00 H new ATOM 0 HE2 TYR B 47 24.935 16.349 -36.500 1.00 0.00 H new ATOM 0 HH TYR B 47 23.496 17.884 -36.912 1.00 0.00 H new ATOM 952 N CYS B 48 26.817 11.591 -38.846 1.00 0.00 N ATOM 953 CA CYS B 48 28.055 12.202 -39.372 1.00 0.00 C ATOM 954 C CYS B 48 28.167 12.078 -40.910 1.00 0.00 C ATOM 955 O CYS B 48 28.535 13.119 -41.476 1.00 0.00 O ATOM 956 CB CYS B 48 29.224 11.612 -38.615 1.00 0.00 C ATOM 957 SG CYS B 48 30.840 12.398 -38.988 1.00 0.00 S ATOM 0 H CYS B 48 26.992 10.758 -38.284 1.00 0.00 H new ATOM 0 HA CYS B 48 28.046 13.279 -39.204 1.00 0.00 H new ATOM 0 HB2 CYS B 48 29.030 11.698 -37.546 1.00 0.00 H new ATOM 0 HB3 CYS B 48 29.290 10.548 -38.843 1.00 0.00 H new ATOM 0 HG CYS B 48 31.071 12.331 -40.266 1.00 0.00 H new ATOM 963 N GLU B 49 27.840 10.942 -41.558 1.00 0.00 N ATOM 964 CA GLU B 49 27.642 10.788 -43.001 1.00 0.00 C ATOM 965 C GLU B 49 26.448 11.624 -43.675 1.00 0.00 C ATOM 966 O GLU B 49 26.599 12.165 -44.755 1.00 0.00 O ATOM 967 CB GLU B 49 27.456 9.264 -43.197 1.00 0.00 C ATOM 968 CG GLU B 49 28.646 8.354 -43.073 1.00 0.00 C ATOM 969 CD GLU B 49 29.702 8.657 -44.083 1.00 0.00 C ATOM 970 OE1 GLU B 49 29.475 9.444 -45.060 1.00 0.00 O ATOM 971 OE2 GLU B 49 30.871 8.347 -43.812 1.00 0.00 O ATOM 0 H GLU B 49 27.701 10.065 -41.056 1.00 0.00 H new ATOM 0 HA GLU B 49 28.502 11.212 -43.519 1.00 0.00 H new ATOM 0 HB2 GLU B 49 26.712 8.930 -42.474 1.00 0.00 H new ATOM 0 HB3 GLU B 49 27.029 9.111 -44.188 1.00 0.00 H new ATOM 0 HG2 GLU B 49 29.067 8.446 -42.072 1.00 0.00 H new ATOM 0 HG3 GLU B 49 28.322 7.320 -43.189 1.00 0.00 H new ATOM 978 N ARG B 50 25.352 11.604 -42.935 1.00 0.00 N ATOM 979 CA ARG B 50 24.196 12.485 -43.225 1.00 0.00 C ATOM 980 C ARG B 50 24.552 13.954 -43.392 1.00 0.00 C ATOM 981 O ARG B 50 24.204 14.518 -44.442 1.00 0.00 O ATOM 982 CB ARG B 50 23.096 12.293 -42.198 1.00 0.00 C ATOM 983 CG ARG B 50 22.234 11.118 -42.711 1.00 0.00 C ATOM 984 CD ARG B 50 21.036 10.691 -41.770 1.00 0.00 C ATOM 985 NE ARG B 50 20.224 9.699 -42.522 1.00 0.00 N ATOM 986 CZ ARG B 50 19.059 9.907 -43.063 1.00 0.00 C ATOM 987 NH1 ARG B 50 18.508 11.037 -43.194 1.00 0.00 N ATOM 988 NH2 ARG B 50 18.399 8.911 -43.536 1.00 0.00 N ATOM 0 H ARG B 50 25.223 10.994 -42.127 1.00 0.00 H new ATOM 0 HA ARG B 50 23.826 12.171 -44.201 1.00 0.00 H new ATOM 0 HB2 ARG B 50 23.514 12.071 -41.216 1.00 0.00 H new ATOM 0 HB3 ARG B 50 22.498 13.198 -42.093 1.00 0.00 H new ATOM 0 HG2 ARG B 50 21.829 11.386 -43.687 1.00 0.00 H new ATOM 0 HG3 ARG B 50 22.881 10.254 -42.861 1.00 0.00 H new ATOM 0 HD2 ARG B 50 21.410 10.259 -40.842 1.00 0.00 H new ATOM 0 HD3 ARG B 50 20.432 11.557 -41.498 1.00 0.00 H new ATOM 0 HE ARG B 50 20.618 8.764 -42.624 1.00 0.00 H new ATOM 0 HH11 ARG B 50 18.982 11.877 -42.862 1.00 0.00 H new ATOM 0 HH12 ARG B 50 17.589 11.109 -43.632 1.00 0.00 H new ATOM 0 HH21 ARG B 50 18.789 7.970 -43.485 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.485 9.061 -43.962 1.00 0.00 H new ATOM 1002 N GLN B 51 25.255 14.541 -42.435 1.00 0.00 N ATOM 1003 CA GLN B 51 25.953 15.812 -42.619 1.00 0.00 C ATOM 1004 C GLN B 51 27.133 15.809 -43.594 1.00 0.00 C ATOM 1005 O GLN B 51 27.753 16.826 -43.788 1.00 0.00 O ATOM 1006 CB GLN B 51 26.479 16.293 -41.230 1.00 0.00 C ATOM 1007 CG GLN B 51 25.454 16.572 -40.061 1.00 0.00 C ATOM 1008 CD GLN B 51 24.245 17.360 -40.496 1.00 0.00 C ATOM 1009 OE1 GLN B 51 23.241 16.746 -40.791 1.00 0.00 O ATOM 1010 NE2 GLN B 51 24.378 18.662 -40.603 1.00 0.00 N ATOM 0 H GLN B 51 25.360 14.148 -41.500 1.00 0.00 H new ATOM 0 HA GLN B 51 25.211 16.475 -43.065 1.00 0.00 H new ATOM 0 HB2 GLN B 51 27.186 15.544 -40.872 1.00 0.00 H new ATOM 0 HB3 GLN B 51 27.043 17.211 -41.395 1.00 0.00 H new ATOM 0 HG2 GLN B 51 25.126 15.621 -39.641 1.00 0.00 H new ATOM 0 HG3 GLN B 51 25.963 17.114 -39.264 1.00 0.00 H new ATOM 0 HE21 GLN B 51 25.255 19.109 -40.335 1.00 0.00 H new ATOM 0 HE22 GLN B 51 23.605 19.226 -40.954 1.00 0.00 H new ATOM 1019 N GLY B 52 27.582 14.730 -44.178 1.00 0.00 N ATOM 1020 CA GLY B 52 28.730 14.709 -45.146 1.00 0.00 C ATOM 1021 C GLY B 52 30.090 14.969 -44.575 1.00 0.00 C ATOM 1022 O GLY B 52 31.007 15.398 -45.246 1.00 0.00 O ATOM 0 H GLY B 52 27.177 13.808 -44.015 1.00 0.00 H new ATOM 0 HA2 GLY B 52 28.746 13.735 -45.635 1.00 0.00 H new ATOM 0 HA3 GLY B 52 28.537 15.452 -45.920 1.00 0.00 H new ATOM 1026 N LEU B 53 30.295 14.820 -43.265 1.00 0.00 N ATOM 1027 CA LEU B 53 31.552 15.039 -42.526 1.00 0.00 C ATOM 1028 C LEU B 53 32.361 13.763 -42.126 1.00 0.00 C ATOM 1029 O LEU B 53 31.891 12.644 -42.312 1.00 0.00 O ATOM 1030 CB LEU B 53 31.171 15.907 -41.347 1.00 0.00 C ATOM 1031 CG LEU B 53 30.634 17.266 -41.745 1.00 0.00 C ATOM 1032 CD1 LEU B 53 30.378 18.136 -40.452 1.00 0.00 C ATOM 1033 CD2 LEU B 53 31.650 17.997 -42.639 1.00 0.00 C ATOM 0 H LEU B 53 29.541 14.524 -42.646 1.00 0.00 H new ATOM 0 HA LEU B 53 32.275 15.521 -43.184 1.00 0.00 H new ATOM 0 HB2 LEU B 53 30.419 15.388 -40.752 1.00 0.00 H new ATOM 0 HB3 LEU B 53 32.044 16.043 -40.709 1.00 0.00 H new ATOM 0 HG LEU B 53 29.702 17.125 -42.292 1.00 0.00 H new ATOM 0 HD11 LEU B 53 29.992 19.113 -40.742 1.00 0.00 H new ATOM 0 HD12 LEU B 53 29.652 17.633 -39.813 1.00 0.00 H new ATOM 0 HD13 LEU B 53 31.314 18.263 -39.908 1.00 0.00 H new ATOM 0 HD21 LEU B 53 31.253 18.973 -42.919 1.00 0.00 H new ATOM 0 HD22 LEU B 53 32.585 18.128 -42.095 1.00 0.00 H new ATOM 0 HD23 LEU B 53 31.833 17.409 -43.538 1.00 0.00 H new ATOM 1045 N SER B 54 33.551 14.033 -41.559 1.00 0.00 N ATOM 1046 CA SER B 54 34.205 13.071 -40.607 1.00 0.00 C ATOM 1047 C SER B 54 33.830 13.427 -39.096 1.00 0.00 C ATOM 1048 O SER B 54 33.624 14.601 -38.825 1.00 0.00 O ATOM 1049 CB SER B 54 35.728 13.116 -40.836 1.00 0.00 C ATOM 1050 OG SER B 54 36.385 12.627 -39.726 1.00 0.00 O ATOM 0 H SER B 54 34.083 14.887 -41.728 1.00 0.00 H new ATOM 0 HA SER B 54 33.844 12.060 -40.793 1.00 0.00 H new ATOM 0 HB2 SER B 54 35.990 12.525 -41.714 1.00 0.00 H new ATOM 0 HB3 SER B 54 36.044 14.140 -41.035 1.00 0.00 H new ATOM 0 HG SER B 54 37.353 12.657 -39.879 1.00 0.00 H new ATOM 1056 N MET B 55 33.772 12.444 -38.200 1.00 0.00 N ATOM 1057 CA MET B 55 33.315 12.622 -36.786 1.00 0.00 C ATOM 1058 C MET B 55 34.267 13.585 -36.020 1.00 0.00 C ATOM 1059 O MET B 55 33.932 14.251 -35.028 1.00 0.00 O ATOM 1060 CB MET B 55 33.412 11.267 -36.148 1.00 0.00 C ATOM 1061 CG MET B 55 32.575 11.148 -34.837 1.00 0.00 C ATOM 1062 SD MET B 55 31.923 9.450 -34.554 1.00 0.00 S ATOM 1063 CE MET B 55 31.435 9.689 -32.775 1.00 0.00 C ATOM 0 H MET B 55 34.040 11.484 -38.418 1.00 0.00 H new ATOM 0 HA MET B 55 32.307 13.036 -36.758 1.00 0.00 H new ATOM 0 HB2 MET B 55 33.074 10.512 -36.858 1.00 0.00 H new ATOM 0 HB3 MET B 55 34.457 11.050 -35.926 1.00 0.00 H new ATOM 0 HG2 MET B 55 33.194 11.440 -33.989 1.00 0.00 H new ATOM 0 HG3 MET B 55 31.742 11.849 -34.879 1.00 0.00 H new ATOM 0 HE1 MET B 55 31.089 8.741 -32.362 1.00 0.00 H new ATOM 0 HE2 MET B 55 32.296 10.040 -32.206 1.00 0.00 H new ATOM 0 HE3 MET B 55 30.634 10.426 -32.713 1.00 0.00 H new ATOM 1073 N ARG B 56 35.537 13.652 -36.401 1.00 0.00 N ATOM 1074 CA ARG B 56 36.604 14.540 -35.941 1.00 0.00 C ATOM 1075 C ARG B 56 36.237 16.026 -35.970 1.00 0.00 C ATOM 1076 O ARG B 56 36.619 16.771 -35.055 1.00 0.00 O ATOM 1077 CB ARG B 56 37.983 14.144 -36.554 1.00 0.00 C ATOM 1078 CG ARG B 56 39.137 14.320 -35.543 1.00 0.00 C ATOM 1079 CD ARG B 56 40.510 13.862 -36.036 1.00 0.00 C ATOM 1080 NE ARG B 56 41.492 14.631 -35.303 1.00 0.00 N ATOM 1081 CZ ARG B 56 42.062 14.308 -34.094 1.00 0.00 C ATOM 1082 NH1 ARG B 56 41.951 13.130 -33.594 1.00 0.00 N ATOM 1083 NH2 ARG B 56 42.702 15.191 -33.431 1.00 0.00 N ATOM 0 H ARG B 56 35.885 13.016 -37.119 1.00 0.00 H new ATOM 0 HA ARG B 56 36.730 14.378 -34.870 1.00 0.00 H new ATOM 0 HB2 ARG B 56 37.947 13.107 -36.887 1.00 0.00 H new ATOM 0 HB3 ARG B 56 38.177 14.755 -37.436 1.00 0.00 H new ATOM 0 HG2 ARG B 56 39.200 15.373 -35.268 1.00 0.00 H new ATOM 0 HG3 ARG B 56 38.892 13.768 -34.636 1.00 0.00 H new ATOM 0 HD2 ARG B 56 40.647 12.794 -35.864 1.00 0.00 H new ATOM 0 HD3 ARG B 56 40.611 14.027 -37.109 1.00 0.00 H new ATOM 0 HE ARG B 56 41.794 15.507 -35.729 1.00 0.00 H new ATOM 0 HH11 ARG B 56 41.431 12.410 -34.096 1.00 0.00 H new ATOM 0 HH12 ARG B 56 42.383 12.915 -32.695 1.00 0.00 H new ATOM 0 HH21 ARG B 56 42.791 16.139 -33.798 1.00 0.00 H new ATOM 0 HH22 ARG B 56 43.124 14.949 -32.534 1.00 0.00 H new ATOM 1097 N GLN B 57 35.461 16.451 -36.951 1.00 0.00 N ATOM 1098 CA GLN B 57 35.077 17.873 -37.042 1.00 0.00 C ATOM 1099 C GLN B 57 34.000 18.261 -36.065 1.00 0.00 C ATOM 1100 O GLN B 57 33.853 19.473 -35.777 1.00 0.00 O ATOM 1101 CB GLN B 57 34.701 18.153 -38.474 1.00 0.00 C ATOM 1102 CG GLN B 57 34.223 19.592 -38.727 1.00 0.00 C ATOM 1103 CD GLN B 57 34.220 19.933 -40.229 1.00 0.00 C ATOM 1104 OE1 GLN B 57 34.587 19.139 -41.092 1.00 0.00 O ATOM 1105 NE2 GLN B 57 33.834 21.151 -40.571 1.00 0.00 N ATOM 0 H GLN B 57 35.084 15.856 -37.689 1.00 0.00 H new ATOM 0 HA GLN B 57 35.923 18.497 -36.754 1.00 0.00 H new ATOM 0 HB2 GLN B 57 35.562 17.950 -39.111 1.00 0.00 H new ATOM 0 HB3 GLN B 57 33.913 17.462 -38.773 1.00 0.00 H new ATOM 0 HG2 GLN B 57 33.219 19.719 -38.323 1.00 0.00 H new ATOM 0 HG3 GLN B 57 34.871 20.290 -38.196 1.00 0.00 H new ATOM 0 HE21 GLN B 57 33.529 21.810 -39.854 1.00 0.00 H new ATOM 0 HE22 GLN B 57 33.841 21.432 -41.552 1.00 0.00 H new ATOM 1114 N ILE B 58 33.244 17.338 -35.462 1.00 0.00 N ATOM 1115 CA ILE B 58 32.022 17.556 -34.746 1.00 0.00 C ATOM 1116 C ILE B 58 31.988 16.952 -33.334 1.00 0.00 C ATOM 1117 O ILE B 58 32.821 16.095 -33.116 1.00 0.00 O ATOM 1118 CB ILE B 58 30.817 17.103 -35.616 1.00 0.00 C ATOM 1119 CG1 ILE B 58 30.645 15.617 -35.737 1.00 0.00 C ATOM 1120 CG2 ILE B 58 30.883 17.882 -36.992 1.00 0.00 C ATOM 1121 CD1 ILE B 58 29.366 15.215 -36.527 1.00 0.00 C ATOM 0 H ILE B 58 33.506 16.352 -35.473 1.00 0.00 H new ATOM 0 HA ILE B 58 31.951 18.629 -34.566 1.00 0.00 H new ATOM 0 HB ILE B 58 29.894 17.374 -35.103 1.00 0.00 H new ATOM 0 HG12 ILE B 58 31.519 15.195 -36.233 1.00 0.00 H new ATOM 0 HG13 ILE B 58 30.602 15.179 -34.740 1.00 0.00 H new ATOM 0 HG21 ILE B 58 30.046 17.580 -37.621 1.00 0.00 H new ATOM 0 HG22 ILE B 58 30.829 18.955 -36.806 1.00 0.00 H new ATOM 0 HG23 ILE B 58 31.820 17.648 -37.498 1.00 0.00 H new ATOM 0 HD11 ILE B 58 29.298 14.128 -36.580 1.00 0.00 H new ATOM 0 HD12 ILE B 58 28.486 15.610 -36.019 1.00 0.00 H new ATOM 0 HD13 ILE B 58 29.417 15.625 -37.536 1.00 0.00 H new ATOM 1133 N ARG B 59 31.077 17.277 -32.454 1.00 0.00 N ATOM 1134 CA ARG B 59 30.820 16.721 -31.181 1.00 0.00 C ATOM 1135 C ARG B 59 29.306 16.680 -30.948 1.00 0.00 C ATOM 1136 O ARG B 59 28.606 17.639 -31.259 1.00 0.00 O ATOM 1137 CB ARG B 59 31.465 17.555 -30.053 1.00 0.00 C ATOM 1138 CG ARG B 59 33.012 17.477 -30.196 1.00 0.00 C ATOM 1139 CD ARG B 59 33.578 16.052 -30.016 1.00 0.00 C ATOM 1140 NE ARG B 59 35.053 16.028 -30.041 1.00 0.00 N ATOM 1141 CZ ARG B 59 35.850 16.241 -31.045 1.00 0.00 C ATOM 1142 NH1 ARG B 59 35.507 16.373 -32.283 1.00 0.00 N ATOM 1143 NH2 ARG B 59 37.117 16.338 -30.828 1.00 0.00 N ATOM 0 H ARG B 59 30.424 18.035 -32.654 1.00 0.00 H new ATOM 0 HA ARG B 59 31.249 15.719 -31.161 1.00 0.00 H new ATOM 0 HB2 ARG B 59 31.132 18.591 -30.112 1.00 0.00 H new ATOM 0 HB3 ARG B 59 31.156 17.176 -29.079 1.00 0.00 H new ATOM 0 HG2 ARG B 59 33.297 17.851 -31.180 1.00 0.00 H new ATOM 0 HG3 ARG B 59 33.470 18.137 -29.459 1.00 0.00 H new ATOM 0 HD2 ARG B 59 33.226 15.641 -29.070 1.00 0.00 H new ATOM 0 HD3 ARG B 59 33.193 15.408 -30.807 1.00 0.00 H new ATOM 0 HE ARG B 59 35.507 15.816 -29.153 1.00 0.00 H new ATOM 0 HH11 ARG B 59 34.524 16.312 -32.549 1.00 0.00 H new ATOM 0 HH12 ARG B 59 36.219 16.538 -32.995 1.00 0.00 H new ATOM 0 HH21 ARG B 59 37.480 16.248 -29.879 1.00 0.00 H new ATOM 0 HH22 ARG B 59 37.756 16.505 -31.605 1.00 0.00 H new ATOM 1157 N PHE B 60 28.830 15.584 -30.272 1.00 0.00 N ATOM 1158 CA PHE B 60 27.436 15.399 -29.865 1.00 0.00 C ATOM 1159 C PHE B 60 27.286 15.590 -28.360 1.00 0.00 C ATOM 1160 O PHE B 60 28.011 15.007 -27.597 1.00 0.00 O ATOM 1161 CB PHE B 60 27.121 13.914 -30.252 1.00 0.00 C ATOM 1162 CG PHE B 60 27.223 13.530 -31.706 1.00 0.00 C ATOM 1163 CD1 PHE B 60 28.452 13.105 -32.272 1.00 0.00 C ATOM 1164 CD2 PHE B 60 26.058 13.479 -32.480 1.00 0.00 C ATOM 1165 CE1 PHE B 60 28.457 12.720 -33.564 1.00 0.00 C ATOM 1166 CE2 PHE B 60 26.011 13.123 -33.806 1.00 0.00 C ATOM 1167 CZ PHE B 60 27.269 12.750 -34.358 1.00 0.00 C ATOM 0 H PHE B 60 29.431 14.805 -30.001 1.00 0.00 H new ATOM 0 HA PHE B 60 26.765 16.115 -30.340 1.00 0.00 H new ATOM 0 HB2 PHE B 60 27.796 13.270 -29.687 1.00 0.00 H new ATOM 0 HB3 PHE B 60 26.109 13.688 -29.916 1.00 0.00 H new ATOM 0 HD1 PHE B 60 29.358 13.090 -31.685 1.00 0.00 H new ATOM 0 HD2 PHE B 60 25.127 13.739 -31.999 1.00 0.00 H new ATOM 0 HE1 PHE B 60 29.381 12.381 -34.010 1.00 0.00 H new ATOM 0 HE2 PHE B 60 25.097 13.126 -34.381 1.00 0.00 H new ATOM 0 HZ PHE B 60 27.327 12.483 -35.403 1.00 0.00 H new ATOM 1177 N ARG B 61 26.263 16.265 -27.840 1.00 0.00 N ATOM 1178 CA ARG B 61 25.910 16.400 -26.392 1.00 0.00 C ATOM 1179 C ARG B 61 24.534 15.948 -26.024 1.00 0.00 C ATOM 1180 O ARG B 61 23.614 16.145 -26.854 1.00 0.00 O ATOM 1181 CB ARG B 61 26.165 17.818 -25.862 1.00 0.00 C ATOM 1182 CG ARG B 61 27.617 18.174 -26.162 1.00 0.00 C ATOM 1183 CD ARG B 61 27.923 19.567 -25.565 1.00 0.00 C ATOM 1184 NE ARG B 61 29.106 20.197 -26.131 1.00 0.00 N ATOM 1185 CZ ARG B 61 29.357 21.437 -25.836 1.00 0.00 C ATOM 1186 NH1 ARG B 61 28.517 22.299 -25.284 1.00 0.00 N ATOM 1187 NH2 ARG B 61 30.500 21.939 -26.183 1.00 0.00 N ATOM 0 H ARG B 61 25.608 16.769 -28.437 1.00 0.00 H new ATOM 0 HA ARG B 61 26.590 15.704 -25.899 1.00 0.00 H new ATOM 0 HB2 ARG B 61 25.491 18.530 -26.338 1.00 0.00 H new ATOM 0 HB3 ARG B 61 25.974 17.865 -24.790 1.00 0.00 H new ATOM 0 HG2 ARG B 61 28.285 17.426 -25.735 1.00 0.00 H new ATOM 0 HG3 ARG B 61 27.790 18.179 -27.238 1.00 0.00 H new ATOM 0 HD2 ARG B 61 27.064 20.218 -25.725 1.00 0.00 H new ATOM 0 HD3 ARG B 61 28.054 19.470 -24.487 1.00 0.00 H new ATOM 0 HE ARG B 61 29.727 19.674 -26.748 1.00 0.00 H new ATOM 0 HH11 ARG B 61 27.568 22.007 -25.049 1.00 0.00 H new ATOM 0 HH12 ARG B 61 28.819 23.255 -25.094 1.00 0.00 H new ATOM 0 HH21 ARG B 61 31.181 21.363 -26.677 1.00 0.00 H new ATOM 0 HH22 ARG B 61 30.719 22.910 -25.962 1.00 0.00 H new ATOM 1201 N PHE B 62 24.370 15.439 -24.830 1.00 0.00 N ATOM 1202 CA PHE B 62 23.032 15.182 -24.156 1.00 0.00 C ATOM 1203 C PHE B 62 23.012 15.576 -22.615 1.00 0.00 C ATOM 1204 O PHE B 62 23.957 15.264 -21.902 1.00 0.00 O ATOM 1205 CB PHE B 62 22.793 13.595 -24.311 1.00 0.00 C ATOM 1206 CG PHE B 62 21.647 13.067 -23.504 1.00 0.00 C ATOM 1207 CD1 PHE B 62 20.344 13.311 -23.934 1.00 0.00 C ATOM 1208 CD2 PHE B 62 21.815 12.248 -22.337 1.00 0.00 C ATOM 1209 CE1 PHE B 62 19.243 12.801 -23.230 1.00 0.00 C ATOM 1210 CE2 PHE B 62 20.699 11.770 -21.631 1.00 0.00 C ATOM 1211 CZ PHE B 62 19.421 12.034 -22.042 1.00 0.00 C ATOM 0 H PHE B 62 25.161 15.169 -24.245 1.00 0.00 H new ATOM 0 HA PHE B 62 22.257 15.793 -24.618 1.00 0.00 H new ATOM 0 HB2 PHE B 62 22.619 13.366 -25.362 1.00 0.00 H new ATOM 0 HB3 PHE B 62 23.702 13.071 -24.017 1.00 0.00 H new ATOM 0 HD1 PHE B 62 20.179 13.902 -24.823 1.00 0.00 H new ATOM 0 HD2 PHE B 62 22.809 11.997 -21.999 1.00 0.00 H new ATOM 0 HE1 PHE B 62 18.244 12.993 -23.594 1.00 0.00 H new ATOM 0 HE2 PHE B 62 20.854 11.179 -20.741 1.00 0.00 H new ATOM 0 HZ PHE B 62 18.571 11.672 -21.482 1.00 0.00 H new ATOM 1221 N ASP B 63 21.953 16.242 -22.224 1.00 0.00 N ATOM 1222 CA ASP B 63 21.923 16.946 -20.960 1.00 0.00 C ATOM 1223 C ASP B 63 23.150 17.864 -20.703 1.00 0.00 C ATOM 1224 O ASP B 63 23.811 17.736 -19.631 1.00 0.00 O ATOM 1225 CB ASP B 63 21.566 15.990 -19.793 1.00 0.00 C ATOM 1226 CG ASP B 63 20.979 16.822 -18.569 1.00 0.00 C ATOM 1227 OD1 ASP B 63 20.878 18.074 -18.703 1.00 0.00 O ATOM 1228 OD2 ASP B 63 20.658 16.230 -17.489 1.00 0.00 O ATOM 0 H ASP B 63 21.092 16.313 -22.767 1.00 0.00 H new ATOM 0 HA ASP B 63 21.107 17.666 -21.023 1.00 0.00 H new ATOM 0 HB2 ASP B 63 20.835 15.253 -20.126 1.00 0.00 H new ATOM 0 HB3 ASP B 63 22.453 15.440 -19.478 1.00 0.00 H new ATOM 1233 N GLY B 64 23.606 18.491 -21.769 1.00 0.00 N ATOM 1234 CA GLY B 64 24.940 19.096 -21.854 1.00 0.00 C ATOM 1235 C GLY B 64 26.193 18.235 -21.831 1.00 0.00 C ATOM 1236 O GLY B 64 27.293 18.829 -21.850 1.00 0.00 O ATOM 0 H GLY B 64 23.057 18.602 -22.622 1.00 0.00 H new ATOM 0 HA2 GLY B 64 24.969 19.677 -22.776 1.00 0.00 H new ATOM 0 HA3 GLY B 64 25.023 19.803 -21.029 1.00 0.00 H new ATOM 1240 N GLN B 65 26.156 16.908 -21.702 1.00 0.00 N ATOM 1241 CA GLN B 65 27.309 15.992 -21.513 1.00 0.00 C ATOM 1242 C GLN B 65 27.702 15.298 -22.795 1.00 0.00 C ATOM 1243 O GLN B 65 26.870 14.685 -23.386 1.00 0.00 O ATOM 1244 CB GLN B 65 27.188 15.055 -20.267 1.00 0.00 C ATOM 1245 CG GLN B 65 26.812 15.807 -19.003 1.00 0.00 C ATOM 1246 CD GLN B 65 27.330 17.185 -18.719 1.00 0.00 C ATOM 1247 OE1 GLN B 65 28.517 17.395 -18.556 1.00 0.00 O ATOM 1248 NE2 GLN B 65 26.538 18.196 -18.696 1.00 0.00 N ATOM 0 H GLN B 65 25.271 16.401 -21.727 1.00 0.00 H new ATOM 0 HA GLN B 65 28.159 16.624 -21.256 1.00 0.00 H new ATOM 0 HB2 GLN B 65 26.439 14.288 -20.465 1.00 0.00 H new ATOM 0 HB3 GLN B 65 28.136 14.541 -20.111 1.00 0.00 H new ATOM 0 HG2 GLN B 65 25.724 15.870 -18.985 1.00 0.00 H new ATOM 0 HG3 GLN B 65 27.109 15.179 -18.163 1.00 0.00 H new ATOM 0 HE21 GLN B 65 25.536 18.062 -18.829 1.00 0.00 H new ATOM 0 HE22 GLN B 65 26.911 19.133 -18.545 1.00 0.00 H new ATOM 1257 N PRO B 66 28.977 15.316 -23.307 1.00 0.00 N ATOM 1258 CA PRO B 66 29.335 14.615 -24.569 1.00 0.00 C ATOM 1259 C PRO B 66 29.093 13.187 -24.373 1.00 0.00 C ATOM 1260 O PRO B 66 29.620 12.574 -23.427 1.00 0.00 O ATOM 1261 CB PRO B 66 30.834 14.926 -24.861 1.00 0.00 C ATOM 1262 CG PRO B 66 31.043 16.247 -24.041 1.00 0.00 C ATOM 1263 CD PRO B 66 30.165 16.006 -22.850 1.00 0.00 C ATOM 0 HA PRO B 66 28.740 14.943 -25.421 1.00 0.00 H new ATOM 0 HB2 PRO B 66 31.492 14.125 -24.524 1.00 0.00 H new ATOM 0 HB3 PRO B 66 31.024 15.069 -25.925 1.00 0.00 H new ATOM 0 HG2 PRO B 66 32.086 16.393 -23.758 1.00 0.00 H new ATOM 0 HG3 PRO B 66 30.738 17.130 -24.602 1.00 0.00 H new ATOM 0 HD2 PRO B 66 30.689 15.410 -22.103 1.00 0.00 H new ATOM 0 HD3 PRO B 66 29.899 16.950 -22.374 1.00 0.00 H new ATOM 1271 N ILE B 67 28.327 12.545 -25.229 1.00 0.00 N ATOM 1272 CA ILE B 67 28.123 11.072 -25.320 1.00 0.00 C ATOM 1273 C ILE B 67 29.407 10.433 -25.762 1.00 0.00 C ATOM 1274 O ILE B 67 29.879 10.728 -26.877 1.00 0.00 O ATOM 1275 CB ILE B 67 26.935 10.626 -26.196 1.00 0.00 C ATOM 1276 CG1 ILE B 67 25.580 11.302 -25.824 1.00 0.00 C ATOM 1277 CG2 ILE B 67 26.895 9.110 -26.412 1.00 0.00 C ATOM 1278 CD1 ILE B 67 24.720 11.521 -27.018 1.00 0.00 C ATOM 0 H ILE B 67 27.787 13.047 -25.933 1.00 0.00 H new ATOM 0 HA ILE B 67 27.847 10.731 -24.322 1.00 0.00 H new ATOM 0 HB ILE B 67 27.122 11.026 -27.193 1.00 0.00 H new ATOM 0 HG12 ILE B 67 25.049 10.678 -25.104 1.00 0.00 H new ATOM 0 HG13 ILE B 67 25.773 12.257 -25.336 1.00 0.00 H new ATOM 0 HG21 ILE B 67 26.038 8.854 -27.035 1.00 0.00 H new ATOM 0 HG22 ILE B 67 27.812 8.788 -26.906 1.00 0.00 H new ATOM 0 HG23 ILE B 67 26.806 8.607 -25.449 1.00 0.00 H new ATOM 0 HD11 ILE B 67 23.787 11.994 -26.712 1.00 0.00 H new ATOM 0 HD12 ILE B 67 25.239 12.167 -27.727 1.00 0.00 H new ATOM 0 HD13 ILE B 67 24.504 10.563 -27.491 1.00 0.00 H new ATOM 1290 N ASN B 68 29.873 9.430 -25.014 1.00 0.00 N ATOM 1291 CA ASN B 68 31.023 8.576 -25.367 1.00 0.00 C ATOM 1292 C ASN B 68 30.562 7.393 -26.197 1.00 0.00 C ATOM 1293 O ASN B 68 29.441 6.895 -25.995 1.00 0.00 O ATOM 1294 CB ASN B 68 31.778 7.989 -24.089 1.00 0.00 C ATOM 1295 CG ASN B 68 32.332 9.146 -23.287 1.00 0.00 C ATOM 1296 OD1 ASN B 68 33.474 9.472 -23.460 1.00 0.00 O ATOM 1297 ND2 ASN B 68 31.501 9.836 -22.545 1.00 0.00 N ATOM 0 H ASN B 68 29.453 9.178 -24.120 1.00 0.00 H new ATOM 0 HA ASN B 68 31.710 9.216 -25.921 1.00 0.00 H new ATOM 0 HB2 ASN B 68 31.092 7.400 -23.480 1.00 0.00 H new ATOM 0 HB3 ASN B 68 32.583 7.322 -24.398 1.00 0.00 H new ATOM 0 HD21 ASN B 68 31.817 10.690 -22.085 1.00 0.00 H new ATOM 0 HD22 ASN B 68 30.539 9.519 -22.427 1.00 0.00 H new ATOM 1304 N GLU B 69 31.334 6.832 -27.214 1.00 0.00 N ATOM 1305 CA GLU B 69 31.120 5.685 -28.107 1.00 0.00 C ATOM 1306 C GLU B 69 31.189 4.398 -27.415 1.00 0.00 C ATOM 1307 O GLU B 69 31.123 3.349 -28.079 1.00 0.00 O ATOM 1308 CB GLU B 69 32.220 5.709 -29.198 1.00 0.00 C ATOM 1309 CG GLU B 69 32.122 6.984 -30.020 1.00 0.00 C ATOM 1310 CD GLU B 69 33.136 7.042 -31.159 1.00 0.00 C ATOM 1311 OE1 GLU B 69 33.327 6.002 -31.789 1.00 0.00 O ATOM 1312 OE2 GLU B 69 33.758 8.158 -31.343 1.00 0.00 O ATOM 0 H GLU B 69 32.236 7.258 -27.427 1.00 0.00 H new ATOM 0 HA GLU B 69 30.118 5.778 -28.525 1.00 0.00 H new ATOM 0 HB2 GLU B 69 33.204 5.643 -28.733 1.00 0.00 H new ATOM 0 HB3 GLU B 69 32.116 4.840 -29.848 1.00 0.00 H new ATOM 0 HG2 GLU B 69 31.116 7.067 -30.432 1.00 0.00 H new ATOM 0 HG3 GLU B 69 32.270 7.843 -29.366 1.00 0.00 H new ATOM 1319 N THR B 70 31.218 4.407 -26.079 1.00 0.00 N ATOM 1320 CA THR B 70 31.082 3.250 -25.234 1.00 0.00 C ATOM 1321 C THR B 70 29.593 3.034 -24.764 1.00 0.00 C ATOM 1322 O THR B 70 29.284 2.116 -24.038 1.00 0.00 O ATOM 1323 CB THR B 70 32.002 3.381 -24.027 1.00 0.00 C ATOM 1324 OG1 THR B 70 32.015 4.620 -23.333 1.00 0.00 O ATOM 1325 CG2 THR B 70 33.417 3.201 -24.421 1.00 0.00 C ATOM 0 H THR B 70 31.343 5.268 -25.547 1.00 0.00 H new ATOM 0 HA THR B 70 31.368 2.376 -25.819 1.00 0.00 H new ATOM 0 HB THR B 70 31.586 2.616 -23.371 1.00 0.00 H new ATOM 0 HG1 THR B 70 31.232 4.674 -22.746 1.00 0.00 H new ATOM 0 HG21 THR B 70 34.055 3.299 -23.542 1.00 0.00 H new ATOM 0 HG22 THR B 70 33.550 2.211 -24.857 1.00 0.00 H new ATOM 0 HG23 THR B 70 33.690 3.960 -25.154 1.00 0.00 H new ATOM 1333 N ASP B 71 28.671 3.974 -25.024 1.00 0.00 N ATOM 1334 CA ASP B 71 27.430 4.140 -24.195 1.00 0.00 C ATOM 1335 C ASP B 71 26.232 3.881 -25.154 1.00 0.00 C ATOM 1336 O ASP B 71 26.318 4.085 -26.400 1.00 0.00 O ATOM 1337 CB ASP B 71 27.396 5.509 -23.671 1.00 0.00 C ATOM 1338 CG ASP B 71 28.523 5.782 -22.650 1.00 0.00 C ATOM 1339 OD1 ASP B 71 29.576 5.066 -22.547 1.00 0.00 O ATOM 1340 OD2 ASP B 71 28.389 6.747 -21.908 1.00 0.00 O ATOM 0 H ASP B 71 28.746 4.637 -25.796 1.00 0.00 H new ATOM 0 HA ASP B 71 27.395 3.454 -23.348 1.00 0.00 H new ATOM 0 HB2 ASP B 71 27.482 6.213 -24.499 1.00 0.00 H new ATOM 0 HB3 ASP B 71 26.431 5.689 -23.198 1.00 0.00 H new ATOM 1345 N THR B 72 25.138 3.413 -24.626 1.00 0.00 N ATOM 1346 CA THR B 72 23.924 3.038 -25.369 1.00 0.00 C ATOM 1347 C THR B 72 22.789 3.814 -24.672 1.00 0.00 C ATOM 1348 O THR B 72 23.021 4.349 -23.547 1.00 0.00 O ATOM 1349 CB THR B 72 23.564 1.536 -25.257 1.00 0.00 C ATOM 1350 OG1 THR B 72 23.369 1.144 -23.890 1.00 0.00 O ATOM 1351 CG2 THR B 72 24.678 0.693 -25.823 1.00 0.00 C ATOM 0 H THR B 72 25.043 3.268 -23.621 1.00 0.00 H new ATOM 0 HA THR B 72 24.072 3.256 -26.427 1.00 0.00 H new ATOM 0 HB THR B 72 22.640 1.384 -25.815 1.00 0.00 H new ATOM 0 HG1 THR B 72 23.141 0.192 -23.852 1.00 0.00 H new ATOM 0 HG21 THR B 72 24.415 -0.361 -25.739 1.00 0.00 H new ATOM 0 HG22 THR B 72 24.830 0.947 -26.872 1.00 0.00 H new ATOM 0 HG23 THR B 72 25.596 0.883 -25.267 1.00 0.00 H new ATOM 1359 N PRO B 73 21.507 3.883 -25.223 1.00 0.00 N ATOM 1360 CA PRO B 73 20.392 4.570 -24.539 1.00 0.00 C ATOM 1361 C PRO B 73 19.962 3.994 -23.179 1.00 0.00 C ATOM 1362 O PRO B 73 19.567 4.807 -22.351 1.00 0.00 O ATOM 1363 CB PRO B 73 19.166 4.479 -25.465 1.00 0.00 C ATOM 1364 CG PRO B 73 19.842 4.392 -26.862 1.00 0.00 C ATOM 1365 CD PRO B 73 21.172 3.605 -26.657 1.00 0.00 C ATOM 0 HA PRO B 73 20.753 5.578 -24.336 1.00 0.00 H new ATOM 0 HB2 PRO B 73 18.553 3.604 -25.250 1.00 0.00 H new ATOM 0 HB3 PRO B 73 18.518 5.351 -25.376 1.00 0.00 H new ATOM 0 HG2 PRO B 73 19.195 3.882 -27.576 1.00 0.00 H new ATOM 0 HG3 PRO B 73 20.037 5.387 -27.262 1.00 0.00 H new ATOM 0 HD2 PRO B 73 21.043 2.539 -26.843 1.00 0.00 H new ATOM 0 HD3 PRO B 73 21.956 3.953 -27.330 1.00 0.00 H new ATOM 1373 N ALA B 74 20.146 2.733 -22.931 1.00 0.00 N ATOM 1374 CA ALA B 74 19.967 2.114 -21.615 1.00 0.00 C ATOM 1375 C ALA B 74 20.919 2.645 -20.520 1.00 0.00 C ATOM 1376 O ALA B 74 20.428 2.904 -19.411 1.00 0.00 O ATOM 1377 CB ALA B 74 20.197 0.596 -21.836 1.00 0.00 C ATOM 0 H ALA B 74 20.434 2.069 -23.650 1.00 0.00 H new ATOM 0 HA ALA B 74 18.971 2.353 -21.242 1.00 0.00 H new ATOM 0 HB1 ALA B 74 20.078 0.068 -20.890 1.00 0.00 H new ATOM 0 HB2 ALA B 74 19.470 0.219 -22.555 1.00 0.00 H new ATOM 0 HB3 ALA B 74 21.204 0.433 -22.219 1.00 0.00 H new ATOM 1383 N GLN B 75 22.175 2.799 -20.743 1.00 0.00 N ATOM 1384 CA GLN B 75 23.113 3.316 -19.777 1.00 0.00 C ATOM 1385 C GLN B 75 22.935 4.761 -19.427 1.00 0.00 C ATOM 1386 O GLN B 75 23.288 5.169 -18.274 1.00 0.00 O ATOM 1387 CB GLN B 75 24.534 3.108 -20.349 1.00 0.00 C ATOM 1388 CG GLN B 75 25.764 3.813 -19.693 1.00 0.00 C ATOM 1389 CD GLN B 75 25.878 3.532 -18.196 1.00 0.00 C ATOM 1390 OE1 GLN B 75 25.281 2.683 -17.587 1.00 0.00 O ATOM 1391 NE2 GLN B 75 26.777 4.285 -17.506 1.00 0.00 N ATOM 0 H GLN B 75 22.608 2.562 -21.636 1.00 0.00 H new ATOM 0 HA GLN B 75 22.940 2.772 -18.848 1.00 0.00 H new ATOM 0 HB2 GLN B 75 24.733 2.036 -20.335 1.00 0.00 H new ATOM 0 HB3 GLN B 75 24.508 3.414 -21.395 1.00 0.00 H new ATOM 0 HG2 GLN B 75 26.675 3.481 -20.191 1.00 0.00 H new ATOM 0 HG3 GLN B 75 25.688 4.889 -19.851 1.00 0.00 H new ATOM 0 HE21 GLN B 75 27.304 5.015 -17.984 1.00 0.00 H new ATOM 0 HE22 GLN B 75 26.924 4.119 -16.510 1.00 0.00 H new ATOM 1400 N LEU B 76 22.512 5.585 -20.449 1.00 0.00 N ATOM 1401 CA LEU B 76 22.229 7.021 -20.279 1.00 0.00 C ATOM 1402 C LEU B 76 20.767 7.227 -19.831 1.00 0.00 C ATOM 1403 O LEU B 76 20.339 8.417 -19.711 1.00 0.00 O ATOM 1404 CB LEU B 76 22.568 7.728 -21.628 1.00 0.00 C ATOM 1405 CG LEU B 76 24.062 7.561 -22.244 1.00 0.00 C ATOM 1406 CD1 LEU B 76 24.116 8.221 -23.586 1.00 0.00 C ATOM 1407 CD2 LEU B 76 24.989 8.241 -21.246 1.00 0.00 C ATOM 0 H LEU B 76 22.365 5.253 -21.402 1.00 0.00 H new ATOM 0 HA LEU B 76 22.842 7.463 -19.494 1.00 0.00 H new ATOM 0 HB2 LEU B 76 21.861 7.369 -22.376 1.00 0.00 H new ATOM 0 HB3 LEU B 76 22.382 8.794 -21.498 1.00 0.00 H new ATOM 0 HG LEU B 76 24.351 6.520 -22.389 1.00 0.00 H new ATOM 0 HD11 LEU B 76 25.116 8.112 -24.005 1.00 0.00 H new ATOM 0 HD12 LEU B 76 23.391 7.752 -24.251 1.00 0.00 H new ATOM 0 HD13 LEU B 76 23.880 9.280 -23.480 1.00 0.00 H new ATOM 0 HD21 LEU B 76 26.018 8.168 -21.597 1.00 0.00 H new ATOM 0 HD22 LEU B 76 24.713 9.291 -21.150 1.00 0.00 H new ATOM 0 HD23 LEU B 76 24.901 7.752 -20.276 1.00 0.00 H new ATOM 1419 N GLU B 77 20.079 6.147 -19.535 1.00 0.00 N ATOM 1420 CA GLU B 77 18.701 6.131 -19.103 1.00 0.00 C ATOM 1421 C GLU B 77 17.737 7.091 -19.909 1.00 0.00 C ATOM 1422 O GLU B 77 17.052 7.994 -19.361 1.00 0.00 O ATOM 1423 CB GLU B 77 18.538 6.455 -17.646 1.00 0.00 C ATOM 1424 CG GLU B 77 19.263 5.369 -16.794 1.00 0.00 C ATOM 1425 CD GLU B 77 18.640 4.018 -16.706 1.00 0.00 C ATOM 1426 OE1 GLU B 77 17.461 3.843 -17.044 1.00 0.00 O ATOM 1427 OE2 GLU B 77 19.205 3.045 -16.093 1.00 0.00 O ATOM 0 H GLU B 77 20.485 5.213 -19.592 1.00 0.00 H new ATOM 0 HA GLU B 77 18.409 5.100 -19.303 1.00 0.00 H new ATOM 0 HB2 GLU B 77 18.954 7.440 -17.432 1.00 0.00 H new ATOM 0 HB3 GLU B 77 17.480 6.492 -17.386 1.00 0.00 H new ATOM 0 HG2 GLU B 77 20.269 5.247 -17.195 1.00 0.00 H new ATOM 0 HG3 GLU B 77 19.368 5.755 -15.780 1.00 0.00 H new ATOM 1434 N MET B 78 17.745 6.962 -21.238 1.00 0.00 N ATOM 1435 CA MET B 78 16.956 7.735 -22.283 1.00 0.00 C ATOM 1436 C MET B 78 15.563 7.151 -22.485 1.00 0.00 C ATOM 1437 O MET B 78 15.206 6.084 -21.972 1.00 0.00 O ATOM 1438 CB MET B 78 17.823 7.798 -23.555 1.00 0.00 C ATOM 1439 CG MET B 78 19.104 8.611 -23.583 1.00 0.00 C ATOM 1440 SD MET B 78 20.090 8.369 -25.096 1.00 0.00 S ATOM 1441 CE MET B 78 20.853 9.963 -25.016 1.00 0.00 C ATOM 0 H MET B 78 18.344 6.264 -21.679 1.00 0.00 H new ATOM 0 HA MET B 78 16.755 8.756 -21.958 1.00 0.00 H new ATOM 0 HB2 MET B 78 18.089 6.773 -23.812 1.00 0.00 H new ATOM 0 HB3 MET B 78 17.188 8.174 -24.357 1.00 0.00 H new ATOM 0 HG2 MET B 78 18.856 9.668 -23.487 1.00 0.00 H new ATOM 0 HG3 MET B 78 19.711 8.346 -22.718 1.00 0.00 H new ATOM 0 HE1 MET B 78 21.573 10.063 -25.828 1.00 0.00 H new ATOM 0 HE2 MET B 78 20.091 10.736 -25.110 1.00 0.00 H new ATOM 0 HE3 MET B 78 21.366 10.073 -24.061 1.00 0.00 H new ATOM 1451 N GLU B 79 14.758 7.854 -23.258 1.00 0.00 N ATOM 1452 CA GLU B 79 13.364 7.551 -23.610 1.00 0.00 C ATOM 1453 C GLU B 79 13.093 8.129 -25.027 1.00 0.00 C ATOM 1454 O GLU B 79 13.951 8.801 -25.615 1.00 0.00 O ATOM 1455 CB GLU B 79 12.502 8.284 -22.581 1.00 0.00 C ATOM 1456 CG GLU B 79 12.711 7.949 -21.105 1.00 0.00 C ATOM 1457 CD GLU B 79 12.569 6.470 -20.692 1.00 0.00 C ATOM 1458 OE1 GLU B 79 12.173 5.545 -21.523 1.00 0.00 O ATOM 1459 OE2 GLU B 79 12.679 6.228 -19.477 1.00 0.00 O ATOM 0 H GLU B 79 15.075 8.719 -23.695 1.00 0.00 H new ATOM 0 HA GLU B 79 13.151 6.482 -23.611 1.00 0.00 H new ATOM 0 HB2 GLU B 79 12.667 9.354 -22.708 1.00 0.00 H new ATOM 0 HB3 GLU B 79 11.457 8.092 -22.823 1.00 0.00 H new ATOM 0 HG2 GLU B 79 13.708 8.285 -20.820 1.00 0.00 H new ATOM 0 HG3 GLU B 79 11.999 8.533 -20.522 1.00 0.00 H new ATOM 1466 N ASP B 80 11.854 7.947 -25.554 1.00 0.00 N ATOM 1467 CA ASP B 80 11.487 8.471 -26.905 1.00 0.00 C ATOM 1468 C ASP B 80 11.318 9.984 -26.866 1.00 0.00 C ATOM 1469 O ASP B 80 10.790 10.554 -25.927 1.00 0.00 O ATOM 1470 CB ASP B 80 10.231 7.813 -27.533 1.00 0.00 C ATOM 1471 CG ASP B 80 10.322 6.291 -27.811 1.00 0.00 C ATOM 1472 OD1 ASP B 80 11.006 5.571 -27.037 1.00 0.00 O ATOM 1473 OD2 ASP B 80 9.839 5.853 -28.845 1.00 0.00 O ATOM 0 H ASP B 80 11.101 7.451 -25.077 1.00 0.00 H new ATOM 0 HA ASP B 80 12.321 8.201 -27.553 1.00 0.00 H new ATOM 0 HB2 ASP B 80 9.384 7.990 -26.870 1.00 0.00 H new ATOM 0 HB3 ASP B 80 10.012 8.320 -28.473 1.00 0.00 H new ATOM 1478 N GLU B 81 11.711 10.694 -27.887 1.00 0.00 N ATOM 1479 CA GLU B 81 11.783 12.168 -27.880 1.00 0.00 C ATOM 1480 C GLU B 81 12.747 12.793 -26.874 1.00 0.00 C ATOM 1481 O GLU B 81 12.692 13.956 -26.554 1.00 0.00 O ATOM 1482 CB GLU B 81 10.427 12.861 -28.021 1.00 0.00 C ATOM 1483 CG GLU B 81 9.516 12.451 -29.136 1.00 0.00 C ATOM 1484 CD GLU B 81 8.294 13.401 -29.273 1.00 0.00 C ATOM 1485 OE1 GLU B 81 8.478 14.624 -29.497 1.00 0.00 O ATOM 1486 OE2 GLU B 81 7.188 12.863 -29.091 1.00 0.00 O ATOM 0 H GLU B 81 12.000 10.278 -28.772 1.00 0.00 H new ATOM 0 HA GLU B 81 12.291 12.396 -28.817 1.00 0.00 H new ATOM 0 HB2 GLU B 81 9.886 12.720 -27.085 1.00 0.00 H new ATOM 0 HB3 GLU B 81 10.613 13.930 -28.124 1.00 0.00 H new ATOM 0 HG2 GLU B 81 10.073 12.440 -30.073 1.00 0.00 H new ATOM 0 HG3 GLU B 81 9.166 11.434 -28.962 1.00 0.00 H new ATOM 1493 N ASP B 82 13.811 12.132 -26.540 1.00 0.00 N ATOM 1494 CA ASP B 82 15.085 12.709 -26.069 1.00 0.00 C ATOM 1495 C ASP B 82 15.849 13.226 -27.352 1.00 0.00 C ATOM 1496 O ASP B 82 15.928 12.473 -28.334 1.00 0.00 O ATOM 1497 CB ASP B 82 15.842 11.776 -25.168 1.00 0.00 C ATOM 1498 CG ASP B 82 15.169 11.615 -23.854 1.00 0.00 C ATOM 1499 OD1 ASP B 82 14.503 12.528 -23.299 1.00 0.00 O ATOM 1500 OD2 ASP B 82 15.622 10.743 -23.048 1.00 0.00 O ATOM 0 H ASP B 82 13.842 11.113 -26.582 1.00 0.00 H new ATOM 0 HA ASP B 82 14.930 13.562 -25.408 1.00 0.00 H new ATOM 0 HB2 ASP B 82 15.938 10.803 -25.650 1.00 0.00 H new ATOM 0 HB3 ASP B 82 16.852 12.157 -25.015 1.00 0.00 H new ATOM 1505 N THR B 83 16.387 14.453 -27.324 1.00 0.00 N ATOM 1506 CA THR B 83 17.235 15.070 -28.375 1.00 0.00 C ATOM 1507 C THR B 83 18.742 15.291 -27.964 1.00 0.00 C ATOM 1508 O THR B 83 19.032 15.690 -26.872 1.00 0.00 O ATOM 1509 CB THR B 83 16.703 16.453 -28.791 1.00 0.00 C ATOM 1510 OG1 THR B 83 15.335 16.544 -29.126 1.00 0.00 O ATOM 1511 CG2 THR B 83 17.584 16.975 -29.971 1.00 0.00 C ATOM 0 H THR B 83 16.241 15.080 -26.533 1.00 0.00 H new ATOM 0 HA THR B 83 17.190 14.345 -29.188 1.00 0.00 H new ATOM 0 HB THR B 83 16.777 17.072 -27.897 1.00 0.00 H new ATOM 0 HG1 THR B 83 15.119 17.468 -29.370 1.00 0.00 H new ATOM 0 HG21 THR B 83 17.227 17.956 -30.285 1.00 0.00 H new ATOM 0 HG22 THR B 83 18.621 17.054 -29.644 1.00 0.00 H new ATOM 0 HG23 THR B 83 17.520 16.280 -30.808 1.00 0.00 H new ATOM 1519 N ILE B 84 19.571 14.915 -28.884 1.00 0.00 N ATOM 1520 CA ILE B 84 21.036 14.999 -28.985 1.00 0.00 C ATOM 1521 C ILE B 84 21.315 16.236 -29.923 1.00 0.00 C ATOM 1522 O ILE B 84 21.147 16.270 -31.119 1.00 0.00 O ATOM 1523 CB ILE B 84 21.659 13.714 -29.588 1.00 0.00 C ATOM 1524 CG1 ILE B 84 21.226 12.443 -28.859 1.00 0.00 C ATOM 1525 CG2 ILE B 84 23.174 13.719 -29.715 1.00 0.00 C ATOM 1526 CD1 ILE B 84 21.712 11.095 -29.492 1.00 0.00 C ATOM 0 H ILE B 84 19.199 14.469 -29.723 1.00 0.00 H new ATOM 0 HA ILE B 84 21.486 15.109 -27.998 1.00 0.00 H new ATOM 0 HB ILE B 84 21.256 13.714 -30.601 1.00 0.00 H new ATOM 0 HG12 ILE B 84 21.591 12.493 -27.833 1.00 0.00 H new ATOM 0 HG13 ILE B 84 20.137 12.428 -28.810 1.00 0.00 H new ATOM 0 HG21 ILE B 84 23.506 12.775 -30.147 1.00 0.00 H new ATOM 0 HG22 ILE B 84 23.482 14.542 -30.360 1.00 0.00 H new ATOM 0 HG23 ILE B 84 23.621 13.844 -28.729 1.00 0.00 H new ATOM 0 HD11 ILE B 84 21.347 10.260 -28.894 1.00 0.00 H new ATOM 0 HD12 ILE B 84 21.326 11.010 -30.508 1.00 0.00 H new ATOM 0 HD13 ILE B 84 22.802 11.076 -29.516 1.00 0.00 H new ATOM 1538 N ASP B 85 21.966 17.264 -29.282 1.00 0.00 N ATOM 1539 CA ASP B 85 22.473 18.438 -29.844 1.00 0.00 C ATOM 1540 C ASP B 85 23.896 18.298 -30.358 1.00 0.00 C ATOM 1541 O ASP B 85 24.794 17.911 -29.567 1.00 0.00 O ATOM 1542 CB ASP B 85 22.314 19.664 -28.918 1.00 0.00 C ATOM 1543 CG ASP B 85 20.944 20.159 -28.614 1.00 0.00 C ATOM 1544 OD1 ASP B 85 20.072 19.361 -28.310 1.00 0.00 O ATOM 1545 OD2 ASP B 85 20.818 21.416 -28.506 1.00 0.00 O ATOM 0 H ASP B 85 22.132 17.230 -28.276 1.00 0.00 H new ATOM 0 HA ASP B 85 21.851 18.621 -30.720 1.00 0.00 H new ATOM 0 HB2 ASP B 85 22.797 19.427 -27.970 1.00 0.00 H new ATOM 0 HB3 ASP B 85 22.872 20.488 -29.363 1.00 0.00 H new ATOM 1550 N VAL B 86 24.246 18.715 -31.565 1.00 0.00 N ATOM 1551 CA VAL B 86 25.556 18.544 -32.178 1.00 0.00 C ATOM 1552 C VAL B 86 26.247 19.851 -32.425 1.00 0.00 C ATOM 1553 O VAL B 86 25.615 20.764 -32.918 1.00 0.00 O ATOM 1554 CB VAL B 86 25.447 17.686 -33.485 1.00 0.00 C ATOM 1555 CG1 VAL B 86 26.788 17.279 -34.115 1.00 0.00 C ATOM 1556 CG2 VAL B 86 24.633 16.414 -33.156 1.00 0.00 C ATOM 0 H VAL B 86 23.592 19.206 -32.175 1.00 0.00 H new ATOM 0 HA VAL B 86 26.180 18.001 -31.468 1.00 0.00 H new ATOM 0 HB VAL B 86 24.961 18.317 -34.229 1.00 0.00 H new ATOM 0 HG11 VAL B 86 26.604 16.689 -35.013 1.00 0.00 H new ATOM 0 HG12 VAL B 86 27.353 18.173 -34.378 1.00 0.00 H new ATOM 0 HG13 VAL B 86 27.360 16.685 -33.402 1.00 0.00 H new ATOM 0 HG21 VAL B 86 24.542 15.798 -34.051 1.00 0.00 H new ATOM 0 HG22 VAL B 86 25.142 15.848 -32.376 1.00 0.00 H new ATOM 0 HG23 VAL B 86 23.640 16.698 -32.809 1.00 0.00 H new ATOM 1566 N PHE B 87 27.552 19.918 -32.136 1.00 0.00 N ATOM 1567 CA PHE B 87 28.405 21.078 -32.194 1.00 0.00 C ATOM 1568 C PHE B 87 29.556 20.925 -33.146 1.00 0.00 C ATOM 1569 O PHE B 87 30.039 19.801 -33.188 1.00 0.00 O ATOM 1570 CB PHE B 87 28.736 21.497 -30.768 1.00 0.00 C ATOM 1571 CG PHE B 87 27.625 21.893 -29.798 1.00 0.00 C ATOM 1572 CD1 PHE B 87 26.785 20.884 -29.282 1.00 0.00 C ATOM 1573 CD2 PHE B 87 27.537 23.246 -29.466 1.00 0.00 C ATOM 1574 CE1 PHE B 87 25.800 21.247 -28.364 1.00 0.00 C ATOM 1575 CE2 PHE B 87 26.642 23.577 -28.459 1.00 0.00 C ATOM 1576 CZ PHE B 87 25.807 22.599 -27.895 1.00 0.00 C ATOM 0 H PHE B 87 28.065 19.090 -31.833 1.00 0.00 H new ATOM 0 HA PHE B 87 27.883 21.919 -32.650 1.00 0.00 H new ATOM 0 HB2 PHE B 87 29.284 20.674 -30.310 1.00 0.00 H new ATOM 0 HB3 PHE B 87 29.423 22.341 -30.832 1.00 0.00 H new ATOM 0 HD1 PHE B 87 26.902 19.856 -29.590 1.00 0.00 H new ATOM 0 HD2 PHE B 87 28.133 23.995 -29.966 1.00 0.00 H new ATOM 0 HE1 PHE B 87 25.062 20.537 -28.021 1.00 0.00 H new ATOM 0 HE2 PHE B 87 26.587 24.596 -28.106 1.00 0.00 H new ATOM 0 HZ PHE B 87 25.151 22.875 -27.083 1.00 0.00 H new ATOM 1586 N GLN B 88 30.027 22.042 -33.787 1.00 0.00 N ATOM 1587 CA GLN B 88 31.295 22.005 -34.535 1.00 0.00 C ATOM 1588 C GLN B 88 32.408 22.069 -33.515 1.00 0.00 C ATOM 1589 O GLN B 88 32.349 22.905 -32.609 1.00 0.00 O ATOM 1590 CB GLN B 88 31.478 23.188 -35.485 1.00 0.00 C ATOM 1591 CG GLN B 88 30.577 23.060 -36.737 1.00 0.00 C ATOM 1592 CD GLN B 88 31.312 22.396 -37.909 1.00 0.00 C ATOM 1593 OE1 GLN B 88 32.521 22.354 -38.064 1.00 0.00 O ATOM 1594 NE2 GLN B 88 30.605 21.908 -38.919 1.00 0.00 N ATOM 0 H GLN B 88 29.553 22.945 -33.793 1.00 0.00 H new ATOM 0 HA GLN B 88 31.300 21.098 -35.140 1.00 0.00 H new ATOM 0 HB2 GLN B 88 31.244 24.115 -34.961 1.00 0.00 H new ATOM 0 HB3 GLN B 88 32.522 23.250 -35.792 1.00 0.00 H new ATOM 0 HG2 GLN B 88 29.691 22.477 -36.488 1.00 0.00 H new ATOM 0 HG3 GLN B 88 30.233 24.049 -37.039 1.00 0.00 H new ATOM 0 HE21 GLN B 88 29.586 21.904 -38.873 1.00 0.00 H new ATOM 0 HE22 GLN B 88 31.080 21.537 -39.742 1.00 0.00 H new ATOM 1603 N GLN B 89 33.439 21.304 -33.601 1.00 0.00 N ATOM 1604 CA GLN B 89 34.625 21.325 -32.715 1.00 0.00 C ATOM 1605 C GLN B 89 35.510 22.556 -32.931 1.00 0.00 C ATOM 1606 O GLN B 89 36.027 22.775 -34.020 1.00 0.00 O ATOM 1607 CB GLN B 89 35.436 20.015 -32.846 1.00 0.00 C ATOM 1608 CG GLN B 89 36.820 19.942 -32.186 1.00 0.00 C ATOM 1609 CD GLN B 89 36.858 20.410 -30.733 1.00 0.00 C ATOM 1610 OE1 GLN B 89 36.252 19.799 -29.852 1.00 0.00 O ATOM 1611 NE2 GLN B 89 37.568 21.459 -30.383 1.00 0.00 N ATOM 0 H GLN B 89 33.514 20.591 -34.326 1.00 0.00 H new ATOM 0 HA GLN B 89 34.252 21.396 -31.693 1.00 0.00 H new ATOM 0 HB2 GLN B 89 34.830 19.207 -32.436 1.00 0.00 H new ATOM 0 HB3 GLN B 89 35.564 19.809 -33.909 1.00 0.00 H new ATOM 0 HG2 GLN B 89 37.176 18.913 -32.232 1.00 0.00 H new ATOM 0 HG3 GLN B 89 37.517 20.546 -32.767 1.00 0.00 H new ATOM 0 HE21 GLN B 89 38.081 21.986 -31.089 1.00 0.00 H new ATOM 0 HE22 GLN B 89 37.606 21.746 -29.405 1.00 0.00 H new ATOM 1620 N GLN B 90 35.754 23.361 -31.849 1.00 0.00 N ATOM 1621 CA GLN B 90 36.412 24.690 -31.867 1.00 0.00 C ATOM 1622 C GLN B 90 37.850 24.498 -32.401 1.00 0.00 C ATOM 1623 O GLN B 90 38.434 23.476 -32.200 1.00 0.00 O ATOM 1624 CB GLN B 90 36.455 25.215 -30.348 1.00 0.00 C ATOM 1625 CG GLN B 90 35.063 25.583 -29.860 1.00 0.00 C ATOM 1626 CD GLN B 90 34.434 24.478 -29.016 1.00 0.00 C ATOM 1627 OE1 GLN B 90 34.456 23.334 -29.402 1.00 0.00 O ATOM 1628 NE2 GLN B 90 33.726 24.754 -27.954 1.00 0.00 N ATOM 0 H GLN B 90 35.483 23.081 -30.907 1.00 0.00 H new ATOM 0 HA GLN B 90 35.883 25.405 -32.497 1.00 0.00 H new ATOM 0 HB2 GLN B 90 36.878 24.443 -29.705 1.00 0.00 H new ATOM 0 HB3 GLN B 90 37.110 26.083 -30.278 1.00 0.00 H new ATOM 0 HG2 GLN B 90 35.117 26.500 -29.273 1.00 0.00 H new ATOM 0 HG3 GLN B 90 34.423 25.791 -30.717 1.00 0.00 H new ATOM 0 HE21 GLN B 90 33.686 25.710 -27.602 1.00 0.00 H new ATOM 0 HE22 GLN B 90 33.213 24.013 -27.477 1.00 0.00 H new ATOM 1637 N THR B 91 38.562 25.519 -32.913 1.00 0.00 N ATOM 1638 CA THR B 91 39.984 25.519 -33.279 1.00 0.00 C ATOM 1639 C THR B 91 40.863 26.189 -32.203 1.00 0.00 C ATOM 1640 O THR B 91 41.916 25.654 -31.873 1.00 0.00 O ATOM 1641 CB THR B 91 40.099 26.105 -34.639 1.00 0.00 C ATOM 1642 OG1 THR B 91 39.690 27.467 -34.653 1.00 0.00 O ATOM 1643 CG2 THR B 91 39.352 25.369 -35.781 1.00 0.00 C ATOM 0 H THR B 91 38.127 26.424 -33.092 1.00 0.00 H new ATOM 0 HA THR B 91 40.378 24.503 -33.317 1.00 0.00 H new ATOM 0 HB THR B 91 41.162 25.994 -34.851 1.00 0.00 H new ATOM 0 HG1 THR B 91 39.778 27.826 -35.561 1.00 0.00 H new ATOM 0 HG21 THR B 91 39.515 25.896 -36.721 1.00 0.00 H new ATOM 0 HG22 THR B 91 39.730 24.350 -35.866 1.00 0.00 H new ATOM 0 HG23 THR B 91 38.285 25.343 -35.560 1.00 0.00 H new ATOM 1651 N GLY B 92 40.422 27.300 -31.614 1.00 0.00 N ATOM 1652 CA GLY B 92 41.292 28.180 -30.843 1.00 0.00 C ATOM 1653 C GLY B 92 42.488 28.782 -31.549 1.00 0.00 C ATOM 1654 O GLY B 92 42.296 29.145 -32.708 1.00 0.00 O ATOM 0 H GLY B 92 39.452 27.613 -31.659 1.00 0.00 H new ATOM 0 HA2 GLY B 92 40.684 28.998 -30.456 1.00 0.00 H new ATOM 0 HA3 GLY B 92 41.658 27.620 -29.982 1.00 0.00 H new ATOM 1658 N GLY B 93 43.637 28.874 -30.977 1.00 0.00 N ATOM 1659 CA GLY B 93 44.727 29.698 -31.478 1.00 0.00 C ATOM 1660 C GLY B 93 45.683 29.101 -32.502 1.00 0.00 C ATOM 1661 O GLY B 93 45.557 27.982 -32.891 1.00 0.00 O ATOM 0 H GLY B 93 43.871 28.371 -30.121 1.00 0.00 H new ATOM 0 HA2 GLY B 93 44.289 30.594 -31.918 1.00 0.00 H new ATOM 0 HA3 GLY B 93 45.319 30.020 -30.621 1.00 0.00 H new ATOM 1665 N VAL B 94 46.566 29.927 -33.016 1.00 0.00 N ATOM 1666 CA VAL B 94 47.679 29.610 -33.934 1.00 0.00 C ATOM 1667 C VAL B 94 48.998 30.078 -33.373 1.00 0.00 C ATOM 1668 O VAL B 94 48.947 31.118 -32.672 1.00 0.00 O ATOM 1669 CB VAL B 94 47.407 30.202 -35.353 1.00 0.00 C ATOM 1670 CG1 VAL B 94 48.449 29.702 -36.362 1.00 0.00 C ATOM 1671 CG2 VAL B 94 46.073 29.702 -35.907 1.00 0.00 C ATOM 0 H VAL B 94 46.537 30.923 -32.796 1.00 0.00 H new ATOM 0 HA VAL B 94 47.742 28.527 -34.036 1.00 0.00 H new ATOM 0 HB VAL B 94 47.427 31.286 -35.236 1.00 0.00 H new ATOM 0 HG11 VAL B 94 48.239 30.128 -37.343 1.00 0.00 H new ATOM 0 HG12 VAL B 94 49.444 30.008 -36.039 1.00 0.00 H new ATOM 0 HG13 VAL B 94 48.405 28.615 -36.421 1.00 0.00 H new ATOM 0 HG21 VAL B 94 45.907 30.129 -36.896 1.00 0.00 H new ATOM 0 HG22 VAL B 94 46.094 28.615 -35.980 1.00 0.00 H new ATOM 0 HG23 VAL B 94 45.266 30.006 -35.241 1.00 0.00 H new ATOM 1681 N TYR B 95 50.073 29.400 -33.682 1.00 0.00 N ATOM 1682 CA TYR B 95 51.342 29.232 -32.871 1.00 0.00 C ATOM 1683 C TYR B 95 52.596 29.189 -33.667 1.00 0.00 C ATOM 1684 O TYR B 95 53.470 30.079 -33.417 1.00 0.00 O ATOM 1685 CB TYR B 95 51.240 27.930 -32.022 1.00 0.00 C ATOM 1686 CG TYR B 95 50.013 27.916 -31.127 1.00 0.00 C ATOM 1687 CD1 TYR B 95 49.989 28.758 -29.953 1.00 0.00 C ATOM 1688 CD2 TYR B 95 48.898 27.137 -31.466 1.00 0.00 C ATOM 1689 CE1 TYR B 95 48.969 28.567 -29.029 1.00 0.00 C ATOM 1690 CE2 TYR B 95 47.859 27.002 -30.540 1.00 0.00 C ATOM 1691 CZ TYR B 95 47.961 27.604 -29.281 1.00 0.00 C ATOM 1692 OH TYR B 95 46.864 27.437 -28.491 1.00 0.00 O ATOM 1693 OXT TYR B 95 52.912 28.260 -34.503 1.00 0.00 O ATOM 0 H TYR B 95 50.131 28.896 -34.567 1.00 0.00 H new ATOM 0 HA TYR B 95 51.412 30.124 -32.249 1.00 0.00 H new ATOM 0 HB2 TYR B 95 51.211 27.067 -32.687 1.00 0.00 H new ATOM 0 HB3 TYR B 95 52.135 27.829 -31.408 1.00 0.00 H new ATOM 0 HD1 TYR B 95 50.743 29.515 -29.798 1.00 0.00 H new ATOM 0 HD2 TYR B 95 48.842 26.649 -32.428 1.00 0.00 H new ATOM 0 HE1 TYR B 95 48.945 29.151 -28.121 1.00 0.00 H new ATOM 0 HE2 TYR B 95 46.978 26.433 -30.797 1.00 0.00 H new ATOM 0 HH TYR B 95 46.305 26.719 -28.855 1.00 0.00 H new TER 1703 TYR B 95