USER MOD reduce.3.24.130724 H: found=0, std=0, add=829, rem=0, adj=20 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 X(o=-0.23,f=-0.52) USER MOD Set 1.2: B 88 GLN : amide:sc= -0.227 K(o=-0.23,f=-2.5!) USER MOD Set 2.1: B 47 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: B 51 GLN : amide:sc= -0.0528 X(o=-0.053,f=-0.49) USER MOD Single : B 1 MET CE :methyl -176:sc= 0 (180deg=-0.028) USER MOD Single : B 1 MET N :NH3+ -179:sc= 0.0771 (180deg=0.0753) USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 172:sc=-0.00524 (180deg=-0.0977) USER MOD Single : B 12 THR OG1 : rot 132:sc= 1.3 USER MOD Single : B 14 ASN : amide:sc= -0.103 K(o=-0.1,f=-3.6!) USER MOD Single : B 15 ASN : amide:sc= -0.21 X(o=-0.21,f=-0.51) USER MOD Single : B 17 HIS : no HD1:sc= -3.02! C(o=-3!,f=-4.3!) USER MOD Single : B 19 ASN : amide:sc= 1.15 K(o=1.1,f=-0.21) USER MOD Single : B 21 LYS NZ :NH3+ 149:sc= -0.0804 (180deg=-0.111) USER MOD Single : B 25 GLN : amide:sc= 0.375 X(o=0.37,f=-0.0028) USER MOD Single : B 28 SER OG : rot -100:sc= 1.24 USER MOD Single : B 31 GLN : amide:sc= -0.435 K(o=-0.44,f=-4.2!) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 LYS NZ :NH3+ 162:sc= 1.2 (180deg=0.712) USER MOD Single : B 37 HIS : no HD1:sc= 0.0354 K(o=0.035,f=-0.54) USER MOD Single : B 38 THR OG1 : rot 180:sc= 0 USER MOD Single : B 41 SER OG : rot 180:sc=-0.000315 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 MET CE :methyl 173:sc= -0.0107 (180deg=-0.0756) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 48 CYS SG : rot -79:sc= -0.942 USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 55 MET CE :methyl 175:sc= 0 (180deg=-0.0411) USER MOD Single : B 65 GLN : amide:sc= -0.0323 K(o=-0.032,f=-1.4) USER MOD Single : B 68 ASN : amide:sc= -0.415 X(o=-0.42,f=0) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0.0183 USER MOD Single : B 72 THR OG1 : rot 180:sc= 0.0948 USER MOD Single : B 75 GLN : amide:sc= 0.275 X(o=0.27,f=-0.033) USER MOD Single : B 78 MET CE :methyl -145:sc= -0.103 (180deg=-0.965) USER MOD Single : B 83 THR OG1 : rot 180:sc= 0 USER MOD Single : B 89 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : B 90 GLN : amide:sc= 0 X(o=0,f=0) 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 10.253 12.781 -44.283 1.00 0.00 C HETATM 2 O ACE A 36 10.660 12.327 -43.238 1.00 0.00 O HETATM 3 CH3 ACE A 36 9.980 14.185 -44.578 1.00 0.00 C HETATM 0 H1 ACE A 36 10.606 14.511 -45.409 1.00 0.00 H new HETATM 0 H2 ACE A 36 8.930 14.303 -44.846 1.00 0.00 H new HETATM 0 H3 ACE A 36 10.200 14.791 -43.699 1.00 0.00 H new ATOM 7 N GLU A 37 9.994 11.924 -45.218 1.00 0.00 N ATOM 8 CA GLU A 37 10.200 10.449 -45.189 1.00 0.00 C ATOM 9 C GLU A 37 11.647 10.083 -44.819 1.00 0.00 C ATOM 10 O GLU A 37 11.860 9.100 -44.148 1.00 0.00 O ATOM 11 CB GLU A 37 9.674 9.856 -46.530 1.00 0.00 C ATOM 12 CG GLU A 37 9.705 8.276 -46.802 1.00 0.00 C ATOM 13 CD GLU A 37 8.888 7.534 -45.806 1.00 0.00 C ATOM 14 OE1 GLU A 37 8.070 8.098 -45.114 1.00 0.00 O ATOM 15 OE2 GLU A 37 9.219 6.313 -45.453 1.00 0.00 O ATOM 0 H GLU A 37 9.600 12.228 -46.108 1.00 0.00 H new ATOM 0 HA GLU A 37 9.620 9.986 -44.391 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.638 10.178 -46.637 1.00 0.00 H new ATOM 0 HB3 GLU A 37 10.240 10.329 -47.332 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.331 8.071 -47.805 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.735 7.920 -46.767 1.00 0.00 H new ATOM 22 N ASP A 38 12.588 10.892 -45.250 1.00 0.00 N ATOM 23 CA ASP A 38 13.995 10.688 -44.935 1.00 0.00 C ATOM 24 C ASP A 38 14.431 11.194 -43.545 1.00 0.00 C ATOM 25 O ASP A 38 15.639 11.172 -43.233 1.00 0.00 O ATOM 26 CB ASP A 38 14.798 11.290 -46.077 1.00 0.00 C ATOM 27 CG ASP A 38 16.205 10.703 -46.041 1.00 0.00 C ATOM 28 OD1 ASP A 38 16.508 9.564 -45.654 1.00 0.00 O ATOM 29 OD2 ASP A 38 17.060 11.441 -46.592 1.00 0.00 O ATOM 0 H ASP A 38 12.406 11.712 -45.829 1.00 0.00 H new ATOM 0 HA ASP A 38 14.187 9.618 -44.853 1.00 0.00 H new ATOM 0 HB2 ASP A 38 14.321 11.071 -47.032 1.00 0.00 H new ATOM 0 HB3 ASP A 38 14.838 12.375 -45.981 1.00 0.00 H new ATOM 34 N ALA A 39 13.523 11.909 -42.830 1.00 0.00 N ATOM 35 CA ALA A 39 13.810 12.417 -41.432 1.00 0.00 C ATOM 36 C ALA A 39 13.687 11.326 -40.363 1.00 0.00 C ATOM 37 O ALA A 39 13.120 11.503 -39.271 1.00 0.00 O ATOM 38 CB ALA A 39 12.793 13.510 -41.093 1.00 0.00 C ATOM 0 H ALA A 39 12.596 12.152 -43.178 1.00 0.00 H new ATOM 0 HA ALA A 39 14.837 12.783 -41.428 1.00 0.00 H new ATOM 0 HB1 ALA A 39 12.985 13.887 -40.089 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.883 14.326 -41.810 1.00 0.00 H new ATOM 0 HB3 ALA A 39 11.786 13.096 -41.138 1.00 0.00 H new ATOM 44 N PHE A 40 14.089 10.072 -40.714 1.00 0.00 N ATOM 45 CA PHE A 40 13.739 8.749 -40.149 1.00 0.00 C ATOM 46 C PHE A 40 14.871 7.724 -40.496 1.00 0.00 C ATOM 47 O PHE A 40 15.008 7.387 -41.681 1.00 0.00 O ATOM 48 CB PHE A 40 12.383 8.272 -40.804 1.00 0.00 C ATOM 49 CG PHE A 40 11.532 7.455 -39.762 1.00 0.00 C ATOM 50 CD1 PHE A 40 10.699 8.132 -38.840 1.00 0.00 C ATOM 51 CD2 PHE A 40 11.692 6.062 -39.676 1.00 0.00 C ATOM 52 CE1 PHE A 40 10.003 7.425 -37.881 1.00 0.00 C ATOM 53 CE2 PHE A 40 10.929 5.389 -38.738 1.00 0.00 C ATOM 54 CZ PHE A 40 10.145 6.053 -37.818 1.00 0.00 C ATOM 0 H PHE A 40 14.741 9.958 -41.490 1.00 0.00 H new ATOM 0 HA PHE A 40 13.632 8.816 -39.066 1.00 0.00 H new ATOM 0 HB2 PHE A 40 11.815 9.135 -41.151 1.00 0.00 H new ATOM 0 HB3 PHE A 40 12.591 7.655 -41.678 1.00 0.00 H new ATOM 0 HD1 PHE A 40 10.608 9.207 -38.887 1.00 0.00 H new ATOM 0 HD2 PHE A 40 12.384 5.536 -40.317 1.00 0.00 H new ATOM 0 HE1 PHE A 40 9.354 7.939 -37.187 1.00 0.00 H new ATOM 0 HE2 PHE A 40 10.948 4.309 -38.726 1.00 0.00 H new ATOM 0 HZ PHE A 40 9.639 5.496 -37.043 1.00 0.00 H new ATOM 64 N ILE A 41 15.662 7.396 -39.471 1.00 0.00 N ATOM 65 CA ILE A 41 16.806 6.472 -39.565 1.00 0.00 C ATOM 66 C ILE A 41 16.369 5.207 -38.717 1.00 0.00 C ATOM 67 O ILE A 41 15.958 5.297 -37.535 1.00 0.00 O ATOM 68 CB ILE A 41 18.129 7.122 -39.077 1.00 0.00 C ATOM 69 CG1 ILE A 41 18.523 8.413 -39.841 1.00 0.00 C ATOM 70 CG2 ILE A 41 19.196 6.105 -39.257 1.00 0.00 C ATOM 71 CD1 ILE A 41 17.710 9.648 -39.517 1.00 0.00 C ATOM 0 H ILE A 41 15.526 7.770 -38.532 1.00 0.00 H new ATOM 0 HA ILE A 41 17.032 6.193 -40.594 1.00 0.00 H new ATOM 0 HB ILE A 41 17.994 7.425 -38.039 1.00 0.00 H new ATOM 0 HG12 ILE A 41 19.572 8.628 -39.635 1.00 0.00 H new ATOM 0 HG13 ILE A 41 18.441 8.218 -40.910 1.00 0.00 H new ATOM 0 HG21 ILE A 41 20.150 6.516 -38.927 1.00 0.00 H new ATOM 0 HG22 ILE A 41 18.958 5.220 -38.667 1.00 0.00 H new ATOM 0 HG23 ILE A 41 19.264 5.831 -40.310 1.00 0.00 H new ATOM 0 HD11 ILE A 41 18.073 10.488 -40.109 1.00 0.00 H new ATOM 0 HD12 ILE A 41 16.661 9.465 -39.752 1.00 0.00 H new ATOM 0 HD13 ILE A 41 17.809 9.881 -38.457 1.00 0.00 H new ATOM 83 N VAL A 42 16.601 3.989 -39.181 1.00 0.00 N ATOM 84 CA VAL A 42 16.104 2.756 -38.542 1.00 0.00 C ATOM 85 C VAL A 42 17.215 1.692 -38.579 1.00 0.00 C ATOM 86 O VAL A 42 17.783 1.317 -39.607 1.00 0.00 O ATOM 87 CB VAL A 42 14.783 2.227 -39.181 1.00 0.00 C ATOM 88 CG1 VAL A 42 13.957 1.291 -38.253 1.00 0.00 C ATOM 89 CG2 VAL A 42 13.733 3.379 -39.359 1.00 0.00 C ATOM 0 H VAL A 42 17.147 3.815 -40.025 1.00 0.00 H new ATOM 0 HA VAL A 42 15.851 2.988 -37.508 1.00 0.00 H new ATOM 0 HB VAL A 42 15.143 1.746 -40.091 1.00 0.00 H new ATOM 0 HG11 VAL A 42 13.055 0.968 -38.772 1.00 0.00 H new ATOM 0 HG12 VAL A 42 14.556 0.419 -37.989 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.680 1.829 -37.346 1.00 0.00 H new ATOM 0 HG21 VAL A 42 12.824 2.977 -39.807 1.00 0.00 H new ATOM 0 HG22 VAL A 42 13.498 3.811 -38.386 1.00 0.00 H new ATOM 0 HG23 VAL A 42 14.146 4.151 -40.008 1.00 0.00 H new ATOM 99 N ILE A 43 17.672 1.264 -37.408 1.00 0.00 N ATOM 100 CA ILE A 43 18.926 0.482 -37.121 1.00 0.00 C ATOM 101 C ILE A 43 18.609 -0.456 -36.011 1.00 0.00 C ATOM 102 O ILE A 43 17.844 -0.092 -35.143 1.00 0.00 O ATOM 103 CB ILE A 43 20.138 1.463 -36.848 1.00 0.00 C ATOM 104 CG1 ILE A 43 20.536 2.439 -37.948 1.00 0.00 C ATOM 105 CG2 ILE A 43 21.466 0.741 -36.440 1.00 0.00 C ATOM 106 CD1 ILE A 43 21.429 3.648 -37.522 1.00 0.00 C ATOM 0 H ILE A 43 17.154 1.456 -36.550 1.00 0.00 H new ATOM 0 HA ILE A 43 19.254 -0.113 -37.973 1.00 0.00 H new ATOM 0 HB ILE A 43 19.694 2.031 -36.030 1.00 0.00 H new ATOM 0 HG12 ILE A 43 21.063 1.882 -38.723 1.00 0.00 H new ATOM 0 HG13 ILE A 43 19.626 2.831 -38.401 1.00 0.00 H new ATOM 0 HG21 ILE A 43 22.246 1.483 -36.271 1.00 0.00 H new ATOM 0 HG22 ILE A 43 21.304 0.170 -35.526 1.00 0.00 H new ATOM 0 HG23 ILE A 43 21.774 0.066 -37.239 1.00 0.00 H new ATOM 0 HD11 ILE A 43 21.643 4.267 -38.393 1.00 0.00 H new ATOM 0 HD12 ILE A 43 20.904 4.242 -36.774 1.00 0.00 H new ATOM 0 HD13 ILE A 43 22.364 3.279 -37.101 1.00 0.00 H new HETATM 118 N SEP A 44 19.205 -1.655 -36.093 1.00 0.00 N HETATM 119 CA SEP A 44 19.466 -2.651 -35.035 1.00 0.00 C HETATM 120 CB SEP A 44 18.352 -3.740 -35.107 1.00 0.00 C HETATM 121 OG SEP A 44 18.510 -4.729 -36.155 1.00 0.00 O HETATM 122 C SEP A 44 20.817 -3.323 -35.147 1.00 0.00 C HETATM 123 O SEP A 44 21.520 -3.016 -36.107 1.00 0.00 O HETATM 124 P SEP A 44 18.003 -6.212 -35.999 1.00 0.00 P HETATM 125 O1P SEP A 44 18.104 -6.805 -37.342 1.00 0.00 O HETATM 126 O2P SEP A 44 18.923 -6.844 -35.071 1.00 0.00 O HETATM 127 O3P SEP A 44 16.620 -6.120 -35.535 1.00 0.00 O HETATM 0 HB3 SEP A 44 18.311 -4.256 -34.148 1.00 0.00 H new HETATM 0 HB2 SEP A 44 17.391 -3.243 -35.243 1.00 0.00 H new HETATM 0 HA SEP A 44 19.464 -2.119 -34.084 1.00 0.00 H new ATOM 132 N ASP A 45 21.188 -4.151 -34.184 1.00 0.00 N ATOM 133 CA ASP A 45 22.557 -4.590 -34.045 1.00 0.00 C ATOM 134 C ASP A 45 22.806 -6.030 -33.591 1.00 0.00 C ATOM 135 O ASP A 45 23.846 -6.301 -33.055 1.00 0.00 O ATOM 136 CB ASP A 45 23.295 -3.537 -33.087 1.00 0.00 C ATOM 137 CG ASP A 45 24.828 -3.747 -33.156 1.00 0.00 C ATOM 138 OD1 ASP A 45 25.351 -3.977 -34.253 1.00 0.00 O ATOM 139 OD2 ASP A 45 25.502 -3.588 -32.130 1.00 0.00 O ATOM 0 H ASP A 45 20.551 -4.532 -33.485 1.00 0.00 H new ATOM 0 HA ASP A 45 22.968 -4.615 -35.054 1.00 0.00 H new ATOM 0 HB2 ASP A 45 23.044 -2.520 -33.388 1.00 0.00 H new ATOM 0 HB3 ASP A 45 22.948 -3.660 -32.061 1.00 0.00 H new HETATM 144 N SEP A 46 21.947 -6.959 -33.898 1.00 0.00 N HETATM 145 CA SEP A 46 22.222 -8.520 -33.851 1.00 0.00 C HETATM 146 CB SEP A 46 21.584 -9.227 -32.661 1.00 0.00 C HETATM 147 OG SEP A 46 20.199 -9.443 -32.693 1.00 0.00 O HETATM 148 C SEP A 46 21.996 -9.316 -35.134 1.00 0.00 C HETATM 149 O SEP A 46 21.227 -8.858 -36.000 1.00 0.00 O HETATM 150 P SEP A 46 19.411 -9.876 -31.412 1.00 0.00 P HETATM 151 O1P SEP A 46 18.048 -10.023 -31.943 1.00 0.00 O HETATM 152 O2P SEP A 46 19.991 -11.143 -30.875 1.00 0.00 O HETATM 153 O3P SEP A 46 19.491 -8.710 -30.580 1.00 0.00 O HETATM 0 HB3 SEP A 46 22.071 -10.195 -32.547 1.00 0.00 H new HETATM 0 HB2 SEP A 46 21.812 -8.648 -31.766 1.00 0.00 H new HETATM 0 HA SEP A 46 23.304 -8.519 -33.720 1.00 0.00 H new ATOM 158 N ASP A 47 22.692 -10.493 -35.289 1.00 0.00 N ATOM 159 CA ASP A 47 22.735 -11.375 -36.392 1.00 0.00 C ATOM 160 C ASP A 47 22.357 -12.808 -35.881 1.00 0.00 C ATOM 161 O ASP A 47 22.893 -13.333 -34.903 1.00 0.00 O ATOM 162 CB ASP A 47 24.147 -11.196 -37.047 1.00 0.00 C ATOM 163 CG ASP A 47 24.432 -12.106 -38.218 1.00 0.00 C ATOM 164 OD1 ASP A 47 23.474 -12.435 -38.923 1.00 0.00 O ATOM 165 OD2 ASP A 47 25.634 -12.278 -38.555 1.00 0.00 O ATOM 0 H ASP A 47 23.284 -10.836 -34.532 1.00 0.00 H new ATOM 0 HA ASP A 47 22.012 -11.173 -37.183 1.00 0.00 H new ATOM 0 HB2 ASP A 47 24.248 -10.162 -37.378 1.00 0.00 H new ATOM 0 HB3 ASP A 47 24.908 -11.363 -36.284 1.00 0.00 H new ATOM 170 N GLY A 48 21.367 -13.419 -36.542 1.00 0.00 N ATOM 171 CA GLY A 48 20.889 -14.777 -36.108 1.00 0.00 C ATOM 172 C GLY A 48 19.754 -15.312 -36.998 1.00 0.00 C ATOM 173 O GLY A 48 19.172 -14.605 -37.830 1.00 0.00 O ATOM 0 H GLY A 48 20.884 -13.030 -37.352 1.00 0.00 H new ATOM 0 HA2 GLY A 48 21.724 -15.477 -36.129 1.00 0.00 H new ATOM 0 HA3 GLY A 48 20.543 -14.725 -35.076 1.00 0.00 H new ATOM 177 N GLU A 49 19.461 -16.547 -36.822 1.00 0.00 N ATOM 178 CA GLU A 49 18.136 -17.138 -36.862 1.00 0.00 C ATOM 179 C GLU A 49 17.927 -17.937 -35.599 1.00 0.00 C ATOM 180 O GLU A 49 18.853 -18.279 -34.830 1.00 0.00 O ATOM 181 CB GLU A 49 18.147 -17.786 -38.269 1.00 0.00 C ATOM 182 CG GLU A 49 17.039 -18.833 -38.592 1.00 0.00 C ATOM 183 CD GLU A 49 15.657 -18.181 -38.542 1.00 0.00 C ATOM 184 OE1 GLU A 49 15.380 -17.137 -37.887 1.00 0.00 O ATOM 185 OE2 GLU A 49 14.772 -18.687 -39.252 1.00 0.00 O ATOM 0 H GLU A 49 20.183 -17.241 -36.630 1.00 0.00 H new ATOM 0 HA GLU A 49 17.241 -16.519 -36.812 1.00 0.00 H new ATOM 0 HB2 GLU A 49 18.079 -16.987 -39.007 1.00 0.00 H new ATOM 0 HB3 GLU A 49 19.115 -18.268 -38.409 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.211 -19.260 -39.580 1.00 0.00 H new ATOM 0 HG3 GLU A 49 17.087 -19.654 -37.877 1.00 0.00 H new HETATM 192 N NH2 A 50 16.746 -18.400 -35.457 1.00 0.00 N TER 195 NH2 A 50 ATOM 196 N MET B 1 -10.608 -27.883 -37.355 1.00 0.00 N ATOM 197 CA MET B 1 -10.310 -26.525 -36.889 1.00 0.00 C ATOM 198 C MET B 1 -9.232 -25.885 -37.696 1.00 0.00 C ATOM 199 O MET B 1 -8.300 -26.525 -38.015 1.00 0.00 O ATOM 200 CB MET B 1 -9.859 -26.348 -35.452 1.00 0.00 C ATOM 201 CG MET B 1 -10.570 -27.215 -34.439 1.00 0.00 C ATOM 202 SD MET B 1 -12.350 -27.237 -34.547 1.00 0.00 S ATOM 203 CE MET B 1 -12.578 -27.219 -32.787 1.00 0.00 C ATOM 0 H1 MET B 1 -11.374 -28.287 -36.779 1.00 0.00 H new ATOM 0 H2 MET B 1 -10.904 -27.851 -38.352 1.00 0.00 H new ATOM 0 H3 MET B 1 -9.758 -28.475 -37.265 1.00 0.00 H new ATOM 0 HA MET B 1 -11.294 -26.067 -36.996 1.00 0.00 H new ATOM 0 HB2 MET B 1 -8.790 -26.555 -35.396 1.00 0.00 H new ATOM 0 HB3 MET B 1 -9.996 -25.304 -35.172 1.00 0.00 H new ATOM 0 HG2 MET B 1 -10.206 -28.237 -34.545 1.00 0.00 H new ATOM 0 HG3 MET B 1 -10.290 -26.879 -33.441 1.00 0.00 H new ATOM 0 HE1 MET B 1 -13.640 -27.300 -32.557 1.00 0.00 H new ATOM 0 HE2 MET B 1 -12.045 -28.059 -32.342 1.00 0.00 H new ATOM 0 HE3 MET B 1 -12.189 -26.286 -32.379 1.00 0.00 H new ATOM 215 N ALA B 2 -9.304 -24.608 -38.077 1.00 0.00 N ATOM 216 CA ALA B 2 -8.205 -23.899 -38.809 1.00 0.00 C ATOM 217 C ALA B 2 -6.928 -23.805 -37.976 1.00 0.00 C ATOM 218 O ALA B 2 -6.995 -23.887 -36.749 1.00 0.00 O ATOM 219 CB ALA B 2 -8.848 -22.515 -39.162 1.00 0.00 C ATOM 0 H ALA B 2 -10.117 -24.020 -37.896 1.00 0.00 H new ATOM 0 HA ALA B 2 -7.865 -24.421 -39.703 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -8.125 -21.906 -39.705 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -9.730 -22.671 -39.783 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -9.136 -22.003 -38.244 1.00 0.00 H new ATOM 225 N ASP B 3 -5.720 -23.654 -38.536 1.00 0.00 N ATOM 226 CA ASP B 3 -4.425 -23.354 -37.947 1.00 0.00 C ATOM 227 C ASP B 3 -4.351 -22.078 -37.056 1.00 0.00 C ATOM 228 O ASP B 3 -3.268 -21.475 -37.019 1.00 0.00 O ATOM 229 CB ASP B 3 -3.491 -23.348 -39.188 1.00 0.00 C ATOM 230 CG ASP B 3 -2.045 -23.472 -38.700 1.00 0.00 C ATOM 231 OD1 ASP B 3 -1.744 -24.111 -37.663 1.00 0.00 O ATOM 232 OD2 ASP B 3 -1.116 -23.136 -39.490 1.00 0.00 O ATOM 0 H ASP B 3 -5.627 -23.755 -39.547 1.00 0.00 H new ATOM 0 HA ASP B 3 -4.137 -24.088 -37.194 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -3.739 -24.174 -39.854 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -3.622 -22.428 -39.758 1.00 0.00 H new ATOM 237 N GLU B 4 -5.335 -21.690 -36.347 1.00 0.00 N ATOM 238 CA GLU B 4 -5.534 -20.442 -35.597 1.00 0.00 C ATOM 239 C GLU B 4 -4.767 -20.540 -34.243 1.00 0.00 C ATOM 240 O GLU B 4 -4.777 -21.566 -33.590 1.00 0.00 O ATOM 241 CB GLU B 4 -7.014 -20.293 -35.343 1.00 0.00 C ATOM 242 CG GLU B 4 -7.396 -18.999 -34.673 1.00 0.00 C ATOM 243 CD GLU B 4 -6.907 -17.767 -35.379 1.00 0.00 C ATOM 244 OE1 GLU B 4 -7.688 -17.284 -36.247 1.00 0.00 O ATOM 245 OE2 GLU B 4 -5.723 -17.436 -35.306 1.00 0.00 O ATOM 0 H GLU B 4 -6.148 -22.297 -36.243 1.00 0.00 H new ATOM 0 HA GLU B 4 -5.160 -19.582 -36.153 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -7.544 -20.368 -36.292 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -7.351 -21.124 -34.723 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -8.482 -18.951 -34.595 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -7.003 -19.001 -33.656 1.00 0.00 H new ATOM 252 N LYS B 5 -4.125 -19.388 -33.866 1.00 0.00 N ATOM 253 CA LYS B 5 -3.441 -19.217 -32.553 1.00 0.00 C ATOM 254 C LYS B 5 -3.393 -17.828 -31.880 1.00 0.00 C ATOM 255 O LYS B 5 -3.273 -16.879 -32.632 1.00 0.00 O ATOM 256 CB LYS B 5 -2.061 -19.868 -32.542 1.00 0.00 C ATOM 257 CG LYS B 5 -1.270 -19.961 -31.251 1.00 0.00 C ATOM 258 CD LYS B 5 -0.002 -20.727 -31.438 1.00 0.00 C ATOM 259 CE LYS B 5 0.784 -21.107 -30.140 1.00 0.00 C ATOM 260 NZ LYS B 5 2.239 -21.486 -30.407 1.00 0.00 N ATOM 0 H LYS B 5 -4.071 -18.563 -34.463 1.00 0.00 H new ATOM 0 HA LYS B 5 -4.143 -19.745 -31.908 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -2.180 -20.883 -32.922 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -1.444 -19.329 -33.261 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -1.040 -18.958 -30.891 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -1.878 -20.443 -30.485 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -0.235 -21.646 -31.976 1.00 0.00 H new ATOM 0 HD3 LYS B 5 0.659 -20.142 -32.077 1.00 0.00 H new ATOM 0 HE2 LYS B 5 0.756 -20.266 -29.447 1.00 0.00 H new ATOM 0 HE3 LYS B 5 0.282 -21.941 -29.650 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.705 -21.727 -29.509 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 2.273 -22.306 -31.046 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 2.731 -20.683 -30.848 1.00 0.00 H new ATOM 274 N PRO B 6 -3.432 -17.648 -30.564 1.00 0.00 N ATOM 275 CA PRO B 6 -3.413 -16.325 -29.969 1.00 0.00 C ATOM 276 C PRO B 6 -2.035 -15.718 -30.032 1.00 0.00 C ATOM 277 O PRO B 6 -1.119 -16.481 -29.664 1.00 0.00 O ATOM 278 CB PRO B 6 -3.871 -16.482 -28.533 1.00 0.00 C ATOM 279 CG PRO B 6 -3.542 -17.909 -28.187 1.00 0.00 C ATOM 280 CD PRO B 6 -3.908 -18.562 -29.503 1.00 0.00 C ATOM 0 HA PRO B 6 -4.073 -15.650 -30.515 1.00 0.00 H new ATOM 0 HB2 PRO B 6 -3.355 -15.784 -27.873 1.00 0.00 H new ATOM 0 HB3 PRO B 6 -4.938 -16.285 -28.433 1.00 0.00 H new ATOM 0 HG2 PRO B 6 -2.493 -18.048 -27.925 1.00 0.00 H new ATOM 0 HG3 PRO B 6 -4.131 -18.286 -27.351 1.00 0.00 H new ATOM 0 HD2 PRO B 6 -3.440 -19.542 -29.595 1.00 0.00 H new ATOM 0 HD3 PRO B 6 -4.985 -18.715 -29.575 1.00 0.00 H new ATOM 288 N LYS B 7 -1.816 -14.501 -30.357 1.00 0.00 N ATOM 289 CA LYS B 7 -0.650 -13.636 -30.390 1.00 0.00 C ATOM 290 C LYS B 7 -0.588 -12.580 -29.257 1.00 0.00 C ATOM 291 O LYS B 7 -1.660 -12.213 -28.794 1.00 0.00 O ATOM 292 CB LYS B 7 -0.537 -12.967 -31.803 1.00 0.00 C ATOM 293 CG LYS B 7 0.956 -12.592 -32.110 1.00 0.00 C ATOM 294 CD LYS B 7 1.173 -11.741 -33.365 1.00 0.00 C ATOM 295 CE LYS B 7 2.534 -11.675 -33.948 1.00 0.00 C ATOM 296 NZ LYS B 7 2.508 -10.971 -35.254 1.00 0.00 N ATOM 0 H LYS B 7 -2.618 -13.958 -30.678 1.00 0.00 H new ATOM 0 HA LYS B 7 0.213 -14.276 -30.205 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -0.912 -13.648 -32.567 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -1.159 -12.073 -31.840 1.00 0.00 H new ATOM 0 HG2 LYS B 7 1.362 -12.055 -31.253 1.00 0.00 H new ATOM 0 HG3 LYS B 7 1.531 -13.512 -32.211 1.00 0.00 H new ATOM 0 HD2 LYS B 7 0.499 -12.112 -34.137 1.00 0.00 H new ATOM 0 HD3 LYS B 7 0.862 -10.722 -33.133 1.00 0.00 H new ATOM 0 HE2 LYS B 7 3.205 -11.157 -33.263 1.00 0.00 H new ATOM 0 HE3 LYS B 7 2.929 -12.683 -34.079 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 3.470 -10.934 -35.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 1.884 -11.481 -35.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 2.152 -10.003 -35.120 1.00 0.00 H new ATOM 310 N GLU B 8 0.552 -12.353 -28.684 1.00 0.00 N ATOM 311 CA GLU B 8 0.768 -11.317 -27.602 1.00 0.00 C ATOM 312 C GLU B 8 2.093 -10.552 -27.703 1.00 0.00 C ATOM 313 O GLU B 8 3.024 -11.109 -28.344 1.00 0.00 O ATOM 314 CB GLU B 8 0.621 -12.086 -26.208 1.00 0.00 C ATOM 315 CG GLU B 8 1.395 -13.464 -26.078 1.00 0.00 C ATOM 316 CD GLU B 8 0.819 -14.437 -24.987 1.00 0.00 C ATOM 317 OE1 GLU B 8 0.825 -14.081 -23.808 1.00 0.00 O ATOM 318 OE2 GLU B 8 0.178 -15.453 -25.391 1.00 0.00 O ATOM 0 H GLU B 8 1.401 -12.865 -28.925 1.00 0.00 H new ATOM 0 HA GLU B 8 0.023 -10.528 -27.710 1.00 0.00 H new ATOM 0 HB2 GLU B 8 0.967 -11.424 -25.414 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -0.438 -12.271 -26.030 1.00 0.00 H new ATOM 0 HG2 GLU B 8 1.375 -13.969 -27.044 1.00 0.00 H new ATOM 0 HG3 GLU B 8 2.440 -13.258 -25.847 1.00 0.00 H new ATOM 325 N GLY B 9 2.233 -9.361 -27.096 1.00 0.00 N ATOM 326 CA GLY B 9 3.526 -8.651 -27.135 1.00 0.00 C ATOM 327 C GLY B 9 4.727 -9.247 -26.481 1.00 0.00 C ATOM 328 O GLY B 9 5.813 -8.702 -26.443 1.00 0.00 O ATOM 0 H GLY B 9 1.492 -8.880 -26.586 1.00 0.00 H new ATOM 0 HA2 GLY B 9 3.775 -8.490 -28.184 1.00 0.00 H new ATOM 0 HA3 GLY B 9 3.369 -7.668 -26.690 1.00 0.00 H new ATOM 332 N VAL B 10 4.508 -10.421 -25.951 1.00 0.00 N ATOM 333 CA VAL B 10 5.540 -11.307 -25.381 1.00 0.00 C ATOM 334 C VAL B 10 6.490 -11.989 -26.388 1.00 0.00 C ATOM 335 O VAL B 10 6.558 -13.245 -26.503 1.00 0.00 O ATOM 336 CB VAL B 10 4.943 -12.416 -24.359 1.00 0.00 C ATOM 337 CG1 VAL B 10 5.902 -13.234 -23.550 1.00 0.00 C ATOM 338 CG2 VAL B 10 3.900 -11.880 -23.371 1.00 0.00 C ATOM 0 H VAL B 10 3.572 -10.821 -25.893 1.00 0.00 H new ATOM 0 HA VAL B 10 6.153 -10.596 -24.827 1.00 0.00 H new ATOM 0 HB VAL B 10 4.500 -13.073 -25.107 1.00 0.00 H new ATOM 0 HG11 VAL B 10 5.346 -13.927 -22.918 1.00 0.00 H new ATOM 0 HG12 VAL B 10 6.555 -13.796 -24.218 1.00 0.00 H new ATOM 0 HG13 VAL B 10 6.504 -12.575 -22.924 1.00 0.00 H new ATOM 0 HG21 VAL B 10 3.557 -12.691 -22.728 1.00 0.00 H new ATOM 0 HG22 VAL B 10 4.347 -11.096 -22.759 1.00 0.00 H new ATOM 0 HG23 VAL B 10 3.053 -11.471 -23.922 1.00 0.00 H new ATOM 348 N LYS B 11 7.058 -11.144 -27.354 1.00 0.00 N ATOM 349 CA LYS B 11 7.886 -11.725 -28.335 1.00 0.00 C ATOM 350 C LYS B 11 9.011 -10.772 -28.696 1.00 0.00 C ATOM 351 O LYS B 11 8.864 -9.520 -28.717 1.00 0.00 O ATOM 352 CB LYS B 11 7.084 -12.149 -29.546 1.00 0.00 C ATOM 353 CG LYS B 11 7.767 -13.042 -30.509 1.00 0.00 C ATOM 354 CD LYS B 11 6.850 -13.316 -31.724 1.00 0.00 C ATOM 355 CE LYS B 11 7.531 -14.218 -32.769 1.00 0.00 C ATOM 356 NZ LYS B 11 7.881 -15.549 -32.210 1.00 0.00 N ATOM 0 H LYS B 11 6.928 -10.134 -27.416 1.00 0.00 H new ATOM 0 HA LYS B 11 8.335 -12.631 -27.927 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.180 -12.649 -29.199 1.00 0.00 H new ATOM 0 HB3 LYS B 11 6.768 -11.251 -30.078 1.00 0.00 H new ATOM 0 HG2 LYS B 11 8.699 -12.585 -30.843 1.00 0.00 H new ATOM 0 HG3 LYS B 11 8.029 -13.981 -30.022 1.00 0.00 H new ATOM 0 HD2 LYS B 11 5.928 -13.788 -31.383 1.00 0.00 H new ATOM 0 HD3 LYS B 11 6.571 -12.370 -32.188 1.00 0.00 H new ATOM 0 HE2 LYS B 11 6.868 -14.347 -33.624 1.00 0.00 H new ATOM 0 HE3 LYS B 11 8.434 -13.730 -33.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 8.212 -16.171 -32.975 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 8.635 -15.441 -31.502 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 7.042 -15.969 -31.761 1.00 0.00 H new ATOM 370 N THR B 12 10.155 -11.347 -29.086 1.00 0.00 N ATOM 371 CA THR B 12 11.287 -10.558 -29.702 1.00 0.00 C ATOM 372 C THR B 12 10.819 -9.682 -30.947 1.00 0.00 C ATOM 373 O THR B 12 11.002 -8.436 -31.074 1.00 0.00 O ATOM 374 CB THR B 12 12.412 -11.482 -30.097 1.00 0.00 C ATOM 375 OG1 THR B 12 11.898 -12.506 -30.834 1.00 0.00 O ATOM 376 CG2 THR B 12 13.098 -11.865 -28.797 1.00 0.00 C ATOM 0 H THR B 12 10.344 -12.345 -28.997 1.00 0.00 H new ATOM 0 HA THR B 12 11.642 -9.860 -28.943 1.00 0.00 H new ATOM 0 HB THR B 12 13.168 -11.041 -30.747 1.00 0.00 H new ATOM 0 HG1 THR B 12 12.433 -12.625 -31.647 1.00 0.00 H new ATOM 0 HG21 THR B 12 13.929 -12.538 -29.009 1.00 0.00 H new ATOM 0 HG22 THR B 12 13.474 -10.968 -28.306 1.00 0.00 H new ATOM 0 HG23 THR B 12 12.384 -12.365 -28.142 1.00 0.00 H new ATOM 384 N GLU B 13 10.130 -10.384 -31.858 1.00 0.00 N ATOM 385 CA GLU B 13 9.672 -9.830 -33.122 1.00 0.00 C ATOM 386 C GLU B 13 8.527 -8.826 -32.999 1.00 0.00 C ATOM 387 O GLU B 13 7.862 -8.525 -34.008 1.00 0.00 O ATOM 388 CB GLU B 13 9.399 -10.922 -34.191 1.00 0.00 C ATOM 389 CG GLU B 13 10.518 -11.953 -34.287 1.00 0.00 C ATOM 390 CD GLU B 13 11.911 -11.445 -34.037 1.00 0.00 C ATOM 391 OE1 GLU B 13 12.284 -10.392 -34.483 1.00 0.00 O ATOM 392 OE2 GLU B 13 12.686 -12.203 -33.317 1.00 0.00 O ATOM 0 H GLU B 13 9.877 -11.363 -31.728 1.00 0.00 H new ATOM 0 HA GLU B 13 10.515 -9.240 -33.483 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.464 -11.429 -33.954 1.00 0.00 H new ATOM 0 HB3 GLU B 13 9.266 -10.446 -35.163 1.00 0.00 H new ATOM 0 HG2 GLU B 13 10.311 -12.751 -33.574 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.489 -12.399 -35.281 1.00 0.00 H new ATOM 399 N ASN B 14 8.144 -8.451 -31.719 1.00 0.00 N ATOM 400 CA ASN B 14 7.173 -7.417 -31.316 1.00 0.00 C ATOM 401 C ASN B 14 7.654 -6.578 -30.105 1.00 0.00 C ATOM 402 O ASN B 14 6.840 -5.937 -29.463 1.00 0.00 O ATOM 403 CB ASN B 14 5.840 -8.045 -30.987 1.00 0.00 C ATOM 404 CG ASN B 14 5.306 -8.985 -32.037 1.00 0.00 C ATOM 405 OD1 ASN B 14 5.400 -10.208 -31.961 1.00 0.00 O ATOM 406 ND2 ASN B 14 4.780 -8.465 -33.067 1.00 0.00 N ATOM 0 H ASN B 14 8.549 -8.911 -30.904 1.00 0.00 H new ATOM 0 HA ASN B 14 7.072 -6.743 -32.166 1.00 0.00 H new ATOM 0 HB2 ASN B 14 5.933 -8.589 -30.047 1.00 0.00 H new ATOM 0 HB3 ASN B 14 5.111 -7.251 -30.826 1.00 0.00 H new ATOM 0 HD21 ASN B 14 4.440 -9.061 -33.822 1.00 0.00 H new ATOM 0 HD22 ASN B 14 4.697 -7.451 -33.141 1.00 0.00 H new ATOM 413 N ASN B 15 8.957 -6.453 -29.751 1.00 0.00 N ATOM 414 CA ASN B 15 9.489 -5.709 -28.624 1.00 0.00 C ATOM 415 C ASN B 15 9.773 -4.237 -29.038 1.00 0.00 C ATOM 416 O ASN B 15 10.129 -3.890 -30.171 1.00 0.00 O ATOM 417 CB ASN B 15 10.760 -6.482 -28.151 1.00 0.00 C ATOM 418 CG ASN B 15 11.452 -5.721 -27.074 1.00 0.00 C ATOM 419 OD1 ASN B 15 10.877 -5.494 -26.060 1.00 0.00 O ATOM 420 ND2 ASN B 15 12.682 -5.308 -27.262 1.00 0.00 N ATOM 0 H ASN B 15 9.696 -6.904 -30.290 1.00 0.00 H new ATOM 0 HA ASN B 15 8.783 -5.640 -27.796 1.00 0.00 H new ATOM 0 HB2 ASN B 15 10.479 -7.470 -27.786 1.00 0.00 H new ATOM 0 HB3 ASN B 15 11.437 -6.634 -28.992 1.00 0.00 H new ATOM 0 HD21 ASN B 15 13.161 -4.782 -26.531 1.00 0.00 H new ATOM 0 HD22 ASN B 15 13.160 -5.512 -28.140 1.00 0.00 H new ATOM 427 N ASP B 16 9.697 -3.408 -27.978 1.00 0.00 N ATOM 428 CA ASP B 16 9.699 -1.915 -28.147 1.00 0.00 C ATOM 429 C ASP B 16 11.135 -1.410 -28.570 1.00 0.00 C ATOM 430 O ASP B 16 12.097 -1.675 -27.829 1.00 0.00 O ATOM 431 CB ASP B 16 9.315 -1.157 -26.854 1.00 0.00 C ATOM 432 CG ASP B 16 7.896 -1.542 -26.294 1.00 0.00 C ATOM 433 OD1 ASP B 16 7.047 -2.272 -26.967 1.00 0.00 O ATOM 434 OD2 ASP B 16 7.553 -1.156 -25.110 1.00 0.00 O ATOM 0 H ASP B 16 9.634 -3.724 -27.010 1.00 0.00 H new ATOM 0 HA ASP B 16 8.954 -1.707 -28.915 1.00 0.00 H new ATOM 0 HB2 ASP B 16 10.065 -1.358 -26.089 1.00 0.00 H new ATOM 0 HB3 ASP B 16 9.340 -0.085 -27.051 1.00 0.00 H new ATOM 439 N HIS B 17 11.239 -0.653 -29.621 1.00 0.00 N ATOM 440 CA HIS B 17 12.302 0.358 -29.888 1.00 0.00 C ATOM 441 C HIS B 17 12.174 1.703 -29.133 1.00 0.00 C ATOM 442 O HIS B 17 11.081 1.945 -28.654 1.00 0.00 O ATOM 443 CB HIS B 17 12.114 0.591 -31.401 1.00 0.00 C ATOM 444 CG HIS B 17 12.370 -0.649 -32.327 1.00 0.00 C ATOM 445 ND1 HIS B 17 11.408 -1.276 -33.143 1.00 0.00 N ATOM 446 CD2 HIS B 17 13.493 -1.347 -32.495 1.00 0.00 C ATOM 447 CE1 HIS B 17 11.900 -2.381 -33.695 1.00 0.00 C ATOM 448 NE2 HIS B 17 13.207 -2.462 -33.293 1.00 0.00 N ATOM 0 H HIS B 17 10.559 -0.703 -30.380 1.00 0.00 H new ATOM 0 HA HIS B 17 13.275 -0.005 -29.555 1.00 0.00 H new ATOM 0 HB2 HIS B 17 11.096 0.941 -31.570 1.00 0.00 H new ATOM 0 HB3 HIS B 17 12.783 1.394 -31.710 1.00 0.00 H new ATOM 0 HD2 HIS B 17 14.460 -1.095 -32.085 1.00 0.00 H new ATOM 0 HE1 HIS B 17 11.374 -3.076 -34.333 1.00 0.00 H new ATOM 0 HE2 HIS B 17 13.861 -3.207 -33.534 1.00 0.00 H new ATOM 456 N ILE B 18 13.327 2.442 -29.063 1.00 0.00 N ATOM 457 CA ILE B 18 13.329 3.863 -28.472 1.00 0.00 C ATOM 458 C ILE B 18 13.266 4.912 -29.590 1.00 0.00 C ATOM 459 O ILE B 18 13.852 4.681 -30.635 1.00 0.00 O ATOM 460 CB ILE B 18 14.471 4.141 -27.498 1.00 0.00 C ATOM 461 CG1 ILE B 18 14.290 5.551 -26.857 1.00 0.00 C ATOM 462 CG2 ILE B 18 15.887 3.877 -28.128 1.00 0.00 C ATOM 463 CD1 ILE B 18 15.115 5.628 -25.671 1.00 0.00 C ATOM 0 H ILE B 18 14.237 2.115 -29.387 1.00 0.00 H new ATOM 0 HA ILE B 18 12.427 3.937 -27.865 1.00 0.00 H new ATOM 0 HB ILE B 18 14.424 3.420 -26.682 1.00 0.00 H new ATOM 0 HG12 ILE B 18 14.574 6.328 -27.566 1.00 0.00 H new ATOM 0 HG13 ILE B 18 13.244 5.719 -26.602 1.00 0.00 H new ATOM 0 HG21 ILE B 18 16.660 4.091 -27.390 1.00 0.00 H new ATOM 0 HG22 ILE B 18 15.959 2.834 -28.436 1.00 0.00 H new ATOM 0 HG23 ILE B 18 16.025 4.522 -28.996 1.00 0.00 H new ATOM 0 HD11 ILE B 18 15.000 6.609 -25.211 1.00 0.00 H new ATOM 0 HD12 ILE B 18 14.809 4.857 -24.964 1.00 0.00 H new ATOM 0 HD13 ILE B 18 16.159 5.476 -25.944 1.00 0.00 H new ATOM 475 N ASN B 19 12.662 6.056 -29.380 1.00 0.00 N ATOM 476 CA ASN B 19 12.347 7.064 -30.420 1.00 0.00 C ATOM 477 C ASN B 19 13.055 8.371 -29.977 1.00 0.00 C ATOM 478 O ASN B 19 12.563 9.257 -29.254 1.00 0.00 O ATOM 479 CB ASN B 19 10.821 7.236 -30.545 1.00 0.00 C ATOM 480 CG ASN B 19 10.072 5.965 -30.688 1.00 0.00 C ATOM 481 OD1 ASN B 19 9.823 5.471 -31.780 1.00 0.00 O ATOM 482 ND2 ASN B 19 9.763 5.261 -29.633 1.00 0.00 N ATOM 0 H ASN B 19 12.355 6.343 -28.450 1.00 0.00 H new ATOM 0 HA ASN B 19 12.697 6.765 -31.408 1.00 0.00 H new ATOM 0 HB2 ASN B 19 10.454 7.763 -29.665 1.00 0.00 H new ATOM 0 HB3 ASN B 19 10.608 7.868 -31.407 1.00 0.00 H new ATOM 0 HD21 ASN B 19 9.334 4.342 -29.741 1.00 0.00 H new ATOM 0 HD22 ASN B 19 9.951 5.630 -28.701 1.00 0.00 H new ATOM 489 N LEU B 20 14.252 8.499 -30.572 1.00 0.00 N ATOM 490 CA LEU B 20 15.138 9.673 -30.312 1.00 0.00 C ATOM 491 C LEU B 20 15.256 10.656 -31.546 1.00 0.00 C ATOM 492 O LEU B 20 15.027 10.204 -32.660 1.00 0.00 O ATOM 493 CB LEU B 20 16.549 9.111 -30.046 1.00 0.00 C ATOM 494 CG LEU B 20 16.725 8.570 -28.587 1.00 0.00 C ATOM 495 CD1 LEU B 20 18.103 7.859 -28.357 1.00 0.00 C ATOM 496 CD2 LEU B 20 16.783 9.666 -27.545 1.00 0.00 C ATOM 0 H LEU B 20 14.636 7.820 -31.230 1.00 0.00 H new ATOM 0 HA LEU B 20 14.716 10.236 -29.480 1.00 0.00 H new ATOM 0 HB2 LEU B 20 16.754 8.307 -30.753 1.00 0.00 H new ATOM 0 HB3 LEU B 20 17.286 9.892 -30.230 1.00 0.00 H new ATOM 0 HG LEU B 20 15.863 7.911 -28.484 1.00 0.00 H new ATOM 0 HD11 LEU B 20 18.163 7.507 -27.327 1.00 0.00 H new ATOM 0 HD12 LEU B 20 18.193 7.011 -29.036 1.00 0.00 H new ATOM 0 HD13 LEU B 20 18.912 8.564 -28.547 1.00 0.00 H new ATOM 0 HD21 LEU B 20 16.906 9.222 -26.557 1.00 0.00 H new ATOM 0 HD22 LEU B 20 17.627 10.323 -27.755 1.00 0.00 H new ATOM 0 HD23 LEU B 20 15.858 10.243 -27.572 1.00 0.00 H new ATOM 508 N LYS B 21 15.696 11.913 -31.366 1.00 0.00 N ATOM 509 CA LYS B 21 16.035 12.829 -32.417 1.00 0.00 C ATOM 510 C LYS B 21 17.398 13.392 -32.348 1.00 0.00 C ATOM 511 O LYS B 21 18.046 13.456 -31.291 1.00 0.00 O ATOM 512 CB LYS B 21 14.970 13.913 -32.361 1.00 0.00 C ATOM 513 CG LYS B 21 13.552 13.460 -32.741 1.00 0.00 C ATOM 514 CD LYS B 21 12.623 14.613 -32.971 1.00 0.00 C ATOM 515 CE LYS B 21 11.086 14.361 -33.069 1.00 0.00 C ATOM 516 NZ LYS B 21 10.554 13.749 -31.813 1.00 0.00 N ATOM 0 H LYS B 21 15.823 12.315 -30.437 1.00 0.00 H new ATOM 0 HA LYS B 21 16.051 12.298 -33.369 1.00 0.00 H new ATOM 0 HB2 LYS B 21 14.944 14.323 -31.351 1.00 0.00 H new ATOM 0 HB3 LYS B 21 15.265 14.724 -33.027 1.00 0.00 H new ATOM 0 HG2 LYS B 21 13.599 12.850 -33.643 1.00 0.00 H new ATOM 0 HG3 LYS B 21 13.152 12.828 -31.949 1.00 0.00 H new ATOM 0 HD2 LYS B 21 12.785 15.327 -32.164 1.00 0.00 H new ATOM 0 HD3 LYS B 21 12.932 15.101 -33.895 1.00 0.00 H new ATOM 0 HE2 LYS B 21 10.573 15.303 -33.263 1.00 0.00 H new ATOM 0 HE3 LYS B 21 10.876 13.704 -33.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 9.571 14.056 -31.666 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 10.585 12.712 -31.892 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 11.136 14.052 -31.006 1.00 0.00 H new ATOM 530 N VAL B 22 17.944 13.971 -33.455 1.00 0.00 N ATOM 531 CA VAL B 22 19.282 14.555 -33.569 1.00 0.00 C ATOM 532 C VAL B 22 19.218 15.956 -34.198 1.00 0.00 C ATOM 533 O VAL B 22 19.170 16.057 -35.446 1.00 0.00 O ATOM 534 CB VAL B 22 20.261 13.633 -34.308 1.00 0.00 C ATOM 535 CG1 VAL B 22 21.725 14.123 -34.464 1.00 0.00 C ATOM 536 CG2 VAL B 22 20.337 12.254 -33.539 1.00 0.00 C ATOM 0 H VAL B 22 17.423 14.039 -34.329 1.00 0.00 H new ATOM 0 HA VAL B 22 19.676 14.665 -32.559 1.00 0.00 H new ATOM 0 HB VAL B 22 19.850 13.582 -35.316 1.00 0.00 H new ATOM 0 HG11 VAL B 22 22.304 13.374 -35.004 1.00 0.00 H new ATOM 0 HG12 VAL B 22 21.738 15.061 -35.019 1.00 0.00 H new ATOM 0 HG13 VAL B 22 22.164 14.279 -33.478 1.00 0.00 H new ATOM 0 HG21 VAL B 22 21.030 11.588 -34.054 1.00 0.00 H new ATOM 0 HG22 VAL B 22 20.686 12.424 -32.521 1.00 0.00 H new ATOM 0 HG23 VAL B 22 19.348 11.797 -33.512 1.00 0.00 H new ATOM 546 N ALA B 23 19.247 16.986 -33.302 1.00 0.00 N ATOM 547 CA ALA B 23 19.122 18.438 -33.619 1.00 0.00 C ATOM 548 C ALA B 23 20.297 19.386 -33.323 1.00 0.00 C ATOM 549 O ALA B 23 21.096 19.135 -32.465 1.00 0.00 O ATOM 550 CB ALA B 23 17.815 18.925 -32.980 1.00 0.00 C ATOM 0 H ALA B 23 19.362 16.819 -32.302 1.00 0.00 H new ATOM 0 HA ALA B 23 19.128 18.491 -34.708 1.00 0.00 H new ATOM 0 HB1 ALA B 23 17.682 19.987 -33.187 1.00 0.00 H new ATOM 0 HB2 ALA B 23 16.976 18.366 -33.396 1.00 0.00 H new ATOM 0 HB3 ALA B 23 17.856 18.768 -31.902 1.00 0.00 H new ATOM 556 N GLY B 24 20.288 20.552 -34.004 1.00 0.00 N ATOM 557 CA GLY B 24 21.503 21.361 -34.077 1.00 0.00 C ATOM 558 C GLY B 24 21.283 22.858 -34.020 1.00 0.00 C ATOM 559 O GLY B 24 20.208 23.333 -33.844 1.00 0.00 O ATOM 0 H GLY B 24 19.479 20.936 -34.492 1.00 0.00 H new ATOM 0 HA2 GLY B 24 22.161 21.075 -33.257 1.00 0.00 H new ATOM 0 HA3 GLY B 24 22.025 21.121 -35.003 1.00 0.00 H new ATOM 563 N GLN B 25 22.393 23.567 -34.029 1.00 0.00 N ATOM 564 CA GLN B 25 22.375 25.039 -33.849 1.00 0.00 C ATOM 565 C GLN B 25 21.955 25.746 -35.152 1.00 0.00 C ATOM 566 O GLN B 25 21.578 26.940 -35.171 1.00 0.00 O ATOM 567 CB GLN B 25 23.779 25.512 -33.384 1.00 0.00 C ATOM 568 CG GLN B 25 24.481 24.919 -32.187 1.00 0.00 C ATOM 569 CD GLN B 25 23.493 24.489 -31.106 1.00 0.00 C ATOM 570 OE1 GLN B 25 22.764 25.269 -30.447 1.00 0.00 O ATOM 571 NE2 GLN B 25 23.357 23.195 -30.947 1.00 0.00 N ATOM 0 H GLN B 25 23.323 23.169 -34.157 1.00 0.00 H new ATOM 0 HA GLN B 25 21.640 25.300 -33.087 1.00 0.00 H new ATOM 0 HB2 GLN B 25 24.449 25.382 -34.234 1.00 0.00 H new ATOM 0 HB3 GLN B 25 23.702 26.584 -33.200 1.00 0.00 H new ATOM 0 HG2 GLN B 25 25.072 24.059 -32.502 1.00 0.00 H new ATOM 0 HG3 GLN B 25 25.176 25.650 -31.774 1.00 0.00 H new ATOM 0 HE21 GLN B 25 23.944 22.551 -31.478 1.00 0.00 H new ATOM 0 HE22 GLN B 25 22.664 22.832 -30.293 1.00 0.00 H new ATOM 580 N ASP B 26 21.955 24.973 -36.273 1.00 0.00 N ATOM 581 CA ASP B 26 21.414 25.322 -37.574 1.00 0.00 C ATOM 582 C ASP B 26 19.859 25.187 -37.700 1.00 0.00 C ATOM 583 O ASP B 26 19.262 25.500 -38.705 1.00 0.00 O ATOM 584 CB ASP B 26 22.103 24.497 -38.657 1.00 0.00 C ATOM 585 CG ASP B 26 21.800 22.993 -38.844 1.00 0.00 C ATOM 586 OD1 ASP B 26 21.391 22.401 -37.822 1.00 0.00 O ATOM 587 OD2 ASP B 26 21.972 22.344 -39.876 1.00 0.00 O ATOM 0 H ASP B 26 22.362 24.038 -36.270 1.00 0.00 H new ATOM 0 HA ASP B 26 21.621 26.384 -37.704 1.00 0.00 H new ATOM 0 HB2 ASP B 26 21.890 24.983 -39.609 1.00 0.00 H new ATOM 0 HB3 ASP B 26 23.176 24.585 -38.487 1.00 0.00 H new ATOM 592 N GLY B 27 19.287 24.616 -36.660 1.00 0.00 N ATOM 593 CA GLY B 27 17.819 24.295 -36.670 1.00 0.00 C ATOM 594 C GLY B 27 17.466 22.971 -37.360 1.00 0.00 C ATOM 595 O GLY B 27 16.289 22.663 -37.574 1.00 0.00 O ATOM 0 H GLY B 27 19.776 24.358 -35.803 1.00 0.00 H new ATOM 0 HA2 GLY B 27 17.459 24.262 -35.642 1.00 0.00 H new ATOM 0 HA3 GLY B 27 17.286 25.104 -37.169 1.00 0.00 H new ATOM 599 N SER B 28 18.409 22.112 -37.674 1.00 0.00 N ATOM 600 CA SER B 28 18.141 20.882 -38.337 1.00 0.00 C ATOM 601 C SER B 28 17.402 19.896 -37.405 1.00 0.00 C ATOM 602 O SER B 28 17.706 19.878 -36.188 1.00 0.00 O ATOM 603 CB SER B 28 19.417 20.237 -38.972 1.00 0.00 C ATOM 604 OG SER B 28 20.359 20.043 -37.967 1.00 0.00 O ATOM 0 H SER B 28 19.396 22.263 -37.467 1.00 0.00 H new ATOM 0 HA SER B 28 17.480 21.116 -39.171 1.00 0.00 H new ATOM 0 HB2 SER B 28 19.166 19.287 -39.445 1.00 0.00 H new ATOM 0 HB3 SER B 28 19.821 20.884 -39.751 1.00 0.00 H new ATOM 0 HG SER B 28 21.022 20.764 -37.996 1.00 0.00 H new ATOM 610 N VAL B 29 16.608 18.912 -37.936 1.00 0.00 N ATOM 611 CA VAL B 29 16.034 17.756 -37.222 1.00 0.00 C ATOM 612 C VAL B 29 16.017 16.447 -38.005 1.00 0.00 C ATOM 613 O VAL B 29 15.743 16.464 -39.165 1.00 0.00 O ATOM 614 CB VAL B 29 14.560 18.093 -36.610 1.00 0.00 C ATOM 615 CG1 VAL B 29 14.013 16.832 -35.831 1.00 0.00 C ATOM 616 CG2 VAL B 29 14.578 19.345 -35.594 1.00 0.00 C ATOM 0 H VAL B 29 16.347 18.918 -38.922 1.00 0.00 H new ATOM 0 HA VAL B 29 16.728 17.581 -36.400 1.00 0.00 H new ATOM 0 HB VAL B 29 13.919 18.350 -37.453 1.00 0.00 H new ATOM 0 HG11 VAL B 29 13.028 17.056 -35.422 1.00 0.00 H new ATOM 0 HG12 VAL B 29 13.938 15.986 -36.515 1.00 0.00 H new ATOM 0 HG13 VAL B 29 14.695 16.582 -35.018 1.00 0.00 H new ATOM 0 HG21 VAL B 29 13.570 19.523 -35.218 1.00 0.00 H new ATOM 0 HG22 VAL B 29 15.243 19.126 -34.759 1.00 0.00 H new ATOM 0 HG23 VAL B 29 14.932 20.233 -36.117 1.00 0.00 H new ATOM 626 N VAL B 30 16.325 15.331 -37.369 1.00 0.00 N ATOM 627 CA VAL B 30 16.014 13.965 -37.864 1.00 0.00 C ATOM 628 C VAL B 30 15.472 13.086 -36.708 1.00 0.00 C ATOM 629 O VAL B 30 15.983 13.237 -35.606 1.00 0.00 O ATOM 630 CB VAL B 30 17.283 13.253 -38.431 1.00 0.00 C ATOM 631 CG1 VAL B 30 17.579 13.697 -39.875 1.00 0.00 C ATOM 632 CG2 VAL B 30 18.522 13.226 -37.598 1.00 0.00 C ATOM 0 H VAL B 30 16.810 15.329 -36.472 1.00 0.00 H new ATOM 0 HA VAL B 30 15.272 14.079 -38.654 1.00 0.00 H new ATOM 0 HB VAL B 30 16.981 12.206 -38.406 1.00 0.00 H new ATOM 0 HG11 VAL B 30 18.468 13.182 -40.239 1.00 0.00 H new ATOM 0 HG12 VAL B 30 16.730 13.450 -40.513 1.00 0.00 H new ATOM 0 HG13 VAL B 30 17.748 14.774 -39.897 1.00 0.00 H new ATOM 0 HG21 VAL B 30 19.309 12.696 -38.134 1.00 0.00 H new ATOM 0 HG22 VAL B 30 18.846 14.247 -37.394 1.00 0.00 H new ATOM 0 HG23 VAL B 30 18.317 12.716 -36.657 1.00 0.00 H new ATOM 642 N GLN B 31 14.599 12.103 -36.988 1.00 0.00 N ATOM 643 CA GLN B 31 14.219 11.043 -36.029 1.00 0.00 C ATOM 644 C GLN B 31 14.925 9.662 -36.248 1.00 0.00 C ATOM 645 O GLN B 31 15.434 9.235 -37.289 1.00 0.00 O ATOM 646 CB GLN B 31 12.732 11.015 -35.881 1.00 0.00 C ATOM 647 CG GLN B 31 12.104 10.303 -34.605 1.00 0.00 C ATOM 648 CD GLN B 31 10.592 10.453 -34.505 1.00 0.00 C ATOM 649 OE1 GLN B 31 10.099 11.502 -34.178 1.00 0.00 O ATOM 650 NE2 GLN B 31 9.846 9.372 -34.693 1.00 0.00 N ATOM 0 H GLN B 31 14.132 12.018 -37.891 1.00 0.00 H new ATOM 0 HA GLN B 31 14.626 11.303 -35.052 1.00 0.00 H new ATOM 0 HB2 GLN B 31 12.380 12.046 -35.891 1.00 0.00 H new ATOM 0 HB3 GLN B 31 12.321 10.529 -36.766 1.00 0.00 H new ATOM 0 HG2 GLN B 31 12.354 9.242 -34.631 1.00 0.00 H new ATOM 0 HG3 GLN B 31 12.562 10.717 -33.706 1.00 0.00 H new ATOM 0 HE21 GLN B 31 10.283 8.493 -34.970 1.00 0.00 H new ATOM 0 HE22 GLN B 31 8.836 9.420 -34.561 1.00 0.00 H new ATOM 659 N PHE B 32 15.128 8.878 -35.189 1.00 0.00 N ATOM 660 CA PHE B 32 15.648 7.525 -35.059 1.00 0.00 C ATOM 661 C PHE B 32 14.615 6.612 -34.424 1.00 0.00 C ATOM 662 O PHE B 32 13.720 7.028 -33.671 1.00 0.00 O ATOM 663 CB PHE B 32 16.994 7.570 -34.313 1.00 0.00 C ATOM 664 CG PHE B 32 18.169 8.108 -35.085 1.00 0.00 C ATOM 665 CD1 PHE B 32 18.329 9.525 -35.331 1.00 0.00 C ATOM 666 CD2 PHE B 32 19.202 7.272 -35.687 1.00 0.00 C ATOM 667 CE1 PHE B 32 19.389 10.104 -36.027 1.00 0.00 C ATOM 668 CE2 PHE B 32 20.302 7.900 -36.307 1.00 0.00 C ATOM 669 CZ PHE B 32 20.413 9.287 -36.527 1.00 0.00 C ATOM 0 H PHE B 32 14.893 9.240 -34.265 1.00 0.00 H new ATOM 0 HA PHE B 32 15.845 7.094 -36.040 1.00 0.00 H new ATOM 0 HB2 PHE B 32 16.868 8.177 -33.416 1.00 0.00 H new ATOM 0 HB3 PHE B 32 17.236 6.560 -33.983 1.00 0.00 H new ATOM 0 HD1 PHE B 32 17.567 10.186 -34.945 1.00 0.00 H new ATOM 0 HD2 PHE B 32 19.126 6.195 -35.658 1.00 0.00 H new ATOM 0 HE1 PHE B 32 19.421 11.173 -36.180 1.00 0.00 H new ATOM 0 HE2 PHE B 32 21.117 7.273 -36.637 1.00 0.00 H new ATOM 0 HZ PHE B 32 21.254 9.705 -37.060 1.00 0.00 H new ATOM 679 N LYS B 33 14.897 5.343 -34.660 1.00 0.00 N ATOM 680 CA LYS B 33 14.165 4.162 -34.038 1.00 0.00 C ATOM 681 C LYS B 33 15.072 2.940 -33.955 1.00 0.00 C ATOM 682 O LYS B 33 15.517 2.330 -34.963 1.00 0.00 O ATOM 683 CB LYS B 33 12.878 3.867 -34.956 1.00 0.00 C ATOM 684 CG LYS B 33 11.950 2.830 -34.220 1.00 0.00 C ATOM 685 CD LYS B 33 11.117 2.115 -35.290 1.00 0.00 C ATOM 686 CE LYS B 33 10.146 1.219 -34.550 1.00 0.00 C ATOM 687 NZ LYS B 33 9.439 0.310 -35.481 1.00 0.00 N ATOM 0 H LYS B 33 15.645 5.059 -35.292 1.00 0.00 H new ATOM 0 HA LYS B 33 13.861 4.393 -33.017 1.00 0.00 H new ATOM 0 HB2 LYS B 33 12.332 4.791 -35.147 1.00 0.00 H new ATOM 0 HB3 LYS B 33 13.188 3.474 -35.924 1.00 0.00 H new ATOM 0 HG2 LYS B 33 12.548 2.113 -33.657 1.00 0.00 H new ATOM 0 HG3 LYS B 33 11.302 3.336 -33.505 1.00 0.00 H new ATOM 0 HD2 LYS B 33 10.584 2.834 -35.912 1.00 0.00 H new ATOM 0 HD3 LYS B 33 11.756 1.531 -35.953 1.00 0.00 H new ATOM 0 HE2 LYS B 33 10.684 0.633 -33.804 1.00 0.00 H new ATOM 0 HE3 LYS B 33 9.420 1.830 -34.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 8.781 -0.292 -34.946 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 8.908 0.871 -36.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 10.132 -0.289 -35.975 1.00 0.00 H new ATOM 701 N ILE B 34 15.382 2.599 -32.690 1.00 0.00 N ATOM 702 CA ILE B 34 16.515 1.695 -32.435 1.00 0.00 C ATOM 703 C ILE B 34 16.202 0.762 -31.231 1.00 0.00 C ATOM 704 O ILE B 34 15.271 0.962 -30.472 1.00 0.00 O ATOM 705 CB ILE B 34 17.853 2.445 -32.256 1.00 0.00 C ATOM 706 CG1 ILE B 34 17.758 3.254 -30.968 1.00 0.00 C ATOM 707 CG2 ILE B 34 18.178 3.299 -33.472 1.00 0.00 C ATOM 708 CD1 ILE B 34 19.074 3.758 -30.424 1.00 0.00 C ATOM 0 H ILE B 34 14.885 2.921 -31.859 1.00 0.00 H new ATOM 0 HA ILE B 34 16.645 1.076 -33.323 1.00 0.00 H new ATOM 0 HB ILE B 34 18.682 1.742 -32.175 1.00 0.00 H new ATOM 0 HG12 ILE B 34 17.105 4.109 -31.143 1.00 0.00 H new ATOM 0 HG13 ILE B 34 17.281 2.638 -30.206 1.00 0.00 H new ATOM 0 HG21 ILE B 34 19.126 3.813 -33.313 1.00 0.00 H new ATOM 0 HG22 ILE B 34 18.254 2.663 -34.354 1.00 0.00 H new ATOM 0 HG23 ILE B 34 17.387 4.034 -33.622 1.00 0.00 H new ATOM 0 HD11 ILE B 34 18.897 4.321 -29.507 1.00 0.00 H new ATOM 0 HD12 ILE B 34 19.727 2.912 -30.210 1.00 0.00 H new ATOM 0 HD13 ILE B 34 19.548 4.405 -31.161 1.00 0.00 H new ATOM 720 N LYS B 35 16.930 -0.393 -31.115 1.00 0.00 N ATOM 721 CA LYS B 35 17.036 -1.205 -29.912 1.00 0.00 C ATOM 722 C LYS B 35 17.641 -0.289 -28.823 1.00 0.00 C ATOM 723 O LYS B 35 18.591 0.457 -29.094 1.00 0.00 O ATOM 724 CB LYS B 35 17.851 -2.536 -30.173 1.00 0.00 C ATOM 725 CG LYS B 35 17.013 -3.477 -31.046 1.00 0.00 C ATOM 726 CD LYS B 35 17.686 -4.891 -31.189 1.00 0.00 C ATOM 727 CE LYS B 35 16.812 -5.942 -31.977 1.00 0.00 C ATOM 728 NZ LYS B 35 17.706 -7.050 -32.527 1.00 0.00 N ATOM 0 H LYS B 35 17.466 -0.775 -31.894 1.00 0.00 H new ATOM 0 HA LYS B 35 16.064 -1.566 -29.577 1.00 0.00 H new ATOM 0 HB2 LYS B 35 18.796 -2.307 -30.667 1.00 0.00 H new ATOM 0 HB3 LYS B 35 18.095 -3.019 -29.227 1.00 0.00 H new ATOM 0 HG2 LYS B 35 16.020 -3.589 -30.611 1.00 0.00 H new ATOM 0 HG3 LYS B 35 16.880 -3.035 -32.034 1.00 0.00 H new ATOM 0 HD2 LYS B 35 18.643 -4.776 -31.697 1.00 0.00 H new ATOM 0 HD3 LYS B 35 17.898 -5.283 -30.194 1.00 0.00 H new ATOM 0 HE2 LYS B 35 16.055 -6.367 -31.317 1.00 0.00 H new ATOM 0 HE3 LYS B 35 16.283 -5.450 -32.793 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 17.124 -7.877 -32.771 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 18.197 -6.709 -33.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 18.407 -7.320 -31.807 1.00 0.00 H new ATOM 742 N ARG B 36 17.154 -0.254 -27.603 1.00 0.00 N ATOM 743 CA ARG B 36 17.636 0.602 -26.473 1.00 0.00 C ATOM 744 C ARG B 36 19.100 0.312 -26.088 1.00 0.00 C ATOM 745 O ARG B 36 19.605 1.163 -25.364 1.00 0.00 O ATOM 746 CB ARG B 36 16.734 0.341 -25.318 1.00 0.00 C ATOM 747 CG ARG B 36 16.653 1.444 -24.206 1.00 0.00 C ATOM 748 CD ARG B 36 15.871 1.004 -23.001 1.00 0.00 C ATOM 749 NE ARG B 36 16.639 0.161 -22.086 1.00 0.00 N ATOM 750 CZ ARG B 36 16.963 0.488 -20.902 1.00 0.00 C ATOM 751 NH1 ARG B 36 16.827 1.701 -20.429 1.00 0.00 N ATOM 752 NH2 ARG B 36 17.464 -0.363 -20.094 1.00 0.00 N ATOM 0 H ARG B 36 16.368 -0.843 -27.328 1.00 0.00 H new ATOM 0 HA ARG B 36 17.611 1.649 -26.776 1.00 0.00 H new ATOM 0 HB2 ARG B 36 15.728 0.178 -25.705 1.00 0.00 H new ATOM 0 HB3 ARG B 36 17.049 -0.590 -24.847 1.00 0.00 H new ATOM 0 HG2 ARG B 36 17.662 1.717 -23.898 1.00 0.00 H new ATOM 0 HG3 ARG B 36 16.194 2.340 -24.623 1.00 0.00 H new ATOM 0 HD2 ARG B 36 15.520 1.885 -22.463 1.00 0.00 H new ATOM 0 HD3 ARG B 36 14.987 0.458 -23.330 1.00 0.00 H new ATOM 0 HE ARG B 36 16.936 -0.755 -22.422 1.00 0.00 H new ATOM 0 HH11 ARG B 36 16.444 2.439 -21.020 1.00 0.00 H new ATOM 0 HH12 ARG B 36 17.104 1.908 -19.469 1.00 0.00 H new ATOM 0 HH21 ARG B 36 17.611 -1.327 -20.395 1.00 0.00 H new ATOM 0 HH22 ARG B 36 17.717 -0.080 -19.147 1.00 0.00 H new ATOM 766 N HIS B 37 19.720 -0.793 -26.436 1.00 0.00 N ATOM 767 CA HIS B 37 21.127 -1.128 -26.110 1.00 0.00 C ATOM 768 C HIS B 37 22.131 -1.088 -27.265 1.00 0.00 C ATOM 769 O HIS B 37 23.284 -1.275 -27.034 1.00 0.00 O ATOM 770 CB HIS B 37 21.158 -2.508 -25.358 1.00 0.00 C ATOM 771 CG HIS B 37 20.803 -3.713 -26.265 1.00 0.00 C ATOM 772 ND1 HIS B 37 19.580 -3.951 -26.879 1.00 0.00 N ATOM 773 CD2 HIS B 37 21.749 -4.612 -26.641 1.00 0.00 C ATOM 774 CE1 HIS B 37 19.809 -5.059 -27.628 1.00 0.00 C ATOM 775 NE2 HIS B 37 21.097 -5.419 -27.498 1.00 0.00 N ATOM 0 H HIS B 37 19.258 -1.525 -26.975 1.00 0.00 H new ATOM 0 HA HIS B 37 21.480 -0.320 -25.470 1.00 0.00 H new ATOM 0 HB2 HIS B 37 22.151 -2.661 -24.936 1.00 0.00 H new ATOM 0 HB3 HIS B 37 20.459 -2.474 -24.523 1.00 0.00 H new ATOM 0 HD2 HIS B 37 22.781 -4.666 -26.327 1.00 0.00 H new ATOM 0 HE1 HIS B 37 19.074 -5.570 -28.232 1.00 0.00 H new ATOM 0 HE2 HIS B 37 21.526 -6.205 -27.987 1.00 0.00 H new ATOM 783 N THR B 38 21.693 -0.652 -28.481 1.00 0.00 N ATOM 784 CA THR B 38 22.578 -0.202 -29.620 1.00 0.00 C ATOM 785 C THR B 38 23.598 0.952 -29.220 1.00 0.00 C ATOM 786 O THR B 38 23.153 1.908 -28.561 1.00 0.00 O ATOM 787 CB THR B 38 21.716 0.202 -30.776 1.00 0.00 C ATOM 788 OG1 THR B 38 21.054 -0.962 -31.213 1.00 0.00 O ATOM 789 CG2 THR B 38 22.449 0.600 -32.012 1.00 0.00 C ATOM 0 H THR B 38 20.701 -0.599 -28.711 1.00 0.00 H new ATOM 0 HA THR B 38 23.208 -1.046 -29.902 1.00 0.00 H new ATOM 0 HB THR B 38 21.117 1.034 -30.407 1.00 0.00 H new ATOM 0 HG1 THR B 38 20.474 -0.743 -31.972 1.00 0.00 H new ATOM 0 HG21 THR B 38 21.733 0.874 -32.787 1.00 0.00 H new ATOM 0 HG22 THR B 38 23.092 1.453 -31.795 1.00 0.00 H new ATOM 0 HG23 THR B 38 23.058 -0.235 -32.359 1.00 0.00 H new ATOM 797 N PRO B 39 24.926 0.863 -29.527 1.00 0.00 N ATOM 798 CA PRO B 39 25.842 1.997 -29.204 1.00 0.00 C ATOM 799 C PRO B 39 25.566 3.303 -30.027 1.00 0.00 C ATOM 800 O PRO B 39 25.245 3.358 -31.217 1.00 0.00 O ATOM 801 CB PRO B 39 27.266 1.366 -29.440 1.00 0.00 C ATOM 802 CG PRO B 39 26.986 0.216 -30.344 1.00 0.00 C ATOM 803 CD PRO B 39 25.666 -0.266 -29.975 1.00 0.00 C ATOM 0 HA PRO B 39 25.712 2.370 -28.188 1.00 0.00 H new ATOM 0 HB2 PRO B 39 27.951 2.080 -29.897 1.00 0.00 H new ATOM 0 HB3 PRO B 39 27.722 1.041 -28.505 1.00 0.00 H new ATOM 0 HG2 PRO B 39 27.011 0.525 -31.389 1.00 0.00 H new ATOM 0 HG3 PRO B 39 27.735 -0.567 -30.225 1.00 0.00 H new ATOM 0 HD2 PRO B 39 25.175 -0.737 -30.826 1.00 0.00 H new ATOM 0 HD3 PRO B 39 25.735 -1.019 -29.190 1.00 0.00 H new ATOM 811 N LEU B 40 25.796 4.415 -29.282 1.00 0.00 N ATOM 812 CA LEU B 40 25.598 5.716 -29.825 1.00 0.00 C ATOM 813 C LEU B 40 26.544 5.937 -30.918 1.00 0.00 C ATOM 814 O LEU B 40 26.249 6.740 -31.850 1.00 0.00 O ATOM 815 CB LEU B 40 25.513 6.767 -28.714 1.00 0.00 C ATOM 816 CG LEU B 40 24.301 6.512 -27.788 1.00 0.00 C ATOM 817 CD1 LEU B 40 24.069 7.444 -26.568 1.00 0.00 C ATOM 818 CD2 LEU B 40 22.957 6.540 -28.584 1.00 0.00 C ATOM 0 H LEU B 40 26.116 4.401 -28.314 1.00 0.00 H new ATOM 0 HA LEU B 40 24.624 5.818 -30.304 1.00 0.00 H new ATOM 0 HB2 LEU B 40 26.431 6.753 -28.127 1.00 0.00 H new ATOM 0 HB3 LEU B 40 25.433 7.760 -29.156 1.00 0.00 H new ATOM 0 HG LEU B 40 24.582 5.538 -27.387 1.00 0.00 H new ATOM 0 HD11 LEU B 40 23.178 7.123 -26.029 1.00 0.00 H new ATOM 0 HD12 LEU B 40 24.932 7.395 -25.904 1.00 0.00 H new ATOM 0 HD13 LEU B 40 23.934 8.469 -26.914 1.00 0.00 H new ATOM 0 HD21 LEU B 40 22.126 6.357 -27.902 1.00 0.00 H new ATOM 0 HD22 LEU B 40 22.833 7.516 -29.054 1.00 0.00 H new ATOM 0 HD23 LEU B 40 22.973 5.767 -29.352 1.00 0.00 H new ATOM 830 N SER B 41 27.696 5.287 -31.017 1.00 0.00 N ATOM 831 CA SER B 41 28.558 5.194 -32.226 1.00 0.00 C ATOM 832 C SER B 41 27.873 5.092 -33.598 1.00 0.00 C ATOM 833 O SER B 41 28.158 5.933 -34.466 1.00 0.00 O ATOM 834 CB SER B 41 29.655 4.161 -31.991 1.00 0.00 C ATOM 835 OG SER B 41 29.093 2.857 -32.125 1.00 0.00 O ATOM 0 H SER B 41 28.090 4.779 -30.225 1.00 0.00 H new ATOM 0 HA SER B 41 29.002 6.184 -32.334 1.00 0.00 H new ATOM 0 HB2 SER B 41 30.464 4.299 -32.709 1.00 0.00 H new ATOM 0 HB3 SER B 41 30.085 4.286 -30.997 1.00 0.00 H new ATOM 0 HG SER B 41 29.790 2.184 -31.978 1.00 0.00 H new ATOM 841 N LYS B 42 26.965 4.096 -33.734 1.00 0.00 N ATOM 842 CA LYS B 42 26.168 3.831 -34.877 1.00 0.00 C ATOM 843 C LYS B 42 25.265 5.082 -35.187 1.00 0.00 C ATOM 844 O LYS B 42 25.074 5.359 -36.339 1.00 0.00 O ATOM 845 CB LYS B 42 25.413 2.539 -34.729 1.00 0.00 C ATOM 846 CG LYS B 42 26.379 1.365 -34.913 1.00 0.00 C ATOM 847 CD LYS B 42 25.625 0.020 -34.840 1.00 0.00 C ATOM 848 CE LYS B 42 26.631 -1.205 -35.138 1.00 0.00 C ATOM 849 NZ LYS B 42 26.728 -1.685 -36.505 1.00 0.00 N ATOM 0 H LYS B 42 26.785 3.434 -32.979 1.00 0.00 H new ATOM 0 HA LYS B 42 26.803 3.680 -35.750 1.00 0.00 H new ATOM 0 HB2 LYS B 42 24.944 2.489 -33.746 1.00 0.00 H new ATOM 0 HB3 LYS B 42 24.613 2.486 -35.467 1.00 0.00 H new ATOM 0 HG2 LYS B 42 26.885 1.452 -35.874 1.00 0.00 H new ATOM 0 HG3 LYS B 42 27.150 1.398 -34.143 1.00 0.00 H new ATOM 0 HD2 LYS B 42 25.177 -0.100 -33.853 1.00 0.00 H new ATOM 0 HD3 LYS B 42 24.809 0.013 -35.563 1.00 0.00 H new ATOM 0 HE2 LYS B 42 27.628 -0.905 -34.817 1.00 0.00 H new ATOM 0 HE3 LYS B 42 26.333 -2.044 -34.509 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 27.408 -2.471 -36.550 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 25.795 -2.016 -36.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 27.051 -0.913 -37.122 1.00 0.00 H new ATOM 863 N LEU B 43 24.742 5.805 -34.186 1.00 0.00 N ATOM 864 CA LEU B 43 23.945 7.043 -34.388 1.00 0.00 C ATOM 865 C LEU B 43 24.782 8.228 -34.780 1.00 0.00 C ATOM 866 O LEU B 43 24.562 8.877 -35.799 1.00 0.00 O ATOM 867 CB LEU B 43 23.005 7.431 -33.179 1.00 0.00 C ATOM 868 CG LEU B 43 21.816 6.456 -32.998 1.00 0.00 C ATOM 869 CD1 LEU B 43 22.121 5.070 -32.524 1.00 0.00 C ATOM 870 CD2 LEU B 43 20.813 7.148 -32.039 1.00 0.00 C ATOM 0 H LEU B 43 24.856 5.553 -33.204 1.00 0.00 H new ATOM 0 HA LEU B 43 23.295 6.781 -35.223 1.00 0.00 H new ATOM 0 HB2 LEU B 43 23.593 7.452 -32.261 1.00 0.00 H new ATOM 0 HB3 LEU B 43 22.620 8.439 -33.334 1.00 0.00 H new ATOM 0 HG LEU B 43 21.419 6.273 -33.997 1.00 0.00 H new ATOM 0 HD11 LEU B 43 21.195 4.501 -32.444 1.00 0.00 H new ATOM 0 HD12 LEU B 43 22.787 4.581 -33.235 1.00 0.00 H new ATOM 0 HD13 LEU B 43 22.604 5.117 -31.548 1.00 0.00 H new ATOM 0 HD21 LEU B 43 19.954 6.497 -31.880 1.00 0.00 H new ATOM 0 HD22 LEU B 43 21.300 7.346 -31.084 1.00 0.00 H new ATOM 0 HD23 LEU B 43 20.479 8.088 -32.478 1.00 0.00 H new ATOM 882 N MET B 44 25.905 8.436 -34.090 1.00 0.00 N ATOM 883 CA MET B 44 26.925 9.407 -34.488 1.00 0.00 C ATOM 884 C MET B 44 27.426 9.176 -35.923 1.00 0.00 C ATOM 885 O MET B 44 27.462 10.134 -36.730 1.00 0.00 O ATOM 886 CB MET B 44 28.024 9.558 -33.436 1.00 0.00 C ATOM 887 CG MET B 44 27.496 10.052 -32.057 1.00 0.00 C ATOM 888 SD MET B 44 28.792 10.407 -30.866 1.00 0.00 S ATOM 889 CE MET B 44 29.344 8.801 -30.110 1.00 0.00 C ATOM 0 H MET B 44 26.133 7.932 -33.233 1.00 0.00 H new ATOM 0 HA MET B 44 26.449 10.387 -34.525 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.524 8.598 -33.303 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.773 10.260 -33.802 1.00 0.00 H new ATOM 0 HG2 MET B 44 26.899 10.951 -32.209 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.831 9.295 -31.641 1.00 0.00 H new ATOM 0 HE1 MET B 44 30.213 8.977 -29.477 1.00 0.00 H new ATOM 0 HE2 MET B 44 28.535 8.385 -29.509 1.00 0.00 H new ATOM 0 HE3 MET B 44 29.607 8.098 -30.901 1.00 0.00 H new ATOM 899 N LYS B 45 27.778 7.936 -36.344 1.00 0.00 N ATOM 900 CA LYS B 45 28.208 7.625 -37.721 1.00 0.00 C ATOM 901 C LYS B 45 27.088 7.802 -38.803 1.00 0.00 C ATOM 902 O LYS B 45 27.350 8.350 -39.872 1.00 0.00 O ATOM 903 CB LYS B 45 28.635 6.162 -37.789 1.00 0.00 C ATOM 904 CG LYS B 45 30.016 5.835 -37.204 1.00 0.00 C ATOM 905 CD LYS B 45 30.396 4.361 -37.441 1.00 0.00 C ATOM 906 CE LYS B 45 29.948 3.334 -36.420 1.00 0.00 C ATOM 907 NZ LYS B 45 31.037 2.387 -36.053 1.00 0.00 N ATOM 0 H LYS B 45 27.770 7.122 -35.730 1.00 0.00 H new ATOM 0 HA LYS B 45 29.012 8.328 -37.940 1.00 0.00 H new ATOM 0 HB2 LYS B 45 27.890 5.562 -37.266 1.00 0.00 H new ATOM 0 HB3 LYS B 45 28.621 5.848 -38.833 1.00 0.00 H new ATOM 0 HG2 LYS B 45 30.767 6.483 -37.657 1.00 0.00 H new ATOM 0 HG3 LYS B 45 30.018 6.045 -36.134 1.00 0.00 H new ATOM 0 HD2 LYS B 45 29.994 4.065 -38.410 1.00 0.00 H new ATOM 0 HD3 LYS B 45 31.482 4.305 -37.516 1.00 0.00 H new ATOM 0 HE2 LYS B 45 29.597 3.846 -35.524 1.00 0.00 H new ATOM 0 HE3 LYS B 45 29.102 2.774 -36.819 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 30.682 1.705 -35.353 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 31.355 1.878 -36.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 31.835 2.916 -35.647 1.00 0.00 H new ATOM 921 N ALA B 46 25.830 7.429 -38.546 1.00 0.00 N ATOM 922 CA ALA B 46 24.815 7.807 -39.520 1.00 0.00 C ATOM 923 C ALA B 46 24.663 9.290 -39.714 1.00 0.00 C ATOM 924 O ALA B 46 24.409 9.742 -40.849 1.00 0.00 O ATOM 925 CB ALA B 46 23.495 7.115 -39.196 1.00 0.00 C ATOM 0 H ALA B 46 25.509 6.904 -37.732 1.00 0.00 H new ATOM 0 HA ALA B 46 25.163 7.454 -40.491 1.00 0.00 H new ATOM 0 HB1 ALA B 46 22.743 7.404 -39.930 1.00 0.00 H new ATOM 0 HB2 ALA B 46 23.634 6.034 -39.225 1.00 0.00 H new ATOM 0 HB3 ALA B 46 23.164 7.411 -38.201 1.00 0.00 H new ATOM 931 N TYR B 47 24.722 10.039 -38.658 1.00 0.00 N ATOM 932 CA TYR B 47 24.556 11.495 -38.752 1.00 0.00 C ATOM 933 C TYR B 47 25.716 12.149 -39.567 1.00 0.00 C ATOM 934 O TYR B 47 25.466 12.925 -40.503 1.00 0.00 O ATOM 935 CB TYR B 47 24.447 12.110 -37.366 1.00 0.00 C ATOM 936 CG TYR B 47 24.352 13.631 -37.443 1.00 0.00 C ATOM 937 CD1 TYR B 47 25.520 14.434 -37.575 1.00 0.00 C ATOM 938 CD2 TYR B 47 23.114 14.329 -37.506 1.00 0.00 C ATOM 939 CE1 TYR B 47 25.447 15.855 -37.683 1.00 0.00 C ATOM 940 CE2 TYR B 47 23.018 15.737 -37.634 1.00 0.00 C ATOM 941 CZ TYR B 47 24.182 16.487 -37.761 1.00 0.00 C ATOM 942 OH TYR B 47 24.135 17.827 -37.952 1.00 0.00 O ATOM 0 H TYR B 47 24.882 9.688 -37.714 1.00 0.00 H new ATOM 0 HA TYR B 47 23.628 11.694 -39.289 1.00 0.00 H new ATOM 0 HB2 TYR B 47 23.568 11.713 -36.857 1.00 0.00 H new ATOM 0 HB3 TYR B 47 25.315 11.827 -36.770 1.00 0.00 H new ATOM 0 HD1 TYR B 47 26.488 13.955 -37.594 1.00 0.00 H new ATOM 0 HD2 TYR B 47 22.200 13.756 -37.454 1.00 0.00 H new ATOM 0 HE1 TYR B 47 26.351 16.445 -37.705 1.00 0.00 H new ATOM 0 HE2 TYR B 47 22.053 16.222 -37.633 1.00 0.00 H new ATOM 0 HH TYR B 47 23.200 18.120 -37.986 1.00 0.00 H new ATOM 952 N CYS B 48 26.958 11.782 -39.245 1.00 0.00 N ATOM 953 CA CYS B 48 28.178 12.246 -39.842 1.00 0.00 C ATOM 954 C CYS B 48 28.315 11.848 -41.318 1.00 0.00 C ATOM 955 O CYS B 48 28.843 12.643 -42.077 1.00 0.00 O ATOM 956 CB CYS B 48 29.339 11.731 -39.007 1.00 0.00 C ATOM 957 SG CYS B 48 30.769 12.635 -39.291 1.00 0.00 S ATOM 0 H CYS B 48 27.132 11.103 -38.504 1.00 0.00 H new ATOM 0 HA CYS B 48 28.174 13.336 -39.846 1.00 0.00 H new ATOM 0 HB2 CYS B 48 29.079 11.783 -37.950 1.00 0.00 H new ATOM 0 HB3 CYS B 48 29.519 10.682 -39.240 1.00 0.00 H new ATOM 0 HG CYS B 48 31.315 12.245 -40.404 1.00 0.00 H new ATOM 963 N GLU B 49 27.788 10.663 -41.749 1.00 0.00 N ATOM 964 CA GLU B 49 27.694 10.212 -43.197 1.00 0.00 C ATOM 965 C GLU B 49 26.589 10.896 -43.937 1.00 0.00 C ATOM 966 O GLU B 49 26.815 11.186 -45.104 1.00 0.00 O ATOM 967 CB GLU B 49 27.611 8.728 -43.373 1.00 0.00 C ATOM 968 CG GLU B 49 28.724 7.903 -42.770 1.00 0.00 C ATOM 969 CD GLU B 49 28.448 6.413 -42.909 1.00 0.00 C ATOM 970 OE1 GLU B 49 27.475 5.972 -43.512 1.00 0.00 O ATOM 971 OE2 GLU B 49 29.168 5.664 -42.217 1.00 0.00 O ATOM 0 H GLU B 49 27.407 9.975 -41.100 1.00 0.00 H new ATOM 0 HA GLU B 49 28.642 10.519 -43.638 1.00 0.00 H new ATOM 0 HB2 GLU B 49 26.668 8.388 -42.946 1.00 0.00 H new ATOM 0 HB3 GLU B 49 27.572 8.515 -44.441 1.00 0.00 H new ATOM 0 HG2 GLU B 49 29.667 8.147 -43.260 1.00 0.00 H new ATOM 0 HG3 GLU B 49 28.837 8.157 -41.716 1.00 0.00 H new ATOM 978 N ARG B 50 25.429 11.108 -43.341 1.00 0.00 N ATOM 979 CA ARG B 50 24.386 11.950 -44.009 1.00 0.00 C ATOM 980 C ARG B 50 24.828 13.370 -44.179 1.00 0.00 C ATOM 981 O ARG B 50 24.371 14.022 -45.131 1.00 0.00 O ATOM 982 CB ARG B 50 23.098 11.850 -43.154 1.00 0.00 C ATOM 983 CG ARG B 50 22.420 10.450 -43.352 1.00 0.00 C ATOM 984 CD ARG B 50 21.102 10.216 -42.543 1.00 0.00 C ATOM 985 NE ARG B 50 20.323 9.059 -43.115 1.00 0.00 N ATOM 986 CZ ARG B 50 19.091 9.139 -43.498 1.00 0.00 C ATOM 987 NH1 ARG B 50 18.588 10.298 -43.774 1.00 0.00 N ATOM 988 NH2 ARG B 50 18.276 8.088 -43.670 1.00 0.00 N ATOM 0 H ARG B 50 25.167 10.735 -42.429 1.00 0.00 H new ATOM 0 HA ARG B 50 24.203 11.582 -45.019 1.00 0.00 H new ATOM 0 HB2 ARG B 50 23.340 11.999 -42.102 1.00 0.00 H new ATOM 0 HB3 ARG B 50 22.403 12.641 -43.437 1.00 0.00 H new ATOM 0 HG2 ARG B 50 22.203 10.318 -44.412 1.00 0.00 H new ATOM 0 HG3 ARG B 50 23.137 9.677 -43.075 1.00 0.00 H new ATOM 0 HD2 ARG B 50 21.341 10.018 -41.498 1.00 0.00 H new ATOM 0 HD3 ARG B 50 20.491 11.118 -42.565 1.00 0.00 H new ATOM 0 HE ARG B 50 20.796 8.160 -43.205 1.00 0.00 H new ATOM 0 HH11 ARG B 50 19.162 11.137 -43.689 1.00 0.00 H new ATOM 0 HH12 ARG B 50 17.617 10.373 -44.077 1.00 0.00 H new ATOM 0 HH21 ARG B 50 18.618 7.143 -43.496 1.00 0.00 H new ATOM 0 HH22 ARG B 50 17.314 8.233 -43.975 1.00 0.00 H new ATOM 1002 N GLN B 51 25.721 13.899 -43.323 1.00 0.00 N ATOM 1003 CA GLN B 51 26.356 15.221 -43.471 1.00 0.00 C ATOM 1004 C GLN B 51 27.607 15.140 -44.408 1.00 0.00 C ATOM 1005 O GLN B 51 28.002 16.167 -44.977 1.00 0.00 O ATOM 1006 CB GLN B 51 26.791 15.746 -42.085 1.00 0.00 C ATOM 1007 CG GLN B 51 25.594 16.273 -41.357 1.00 0.00 C ATOM 1008 CD GLN B 51 25.427 17.800 -41.360 1.00 0.00 C ATOM 1009 OE1 GLN B 51 26.318 18.595 -41.667 1.00 0.00 O ATOM 1010 NE2 GLN B 51 24.384 18.373 -40.915 1.00 0.00 N ATOM 0 H GLN B 51 26.029 13.405 -42.486 1.00 0.00 H new ATOM 0 HA GLN B 51 25.630 15.901 -43.917 1.00 0.00 H new ATOM 0 HB2 GLN B 51 27.257 14.946 -41.510 1.00 0.00 H new ATOM 0 HB3 GLN B 51 27.537 16.533 -42.199 1.00 0.00 H new ATOM 0 HG2 GLN B 51 24.701 15.828 -41.796 1.00 0.00 H new ATOM 0 HG3 GLN B 51 25.644 15.934 -40.322 1.00 0.00 H new ATOM 0 HE21 GLN B 51 23.579 17.816 -40.628 1.00 0.00 H new ATOM 0 HE22 GLN B 51 24.352 19.390 -40.844 1.00 0.00 H new ATOM 1019 N GLY B 52 28.345 14.001 -44.491 1.00 0.00 N ATOM 1020 CA GLY B 52 29.518 13.715 -45.284 1.00 0.00 C ATOM 1021 C GLY B 52 30.749 14.424 -44.692 1.00 0.00 C ATOM 1022 O GLY B 52 31.462 15.120 -45.372 1.00 0.00 O ATOM 0 H GLY B 52 28.084 13.188 -43.934 1.00 0.00 H new ATOM 0 HA2 GLY B 52 29.690 12.639 -45.316 1.00 0.00 H new ATOM 0 HA3 GLY B 52 29.360 14.043 -46.311 1.00 0.00 H new ATOM 1026 N LEU B 53 30.954 14.224 -43.409 1.00 0.00 N ATOM 1027 CA LEU B 53 31.913 14.942 -42.604 1.00 0.00 C ATOM 1028 C LEU B 53 32.787 13.896 -41.796 1.00 0.00 C ATOM 1029 O LEU B 53 32.680 12.651 -42.043 1.00 0.00 O ATOM 1030 CB LEU B 53 31.152 15.877 -41.645 1.00 0.00 C ATOM 1031 CG LEU B 53 30.407 16.993 -42.219 1.00 0.00 C ATOM 1032 CD1 LEU B 53 29.742 17.775 -41.110 1.00 0.00 C ATOM 1033 CD2 LEU B 53 31.321 17.964 -42.848 1.00 0.00 C ATOM 0 H LEU B 53 30.434 13.526 -42.877 1.00 0.00 H new ATOM 0 HA LEU B 53 32.574 15.542 -43.230 1.00 0.00 H new ATOM 0 HB2 LEU B 53 30.452 15.269 -41.072 1.00 0.00 H new ATOM 0 HB3 LEU B 53 31.873 16.286 -40.937 1.00 0.00 H new ATOM 0 HG LEU B 53 29.701 16.572 -42.935 1.00 0.00 H new ATOM 0 HD11 LEU B 53 29.185 18.609 -41.536 1.00 0.00 H new ATOM 0 HD12 LEU B 53 29.059 17.124 -40.564 1.00 0.00 H new ATOM 0 HD13 LEU B 53 30.502 18.157 -40.428 1.00 0.00 H new ATOM 0 HD21 LEU B 53 30.744 18.787 -43.269 1.00 0.00 H new ATOM 0 HD22 LEU B 53 32.012 18.351 -42.099 1.00 0.00 H new ATOM 0 HD23 LEU B 53 31.884 17.473 -43.641 1.00 0.00 H new ATOM 1045 N SER B 54 33.509 14.287 -40.772 1.00 0.00 N ATOM 1046 CA SER B 54 34.106 13.298 -39.775 1.00 0.00 C ATOM 1047 C SER B 54 33.724 13.643 -38.330 1.00 0.00 C ATOM 1048 O SER B 54 33.771 14.828 -37.946 1.00 0.00 O ATOM 1049 CB SER B 54 35.627 13.466 -39.852 1.00 0.00 C ATOM 1050 OG SER B 54 36.260 12.446 -39.137 1.00 0.00 O ATOM 0 H SER B 54 33.721 15.264 -40.569 1.00 0.00 H new ATOM 0 HA SER B 54 33.747 12.298 -40.018 1.00 0.00 H new ATOM 0 HB2 SER B 54 35.951 13.446 -40.893 1.00 0.00 H new ATOM 0 HB3 SER B 54 35.914 14.437 -39.448 1.00 0.00 H new ATOM 0 HG SER B 54 37.232 12.561 -39.194 1.00 0.00 H new ATOM 1056 N MET B 55 33.450 12.640 -37.526 1.00 0.00 N ATOM 1057 CA MET B 55 33.211 12.837 -36.054 1.00 0.00 C ATOM 1058 C MET B 55 34.382 13.470 -35.331 1.00 0.00 C ATOM 1059 O MET B 55 34.147 14.055 -34.289 1.00 0.00 O ATOM 1060 CB MET B 55 33.034 11.500 -35.400 1.00 0.00 C ATOM 1061 CG MET B 55 31.785 10.676 -35.764 1.00 0.00 C ATOM 1062 SD MET B 55 31.713 8.981 -35.218 1.00 0.00 S ATOM 1063 CE MET B 55 31.815 9.197 -33.453 1.00 0.00 C ATOM 0 H MET B 55 33.380 11.670 -37.834 1.00 0.00 H new ATOM 0 HA MET B 55 32.338 13.486 -35.984 1.00 0.00 H new ATOM 0 HB2 MET B 55 33.911 10.896 -35.632 1.00 0.00 H new ATOM 0 HB3 MET B 55 33.029 11.654 -34.321 1.00 0.00 H new ATOM 0 HG2 MET B 55 30.914 11.194 -35.362 1.00 0.00 H new ATOM 0 HG3 MET B 55 31.686 10.682 -36.849 1.00 0.00 H new ATOM 0 HE1 MET B 55 31.693 8.232 -32.961 1.00 0.00 H new ATOM 0 HE2 MET B 55 32.787 9.617 -33.193 1.00 0.00 H new ATOM 0 HE3 MET B 55 31.027 9.874 -33.123 1.00 0.00 H new ATOM 1073 N ARG B 56 35.571 13.402 -35.924 1.00 0.00 N ATOM 1074 CA ARG B 56 36.807 14.011 -35.452 1.00 0.00 C ATOM 1075 C ARG B 56 36.747 15.552 -35.314 1.00 0.00 C ATOM 1076 O ARG B 56 37.187 16.048 -34.245 1.00 0.00 O ATOM 1077 CB ARG B 56 38.010 13.669 -36.399 1.00 0.00 C ATOM 1078 CG ARG B 56 39.372 14.011 -35.814 1.00 0.00 C ATOM 1079 CD ARG B 56 40.440 13.632 -36.718 1.00 0.00 C ATOM 1080 NE ARG B 56 41.815 13.847 -36.135 1.00 0.00 N ATOM 1081 CZ ARG B 56 42.734 14.674 -36.613 1.00 0.00 C ATOM 1082 NH1 ARG B 56 42.648 15.338 -37.754 1.00 0.00 N ATOM 1083 NH2 ARG B 56 43.750 14.884 -35.908 1.00 0.00 N ATOM 0 H ARG B 56 35.703 12.891 -36.797 1.00 0.00 H new ATOM 0 HA ARG B 56 36.950 13.586 -34.459 1.00 0.00 H new ATOM 0 HB2 ARG B 56 37.983 12.605 -36.634 1.00 0.00 H new ATOM 0 HB3 ARG B 56 37.884 14.206 -37.339 1.00 0.00 H new ATOM 0 HG2 ARG B 56 39.426 15.081 -35.611 1.00 0.00 H new ATOM 0 HG3 ARG B 56 39.500 13.499 -34.860 1.00 0.00 H new ATOM 0 HD2 ARG B 56 40.326 12.581 -36.985 1.00 0.00 H new ATOM 0 HD3 ARG B 56 40.349 14.207 -37.639 1.00 0.00 H new ATOM 0 HE ARG B 56 42.058 13.310 -35.302 1.00 0.00 H new ATOM 0 HH11 ARG B 56 41.823 15.233 -38.344 1.00 0.00 H new ATOM 0 HH12 ARG B 56 43.407 15.955 -38.043 1.00 0.00 H new ATOM 0 HH21 ARG B 56 43.846 14.425 -35.002 1.00 0.00 H new ATOM 0 HH22 ARG B 56 44.480 15.514 -36.240 1.00 0.00 H new ATOM 1097 N GLN B 57 36.080 16.247 -36.261 1.00 0.00 N ATOM 1098 CA GLN B 57 35.766 17.724 -36.184 1.00 0.00 C ATOM 1099 C GLN B 57 34.546 18.055 -35.416 1.00 0.00 C ATOM 1100 O GLN B 57 34.508 19.045 -34.684 1.00 0.00 O ATOM 1101 CB GLN B 57 35.447 18.057 -37.595 1.00 0.00 C ATOM 1102 CG GLN B 57 34.955 19.461 -38.014 1.00 0.00 C ATOM 1103 CD GLN B 57 34.477 19.517 -39.463 1.00 0.00 C ATOM 1104 OE1 GLN B 57 34.359 18.617 -40.209 1.00 0.00 O ATOM 1105 NE2 GLN B 57 34.308 20.739 -39.941 1.00 0.00 N ATOM 0 H GLN B 57 35.733 15.811 -37.115 1.00 0.00 H new ATOM 0 HA GLN B 57 36.592 18.249 -35.705 1.00 0.00 H new ATOM 0 HB2 GLN B 57 36.345 17.852 -38.177 1.00 0.00 H new ATOM 0 HB3 GLN B 57 34.687 17.347 -37.921 1.00 0.00 H new ATOM 0 HG2 GLN B 57 34.141 19.766 -37.356 1.00 0.00 H new ATOM 0 HG3 GLN B 57 35.763 20.180 -37.876 1.00 0.00 H new ATOM 0 HE21 GLN B 57 34.402 21.546 -39.324 1.00 0.00 H new ATOM 0 HE22 GLN B 57 34.083 20.875 -40.927 1.00 0.00 H new ATOM 1114 N ILE B 58 33.447 17.284 -35.520 1.00 0.00 N ATOM 1115 CA ILE B 58 32.153 17.598 -34.926 1.00 0.00 C ATOM 1116 C ILE B 58 32.028 16.963 -33.568 1.00 0.00 C ATOM 1117 O ILE B 58 32.798 16.187 -33.083 1.00 0.00 O ATOM 1118 CB ILE B 58 30.973 17.314 -35.916 1.00 0.00 C ATOM 1119 CG1 ILE B 58 30.881 15.805 -36.144 1.00 0.00 C ATOM 1120 CG2 ILE B 58 31.121 18.079 -37.186 1.00 0.00 C ATOM 1121 CD1 ILE B 58 29.776 15.470 -37.131 1.00 0.00 C ATOM 0 H ILE B 58 33.445 16.404 -36.035 1.00 0.00 H new ATOM 0 HA ILE B 58 32.086 18.671 -34.747 1.00 0.00 H new ATOM 0 HB ILE B 58 30.036 17.659 -35.479 1.00 0.00 H new ATOM 0 HG12 ILE B 58 31.834 15.431 -36.519 1.00 0.00 H new ATOM 0 HG13 ILE B 58 30.692 15.301 -35.196 1.00 0.00 H new ATOM 0 HG21 ILE B 58 30.283 17.855 -37.846 1.00 0.00 H new ATOM 0 HG22 ILE B 58 31.135 19.147 -36.968 1.00 0.00 H new ATOM 0 HG23 ILE B 58 32.053 17.796 -37.675 1.00 0.00 H new ATOM 0 HD11 ILE B 58 29.732 14.390 -37.275 1.00 0.00 H new ATOM 0 HD12 ILE B 58 28.821 15.823 -36.742 1.00 0.00 H new ATOM 0 HD13 ILE B 58 29.981 15.956 -38.085 1.00 0.00 H new ATOM 1133 N ARG B 59 30.992 17.420 -32.860 1.00 0.00 N ATOM 1134 CA ARG B 59 30.743 17.052 -31.441 1.00 0.00 C ATOM 1135 C ARG B 59 29.243 16.745 -31.158 1.00 0.00 C ATOM 1136 O ARG B 59 28.367 17.390 -31.714 1.00 0.00 O ATOM 1137 CB ARG B 59 31.246 18.099 -30.451 1.00 0.00 C ATOM 1138 CG ARG B 59 32.790 18.342 -30.470 1.00 0.00 C ATOM 1139 CD ARG B 59 33.545 17.248 -29.759 1.00 0.00 C ATOM 1140 NE ARG B 59 34.984 17.359 -29.768 1.00 0.00 N ATOM 1141 CZ ARG B 59 35.823 16.924 -30.765 1.00 0.00 C ATOM 1142 NH1 ARG B 59 35.427 16.365 -31.894 1.00 0.00 N ATOM 1143 NH2 ARG B 59 37.087 16.900 -30.625 1.00 0.00 N ATOM 0 H ARG B 59 30.294 18.057 -33.244 1.00 0.00 H new ATOM 0 HA ARG B 59 31.320 16.140 -31.288 1.00 0.00 H new ATOM 0 HB2 ARG B 59 30.743 19.043 -30.658 1.00 0.00 H new ATOM 0 HB3 ARG B 59 30.954 17.796 -29.446 1.00 0.00 H new ATOM 0 HG2 ARG B 59 33.134 18.407 -31.502 1.00 0.00 H new ATOM 0 HG3 ARG B 59 33.012 19.300 -29.999 1.00 0.00 H new ATOM 0 HD2 ARG B 59 33.210 17.218 -28.722 1.00 0.00 H new ATOM 0 HD3 ARG B 59 33.272 16.294 -30.210 1.00 0.00 H new ATOM 0 HE ARG B 59 35.419 17.802 -28.958 1.00 0.00 H new ATOM 0 HH11 ARG B 59 34.432 16.230 -32.075 1.00 0.00 H new ATOM 0 HH12 ARG B 59 36.116 16.069 -32.585 1.00 0.00 H new ATOM 0 HH21 ARG B 59 37.509 17.210 -29.750 1.00 0.00 H new ATOM 0 HH22 ARG B 59 37.678 16.570 -31.388 1.00 0.00 H new ATOM 1157 N PHE B 60 28.865 15.835 -30.180 1.00 0.00 N ATOM 1158 CA PHE B 60 27.496 15.365 -30.001 1.00 0.00 C ATOM 1159 C PHE B 60 27.202 15.333 -28.485 1.00 0.00 C ATOM 1160 O PHE B 60 28.026 14.965 -27.604 1.00 0.00 O ATOM 1161 CB PHE B 60 27.311 13.995 -30.625 1.00 0.00 C ATOM 1162 CG PHE B 60 27.563 13.871 -32.140 1.00 0.00 C ATOM 1163 CD1 PHE B 60 26.472 14.001 -32.973 1.00 0.00 C ATOM 1164 CD2 PHE B 60 28.718 13.300 -32.559 1.00 0.00 C ATOM 1165 CE1 PHE B 60 26.513 13.684 -34.311 1.00 0.00 C ATOM 1166 CE2 PHE B 60 28.732 12.852 -33.947 1.00 0.00 C ATOM 1167 CZ PHE B 60 27.701 13.086 -34.795 1.00 0.00 C ATOM 0 H PHE B 60 29.524 15.430 -29.515 1.00 0.00 H new ATOM 0 HA PHE B 60 26.797 16.036 -30.500 1.00 0.00 H new ATOM 0 HB2 PHE B 60 27.976 13.299 -30.114 1.00 0.00 H new ATOM 0 HB3 PHE B 60 26.291 13.667 -30.424 1.00 0.00 H new ATOM 0 HD1 PHE B 60 25.545 14.368 -32.557 1.00 0.00 H new ATOM 0 HD2 PHE B 60 29.572 13.184 -31.908 1.00 0.00 H new ATOM 0 HE1 PHE B 60 25.676 13.883 -34.963 1.00 0.00 H new ATOM 0 HE2 PHE B 60 29.595 12.315 -34.312 1.00 0.00 H new ATOM 0 HZ PHE B 60 27.786 12.817 -35.837 1.00 0.00 H new ATOM 1177 N ARG B 61 26.024 15.798 -28.107 1.00 0.00 N ATOM 1178 CA ARG B 61 25.627 16.056 -26.689 1.00 0.00 C ATOM 1179 C ARG B 61 24.228 15.545 -26.271 1.00 0.00 C ATOM 1180 O ARG B 61 23.282 15.583 -27.006 1.00 0.00 O ATOM 1181 CB ARG B 61 25.734 17.538 -26.265 1.00 0.00 C ATOM 1182 CG ARG B 61 27.097 18.140 -26.547 1.00 0.00 C ATOM 1183 CD ARG B 61 27.421 19.487 -25.867 1.00 0.00 C ATOM 1184 NE ARG B 61 28.655 20.084 -26.400 1.00 0.00 N ATOM 1185 CZ ARG B 61 28.905 21.344 -26.647 1.00 0.00 C ATOM 1186 NH1 ARG B 61 28.188 22.345 -26.165 1.00 0.00 N ATOM 1187 NH2 ARG B 61 29.963 21.569 -27.340 1.00 0.00 N ATOM 0 H ARG B 61 25.284 16.019 -28.774 1.00 0.00 H new ATOM 0 HA ARG B 61 26.371 15.460 -26.161 1.00 0.00 H new ATOM 0 HB2 ARG B 61 24.973 18.116 -26.789 1.00 0.00 H new ATOM 0 HB3 ARG B 61 25.520 17.621 -25.199 1.00 0.00 H new ATOM 0 HG2 ARG B 61 27.856 17.417 -26.246 1.00 0.00 H new ATOM 0 HG3 ARG B 61 27.193 18.273 -27.625 1.00 0.00 H new ATOM 0 HD2 ARG B 61 26.590 20.177 -26.013 1.00 0.00 H new ATOM 0 HD3 ARG B 61 27.525 19.336 -24.792 1.00 0.00 H new ATOM 0 HE ARG B 61 29.413 19.432 -26.603 1.00 0.00 H new ATOM 0 HH11 ARG B 61 27.387 22.155 -25.562 1.00 0.00 H new ATOM 0 HH12 ARG B 61 28.436 23.307 -26.396 1.00 0.00 H new ATOM 0 HH21 ARG B 61 30.541 20.790 -27.656 1.00 0.00 H new ATOM 0 HH22 ARG B 61 30.225 22.527 -27.574 1.00 0.00 H new ATOM 1201 N PHE B 62 24.086 15.438 -24.959 1.00 0.00 N ATOM 1202 CA PHE B 62 22.897 15.310 -24.162 1.00 0.00 C ATOM 1203 C PHE B 62 23.090 15.795 -22.746 1.00 0.00 C ATOM 1204 O PHE B 62 24.071 15.519 -22.137 1.00 0.00 O ATOM 1205 CB PHE B 62 22.425 13.892 -24.250 1.00 0.00 C ATOM 1206 CG PHE B 62 21.100 13.723 -23.542 1.00 0.00 C ATOM 1207 CD1 PHE B 62 19.911 14.209 -24.155 1.00 0.00 C ATOM 1208 CD2 PHE B 62 21.029 12.976 -22.364 1.00 0.00 C ATOM 1209 CE1 PHE B 62 18.701 13.856 -23.557 1.00 0.00 C ATOM 1210 CE2 PHE B 62 19.833 12.597 -21.720 1.00 0.00 C ATOM 1211 CZ PHE B 62 18.654 13.057 -22.385 1.00 0.00 C ATOM 0 H PHE B 62 24.913 15.440 -24.362 1.00 0.00 H new ATOM 0 HA PHE B 62 22.119 15.963 -24.557 1.00 0.00 H new ATOM 0 HB2 PHE B 62 22.323 13.602 -25.296 1.00 0.00 H new ATOM 0 HB3 PHE B 62 23.167 13.229 -23.806 1.00 0.00 H new ATOM 0 HD1 PHE B 62 19.944 14.823 -25.043 1.00 0.00 H new ATOM 0 HD2 PHE B 62 21.960 12.665 -21.913 1.00 0.00 H new ATOM 0 HE1 PHE B 62 17.777 14.200 -23.997 1.00 0.00 H new ATOM 0 HE2 PHE B 62 19.810 12.015 -20.811 1.00 0.00 H new ATOM 0 HZ PHE B 62 17.690 12.786 -21.980 1.00 0.00 H new ATOM 1221 N ASP B 63 22.078 16.558 -22.252 1.00 0.00 N ATOM 1222 CA ASP B 63 22.044 17.098 -20.851 1.00 0.00 C ATOM 1223 C ASP B 63 23.353 17.789 -20.430 1.00 0.00 C ATOM 1224 O ASP B 63 23.746 17.714 -19.229 1.00 0.00 O ATOM 1225 CB ASP B 63 21.715 15.871 -19.917 1.00 0.00 C ATOM 1226 CG ASP B 63 20.771 16.158 -18.748 1.00 0.00 C ATOM 1227 OD1 ASP B 63 19.979 17.190 -18.823 1.00 0.00 O ATOM 1228 OD2 ASP B 63 20.616 15.400 -17.802 1.00 0.00 O ATOM 0 H ASP B 63 21.262 16.819 -22.806 1.00 0.00 H new ATOM 0 HA ASP B 63 21.289 17.880 -20.775 1.00 0.00 H new ATOM 0 HB2 ASP B 63 21.277 15.081 -20.527 1.00 0.00 H new ATOM 0 HB3 ASP B 63 22.651 15.482 -19.516 1.00 0.00 H new ATOM 1233 N GLY B 64 23.980 18.550 -21.352 1.00 0.00 N ATOM 1234 CA GLY B 64 25.114 19.372 -21.082 1.00 0.00 C ATOM 1235 C GLY B 64 26.454 18.567 -21.064 1.00 0.00 C ATOM 1236 O GLY B 64 27.487 19.202 -20.987 1.00 0.00 O ATOM 0 H GLY B 64 23.679 18.590 -22.326 1.00 0.00 H new ATOM 0 HA2 GLY B 64 25.177 20.156 -21.836 1.00 0.00 H new ATOM 0 HA3 GLY B 64 24.979 19.865 -20.120 1.00 0.00 H new ATOM 1240 N GLN B 65 26.437 17.260 -21.268 1.00 0.00 N ATOM 1241 CA GLN B 65 27.519 16.346 -21.392 1.00 0.00 C ATOM 1242 C GLN B 65 27.906 15.913 -22.792 1.00 0.00 C ATOM 1243 O GLN B 65 27.064 15.849 -23.641 1.00 0.00 O ATOM 1244 CB GLN B 65 27.140 15.101 -20.541 1.00 0.00 C ATOM 1245 CG GLN B 65 26.716 15.426 -19.041 1.00 0.00 C ATOM 1246 CD GLN B 65 27.910 16.165 -18.322 1.00 0.00 C ATOM 1247 OE1 GLN B 65 29.096 16.124 -18.753 1.00 0.00 O ATOM 1248 NE2 GLN B 65 27.599 16.937 -17.323 1.00 0.00 N ATOM 0 H GLN B 65 25.545 16.773 -21.359 1.00 0.00 H new ATOM 0 HA GLN B 65 28.409 16.873 -21.048 1.00 0.00 H new ATOM 0 HB2 GLN B 65 26.319 14.579 -21.032 1.00 0.00 H new ATOM 0 HB3 GLN B 65 27.988 14.417 -20.525 1.00 0.00 H new ATOM 0 HG2 GLN B 65 25.823 16.051 -19.029 1.00 0.00 H new ATOM 0 HG3 GLN B 65 26.468 14.506 -18.511 1.00 0.00 H new ATOM 0 HE21 GLN B 65 26.639 16.965 -16.980 1.00 0.00 H new ATOM 0 HE22 GLN B 65 28.315 17.514 -16.882 1.00 0.00 H new ATOM 1257 N PRO B 66 29.174 15.626 -23.036 1.00 0.00 N ATOM 1258 CA PRO B 66 29.666 14.870 -24.283 1.00 0.00 C ATOM 1259 C PRO B 66 29.174 13.448 -24.433 1.00 0.00 C ATOM 1260 O PRO B 66 29.337 12.726 -23.463 1.00 0.00 O ATOM 1261 CB PRO B 66 31.148 14.902 -24.275 1.00 0.00 C ATOM 1262 CG PRO B 66 31.591 15.432 -22.868 1.00 0.00 C ATOM 1263 CD PRO B 66 30.345 15.914 -22.169 1.00 0.00 C ATOM 0 HA PRO B 66 29.240 15.384 -25.144 1.00 0.00 H new ATOM 0 HB2 PRO B 66 31.556 13.908 -24.458 1.00 0.00 H new ATOM 0 HB3 PRO B 66 31.523 15.551 -25.066 1.00 0.00 H new ATOM 0 HG2 PRO B 66 32.075 14.643 -22.293 1.00 0.00 H new ATOM 0 HG3 PRO B 66 32.314 16.241 -22.970 1.00 0.00 H new ATOM 0 HD2 PRO B 66 30.235 15.415 -21.206 1.00 0.00 H new ATOM 0 HD3 PRO B 66 30.413 16.983 -21.968 1.00 0.00 H new ATOM 1271 N ILE B 67 28.682 12.994 -25.588 1.00 0.00 N ATOM 1272 CA ILE B 67 28.361 11.586 -25.923 1.00 0.00 C ATOM 1273 C ILE B 67 29.565 10.709 -26.352 1.00 0.00 C ATOM 1274 O ILE B 67 30.362 11.160 -27.113 1.00 0.00 O ATOM 1275 CB ILE B 67 27.157 11.517 -26.927 1.00 0.00 C ATOM 1276 CG1 ILE B 67 25.939 12.161 -26.334 1.00 0.00 C ATOM 1277 CG2 ILE B 67 26.827 10.047 -27.255 1.00 0.00 C ATOM 1278 CD1 ILE B 67 24.861 12.561 -27.425 1.00 0.00 C ATOM 0 H ILE B 67 28.482 13.626 -26.364 1.00 0.00 H new ATOM 0 HA ILE B 67 28.054 11.124 -24.985 1.00 0.00 H new ATOM 0 HB ILE B 67 27.443 12.047 -27.835 1.00 0.00 H new ATOM 0 HG12 ILE B 67 25.486 11.478 -25.616 1.00 0.00 H new ATOM 0 HG13 ILE B 67 26.238 13.052 -25.782 1.00 0.00 H new ATOM 0 HG21 ILE B 67 25.990 10.009 -27.952 1.00 0.00 H new ATOM 0 HG22 ILE B 67 27.697 9.571 -27.706 1.00 0.00 H new ATOM 0 HG23 ILE B 67 26.560 9.521 -26.339 1.00 0.00 H new ATOM 0 HD11 ILE B 67 24.003 13.022 -26.936 1.00 0.00 H new ATOM 0 HD12 ILE B 67 25.301 13.267 -28.129 1.00 0.00 H new ATOM 0 HD13 ILE B 67 24.537 11.669 -27.961 1.00 0.00 H new ATOM 1290 N ASN B 68 29.684 9.481 -25.853 1.00 0.00 N ATOM 1291 CA ASN B 68 30.773 8.508 -26.113 1.00 0.00 C ATOM 1292 C ASN B 68 30.294 7.418 -27.093 1.00 0.00 C ATOM 1293 O ASN B 68 29.188 6.937 -27.023 1.00 0.00 O ATOM 1294 CB ASN B 68 31.305 7.869 -24.826 1.00 0.00 C ATOM 1295 CG ASN B 68 31.595 8.896 -23.774 1.00 0.00 C ATOM 1296 OD1 ASN B 68 32.485 9.687 -23.879 1.00 0.00 O ATOM 1297 ND2 ASN B 68 30.803 8.859 -22.735 1.00 0.00 N ATOM 0 H ASN B 68 28.984 9.103 -25.214 1.00 0.00 H new ATOM 0 HA ASN B 68 31.598 9.061 -26.562 1.00 0.00 H new ATOM 0 HB2 ASN B 68 30.574 7.155 -24.446 1.00 0.00 H new ATOM 0 HB3 ASN B 68 32.213 7.308 -25.047 1.00 0.00 H new ATOM 0 HD21 ASN B 68 30.932 9.523 -21.971 1.00 0.00 H new ATOM 0 HD22 ASN B 68 30.056 8.166 -22.688 1.00 0.00 H new ATOM 1304 N GLU B 69 31.234 6.927 -27.897 1.00 0.00 N ATOM 1305 CA GLU B 69 31.138 5.696 -28.752 1.00 0.00 C ATOM 1306 C GLU B 69 30.658 4.420 -27.942 1.00 0.00 C ATOM 1307 O GLU B 69 29.861 3.652 -28.491 1.00 0.00 O ATOM 1308 CB GLU B 69 32.334 5.343 -29.655 1.00 0.00 C ATOM 1309 CG GLU B 69 32.863 6.505 -30.448 1.00 0.00 C ATOM 1310 CD GLU B 69 33.813 5.994 -31.577 1.00 0.00 C ATOM 1311 OE1 GLU B 69 34.200 4.823 -31.763 1.00 0.00 O ATOM 1312 OE2 GLU B 69 34.285 6.866 -32.312 1.00 0.00 O ATOM 0 H GLU B 69 32.141 7.385 -27.991 1.00 0.00 H new ATOM 0 HA GLU B 69 30.367 6.003 -29.459 1.00 0.00 H new ATOM 0 HB2 GLU B 69 33.137 4.942 -29.037 1.00 0.00 H new ATOM 0 HB3 GLU B 69 32.036 4.552 -30.343 1.00 0.00 H new ATOM 0 HG2 GLU B 69 32.036 7.065 -30.884 1.00 0.00 H new ATOM 0 HG3 GLU B 69 33.400 7.189 -29.791 1.00 0.00 H new ATOM 1319 N THR B 70 31.108 4.319 -26.684 1.00 0.00 N ATOM 1320 CA THR B 70 30.714 3.241 -25.809 1.00 0.00 C ATOM 1321 C THR B 70 29.361 3.497 -25.061 1.00 0.00 C ATOM 1322 O THR B 70 28.905 2.600 -24.356 1.00 0.00 O ATOM 1323 CB THR B 70 31.724 3.131 -24.634 1.00 0.00 C ATOM 1324 OG1 THR B 70 32.103 4.375 -24.085 1.00 0.00 O ATOM 1325 CG2 THR B 70 33.017 2.364 -24.962 1.00 0.00 C ATOM 0 H THR B 70 31.752 4.986 -26.259 1.00 0.00 H new ATOM 0 HA THR B 70 30.652 2.369 -26.461 1.00 0.00 H new ATOM 0 HB THR B 70 31.148 2.561 -23.905 1.00 0.00 H new ATOM 0 HG1 THR B 70 32.737 4.230 -23.352 1.00 0.00 H new ATOM 0 HG21 THR B 70 33.659 2.340 -24.081 1.00 0.00 H new ATOM 0 HG22 THR B 70 32.770 1.345 -25.259 1.00 0.00 H new ATOM 0 HG23 THR B 70 33.539 2.863 -25.778 1.00 0.00 H new ATOM 1333 N ASP B 71 28.753 4.678 -25.111 1.00 0.00 N ATOM 1334 CA ASP B 71 27.484 4.906 -24.493 1.00 0.00 C ATOM 1335 C ASP B 71 26.407 4.155 -25.262 1.00 0.00 C ATOM 1336 O ASP B 71 26.503 3.902 -26.487 1.00 0.00 O ATOM 1337 CB ASP B 71 27.103 6.315 -24.370 1.00 0.00 C ATOM 1338 CG ASP B 71 28.015 7.181 -23.531 1.00 0.00 C ATOM 1339 OD1 ASP B 71 28.599 6.625 -22.587 1.00 0.00 O ATOM 1340 OD2 ASP B 71 28.021 8.403 -23.751 1.00 0.00 O ATOM 0 H ASP B 71 29.140 5.494 -25.585 1.00 0.00 H new ATOM 0 HA ASP B 71 27.580 4.537 -23.472 1.00 0.00 H new ATOM 0 HB2 ASP B 71 27.048 6.744 -25.371 1.00 0.00 H new ATOM 0 HB3 ASP B 71 26.100 6.363 -23.947 1.00 0.00 H new ATOM 1345 N THR B 72 25.375 3.857 -24.526 1.00 0.00 N ATOM 1346 CA THR B 72 24.119 3.377 -25.072 1.00 0.00 C ATOM 1347 C THR B 72 22.932 4.116 -24.462 1.00 0.00 C ATOM 1348 O THR B 72 23.030 4.647 -23.291 1.00 0.00 O ATOM 1349 CB THR B 72 24.013 1.820 -24.908 1.00 0.00 C ATOM 1350 OG1 THR B 72 23.788 1.438 -23.562 1.00 0.00 O ATOM 1351 CG2 THR B 72 25.176 0.968 -25.364 1.00 0.00 C ATOM 0 H THR B 72 25.374 3.939 -23.509 1.00 0.00 H new ATOM 0 HA THR B 72 24.095 3.592 -26.140 1.00 0.00 H new ATOM 0 HB THR B 72 23.177 1.624 -25.579 1.00 0.00 H new ATOM 0 HG1 THR B 72 23.727 0.462 -23.505 1.00 0.00 H new ATOM 0 HG21 THR B 72 24.950 -0.083 -25.184 1.00 0.00 H new ATOM 0 HG22 THR B 72 25.347 1.125 -26.429 1.00 0.00 H new ATOM 0 HG23 THR B 72 26.071 1.247 -24.808 1.00 0.00 H new ATOM 1359 N PRO B 73 21.748 4.047 -25.232 1.00 0.00 N ATOM 1360 CA PRO B 73 20.559 4.675 -24.742 1.00 0.00 C ATOM 1361 C PRO B 73 20.156 4.008 -23.383 1.00 0.00 C ATOM 1362 O PRO B 73 19.484 4.722 -22.626 1.00 0.00 O ATOM 1363 CB PRO B 73 19.494 4.683 -25.840 1.00 0.00 C ATOM 1364 CG PRO B 73 20.198 4.017 -27.050 1.00 0.00 C ATOM 1365 CD PRO B 73 21.556 3.620 -26.616 1.00 0.00 C ATOM 0 HA PRO B 73 20.709 5.728 -24.506 1.00 0.00 H new ATOM 0 HB2 PRO B 73 18.606 4.127 -25.539 1.00 0.00 H new ATOM 0 HB3 PRO B 73 19.170 5.697 -26.075 1.00 0.00 H new ATOM 0 HG2 PRO B 73 19.635 3.147 -27.389 1.00 0.00 H new ATOM 0 HG3 PRO B 73 20.252 4.709 -27.890 1.00 0.00 H new ATOM 0 HD2 PRO B 73 21.679 2.540 -26.699 1.00 0.00 H new ATOM 0 HD3 PRO B 73 22.307 4.077 -27.260 1.00 0.00 H new ATOM 1373 N ALA B 74 20.615 2.815 -23.039 1.00 0.00 N ATOM 1374 CA ALA B 74 20.419 2.231 -21.688 1.00 0.00 C ATOM 1375 C ALA B 74 21.496 2.668 -20.687 1.00 0.00 C ATOM 1376 O ALA B 74 21.123 2.913 -19.555 1.00 0.00 O ATOM 1377 CB ALA B 74 20.424 0.728 -21.934 1.00 0.00 C ATOM 0 H ALA B 74 21.136 2.212 -23.676 1.00 0.00 H new ATOM 0 HA ALA B 74 19.493 2.572 -21.225 1.00 0.00 H new ATOM 0 HB1 ALA B 74 20.285 0.204 -20.988 1.00 0.00 H new ATOM 0 HB2 ALA B 74 19.614 0.468 -22.616 1.00 0.00 H new ATOM 0 HB3 ALA B 74 21.377 0.435 -22.374 1.00 0.00 H new ATOM 1383 N GLN B 75 22.786 2.969 -21.019 1.00 0.00 N ATOM 1384 CA GLN B 75 23.716 3.508 -19.982 1.00 0.00 C ATOM 1385 C GLN B 75 23.306 4.870 -19.545 1.00 0.00 C ATOM 1386 O GLN B 75 23.546 5.224 -18.343 1.00 0.00 O ATOM 1387 CB GLN B 75 25.119 3.486 -20.565 1.00 0.00 C ATOM 1388 CG GLN B 75 26.179 4.015 -19.524 1.00 0.00 C ATOM 1389 CD GLN B 75 26.314 3.174 -18.264 1.00 0.00 C ATOM 1390 OE1 GLN B 75 27.136 2.240 -18.249 1.00 0.00 O ATOM 1391 NE2 GLN B 75 25.636 3.461 -17.164 1.00 0.00 N ATOM 0 H GLN B 75 23.190 2.855 -21.949 1.00 0.00 H new ATOM 0 HA GLN B 75 23.687 2.890 -19.085 1.00 0.00 H new ATOM 0 HB2 GLN B 75 25.375 2.470 -20.864 1.00 0.00 H new ATOM 0 HB3 GLN B 75 25.151 4.101 -21.465 1.00 0.00 H new ATOM 0 HG2 GLN B 75 27.152 4.069 -20.013 1.00 0.00 H new ATOM 0 HG3 GLN B 75 25.909 5.032 -19.238 1.00 0.00 H new ATOM 0 HE21 GLN B 75 24.960 4.225 -17.166 1.00 0.00 H new ATOM 0 HE22 GLN B 75 25.790 2.918 -16.314 1.00 0.00 H new ATOM 1400 N LEU B 76 22.724 5.647 -20.508 1.00 0.00 N ATOM 1401 CA LEU B 76 22.061 6.952 -20.238 1.00 0.00 C ATOM 1402 C LEU B 76 20.601 6.882 -19.849 1.00 0.00 C ATOM 1403 O LEU B 76 20.016 7.889 -19.583 1.00 0.00 O ATOM 1404 CB LEU B 76 22.263 7.863 -21.446 1.00 0.00 C ATOM 1405 CG LEU B 76 23.766 8.035 -21.803 1.00 0.00 C ATOM 1406 CD1 LEU B 76 23.794 8.944 -23.057 1.00 0.00 C ATOM 1407 CD2 LEU B 76 24.689 8.670 -20.673 1.00 0.00 C ATOM 0 H LEU B 76 22.704 5.381 -21.493 1.00 0.00 H new ATOM 0 HA LEU B 76 22.543 7.358 -19.348 1.00 0.00 H new ATOM 0 HB2 LEU B 76 21.732 7.450 -22.304 1.00 0.00 H new ATOM 0 HB3 LEU B 76 21.826 8.840 -21.240 1.00 0.00 H new ATOM 0 HG LEU B 76 24.185 7.040 -21.951 1.00 0.00 H new ATOM 0 HD11 LEU B 76 24.827 9.108 -23.365 1.00 0.00 H new ATOM 0 HD12 LEU B 76 23.246 8.463 -23.867 1.00 0.00 H new ATOM 0 HD13 LEU B 76 23.329 9.902 -22.823 1.00 0.00 H new ATOM 0 HD21 LEU B 76 25.714 8.740 -21.037 1.00 0.00 H new ATOM 0 HD22 LEU B 76 24.324 9.666 -20.422 1.00 0.00 H new ATOM 0 HD23 LEU B 76 24.662 8.040 -19.784 1.00 0.00 H new ATOM 1419 N GLU B 77 19.976 5.669 -19.812 1.00 0.00 N ATOM 1420 CA GLU B 77 18.606 5.360 -19.350 1.00 0.00 C ATOM 1421 C GLU B 77 17.636 6.296 -20.097 1.00 0.00 C ATOM 1422 O GLU B 77 16.770 6.898 -19.439 1.00 0.00 O ATOM 1423 CB GLU B 77 18.478 5.420 -17.805 1.00 0.00 C ATOM 1424 CG GLU B 77 19.125 4.248 -17.067 1.00 0.00 C ATOM 1425 CD GLU B 77 18.435 2.893 -17.145 1.00 0.00 C ATOM 1426 OE1 GLU B 77 17.490 2.736 -17.976 1.00 0.00 O ATOM 1427 OE2 GLU B 77 18.830 1.980 -16.390 1.00 0.00 O ATOM 0 H GLU B 77 20.458 4.828 -20.129 1.00 0.00 H new ATOM 0 HA GLU B 77 18.347 4.329 -19.590 1.00 0.00 H new ATOM 0 HB2 GLU B 77 18.928 6.348 -17.452 1.00 0.00 H new ATOM 0 HB3 GLU B 77 17.421 5.459 -17.542 1.00 0.00 H new ATOM 0 HG2 GLU B 77 20.139 4.130 -17.449 1.00 0.00 H new ATOM 0 HG3 GLU B 77 19.210 4.520 -16.015 1.00 0.00 H new ATOM 1434 N MET B 78 17.900 6.585 -21.357 1.00 0.00 N ATOM 1435 CA MET B 78 17.141 7.482 -22.272 1.00 0.00 C ATOM 1436 C MET B 78 15.660 7.182 -22.400 1.00 0.00 C ATOM 1437 O MET B 78 15.284 5.991 -22.364 1.00 0.00 O ATOM 1438 CB MET B 78 17.859 7.562 -23.695 1.00 0.00 C ATOM 1439 CG MET B 78 19.246 8.212 -23.518 1.00 0.00 C ATOM 1440 SD MET B 78 19.940 8.956 -25.075 1.00 0.00 S ATOM 1441 CE MET B 78 19.165 10.660 -24.930 1.00 0.00 C ATOM 0 H MET B 78 18.710 6.178 -21.824 1.00 0.00 H new ATOM 0 HA MET B 78 17.163 8.464 -21.799 1.00 0.00 H new ATOM 0 HB2 MET B 78 17.962 6.564 -24.122 1.00 0.00 H new ATOM 0 HB3 MET B 78 17.255 8.146 -24.390 1.00 0.00 H new ATOM 0 HG2 MET B 78 19.177 8.989 -22.756 1.00 0.00 H new ATOM 0 HG3 MET B 78 19.942 7.461 -23.145 1.00 0.00 H new ATOM 0 HE1 MET B 78 18.912 11.030 -25.923 1.00 0.00 H new ATOM 0 HE2 MET B 78 18.261 10.598 -24.325 1.00 0.00 H new ATOM 0 HE3 MET B 78 19.872 11.342 -24.458 1.00 0.00 H new ATOM 1451 N GLU B 79 14.912 8.207 -22.755 1.00 0.00 N ATOM 1452 CA GLU B 79 13.429 8.146 -23.068 1.00 0.00 C ATOM 1453 C GLU B 79 13.016 8.426 -24.527 1.00 0.00 C ATOM 1454 O GLU B 79 13.801 8.996 -25.338 1.00 0.00 O ATOM 1455 CB GLU B 79 12.478 8.819 -22.018 1.00 0.00 C ATOM 1456 CG GLU B 79 12.254 8.005 -20.746 1.00 0.00 C ATOM 1457 CD GLU B 79 11.637 6.620 -20.866 1.00 0.00 C ATOM 1458 OE1 GLU B 79 10.825 6.374 -21.794 1.00 0.00 O ATOM 1459 OE2 GLU B 79 11.896 5.759 -20.024 1.00 0.00 O ATOM 0 H GLU B 79 15.294 9.148 -22.847 1.00 0.00 H new ATOM 0 HA GLU B 79 13.259 7.076 -22.952 1.00 0.00 H new ATOM 0 HB2 GLU B 79 12.891 9.790 -21.744 1.00 0.00 H new ATOM 0 HB3 GLU B 79 11.513 9.005 -22.489 1.00 0.00 H new ATOM 0 HG2 GLU B 79 13.218 7.896 -20.249 1.00 0.00 H new ATOM 0 HG3 GLU B 79 11.619 8.594 -20.084 1.00 0.00 H new ATOM 1466 N ASP B 80 11.729 8.035 -24.853 1.00 0.00 N ATOM 1467 CA ASP B 80 11.199 8.496 -26.105 1.00 0.00 C ATOM 1468 C ASP B 80 10.912 10.065 -26.168 1.00 0.00 C ATOM 1469 O ASP B 80 10.426 10.565 -25.165 1.00 0.00 O ATOM 1470 CB ASP B 80 9.986 7.765 -26.497 1.00 0.00 C ATOM 1471 CG ASP B 80 10.154 6.311 -26.290 1.00 0.00 C ATOM 1472 OD1 ASP B 80 10.717 5.653 -27.185 1.00 0.00 O ATOM 1473 OD2 ASP B 80 9.512 5.809 -25.338 1.00 0.00 O ATOM 0 H ASP B 80 11.116 7.448 -24.288 1.00 0.00 H new ATOM 0 HA ASP B 80 11.999 8.289 -26.816 1.00 0.00 H new ATOM 0 HB2 ASP B 80 9.137 8.123 -25.915 1.00 0.00 H new ATOM 0 HB3 ASP B 80 9.760 7.963 -27.545 1.00 0.00 H new ATOM 1478 N GLU B 81 11.130 10.719 -27.283 1.00 0.00 N ATOM 1479 CA GLU B 81 11.025 12.175 -27.373 1.00 0.00 C ATOM 1480 C GLU B 81 12.189 12.957 -26.623 1.00 0.00 C ATOM 1481 O GLU B 81 12.118 14.191 -26.349 1.00 0.00 O ATOM 1482 CB GLU B 81 9.564 12.613 -27.116 1.00 0.00 C ATOM 1483 CG GLU B 81 8.471 11.770 -27.782 1.00 0.00 C ATOM 1484 CD GLU B 81 8.635 11.964 -29.303 1.00 0.00 C ATOM 1485 OE1 GLU B 81 8.706 13.122 -29.744 1.00 0.00 O ATOM 1486 OE2 GLU B 81 8.801 11.008 -30.104 1.00 0.00 O ATOM 0 H GLU B 81 11.386 10.266 -28.160 1.00 0.00 H new ATOM 0 HA GLU B 81 11.231 12.497 -28.394 1.00 0.00 H new ATOM 0 HB2 GLU B 81 9.391 12.608 -26.040 1.00 0.00 H new ATOM 0 HB3 GLU B 81 9.453 13.644 -27.452 1.00 0.00 H new ATOM 0 HG2 GLU B 81 8.573 10.719 -27.512 1.00 0.00 H new ATOM 0 HG3 GLU B 81 7.481 12.089 -27.455 1.00 0.00 H new ATOM 1493 N ASP B 82 13.280 12.319 -26.259 1.00 0.00 N ATOM 1494 CA ASP B 82 14.556 12.999 -25.988 1.00 0.00 C ATOM 1495 C ASP B 82 15.331 13.280 -27.269 1.00 0.00 C ATOM 1496 O ASP B 82 15.221 12.633 -28.276 1.00 0.00 O ATOM 1497 CB ASP B 82 15.436 12.117 -25.015 1.00 0.00 C ATOM 1498 CG ASP B 82 14.866 11.879 -23.580 1.00 0.00 C ATOM 1499 OD1 ASP B 82 13.811 12.444 -23.258 1.00 0.00 O ATOM 1500 OD2 ASP B 82 15.590 11.185 -22.861 1.00 0.00 O ATOM 0 H ASP B 82 13.321 11.307 -26.138 1.00 0.00 H new ATOM 0 HA ASP B 82 14.329 13.956 -25.519 1.00 0.00 H new ATOM 0 HB2 ASP B 82 15.594 11.146 -25.484 1.00 0.00 H new ATOM 0 HB3 ASP B 82 16.414 12.588 -24.919 1.00 0.00 H new ATOM 1505 N THR B 83 16.183 14.360 -27.095 1.00 0.00 N ATOM 1506 CA THR B 83 16.867 14.937 -28.314 1.00 0.00 C ATOM 1507 C THR B 83 18.379 15.114 -28.095 1.00 0.00 C ATOM 1508 O THR B 83 18.743 15.830 -27.177 1.00 0.00 O ATOM 1509 CB THR B 83 16.168 16.368 -28.623 1.00 0.00 C ATOM 1510 OG1 THR B 83 14.806 16.190 -29.081 1.00 0.00 O ATOM 1511 CG2 THR B 83 16.939 17.123 -29.546 1.00 0.00 C ATOM 0 H THR B 83 16.397 14.812 -26.206 1.00 0.00 H new ATOM 0 HA THR B 83 16.756 14.253 -29.156 1.00 0.00 H new ATOM 0 HB THR B 83 16.128 16.935 -27.693 1.00 0.00 H new ATOM 0 HG1 THR B 83 14.404 17.066 -29.259 1.00 0.00 H new ATOM 0 HG21 THR B 83 16.448 18.077 -29.735 1.00 0.00 H new ATOM 0 HG22 THR B 83 17.931 17.302 -29.131 1.00 0.00 H new ATOM 0 HG23 THR B 83 17.031 16.570 -30.481 1.00 0.00 H new ATOM 1519 N ILE B 84 19.194 14.608 -29.027 1.00 0.00 N ATOM 1520 CA ILE B 84 20.632 14.856 -29.112 1.00 0.00 C ATOM 1521 C ILE B 84 20.992 16.152 -29.907 1.00 0.00 C ATOM 1522 O ILE B 84 20.339 16.520 -30.845 1.00 0.00 O ATOM 1523 CB ILE B 84 21.268 13.633 -29.821 1.00 0.00 C ATOM 1524 CG1 ILE B 84 21.038 12.318 -29.006 1.00 0.00 C ATOM 1525 CG2 ILE B 84 22.693 13.883 -30.154 1.00 0.00 C ATOM 1526 CD1 ILE B 84 19.876 11.443 -29.438 1.00 0.00 C ATOM 0 H ILE B 84 18.856 13.993 -29.767 1.00 0.00 H new ATOM 0 HA ILE B 84 21.014 15.000 -28.101 1.00 0.00 H new ATOM 0 HB ILE B 84 20.759 13.486 -30.774 1.00 0.00 H new ATOM 0 HG12 ILE B 84 21.950 11.723 -29.057 1.00 0.00 H new ATOM 0 HG13 ILE B 84 20.891 12.587 -27.960 1.00 0.00 H new ATOM 0 HG21 ILE B 84 23.110 13.007 -30.650 1.00 0.00 H new ATOM 0 HG22 ILE B 84 22.766 14.745 -30.818 1.00 0.00 H new ATOM 0 HG23 ILE B 84 23.251 14.082 -29.239 1.00 0.00 H new ATOM 0 HD11 ILE B 84 19.824 10.564 -28.795 1.00 0.00 H new ATOM 0 HD12 ILE B 84 18.947 12.007 -29.358 1.00 0.00 H new ATOM 0 HD13 ILE B 84 20.022 11.129 -30.471 1.00 0.00 H new ATOM 1538 N ASP B 85 21.995 16.857 -29.330 1.00 0.00 N ATOM 1539 CA ASP B 85 22.579 18.121 -29.809 1.00 0.00 C ATOM 1540 C ASP B 85 23.821 17.838 -30.606 1.00 0.00 C ATOM 1541 O ASP B 85 24.605 16.872 -30.344 1.00 0.00 O ATOM 1542 CB ASP B 85 22.821 19.098 -28.668 1.00 0.00 C ATOM 1543 CG ASP B 85 21.607 19.375 -27.819 1.00 0.00 C ATOM 1544 OD1 ASP B 85 20.465 19.648 -28.380 1.00 0.00 O ATOM 1545 OD2 ASP B 85 21.767 19.426 -26.565 1.00 0.00 O ATOM 0 H ASP B 85 22.439 16.536 -28.470 1.00 0.00 H new ATOM 0 HA ASP B 85 21.865 18.612 -30.470 1.00 0.00 H new ATOM 0 HB2 ASP B 85 23.613 18.705 -28.031 1.00 0.00 H new ATOM 0 HB3 ASP B 85 23.183 20.039 -29.082 1.00 0.00 H new ATOM 1550 N VAL B 86 24.035 18.723 -31.617 1.00 0.00 N ATOM 1551 CA VAL B 86 25.194 18.825 -32.533 1.00 0.00 C ATOM 1552 C VAL B 86 25.895 20.223 -32.505 1.00 0.00 C ATOM 1553 O VAL B 86 25.162 21.245 -32.501 1.00 0.00 O ATOM 1554 CB VAL B 86 24.784 18.399 -33.982 1.00 0.00 C ATOM 1555 CG1 VAL B 86 26.063 18.289 -34.967 1.00 0.00 C ATOM 1556 CG2 VAL B 86 24.146 17.030 -33.997 1.00 0.00 C ATOM 0 H VAL B 86 23.341 19.441 -31.826 1.00 0.00 H new ATOM 0 HA VAL B 86 25.947 18.127 -32.168 1.00 0.00 H new ATOM 0 HB VAL B 86 24.092 19.170 -34.320 1.00 0.00 H new ATOM 0 HG11 VAL B 86 25.732 17.991 -35.962 1.00 0.00 H new ATOM 0 HG12 VAL B 86 26.561 19.257 -35.025 1.00 0.00 H new ATOM 0 HG13 VAL B 86 26.759 17.545 -34.578 1.00 0.00 H new ATOM 0 HG21 VAL B 86 23.874 16.767 -35.019 1.00 0.00 H new ATOM 0 HG22 VAL B 86 24.851 16.296 -33.608 1.00 0.00 H new ATOM 0 HG23 VAL B 86 23.251 17.039 -33.374 1.00 0.00 H new ATOM 1566 N PHE B 87 27.232 20.178 -32.495 1.00 0.00 N ATOM 1567 CA PHE B 87 28.199 21.262 -32.381 1.00 0.00 C ATOM 1568 C PHE B 87 29.440 20.989 -33.177 1.00 0.00 C ATOM 1569 O PHE B 87 29.749 19.838 -33.410 1.00 0.00 O ATOM 1570 CB PHE B 87 28.603 21.334 -30.848 1.00 0.00 C ATOM 1571 CG PHE B 87 27.521 21.780 -29.911 1.00 0.00 C ATOM 1572 CD1 PHE B 87 27.242 23.178 -29.830 1.00 0.00 C ATOM 1573 CD2 PHE B 87 26.691 20.874 -29.182 1.00 0.00 C ATOM 1574 CE1 PHE B 87 26.256 23.649 -29.037 1.00 0.00 C ATOM 1575 CE2 PHE B 87 25.575 21.418 -28.513 1.00 0.00 C ATOM 1576 CZ PHE B 87 25.351 22.789 -28.398 1.00 0.00 C ATOM 0 H PHE B 87 27.709 19.280 -32.576 1.00 0.00 H new ATOM 0 HA PHE B 87 27.760 22.186 -32.756 1.00 0.00 H new ATOM 0 HB2 PHE B 87 28.946 20.348 -30.535 1.00 0.00 H new ATOM 0 HB3 PHE B 87 29.450 22.013 -30.746 1.00 0.00 H new ATOM 0 HD1 PHE B 87 27.830 23.871 -30.413 1.00 0.00 H new ATOM 0 HD2 PHE B 87 26.909 19.817 -29.145 1.00 0.00 H new ATOM 0 HE1 PHE B 87 26.162 24.715 -28.891 1.00 0.00 H new ATOM 0 HE2 PHE B 87 24.861 20.741 -28.069 1.00 0.00 H new ATOM 0 HZ PHE B 87 24.512 23.175 -27.838 1.00 0.00 H new ATOM 1586 N GLN B 88 30.318 21.978 -33.511 1.00 0.00 N ATOM 1587 CA GLN B 88 31.642 21.809 -34.004 1.00 0.00 C ATOM 1588 C GLN B 88 32.776 22.226 -33.092 1.00 0.00 C ATOM 1589 O GLN B 88 32.563 23.121 -32.209 1.00 0.00 O ATOM 1590 CB GLN B 88 31.681 22.493 -35.363 1.00 0.00 C ATOM 1591 CG GLN B 88 30.568 22.091 -36.390 1.00 0.00 C ATOM 1592 CD GLN B 88 31.107 21.855 -37.788 1.00 0.00 C ATOM 1593 OE1 GLN B 88 32.303 22.061 -38.074 1.00 0.00 O ATOM 1594 NE2 GLN B 88 30.244 21.452 -38.664 1.00 0.00 N ATOM 0 H GLN B 88 30.066 22.962 -33.423 1.00 0.00 H new ATOM 0 HA GLN B 88 31.839 20.739 -34.075 1.00 0.00 H new ATOM 0 HB2 GLN B 88 31.622 23.570 -35.203 1.00 0.00 H new ATOM 0 HB3 GLN B 88 32.651 22.291 -35.817 1.00 0.00 H new ATOM 0 HG2 GLN B 88 30.070 21.186 -36.041 1.00 0.00 H new ATOM 0 HG3 GLN B 88 29.814 22.877 -36.426 1.00 0.00 H new ATOM 0 HE21 GLN B 88 29.274 21.295 -38.390 1.00 0.00 H new ATOM 0 HE22 GLN B 88 30.534 21.291 -39.629 1.00 0.00 H new ATOM 1603 N GLN B 89 33.963 21.709 -33.313 1.00 0.00 N ATOM 1604 CA GLN B 89 35.213 22.315 -32.871 1.00 0.00 C ATOM 1605 C GLN B 89 36.205 22.563 -34.013 1.00 0.00 C ATOM 1606 O GLN B 89 36.130 21.819 -34.986 1.00 0.00 O ATOM 1607 CB GLN B 89 35.773 21.403 -31.755 1.00 0.00 C ATOM 1608 CG GLN B 89 35.152 21.515 -30.382 1.00 0.00 C ATOM 1609 CD GLN B 89 35.881 20.707 -29.214 1.00 0.00 C ATOM 1610 OE1 GLN B 89 36.692 19.898 -29.461 1.00 0.00 O ATOM 1611 NE2 GLN B 89 35.464 20.837 -28.019 1.00 0.00 N ATOM 0 H GLN B 89 34.097 20.833 -33.818 1.00 0.00 H new ATOM 0 HA GLN B 89 35.033 23.318 -32.483 1.00 0.00 H new ATOM 0 HB2 GLN B 89 35.674 20.369 -32.085 1.00 0.00 H new ATOM 0 HB3 GLN B 89 36.840 21.606 -31.659 1.00 0.00 H new ATOM 0 HG2 GLN B 89 35.122 22.568 -30.104 1.00 0.00 H new ATOM 0 HG3 GLN B 89 34.119 21.172 -30.444 1.00 0.00 H new ATOM 0 HE21 GLN B 89 34.758 21.540 -27.799 1.00 0.00 H new ATOM 0 HE22 GLN B 89 35.836 20.239 -27.281 1.00 0.00 H new ATOM 1620 N GLN B 90 37.092 23.533 -33.966 1.00 0.00 N ATOM 1621 CA GLN B 90 38.086 23.789 -35.021 1.00 0.00 C ATOM 1622 C GLN B 90 39.513 23.190 -34.718 1.00 0.00 C ATOM 1623 O GLN B 90 39.821 22.771 -33.659 1.00 0.00 O ATOM 1624 CB GLN B 90 38.196 25.310 -35.365 1.00 0.00 C ATOM 1625 CG GLN B 90 37.223 25.846 -36.402 1.00 0.00 C ATOM 1626 CD GLN B 90 35.751 25.551 -36.179 1.00 0.00 C ATOM 1627 OE1 GLN B 90 35.152 25.839 -35.165 1.00 0.00 O ATOM 1628 NE2 GLN B 90 35.098 24.849 -37.090 1.00 0.00 N ATOM 0 H GLN B 90 37.155 24.186 -33.185 1.00 0.00 H new ATOM 0 HA GLN B 90 37.706 23.258 -35.894 1.00 0.00 H new ATOM 0 HB2 GLN B 90 38.060 25.878 -34.445 1.00 0.00 H new ATOM 0 HB3 GLN B 90 39.209 25.508 -35.715 1.00 0.00 H new ATOM 0 HG2 GLN B 90 37.348 26.927 -36.457 1.00 0.00 H new ATOM 0 HG3 GLN B 90 37.507 25.442 -37.374 1.00 0.00 H new ATOM 0 HE21 GLN B 90 35.562 24.584 -37.959 1.00 0.00 H new ATOM 0 HE22 GLN B 90 34.130 24.573 -36.924 1.00 0.00 H new ATOM 1637 N THR B 91 40.414 23.164 -35.692 1.00 0.00 N ATOM 1638 CA THR B 91 41.847 22.997 -35.505 1.00 0.00 C ATOM 1639 C THR B 91 42.659 24.344 -35.495 1.00 0.00 C ATOM 1640 O THR B 91 43.700 24.343 -35.003 1.00 0.00 O ATOM 1641 CB THR B 91 42.454 22.086 -36.536 1.00 0.00 C ATOM 1642 OG1 THR B 91 42.362 22.597 -37.825 1.00 0.00 O ATOM 1643 CG2 THR B 91 41.941 20.659 -36.565 1.00 0.00 C ATOM 0 H THR B 91 40.154 23.263 -36.673 1.00 0.00 H new ATOM 0 HA THR B 91 41.927 22.549 -34.515 1.00 0.00 H new ATOM 0 HB THR B 91 43.490 22.044 -36.201 1.00 0.00 H new ATOM 0 HG1 THR B 91 42.772 21.969 -38.456 1.00 0.00 H new ATOM 0 HG21 THR B 91 42.455 20.103 -37.349 1.00 0.00 H new ATOM 0 HG22 THR B 91 42.129 20.185 -35.602 1.00 0.00 H new ATOM 0 HG23 THR B 91 40.869 20.662 -36.765 1.00 0.00 H new ATOM 1651 N GLY B 92 42.100 25.442 -36.054 1.00 0.00 N ATOM 1652 CA GLY B 92 42.487 26.812 -35.732 1.00 0.00 C ATOM 1653 C GLY B 92 43.294 27.581 -36.797 1.00 0.00 C ATOM 1654 O GLY B 92 43.651 26.993 -37.804 1.00 0.00 O ATOM 0 H GLY B 92 41.357 25.387 -36.751 1.00 0.00 H new ATOM 0 HA2 GLY B 92 41.581 27.379 -35.520 1.00 0.00 H new ATOM 0 HA3 GLY B 92 43.073 26.791 -34.813 1.00 0.00 H new ATOM 1658 N GLY B 93 43.639 28.850 -36.579 1.00 0.00 N ATOM 1659 CA GLY B 93 44.127 29.718 -37.627 1.00 0.00 C ATOM 1660 C GLY B 93 45.286 30.581 -37.118 1.00 0.00 C ATOM 1661 O GLY B 93 46.276 30.029 -36.693 1.00 0.00 O ATOM 0 H GLY B 93 43.584 29.297 -35.664 1.00 0.00 H new ATOM 0 HA2 GLY B 93 44.457 29.121 -38.477 1.00 0.00 H new ATOM 0 HA3 GLY B 93 43.319 30.358 -37.982 1.00 0.00 H new ATOM 1665 N VAL B 94 45.209 31.911 -37.162 1.00 0.00 N ATOM 1666 CA VAL B 94 46.295 32.672 -36.621 1.00 0.00 C ATOM 1667 C VAL B 94 46.305 32.697 -35.098 1.00 0.00 C ATOM 1668 O VAL B 94 45.198 32.820 -34.473 1.00 0.00 O ATOM 1669 CB VAL B 94 46.269 34.136 -37.195 1.00 0.00 C ATOM 1670 CG1 VAL B 94 47.357 35.059 -36.658 1.00 0.00 C ATOM 1671 CG2 VAL B 94 46.398 34.161 -38.698 1.00 0.00 C ATOM 0 H VAL B 94 44.436 32.450 -37.552 1.00 0.00 H new ATOM 0 HA VAL B 94 47.215 32.174 -36.929 1.00 0.00 H new ATOM 0 HB VAL B 94 45.298 34.504 -36.863 1.00 0.00 H new ATOM 0 HG11 VAL B 94 47.255 36.044 -37.113 1.00 0.00 H new ATOM 0 HG12 VAL B 94 47.258 35.147 -35.576 1.00 0.00 H new ATOM 0 HG13 VAL B 94 48.336 34.647 -36.901 1.00 0.00 H new ATOM 0 HG21 VAL B 94 46.375 35.193 -39.048 1.00 0.00 H new ATOM 0 HG22 VAL B 94 47.341 33.700 -38.990 1.00 0.00 H new ATOM 0 HG23 VAL B 94 45.571 33.608 -39.143 1.00 0.00 H new ATOM 1681 N TYR B 95 47.554 32.596 -34.492 1.00 0.00 N ATOM 1682 CA TYR B 95 47.800 32.676 -33.035 1.00 0.00 C ATOM 1683 C TYR B 95 48.639 33.917 -32.693 1.00 0.00 C ATOM 1684 O TYR B 95 49.825 34.009 -33.092 1.00 0.00 O ATOM 1685 CB TYR B 95 48.638 31.429 -32.587 1.00 0.00 C ATOM 1686 CG TYR B 95 47.764 30.179 -32.518 1.00 0.00 C ATOM 1687 CD1 TYR B 95 46.938 29.859 -31.382 1.00 0.00 C ATOM 1688 CD2 TYR B 95 47.731 29.357 -33.631 1.00 0.00 C ATOM 1689 CE1 TYR B 95 46.150 28.668 -31.438 1.00 0.00 C ATOM 1690 CE2 TYR B 95 46.825 28.289 -33.757 1.00 0.00 C ATOM 1691 CZ TYR B 95 46.066 27.905 -32.610 1.00 0.00 C ATOM 1692 OH TYR B 95 45.292 26.746 -32.744 1.00 0.00 O ATOM 1693 OXT TYR B 95 48.212 34.719 -31.836 1.00 0.00 O ATOM 0 H TYR B 95 48.409 32.456 -35.030 1.00 0.00 H new ATOM 0 HA TYR B 95 46.834 32.720 -32.532 1.00 0.00 H new ATOM 0 HB2 TYR B 95 49.457 31.266 -33.287 1.00 0.00 H new ATOM 0 HB3 TYR B 95 49.086 31.619 -31.611 1.00 0.00 H new ATOM 0 HD1 TYR B 95 46.915 30.500 -30.513 1.00 0.00 H new ATOM 0 HD2 TYR B 95 48.428 29.543 -34.434 1.00 0.00 H new ATOM 0 HE1 TYR B 95 45.609 28.350 -30.559 1.00 0.00 H new ATOM 0 HE2 TYR B 95 46.706 27.772 -34.698 1.00 0.00 H new ATOM 0 HH TYR B 95 45.392 26.389 -33.651 1.00 0.00 H new TER 1703 TYR B 95