USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1005 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 LYS NZ :NH3+ -151:sc= -0.658 (180deg=0) USER MOD Set 1.2: A 100 GLN :FLIP amide:sc= -0.912 F(o=-3.6,f=-1.6) USER MOD Single : A 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= -0.0203 K(o=-0.02,f=-2.1) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -152:sc= 1.21 (180deg=-0.00498) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.304 X(o=-0.3,f=0) USER MOD Single : A 20 LYS NZ :NH3+ -177:sc= -0.301 (180deg=-0.392) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -175:sc=-0.00127 (180deg=-0.0236) USER MOD Single : A 26 TYR OH : rot -75:sc= 2.62 USER MOD Single : A 28 THR OG1 : rot 92:sc= 0.0189 USER MOD Single : A 30 SER OG : rot 180:sc= -0.168 USER MOD Single : A 31 SER OG : rot -45:sc= 0.0835 USER MOD Single : A 32 ASN : amide:sc= -0.0781 K(o=-0.078,f=-1.1) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -3.23! C(o=-3.2!,f=-3.7!) USER MOD Single : A 40 SER OG : rot 180:sc= 0.153 USER MOD Single : A 42 ASN : amide:sc= -0.199 X(o=-0.2,f=-0.016) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS :FLIP no HD1:sc= -1.46 F(o=-6.8!,f=-1.5) USER MOD Single : A 47 SER OG : rot 180:sc= -0.127 USER MOD Single : A 48 THR OG1 : rot 111:sc= -2.74 USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 53 MET CE :methyl 163:sc= -12.4! (180deg=-14.4!) USER MOD Single : A 58 THR OG1 : rot -71:sc= -2.53 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -132:sc= -0.105 (180deg=-1.79!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 27:sc= 0.07 USER MOD Single : A 84 GLN : amide:sc= -0.0208 X(o=-0.021,f=-0.35) USER MOD Single : A 89 ASN : amide:sc= 0.72 K(o=0.72,f=-0.17) USER MOD Single : A 96 SER OG : rot 129:sc= -2.29! USER MOD Single : A 97 SER OG : rot 150:sc= -1.77 USER MOD Single : A 98 THR OG1 : rot -47:sc= 0.977 USER MOD Single : A 101 THR OG1 : rot 51:sc= 0.378 USER MOD Single : A 103 HIS : no HE2:sc= -7.15! C(o=-7.1!,f=-9.1!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 67:sc= 1.12 USER MOD Single : A 122 GLN : amide:sc= -2.17! C(o=-2.2!,f=-3.7!) USER MOD Single : A 126 SER OG : rot 160:sc= -0.0142 USER MOD Single : A 128 GLN : amide:sc= -0.37 K(o=-0.37,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -15.099 -17.900 14.605 1.00 0.00 N ATOM 2 CA ARG A 1 -15.182 -16.425 14.763 1.00 0.00 C ATOM 3 C ARG A 1 -14.091 -15.722 13.961 1.00 0.00 C ATOM 4 O ARG A 1 -12.971 -16.221 13.847 1.00 0.00 O ATOM 5 CB ARG A 1 -15.051 -16.086 16.250 1.00 0.00 C ATOM 6 CG ARG A 1 -16.150 -15.171 16.764 1.00 0.00 C ATOM 7 CD ARG A 1 -16.214 -15.174 18.282 1.00 0.00 C ATOM 8 NE ARG A 1 -17.346 -14.401 18.784 1.00 0.00 N ATOM 9 CZ ARG A 1 -17.582 -14.186 20.077 1.00 0.00 C ATOM 10 NH1 ARG A 1 -16.768 -14.684 21.000 1.00 0.00 N ATOM 11 NH2 ARG A 1 -18.636 -13.471 20.448 1.00 0.00 N ATOM 0 H1 ARG A 1 -15.853 -18.352 15.161 1.00 0.00 H new ATOM 0 H2 ARG A 1 -15.213 -18.149 13.602 1.00 0.00 H new ATOM 0 H3 ARG A 1 -14.173 -18.234 14.941 1.00 0.00 H new ATOM 0 HA ARG A 1 -16.142 -16.077 14.382 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -15.060 -17.011 16.827 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -14.085 -15.612 16.422 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -15.975 -14.156 16.408 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -17.110 -15.490 16.358 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -16.289 -16.201 18.639 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -15.288 -14.764 18.685 1.00 0.00 H new ATOM 0 HE ARG A 1 -17.994 -14.002 18.105 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -15.956 -15.235 20.721 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -16.954 -14.516 21.989 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -19.265 -13.086 19.743 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -18.817 -13.306 21.438 1.00 0.00 H new ATOM 27 N ALA A 2 -14.425 -14.561 13.408 1.00 0.00 N ATOM 28 CA ALA A 2 -13.475 -13.788 12.617 1.00 0.00 C ATOM 29 C ALA A 2 -13.241 -12.412 13.231 1.00 0.00 C ATOM 30 O ALA A 2 -13.919 -12.021 14.180 1.00 0.00 O ATOM 31 CB ALA A 2 -13.968 -13.650 11.185 1.00 0.00 C ATOM 0 H ALA A 2 -15.348 -14.134 13.493 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.525 -14.323 12.613 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -13.248 -13.071 10.607 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.078 -14.639 10.741 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -14.932 -13.141 11.179 1.00 0.00 H new ATOM 37 N ILE A 3 -12.280 -11.680 12.677 1.00 0.00 N ATOM 38 CA ILE A 3 -11.958 -10.346 13.162 1.00 0.00 C ATOM 39 C ILE A 3 -11.839 -9.361 12.002 1.00 0.00 C ATOM 40 O ILE A 3 -11.186 -9.650 11.001 1.00 0.00 O ATOM 41 CB ILE A 3 -10.641 -10.335 13.963 1.00 0.00 C ATOM 42 CG1 ILE A 3 -10.621 -11.476 14.983 1.00 0.00 C ATOM 43 CG2 ILE A 3 -10.456 -8.994 14.658 1.00 0.00 C ATOM 44 CD1 ILE A 3 -9.225 -11.908 15.378 1.00 0.00 C ATOM 0 H ILE A 3 -11.710 -11.991 11.890 1.00 0.00 H new ATOM 0 HA ILE A 3 -12.773 -10.043 13.819 1.00 0.00 H new ATOM 0 HB ILE A 3 -9.814 -10.483 13.269 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -11.163 -11.164 15.876 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -11.154 -12.332 14.569 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.522 -9.001 15.220 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -10.425 -8.199 13.913 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -11.288 -8.820 15.340 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.287 -12.720 16.103 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -8.687 -12.251 14.494 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -8.695 -11.065 15.821 1.00 0.00 H new ATOM 56 N PRO A 4 -12.469 -8.179 12.114 1.00 0.00 N ATOM 57 CA PRO A 4 -12.421 -7.162 11.058 1.00 0.00 C ATOM 58 C PRO A 4 -10.998 -6.725 10.742 1.00 0.00 C ATOM 59 O PRO A 4 -10.238 -6.346 11.634 1.00 0.00 O ATOM 60 CB PRO A 4 -13.223 -5.992 11.637 1.00 0.00 C ATOM 61 CG PRO A 4 -14.066 -6.591 12.711 1.00 0.00 C ATOM 62 CD PRO A 4 -13.274 -7.739 13.266 1.00 0.00 C ATOM 0 HA PRO A 4 -12.821 -7.540 10.117 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -12.563 -5.222 12.037 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -13.838 -5.519 10.871 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -14.288 -5.859 13.487 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -15.021 -6.932 12.312 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -12.646 -7.429 14.101 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -13.922 -8.535 13.633 1.00 0.00 H new ATOM 70 N ILE A 5 -10.648 -6.778 9.463 1.00 0.00 N ATOM 71 CA ILE A 5 -9.315 -6.383 9.017 1.00 0.00 C ATOM 72 C ILE A 5 -9.285 -4.916 8.591 1.00 0.00 C ATOM 73 O ILE A 5 -8.225 -4.295 8.546 1.00 0.00 O ATOM 74 CB ILE A 5 -8.830 -7.264 7.849 1.00 0.00 C ATOM 75 CG1 ILE A 5 -9.061 -8.741 8.170 1.00 0.00 C ATOM 76 CG2 ILE A 5 -7.360 -7.001 7.557 1.00 0.00 C ATOM 77 CD1 ILE A 5 -8.215 -9.252 9.316 1.00 0.00 C ATOM 0 H ILE A 5 -11.267 -7.090 8.715 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.644 -6.520 9.865 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.404 -7.010 6.958 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -10.113 -8.891 8.411 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.850 -9.335 7.281 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -7.035 -7.632 6.730 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.224 -5.953 7.290 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.767 -7.230 8.442 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -8.432 -10.306 9.487 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.160 -9.134 9.070 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.443 -8.684 10.218 1.00 0.00 H new ATOM 89 N LYS A 6 -10.461 -4.366 8.297 1.00 0.00 N ATOM 90 CA LYS A 6 -10.595 -2.970 7.893 1.00 0.00 C ATOM 91 C LYS A 6 -12.036 -2.683 7.533 1.00 0.00 C ATOM 92 O LYS A 6 -12.524 -3.160 6.527 1.00 0.00 O ATOM 93 CB LYS A 6 -9.711 -2.645 6.677 1.00 0.00 C ATOM 94 CG LYS A 6 -8.776 -1.466 6.879 1.00 0.00 C ATOM 95 CD LYS A 6 -7.896 -1.638 8.108 1.00 0.00 C ATOM 96 CE LYS A 6 -7.384 -0.299 8.621 1.00 0.00 C ATOM 97 NZ LYS A 6 -7.815 -0.041 10.022 1.00 0.00 N ATOM 0 H LYS A 6 -11.345 -4.874 8.332 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.276 -2.351 8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.118 -3.525 6.429 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.353 -2.441 5.820 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.147 -1.347 5.997 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.362 -0.552 6.978 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.462 -2.138 8.894 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.051 -2.282 7.864 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.295 -0.281 8.567 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -7.748 0.500 7.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -7.446 0.880 10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.854 -0.032 10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.446 -0.790 10.642 1.00 0.00 H new ATOM 111 N GLN A 7 -12.711 -1.901 8.342 1.00 0.00 N ATOM 112 CA GLN A 7 -14.099 -1.568 8.062 1.00 0.00 C ATOM 113 C GLN A 7 -14.323 -0.068 8.179 1.00 0.00 C ATOM 114 O GLN A 7 -14.197 0.507 9.260 1.00 0.00 O ATOM 115 CB GLN A 7 -15.033 -2.315 9.016 1.00 0.00 C ATOM 116 CG GLN A 7 -14.823 -1.954 10.477 1.00 0.00 C ATOM 117 CD GLN A 7 -15.516 -2.917 11.421 1.00 0.00 C ATOM 118 OE1 GLN A 7 -16.028 -3.955 11.001 1.00 0.00 O ATOM 119 NE2 GLN A 7 -15.538 -2.577 12.704 1.00 0.00 N ATOM 0 H GLN A 7 -12.332 -1.484 9.192 1.00 0.00 H new ATOM 0 HA GLN A 7 -14.324 -1.876 7.041 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -16.066 -2.101 8.742 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -14.886 -3.388 8.890 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -13.755 -1.943 10.695 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -15.195 -0.945 10.655 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -15.101 -1.707 13.009 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -15.992 -3.186 13.385 1.00 0.00 H new ATOM 128 N SER A 8 -14.648 0.565 7.059 1.00 0.00 N ATOM 129 CA SER A 8 -14.881 2.005 7.042 1.00 0.00 C ATOM 130 C SER A 8 -15.467 2.455 5.711 1.00 0.00 C ATOM 131 O SER A 8 -15.777 1.636 4.846 1.00 0.00 O ATOM 132 CB SER A 8 -13.575 2.755 7.316 1.00 0.00 C ATOM 133 OG SER A 8 -13.802 3.890 8.136 1.00 0.00 O ATOM 0 H SER A 8 -14.756 0.107 6.154 1.00 0.00 H new ATOM 0 HA SER A 8 -15.602 2.236 7.826 1.00 0.00 H new ATOM 0 HB2 SER A 8 -12.863 2.087 7.802 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.126 3.067 6.373 1.00 0.00 H new ATOM 0 HG SER A 8 -12.953 4.351 8.298 1.00 0.00 H new ATOM 139 N PHE A 9 -15.623 3.767 5.558 1.00 0.00 N ATOM 140 CA PHE A 9 -16.177 4.334 4.335 1.00 0.00 C ATOM 141 C PHE A 9 -15.113 4.454 3.251 1.00 0.00 C ATOM 142 O PHE A 9 -14.017 4.961 3.494 1.00 0.00 O ATOM 143 CB PHE A 9 -16.789 5.710 4.615 1.00 0.00 C ATOM 144 CG PHE A 9 -17.584 5.769 5.888 1.00 0.00 C ATOM 145 CD1 PHE A 9 -18.443 4.737 6.232 1.00 0.00 C ATOM 146 CD2 PHE A 9 -17.472 6.855 6.740 1.00 0.00 C ATOM 147 CE1 PHE A 9 -19.176 4.787 7.402 1.00 0.00 C ATOM 148 CE2 PHE A 9 -18.203 6.911 7.913 1.00 0.00 C ATOM 149 CZ PHE A 9 -19.056 5.876 8.243 1.00 0.00 C ATOM 0 H PHE A 9 -15.373 4.457 6.267 1.00 0.00 H new ATOM 0 HA PHE A 9 -16.956 3.660 3.979 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -15.990 6.451 4.661 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -17.434 5.988 3.781 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -18.540 3.883 5.577 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -16.807 7.667 6.486 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -19.842 3.976 7.659 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -18.107 7.763 8.570 1.00 0.00 H new ATOM 0 HZ PHE A 9 -19.629 5.918 9.158 1.00 0.00 H new ATOM 159 N LEU A 10 -15.448 3.991 2.055 1.00 0.00 N ATOM 160 CA LEU A 10 -14.532 4.049 0.922 1.00 0.00 C ATOM 161 C LEU A 10 -15.188 4.757 -0.252 1.00 0.00 C ATOM 162 O LEU A 10 -16.410 4.752 -0.384 1.00 0.00 O ATOM 163 CB LEU A 10 -14.111 2.640 0.501 1.00 0.00 C ATOM 164 CG LEU A 10 -12.852 2.105 1.182 1.00 0.00 C ATOM 165 CD1 LEU A 10 -13.191 1.526 2.547 1.00 0.00 C ATOM 166 CD2 LEU A 10 -12.178 1.056 0.310 1.00 0.00 C ATOM 0 H LEU A 10 -16.352 3.569 1.843 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.647 4.607 1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -14.934 1.956 0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -13.952 2.633 -0.577 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.157 2.933 1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.283 1.149 3.018 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -13.629 2.303 3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -13.904 0.710 2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -11.283 0.686 0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -12.866 0.228 0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.901 1.501 -0.646 1.00 0.00 H new ATOM 178 N LEU A 11 -14.376 5.355 -1.112 1.00 0.00 N ATOM 179 CA LEU A 11 -14.903 6.050 -2.279 1.00 0.00 C ATOM 180 C LEU A 11 -14.995 5.094 -3.465 1.00 0.00 C ATOM 181 O LEU A 11 -14.049 4.364 -3.755 1.00 0.00 O ATOM 182 CB LEU A 11 -14.030 7.258 -2.630 1.00 0.00 C ATOM 183 CG LEU A 11 -14.779 8.590 -2.716 1.00 0.00 C ATOM 184 CD1 LEU A 11 -15.509 8.879 -1.414 1.00 0.00 C ATOM 185 CD2 LEU A 11 -13.819 9.721 -3.055 1.00 0.00 C ATOM 0 H LEU A 11 -13.360 5.374 -1.026 1.00 0.00 H new ATOM 0 HA LEU A 11 -15.904 6.411 -2.043 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.242 7.348 -1.882 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.542 7.070 -3.586 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.519 8.517 -3.513 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.035 9.830 -1.495 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.227 8.083 -1.215 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.789 8.931 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.369 10.660 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.055 9.794 -2.281 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.344 9.520 -4.015 1.00 0.00 H new ATOM 197 N LYS A 12 -16.143 5.094 -4.138 1.00 0.00 N ATOM 198 CA LYS A 12 -16.356 4.214 -5.283 1.00 0.00 C ATOM 199 C LYS A 12 -16.615 5.018 -6.554 1.00 0.00 C ATOM 200 O LYS A 12 -17.663 5.646 -6.700 1.00 0.00 O ATOM 201 CB LYS A 12 -17.531 3.271 -5.012 1.00 0.00 C ATOM 202 CG LYS A 12 -17.878 2.369 -6.188 1.00 0.00 C ATOM 203 CD LYS A 12 -16.824 1.294 -6.400 1.00 0.00 C ATOM 204 CE LYS A 12 -15.981 1.573 -7.635 1.00 0.00 C ATOM 205 NZ LYS A 12 -16.779 1.480 -8.889 1.00 0.00 N ATOM 0 H LYS A 12 -16.938 5.692 -3.911 1.00 0.00 H new ATOM 0 HA LYS A 12 -15.450 3.626 -5.430 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.295 2.651 -4.147 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.407 3.864 -4.749 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.847 1.900 -6.014 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.973 2.970 -7.092 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -16.179 1.238 -5.523 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -17.309 0.323 -6.501 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -15.543 2.568 -7.557 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -15.155 0.863 -7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -16.158 1.204 -9.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -17.528 0.768 -8.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -17.210 2.404 -9.096 1.00 0.00 H new ATOM 219 N ARG A 13 -15.654 4.986 -7.472 1.00 0.00 N ATOM 220 CA ARG A 13 -15.774 5.706 -8.736 1.00 0.00 C ATOM 221 C ARG A 13 -17.013 5.257 -9.504 1.00 0.00 C ATOM 222 O ARG A 13 -17.425 4.099 -9.419 1.00 0.00 O ATOM 223 CB ARG A 13 -14.525 5.486 -9.591 1.00 0.00 C ATOM 224 CG ARG A 13 -14.259 4.024 -9.915 1.00 0.00 C ATOM 225 CD ARG A 13 -13.459 3.874 -11.198 1.00 0.00 C ATOM 226 NE ARG A 13 -13.828 2.668 -11.936 1.00 0.00 N ATOM 227 CZ ARG A 13 -13.221 2.262 -13.048 1.00 0.00 C ATOM 228 NH1 ARG A 13 -12.214 2.962 -13.555 1.00 0.00 N ATOM 229 NH2 ARG A 13 -13.620 1.153 -13.656 1.00 0.00 N ATOM 0 H ARG A 13 -14.782 4.468 -7.364 1.00 0.00 H new ATOM 0 HA ARG A 13 -15.873 6.768 -8.512 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -14.630 6.043 -10.522 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -13.661 5.897 -9.069 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -13.717 3.561 -9.091 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -15.206 3.494 -10.012 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -13.619 4.748 -11.829 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.396 3.842 -10.961 1.00 0.00 H new ATOM 0 HE ARG A 13 -14.598 2.103 -11.577 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -11.902 3.816 -13.092 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -11.752 2.646 -14.408 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -14.393 0.610 -13.271 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -13.154 0.843 -14.509 1.00 0.00 H new ATOM 243 N SER A 14 -17.603 6.181 -10.256 1.00 0.00 N ATOM 244 CA SER A 14 -18.795 5.879 -11.041 1.00 0.00 C ATOM 245 C SER A 14 -18.871 6.769 -12.278 1.00 0.00 C ATOM 246 O SER A 14 -18.951 7.993 -12.170 1.00 0.00 O ATOM 247 CB SER A 14 -20.053 6.062 -10.189 1.00 0.00 C ATOM 248 OG SER A 14 -21.127 5.286 -10.692 1.00 0.00 O ATOM 0 H SER A 14 -17.276 7.144 -10.338 1.00 0.00 H new ATOM 0 HA SER A 14 -18.732 4.840 -11.365 1.00 0.00 H new ATOM 0 HB2 SER A 14 -19.843 5.774 -9.159 1.00 0.00 H new ATOM 0 HB3 SER A 14 -20.336 7.114 -10.174 1.00 0.00 H new ATOM 0 HG SER A 14 -21.918 5.419 -10.129 1.00 0.00 H new ATOM 254 N GLY A 15 -18.844 6.147 -13.451 1.00 0.00 N ATOM 255 CA GLY A 15 -18.910 6.897 -14.692 1.00 0.00 C ATOM 256 C GLY A 15 -17.850 6.470 -15.687 1.00 0.00 C ATOM 257 O GLY A 15 -17.397 5.325 -15.668 1.00 0.00 O ATOM 0 H GLY A 15 -18.778 5.136 -13.565 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -19.896 6.767 -15.139 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -18.795 7.959 -14.477 1.00 0.00 H new ATOM 261 N ASN A 16 -17.452 7.392 -16.559 1.00 0.00 N ATOM 262 CA ASN A 16 -16.438 7.103 -17.567 1.00 0.00 C ATOM 263 C ASN A 16 -15.037 7.183 -16.968 1.00 0.00 C ATOM 264 O ASN A 16 -14.858 7.653 -15.843 1.00 0.00 O ATOM 265 CB ASN A 16 -16.562 8.079 -18.738 1.00 0.00 C ATOM 266 CG ASN A 16 -17.847 7.886 -19.518 1.00 0.00 C ATOM 267 OD1 ASN A 16 -18.737 8.735 -19.490 1.00 0.00 O ATOM 268 ND2 ASN A 16 -17.950 6.762 -20.220 1.00 0.00 N ATOM 0 H ASN A 16 -17.816 8.344 -16.588 1.00 0.00 H new ATOM 0 HA ASN A 16 -16.600 6.088 -17.930 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -16.519 9.101 -18.362 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -15.711 7.949 -19.407 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -18.792 6.576 -20.764 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -17.187 6.085 -20.214 1.00 0.00 H new ATOM 275 N SER A 17 -14.049 6.721 -17.724 1.00 0.00 N ATOM 276 CA SER A 17 -12.663 6.739 -17.270 1.00 0.00 C ATOM 277 C SER A 17 -12.103 8.158 -17.286 1.00 0.00 C ATOM 278 O SER A 17 -11.341 8.545 -16.401 1.00 0.00 O ATOM 279 CB SER A 17 -11.803 5.828 -18.147 1.00 0.00 C ATOM 280 OG SER A 17 -10.448 5.853 -17.735 1.00 0.00 O ATOM 0 H SER A 17 -14.182 6.328 -18.656 1.00 0.00 H new ATOM 0 HA SER A 17 -12.639 6.370 -16.245 1.00 0.00 H new ATOM 0 HB2 SER A 17 -12.182 4.807 -18.098 1.00 0.00 H new ATOM 0 HB3 SER A 17 -11.876 6.145 -19.187 1.00 0.00 H new ATOM 0 HG SER A 17 -9.920 5.261 -18.311 1.00 0.00 H new ATOM 286 N LEU A 18 -12.486 8.929 -18.301 1.00 0.00 N ATOM 287 CA LEU A 18 -12.022 10.304 -18.431 1.00 0.00 C ATOM 288 C LEU A 18 -12.594 11.178 -17.322 1.00 0.00 C ATOM 289 O LEU A 18 -11.901 12.030 -16.766 1.00 0.00 O ATOM 290 CB LEU A 18 -12.415 10.871 -19.797 1.00 0.00 C ATOM 291 CG LEU A 18 -11.600 12.082 -20.254 1.00 0.00 C ATOM 292 CD1 LEU A 18 -11.368 12.034 -21.758 1.00 0.00 C ATOM 293 CD2 LEU A 18 -12.304 13.372 -19.863 1.00 0.00 C ATOM 0 H LEU A 18 -13.115 8.624 -19.043 1.00 0.00 H new ATOM 0 HA LEU A 18 -10.935 10.303 -18.345 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.315 10.083 -20.543 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.468 11.151 -19.768 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.630 12.053 -19.757 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.787 12.904 -22.064 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.823 11.125 -22.013 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -12.328 12.039 -22.275 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -11.712 14.225 -20.195 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -13.287 13.407 -20.334 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -12.419 13.410 -18.780 1.00 0.00 H new ATOM 305 N ASN A 19 -13.863 10.958 -17.004 1.00 0.00 N ATOM 306 CA ASN A 19 -14.537 11.722 -15.960 1.00 0.00 C ATOM 307 C ASN A 19 -14.908 10.818 -14.787 1.00 0.00 C ATOM 308 O ASN A 19 -15.952 10.168 -14.799 1.00 0.00 O ATOM 309 CB ASN A 19 -15.792 12.394 -16.519 1.00 0.00 C ATOM 310 CG ASN A 19 -15.466 13.434 -17.575 1.00 0.00 C ATOM 311 OD1 ASN A 19 -15.330 14.620 -17.273 1.00 0.00 O ATOM 312 ND2 ASN A 19 -15.339 12.994 -18.821 1.00 0.00 N ATOM 0 H ASN A 19 -14.448 10.255 -17.455 1.00 0.00 H new ATOM 0 HA ASN A 19 -13.852 12.492 -15.604 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -16.447 11.636 -16.949 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -16.342 12.866 -15.705 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -15.120 13.648 -19.573 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -15.460 12.002 -19.026 1.00 0.00 H new ATOM 319 N LYS A 20 -14.042 10.782 -13.780 1.00 0.00 N ATOM 320 CA LYS A 20 -14.275 9.955 -12.603 1.00 0.00 C ATOM 321 C LYS A 20 -15.222 10.641 -11.625 1.00 0.00 C ATOM 322 O LYS A 20 -15.401 11.857 -11.660 1.00 0.00 O ATOM 323 CB LYS A 20 -12.949 9.623 -11.915 1.00 0.00 C ATOM 324 CG LYS A 20 -12.450 8.220 -12.221 1.00 0.00 C ATOM 325 CD LYS A 20 -11.188 7.895 -11.444 1.00 0.00 C ATOM 326 CE LYS A 20 -10.353 6.842 -12.154 1.00 0.00 C ATOM 327 NZ LYS A 20 -9.466 6.107 -11.211 1.00 0.00 N ATOM 0 H LYS A 20 -13.173 11.316 -13.756 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.744 9.028 -12.931 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -12.195 10.346 -12.226 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.069 9.732 -10.837 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.226 7.495 -11.975 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.254 8.128 -13.289 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.597 8.801 -11.312 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -11.454 7.540 -10.448 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -11.012 6.135 -12.658 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.748 7.318 -12.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.877 5.434 -11.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.854 6.783 -10.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.046 5.590 -10.520 1.00 0.00 H new ATOM 341 N GLU A 21 -15.823 9.840 -10.752 1.00 0.00 N ATOM 342 CA GLU A 21 -16.753 10.341 -9.754 1.00 0.00 C ATOM 343 C GLU A 21 -16.956 9.295 -8.669 1.00 0.00 C ATOM 344 O GLU A 21 -17.726 8.349 -8.836 1.00 0.00 O ATOM 345 CB GLU A 21 -18.093 10.706 -10.397 1.00 0.00 C ATOM 346 CG GLU A 21 -19.020 11.481 -9.475 1.00 0.00 C ATOM 347 CD GLU A 21 -18.994 12.973 -9.745 1.00 0.00 C ATOM 348 OE1 GLU A 21 -18.096 13.657 -9.211 1.00 0.00 O ATOM 349 OE2 GLU A 21 -19.872 13.456 -10.490 1.00 0.00 O ATOM 0 H GLU A 21 -15.679 8.831 -10.718 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.334 11.243 -9.307 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -17.907 11.298 -11.293 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -18.594 9.792 -10.717 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -20.038 11.111 -9.595 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.734 11.297 -8.439 1.00 0.00 H new ATOM 356 N TRP A 22 -16.241 9.464 -7.570 1.00 0.00 N ATOM 357 CA TRP A 22 -16.314 8.530 -6.457 1.00 0.00 C ATOM 358 C TRP A 22 -17.327 8.989 -5.414 1.00 0.00 C ATOM 359 O TRP A 22 -17.279 10.124 -4.942 1.00 0.00 O ATOM 360 CB TRP A 22 -14.937 8.378 -5.809 1.00 0.00 C ATOM 361 CG TRP A 22 -13.823 8.199 -6.795 1.00 0.00 C ATOM 362 CD1 TRP A 22 -13.482 9.045 -7.812 1.00 0.00 C ATOM 363 CD2 TRP A 22 -12.899 7.108 -6.855 1.00 0.00 C ATOM 364 NE1 TRP A 22 -12.407 8.545 -8.502 1.00 0.00 N ATOM 365 CE2 TRP A 22 -12.031 7.356 -7.934 1.00 0.00 C ATOM 366 CE3 TRP A 22 -12.723 5.942 -6.102 1.00 0.00 C ATOM 367 CZ2 TRP A 22 -11.004 6.484 -8.277 1.00 0.00 C ATOM 368 CZ3 TRP A 22 -11.698 5.078 -6.448 1.00 0.00 C ATOM 369 CH2 TRP A 22 -10.857 5.355 -7.521 1.00 0.00 C ATOM 0 H TRP A 22 -15.600 10.243 -7.423 1.00 0.00 H new ATOM 0 HA TRP A 22 -16.641 7.567 -6.848 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -14.733 9.258 -5.200 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -14.955 7.521 -5.135 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -13.986 9.973 -8.040 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -11.961 8.986 -9.306 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -13.373 5.721 -5.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -10.347 6.691 -9.109 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -11.549 4.174 -5.876 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -10.067 4.659 -7.763 1.00 0.00 H new ATOM 380 N LYS A 23 -18.236 8.091 -5.054 1.00 0.00 N ATOM 381 CA LYS A 23 -19.256 8.393 -4.059 1.00 0.00 C ATOM 382 C LYS A 23 -18.935 7.693 -2.743 1.00 0.00 C ATOM 383 O LYS A 23 -18.170 6.729 -2.715 1.00 0.00 O ATOM 384 CB LYS A 23 -20.635 7.962 -4.561 1.00 0.00 C ATOM 385 CG LYS A 23 -21.350 9.032 -5.371 1.00 0.00 C ATOM 386 CD LYS A 23 -22.443 9.710 -4.560 1.00 0.00 C ATOM 387 CE LYS A 23 -23.814 9.146 -4.894 1.00 0.00 C ATOM 388 NZ LYS A 23 -24.202 8.047 -3.967 1.00 0.00 N ATOM 0 H LYS A 23 -18.287 7.147 -5.437 1.00 0.00 H new ATOM 0 HA LYS A 23 -19.266 9.470 -3.891 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -20.526 7.067 -5.173 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -21.255 7.690 -3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -20.629 9.778 -5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.784 8.584 -6.265 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -22.243 9.579 -3.497 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -22.432 10.782 -4.756 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -24.556 9.942 -4.844 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -23.814 8.774 -5.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -25.143 7.689 -4.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -23.507 7.276 -4.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -24.227 8.408 -2.992 1.00 0.00 H new ATOM 402 N LYS A 24 -19.520 8.181 -1.656 1.00 0.00 N ATOM 403 CA LYS A 24 -19.285 7.592 -0.343 1.00 0.00 C ATOM 404 C LYS A 24 -19.785 6.151 -0.300 1.00 0.00 C ATOM 405 O LYS A 24 -20.957 5.880 -0.557 1.00 0.00 O ATOM 406 CB LYS A 24 -19.968 8.423 0.744 1.00 0.00 C ATOM 407 CG LYS A 24 -19.001 9.268 1.559 1.00 0.00 C ATOM 408 CD LYS A 24 -18.106 8.403 2.432 1.00 0.00 C ATOM 409 CE LYS A 24 -17.387 9.229 3.484 1.00 0.00 C ATOM 410 NZ LYS A 24 -15.993 9.557 3.075 1.00 0.00 N ATOM 0 H LYS A 24 -20.157 8.978 -1.657 1.00 0.00 H new ATOM 0 HA LYS A 24 -18.211 7.589 -0.158 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -20.707 9.076 0.280 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -20.509 7.755 1.415 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -18.386 9.869 0.888 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -19.561 9.962 2.185 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.705 7.634 2.919 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.374 7.890 1.808 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -17.940 10.151 3.662 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.370 8.681 4.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -15.536 10.121 3.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.458 8.677 2.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -16.010 10.102 2.189 1.00 0.00 H new ATOM 424 N LYS A 25 -18.880 5.234 0.023 1.00 0.00 N ATOM 425 CA LYS A 25 -19.213 3.816 0.099 1.00 0.00 C ATOM 426 C LYS A 25 -18.903 3.263 1.485 1.00 0.00 C ATOM 427 O LYS A 25 -18.430 3.986 2.362 1.00 0.00 O ATOM 428 CB LYS A 25 -18.435 3.033 -0.964 1.00 0.00 C ATOM 429 CG LYS A 25 -19.302 2.102 -1.794 1.00 0.00 C ATOM 430 CD LYS A 25 -20.234 2.876 -2.710 1.00 0.00 C ATOM 431 CE LYS A 25 -20.853 1.976 -3.767 1.00 0.00 C ATOM 432 NZ LYS A 25 -21.925 2.670 -4.531 1.00 0.00 N ATOM 0 H LYS A 25 -17.906 5.448 0.237 1.00 0.00 H new ATOM 0 HA LYS A 25 -20.281 3.704 -0.087 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -17.935 3.738 -1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -17.656 2.449 -0.474 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -18.667 1.447 -2.390 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -19.888 1.463 -1.133 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -21.023 3.340 -2.119 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -19.683 3.682 -3.195 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -20.078 1.638 -4.455 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -21.265 1.087 -3.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -22.378 1.998 -5.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -22.636 3.044 -3.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -21.512 3.454 -5.075 1.00 0.00 H new ATOM 446 N TYR A 26 -19.171 1.977 1.674 1.00 0.00 N ATOM 447 CA TYR A 26 -18.919 1.320 2.951 1.00 0.00 C ATOM 448 C TYR A 26 -18.340 -0.072 2.723 1.00 0.00 C ATOM 449 O TYR A 26 -19.002 -0.938 2.162 1.00 0.00 O ATOM 450 CB TYR A 26 -20.219 1.228 3.753 1.00 0.00 C ATOM 451 CG TYR A 26 -20.049 0.642 5.134 1.00 0.00 C ATOM 452 CD1 TYR A 26 -20.045 -0.733 5.331 1.00 0.00 C ATOM 453 CD2 TYR A 26 -19.901 1.464 6.243 1.00 0.00 C ATOM 454 CE1 TYR A 26 -19.897 -1.272 6.594 1.00 0.00 C ATOM 455 CE2 TYR A 26 -19.753 0.933 7.510 1.00 0.00 C ATOM 456 CZ TYR A 26 -19.753 -0.436 7.680 1.00 0.00 C ATOM 457 OH TYR A 26 -19.605 -0.970 8.941 1.00 0.00 O ATOM 0 H TYR A 26 -19.564 1.367 0.957 1.00 0.00 H new ATOM 0 HA TYR A 26 -18.195 1.908 3.515 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -20.649 2.225 3.843 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.934 0.621 3.198 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.160 -1.391 4.483 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.902 2.536 6.113 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.894 -2.343 6.730 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.638 1.586 8.362 1.00 0.00 H new ATOM 0 HH TYR A 26 -20.471 -1.300 9.260 1.00 0.00 H new ATOM 467 N VAL A 27 -17.096 -0.280 3.147 1.00 0.00 N ATOM 468 CA VAL A 27 -16.438 -1.572 2.963 1.00 0.00 C ATOM 469 C VAL A 27 -15.978 -2.163 4.282 1.00 0.00 C ATOM 470 O VAL A 27 -15.571 -1.441 5.192 1.00 0.00 O ATOM 471 CB VAL A 27 -15.201 -1.472 2.044 1.00 0.00 C ATOM 472 CG1 VAL A 27 -14.911 -2.819 1.401 1.00 0.00 C ATOM 473 CG2 VAL A 27 -15.388 -0.401 0.980 1.00 0.00 C ATOM 0 H VAL A 27 -16.526 0.423 3.617 1.00 0.00 H new ATOM 0 HA VAL A 27 -17.189 -2.214 2.503 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.347 -1.185 2.658 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.037 -2.734 0.756 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.718 -3.559 2.178 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -15.770 -3.132 0.808 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -14.500 -0.356 0.350 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -16.256 -0.644 0.367 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -15.542 0.566 1.460 1.00 0.00 H new ATOM 483 N THR A 28 -16.001 -3.487 4.362 1.00 0.00 N ATOM 484 CA THR A 28 -15.539 -4.177 5.552 1.00 0.00 C ATOM 485 C THR A 28 -14.729 -5.413 5.187 1.00 0.00 C ATOM 486 O THR A 28 -15.271 -6.413 4.711 1.00 0.00 O ATOM 487 CB THR A 28 -16.693 -4.586 6.466 1.00 0.00 C ATOM 488 OG1 THR A 28 -17.434 -3.454 6.884 1.00 0.00 O ATOM 489 CG2 THR A 28 -16.216 -5.318 7.708 1.00 0.00 C ATOM 0 H THR A 28 -16.334 -4.100 3.618 1.00 0.00 H new ATOM 0 HA THR A 28 -14.907 -3.472 6.091 1.00 0.00 H new ATOM 0 HB THR A 28 -17.319 -5.256 5.876 1.00 0.00 H new ATOM 0 HG1 THR A 28 -18.175 -3.299 6.261 1.00 0.00 H new ATOM 0 HG21 THR A 28 -17.074 -5.587 8.324 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.682 -6.222 7.415 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.549 -4.671 8.278 1.00 0.00 H new ATOM 497 N LEU A 29 -13.437 -5.343 5.450 1.00 0.00 N ATOM 498 CA LEU A 29 -12.541 -6.450 5.205 1.00 0.00 C ATOM 499 C LEU A 29 -12.504 -7.311 6.452 1.00 0.00 C ATOM 500 O LEU A 29 -12.079 -6.853 7.511 1.00 0.00 O ATOM 501 CB LEU A 29 -11.139 -5.944 4.874 1.00 0.00 C ATOM 502 CG LEU A 29 -10.521 -6.558 3.624 1.00 0.00 C ATOM 503 CD1 LEU A 29 -10.379 -8.061 3.788 1.00 0.00 C ATOM 504 CD2 LEU A 29 -11.362 -6.229 2.401 1.00 0.00 C ATOM 0 H LEU A 29 -12.983 -4.517 5.839 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.895 -7.031 4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.178 -4.862 4.750 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -10.485 -6.145 5.723 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.528 -6.133 3.482 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.936 -8.485 2.887 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.737 -8.275 4.643 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -11.362 -8.504 3.952 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.907 -6.675 1.516 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.368 -6.629 2.533 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.415 -5.147 2.276 1.00 0.00 H new ATOM 516 N SER A 30 -12.976 -8.540 6.335 1.00 0.00 N ATOM 517 CA SER A 30 -13.016 -9.444 7.475 1.00 0.00 C ATOM 518 C SER A 30 -11.934 -10.506 7.378 1.00 0.00 C ATOM 519 O SER A 30 -11.398 -10.769 6.302 1.00 0.00 O ATOM 520 CB SER A 30 -14.390 -10.111 7.575 1.00 0.00 C ATOM 521 OG SER A 30 -14.394 -11.123 8.568 1.00 0.00 O ATOM 0 H SER A 30 -13.336 -8.935 5.466 1.00 0.00 H new ATOM 0 HA SER A 30 -12.834 -8.854 8.373 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.145 -9.362 7.812 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.660 -10.542 6.611 1.00 0.00 H new ATOM 0 HG SER A 30 -15.283 -11.533 8.614 1.00 0.00 H new ATOM 527 N SER A 31 -11.622 -11.119 8.514 1.00 0.00 N ATOM 528 CA SER A 31 -10.606 -12.162 8.556 1.00 0.00 C ATOM 529 C SER A 31 -11.139 -13.480 7.988 1.00 0.00 C ATOM 530 O SER A 31 -10.436 -14.490 7.980 1.00 0.00 O ATOM 531 CB SER A 31 -10.119 -12.379 9.990 1.00 0.00 C ATOM 532 OG SER A 31 -8.849 -13.008 10.009 1.00 0.00 O ATOM 0 H SER A 31 -12.056 -10.913 9.414 1.00 0.00 H new ATOM 0 HA SER A 31 -9.770 -11.833 7.938 1.00 0.00 H new ATOM 0 HB2 SER A 31 -10.061 -11.421 10.506 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.839 -12.991 10.533 1.00 0.00 H new ATOM 0 HG SER A 31 -8.845 -13.755 9.375 1.00 0.00 H new ATOM 538 N ASN A 32 -12.388 -13.466 7.514 1.00 0.00 N ATOM 539 CA ASN A 32 -13.011 -14.658 6.946 1.00 0.00 C ATOM 540 C ASN A 32 -12.754 -14.758 5.450 1.00 0.00 C ATOM 541 O ASN A 32 -13.538 -15.361 4.715 1.00 0.00 O ATOM 542 CB ASN A 32 -14.516 -14.653 7.219 1.00 0.00 C ATOM 543 CG ASN A 32 -15.051 -16.033 7.543 1.00 0.00 C ATOM 544 OD1 ASN A 32 -14.399 -17.042 7.276 1.00 0.00 O ATOM 545 ND2 ASN A 32 -16.245 -16.085 8.123 1.00 0.00 N ATOM 0 H ASN A 32 -12.986 -12.640 7.514 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.563 -15.528 7.426 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.729 -13.980 8.049 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -15.039 -14.259 6.347 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -16.656 -16.987 8.365 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.751 -15.223 8.327 1.00 0.00 H new ATOM 552 N GLY A 33 -11.658 -14.161 5.000 1.00 0.00 N ATOM 553 CA GLY A 33 -11.325 -14.193 3.590 1.00 0.00 C ATOM 554 C GLY A 33 -12.469 -13.698 2.734 1.00 0.00 C ATOM 555 O GLY A 33 -12.749 -14.256 1.673 1.00 0.00 O ATOM 0 H GLY A 33 -10.994 -13.655 5.586 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.443 -13.578 3.410 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.068 -15.212 3.300 1.00 0.00 H new ATOM 559 N PHE A 34 -13.140 -12.653 3.204 1.00 0.00 N ATOM 560 CA PHE A 34 -14.269 -12.091 2.480 1.00 0.00 C ATOM 561 C PHE A 34 -14.250 -10.569 2.518 1.00 0.00 C ATOM 562 O PHE A 34 -14.175 -9.961 3.585 1.00 0.00 O ATOM 563 CB PHE A 34 -15.582 -12.607 3.067 1.00 0.00 C ATOM 564 CG PHE A 34 -16.442 -13.310 2.063 1.00 0.00 C ATOM 565 CD1 PHE A 34 -16.618 -12.784 0.793 1.00 0.00 C ATOM 566 CD2 PHE A 34 -17.068 -14.501 2.384 1.00 0.00 C ATOM 567 CE1 PHE A 34 -17.406 -13.433 -0.137 1.00 0.00 C ATOM 568 CE2 PHE A 34 -17.858 -15.155 1.459 1.00 0.00 C ATOM 569 CZ PHE A 34 -18.027 -14.622 0.197 1.00 0.00 C ATOM 0 H PHE A 34 -12.921 -12.180 4.081 1.00 0.00 H new ATOM 0 HA PHE A 34 -14.188 -12.407 1.440 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -15.362 -13.289 3.888 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -16.138 -11.769 3.489 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -16.133 -11.856 0.528 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -16.938 -14.924 3.369 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -17.537 -13.013 -1.123 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -18.343 -16.083 1.723 1.00 0.00 H new ATOM 0 HZ PHE A 34 -18.643 -15.133 -0.528 1.00 0.00 H new ATOM 579 N LEU A 35 -14.341 -9.962 1.343 1.00 0.00 N ATOM 580 CA LEU A 35 -14.356 -8.514 1.230 1.00 0.00 C ATOM 581 C LEU A 35 -15.772 -8.042 0.913 1.00 0.00 C ATOM 582 O LEU A 35 -16.329 -8.388 -0.129 1.00 0.00 O ATOM 583 CB LEU A 35 -13.374 -8.063 0.140 1.00 0.00 C ATOM 584 CG LEU A 35 -13.641 -6.685 -0.473 1.00 0.00 C ATOM 585 CD1 LEU A 35 -13.891 -5.643 0.610 1.00 0.00 C ATOM 586 CD2 LEU A 35 -12.478 -6.265 -1.360 1.00 0.00 C ATOM 0 H LEU A 35 -14.406 -10.454 0.452 1.00 0.00 H new ATOM 0 HA LEU A 35 -14.043 -8.071 2.175 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -12.369 -8.063 0.561 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -13.384 -8.803 -0.660 1.00 0.00 H new ATOM 0 HG LEU A 35 -14.540 -6.755 -1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.078 -4.674 0.147 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -14.758 -5.935 1.203 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.016 -5.573 1.257 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -12.683 -5.284 -1.788 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.566 -6.218 -0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.351 -6.992 -2.162 1.00 0.00 H new ATOM 598 N LEU A 36 -16.359 -7.268 1.821 1.00 0.00 N ATOM 599 CA LEU A 36 -17.720 -6.779 1.628 1.00 0.00 C ATOM 600 C LEU A 36 -17.750 -5.270 1.434 1.00 0.00 C ATOM 601 O LEU A 36 -16.939 -4.541 2.003 1.00 0.00 O ATOM 602 CB LEU A 36 -18.597 -7.163 2.822 1.00 0.00 C ATOM 603 CG LEU A 36 -18.278 -8.520 3.453 1.00 0.00 C ATOM 604 CD1 LEU A 36 -17.432 -8.343 4.703 1.00 0.00 C ATOM 605 CD2 LEU A 36 -19.559 -9.274 3.774 1.00 0.00 C ATOM 0 H LEU A 36 -15.918 -6.968 2.690 1.00 0.00 H new ATOM 0 HA LEU A 36 -18.112 -7.246 0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -18.500 -6.392 3.587 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -19.639 -7.165 2.502 1.00 0.00 H new ATOM 0 HG LEU A 36 -17.706 -9.107 2.734 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.216 -9.319 5.137 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -16.497 -7.847 4.442 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -17.975 -7.736 5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -19.312 -10.237 4.222 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -20.159 -8.691 4.473 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -20.126 -9.435 2.857 1.00 0.00 H new ATOM 617 N TYR A 37 -18.707 -4.809 0.635 1.00 0.00 N ATOM 618 CA TYR A 37 -18.863 -3.386 0.373 1.00 0.00 C ATOM 619 C TYR A 37 -20.298 -3.074 -0.047 1.00 0.00 C ATOM 620 O TYR A 37 -20.858 -3.729 -0.928 1.00 0.00 O ATOM 621 CB TYR A 37 -17.850 -2.917 -0.685 1.00 0.00 C ATOM 622 CG TYR A 37 -18.405 -2.748 -2.085 1.00 0.00 C ATOM 623 CD1 TYR A 37 -18.723 -3.852 -2.865 1.00 0.00 C ATOM 624 CD2 TYR A 37 -18.595 -1.483 -2.628 1.00 0.00 C ATOM 625 CE1 TYR A 37 -19.218 -3.700 -4.147 1.00 0.00 C ATOM 626 CE2 TYR A 37 -19.088 -1.323 -3.910 1.00 0.00 C ATOM 627 CZ TYR A 37 -19.398 -2.436 -4.664 1.00 0.00 C ATOM 628 OH TYR A 37 -19.890 -2.281 -5.941 1.00 0.00 O ATOM 0 H TYR A 37 -19.386 -5.402 0.158 1.00 0.00 H new ATOM 0 HA TYR A 37 -18.659 -2.836 1.292 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.427 -1.965 -0.362 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -17.030 -3.634 -0.721 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -18.581 -4.845 -2.464 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -18.354 -0.610 -2.039 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -19.462 -4.569 -4.740 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -19.229 -0.333 -4.318 1.00 0.00 H new ATOM 0 HH TYR A 37 -19.958 -1.326 -6.152 1.00 0.00 H new ATOM 638 N HIS A 38 -20.890 -2.078 0.602 1.00 0.00 N ATOM 639 CA HIS A 38 -22.261 -1.680 0.312 1.00 0.00 C ATOM 640 C HIS A 38 -22.316 -0.225 -0.146 1.00 0.00 C ATOM 641 O HIS A 38 -21.410 0.560 0.136 1.00 0.00 O ATOM 642 CB HIS A 38 -23.150 -1.863 1.548 1.00 0.00 C ATOM 643 CG HIS A 38 -22.745 -3.002 2.437 1.00 0.00 C ATOM 644 ND1 HIS A 38 -21.500 -3.101 3.022 1.00 0.00 N ATOM 645 CD2 HIS A 38 -23.437 -4.092 2.847 1.00 0.00 C ATOM 646 CE1 HIS A 38 -21.442 -4.202 3.750 1.00 0.00 C ATOM 647 NE2 HIS A 38 -22.605 -4.820 3.662 1.00 0.00 N ATOM 0 H HIS A 38 -20.439 -1.530 1.335 1.00 0.00 H new ATOM 0 HA HIS A 38 -22.631 -2.318 -0.490 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -23.138 -0.941 2.130 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -24.178 -2.020 1.222 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -24.454 -4.342 2.582 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -20.589 -4.539 4.320 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -22.847 -5.696 4.124 1.00 0.00 H new ATOM 656 N PRO A 39 -23.391 0.156 -0.859 1.00 0.00 N ATOM 657 CA PRO A 39 -23.568 1.524 -1.356 1.00 0.00 C ATOM 658 C PRO A 39 -23.324 2.572 -0.277 1.00 0.00 C ATOM 659 O PRO A 39 -22.692 3.600 -0.526 1.00 0.00 O ATOM 660 CB PRO A 39 -25.030 1.546 -1.805 1.00 0.00 C ATOM 661 CG PRO A 39 -25.335 0.134 -2.166 1.00 0.00 C ATOM 662 CD PRO A 39 -24.519 -0.721 -1.233 1.00 0.00 C ATOM 0 HA PRO A 39 -22.859 1.767 -2.148 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -25.684 1.901 -1.008 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -25.173 2.212 -2.656 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -26.399 -0.075 -2.056 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -25.076 -0.067 -3.206 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -25.096 -1.026 -0.360 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -24.174 -1.632 -1.722 1.00 0.00 H new ATOM 670 N SER A 40 -23.827 2.308 0.925 1.00 0.00 N ATOM 671 CA SER A 40 -23.663 3.231 2.043 1.00 0.00 C ATOM 672 C SER A 40 -23.774 2.495 3.374 1.00 0.00 C ATOM 673 O SER A 40 -23.838 1.266 3.410 1.00 0.00 O ATOM 674 CB SER A 40 -24.712 4.342 1.974 1.00 0.00 C ATOM 675 OG SER A 40 -24.485 5.322 2.971 1.00 0.00 O ATOM 0 H SER A 40 -24.352 1.463 1.150 1.00 0.00 H new ATOM 0 HA SER A 40 -22.670 3.674 1.973 1.00 0.00 H new ATOM 0 HB2 SER A 40 -24.687 4.809 0.989 1.00 0.00 H new ATOM 0 HB3 SER A 40 -25.707 3.915 2.100 1.00 0.00 H new ATOM 0 HG SER A 40 -25.168 6.021 2.904 1.00 0.00 H new ATOM 681 N ILE A 41 -23.797 3.252 4.466 1.00 0.00 N ATOM 682 CA ILE A 41 -23.903 2.666 5.797 1.00 0.00 C ATOM 683 C ILE A 41 -25.263 1.999 5.989 1.00 0.00 C ATOM 684 O ILE A 41 -25.350 0.891 6.517 1.00 0.00 O ATOM 685 CB ILE A 41 -23.670 3.724 6.899 1.00 0.00 C ATOM 686 CG1 ILE A 41 -22.206 4.172 6.888 1.00 0.00 C ATOM 687 CG2 ILE A 41 -24.049 3.178 8.271 1.00 0.00 C ATOM 688 CD1 ILE A 41 -21.868 5.116 5.753 1.00 0.00 C ATOM 0 H ILE A 41 -23.744 4.271 4.456 1.00 0.00 H new ATOM 0 HA ILE A 41 -23.124 1.908 5.883 1.00 0.00 H new ATOM 0 HB ILE A 41 -24.308 4.583 6.693 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -21.977 4.660 7.835 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -21.566 3.292 6.820 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -23.875 3.943 9.028 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -25.103 2.898 8.273 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -23.441 2.302 8.495 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -20.815 5.391 5.810 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -22.064 4.624 4.800 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -22.482 6.014 5.831 1.00 0.00 H new ATOM 700 N ASN A 42 -26.322 2.672 5.542 1.00 0.00 N ATOM 701 CA ASN A 42 -27.672 2.126 5.653 1.00 0.00 C ATOM 702 C ASN A 42 -27.718 0.715 5.068 1.00 0.00 C ATOM 703 O ASN A 42 -28.521 -0.121 5.479 1.00 0.00 O ATOM 704 CB ASN A 42 -28.670 3.026 4.922 1.00 0.00 C ATOM 705 CG ASN A 42 -28.737 4.418 5.520 1.00 0.00 C ATOM 706 OD1 ASN A 42 -29.508 4.672 6.446 1.00 0.00 O ATOM 707 ND2 ASN A 42 -27.930 5.330 4.991 1.00 0.00 N ATOM 0 H ASN A 42 -26.271 3.591 5.102 1.00 0.00 H new ATOM 0 HA ASN A 42 -27.944 2.082 6.708 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -28.389 3.098 3.871 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -29.660 2.570 4.957 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -27.933 6.284 5.351 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -27.307 5.076 4.224 1.00 0.00 H new ATOM 714 N ASP A 43 -26.843 0.453 4.105 1.00 0.00 N ATOM 715 CA ASP A 43 -26.778 -0.856 3.473 1.00 0.00 C ATOM 716 C ASP A 43 -26.071 -1.860 4.379 1.00 0.00 C ATOM 717 O ASP A 43 -26.474 -3.016 4.470 1.00 0.00 O ATOM 718 CB ASP A 43 -26.060 -0.757 2.127 1.00 0.00 C ATOM 719 CG ASP A 43 -26.704 0.255 1.201 1.00 0.00 C ATOM 720 OD1 ASP A 43 -26.797 1.439 1.587 1.00 0.00 O ATOM 721 OD2 ASP A 43 -27.119 -0.136 0.088 1.00 0.00 O ATOM 0 H ASP A 43 -26.170 1.130 3.746 1.00 0.00 H new ATOM 0 HA ASP A 43 -27.796 -1.207 3.304 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -25.019 -0.482 2.293 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -26.058 -1.735 1.647 1.00 0.00 H new ATOM 726 N TYR A 44 -25.019 -1.406 5.057 1.00 0.00 N ATOM 727 CA TYR A 44 -24.263 -2.265 5.966 1.00 0.00 C ATOM 728 C TYR A 44 -25.094 -2.578 7.208 1.00 0.00 C ATOM 729 O TYR A 44 -25.254 -3.736 7.593 1.00 0.00 O ATOM 730 CB TYR A 44 -22.943 -1.582 6.358 1.00 0.00 C ATOM 731 CG TYR A 44 -22.566 -1.735 7.819 1.00 0.00 C ATOM 732 CD1 TYR A 44 -21.998 -2.912 8.289 1.00 0.00 C ATOM 733 CD2 TYR A 44 -22.779 -0.701 8.723 1.00 0.00 C ATOM 734 CE1 TYR A 44 -21.653 -3.055 9.620 1.00 0.00 C ATOM 735 CE2 TYR A 44 -22.436 -0.837 10.055 1.00 0.00 C ATOM 736 CZ TYR A 44 -21.873 -2.015 10.499 1.00 0.00 C ATOM 737 OH TYR A 44 -21.532 -2.153 11.824 1.00 0.00 O ATOM 0 H TYR A 44 -24.671 -0.449 4.994 1.00 0.00 H new ATOM 0 HA TYR A 44 -24.033 -3.203 5.460 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -22.141 -1.991 5.744 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -23.014 -0.520 6.123 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -21.823 -3.728 7.604 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -23.219 0.223 8.379 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -21.213 -3.977 9.970 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -22.608 -0.024 10.745 1.00 0.00 H new ATOM 0 HH TYR A 44 -21.752 -1.328 12.306 1.00 0.00 H new ATOM 747 N ILE A 45 -25.617 -1.526 7.820 1.00 0.00 N ATOM 748 CA ILE A 45 -26.439 -1.646 9.017 1.00 0.00 C ATOM 749 C ILE A 45 -27.674 -2.499 8.754 1.00 0.00 C ATOM 750 O ILE A 45 -27.879 -3.544 9.374 1.00 0.00 O ATOM 751 CB ILE A 45 -26.886 -0.241 9.497 1.00 0.00 C ATOM 752 CG1 ILE A 45 -25.761 0.433 10.280 1.00 0.00 C ATOM 753 CG2 ILE A 45 -28.162 -0.306 10.335 1.00 0.00 C ATOM 754 CD1 ILE A 45 -25.932 1.930 10.404 1.00 0.00 C ATOM 0 H ILE A 45 -25.484 -0.566 7.502 1.00 0.00 H new ATOM 0 HA ILE A 45 -25.837 -2.128 9.787 1.00 0.00 H new ATOM 0 HB ILE A 45 -27.109 0.356 8.613 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -25.710 -0.004 11.277 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -24.810 0.222 9.791 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -28.441 0.699 10.651 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -28.967 -0.736 9.739 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -27.989 -0.928 11.213 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -25.099 2.346 10.971 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -25.954 2.377 9.410 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -26.867 2.148 10.920 1.00 0.00 H new ATOM 766 N HIS A 46 -28.498 -2.014 7.846 1.00 0.00 N ATOM 767 CA HIS A 46 -29.745 -2.669 7.482 1.00 0.00 C ATOM 768 C HIS A 46 -29.515 -3.922 6.638 1.00 0.00 C ATOM 769 O HIS A 46 -30.351 -4.826 6.623 1.00 0.00 O ATOM 770 CB HIS A 46 -30.638 -1.659 6.763 1.00 0.00 C ATOM 771 CG HIS A 46 -30.711 -0.349 7.499 1.00 0.00 C ATOM 772 ND1 HIS A 46 -29.768 0.607 7.701 1.00 0.00 N flip ATOM 773 CD2 HIS A 46 -31.830 0.081 8.176 1.00 0.00 C flip ATOM 774 CE1 HIS A 46 -30.329 1.577 8.484 1.00 0.00 C flip ATOM 775 NE2 HIS A 46 -31.568 1.239 8.760 1.00 0.00 N flip ATOM 0 H HIS A 46 -28.322 -1.149 7.335 1.00 0.00 H new ATOM 0 HA HIS A 46 -30.242 -3.011 8.390 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -30.256 -1.489 5.756 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -31.641 -2.072 6.657 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -32.773 -0.444 8.223 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -29.834 2.476 8.821 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -32.219 1.779 9.329 1.00 0.00 H new ATOM 784 N SER A 47 -28.380 -3.977 5.943 1.00 0.00 N ATOM 785 CA SER A 47 -28.043 -5.130 5.105 1.00 0.00 C ATOM 786 C SER A 47 -28.807 -5.099 3.787 1.00 0.00 C ATOM 787 O SER A 47 -29.750 -5.866 3.584 1.00 0.00 O ATOM 788 CB SER A 47 -28.331 -6.441 5.845 1.00 0.00 C ATOM 789 OG SER A 47 -27.971 -6.346 7.212 1.00 0.00 O ATOM 0 H SER A 47 -27.677 -3.238 5.943 1.00 0.00 H new ATOM 0 HA SER A 47 -26.977 -5.075 4.885 1.00 0.00 H new ATOM 0 HB2 SER A 47 -29.390 -6.684 5.761 1.00 0.00 H new ATOM 0 HB3 SER A 47 -27.779 -7.255 5.376 1.00 0.00 H new ATOM 0 HG SER A 47 -28.166 -7.195 7.661 1.00 0.00 H new ATOM 795 N THR A 48 -28.392 -4.212 2.889 1.00 0.00 N ATOM 796 CA THR A 48 -29.030 -4.085 1.586 1.00 0.00 C ATOM 797 C THR A 48 -28.039 -4.377 0.464 1.00 0.00 C ATOM 798 O THR A 48 -27.018 -3.702 0.332 1.00 0.00 O ATOM 799 CB THR A 48 -29.621 -2.688 1.411 1.00 0.00 C ATOM 800 OG1 THR A 48 -28.595 -1.717 1.311 1.00 0.00 O ATOM 801 CG2 THR A 48 -30.533 -2.279 2.547 1.00 0.00 C ATOM 0 H THR A 48 -27.615 -3.569 3.041 1.00 0.00 H new ATOM 0 HA THR A 48 -29.836 -4.817 1.535 1.00 0.00 H new ATOM 0 HB THR A 48 -30.208 -2.735 0.494 1.00 0.00 H new ATOM 0 HG1 THR A 48 -28.568 -1.362 0.398 1.00 0.00 H new ATOM 0 HG21 THR A 48 -30.919 -1.277 2.361 1.00 0.00 H new ATOM 0 HG22 THR A 48 -31.364 -2.981 2.617 1.00 0.00 H new ATOM 0 HG23 THR A 48 -29.974 -2.284 3.483 1.00 0.00 H new ATOM 809 N HIS A 49 -28.346 -5.394 -0.335 1.00 0.00 N ATOM 810 CA HIS A 49 -27.493 -5.801 -1.448 1.00 0.00 C ATOM 811 C HIS A 49 -26.226 -6.471 -0.933 1.00 0.00 C ATOM 812 O HIS A 49 -25.954 -7.634 -1.232 1.00 0.00 O ATOM 813 CB HIS A 49 -27.135 -4.597 -2.329 1.00 0.00 C ATOM 814 CG HIS A 49 -27.806 -4.616 -3.667 1.00 0.00 C ATOM 815 ND1 HIS A 49 -29.085 -4.144 -3.875 1.00 0.00 N ATOM 816 CD2 HIS A 49 -27.369 -5.052 -4.873 1.00 0.00 C ATOM 817 CE1 HIS A 49 -29.405 -4.289 -5.148 1.00 0.00 C ATOM 818 NE2 HIS A 49 -28.381 -4.837 -5.775 1.00 0.00 N ATOM 0 H HIS A 49 -29.190 -5.958 -0.231 1.00 0.00 H new ATOM 0 HA HIS A 49 -28.047 -6.519 -2.054 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -27.409 -3.680 -1.807 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -26.055 -4.571 -2.473 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -26.404 -5.488 -5.085 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -30.345 -4.007 -5.599 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -28.347 -5.064 -6.769 1.00 0.00 H new ATOM 827 N GLY A 50 -25.466 -5.724 -0.148 1.00 0.00 N ATOM 828 CA GLY A 50 -24.233 -6.238 0.424 1.00 0.00 C ATOM 829 C GLY A 50 -23.376 -6.988 -0.578 1.00 0.00 C ATOM 830 O GLY A 50 -23.511 -8.200 -0.736 1.00 0.00 O ATOM 0 H GLY A 50 -25.682 -4.760 0.107 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -23.658 -5.409 0.835 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -24.474 -6.902 1.254 1.00 0.00 H new ATOM 834 N LYS A 51 -22.489 -6.263 -1.249 1.00 0.00 N ATOM 835 CA LYS A 51 -21.601 -6.870 -2.234 1.00 0.00 C ATOM 836 C LYS A 51 -20.415 -7.540 -1.547 1.00 0.00 C ATOM 837 O LYS A 51 -19.755 -6.937 -0.703 1.00 0.00 O ATOM 838 CB LYS A 51 -21.110 -5.813 -3.227 1.00 0.00 C ATOM 839 CG LYS A 51 -21.760 -5.915 -4.597 1.00 0.00 C ATOM 840 CD LYS A 51 -20.821 -6.536 -5.619 1.00 0.00 C ATOM 841 CE LYS A 51 -20.784 -5.728 -6.908 1.00 0.00 C ATOM 842 NZ LYS A 51 -20.318 -6.544 -8.062 1.00 0.00 N ATOM 0 H LYS A 51 -22.365 -5.258 -1.130 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.159 -7.632 -2.778 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -21.304 -4.822 -2.815 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -20.030 -5.906 -3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -22.668 -6.514 -4.526 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -22.059 -4.922 -4.933 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -19.817 -6.600 -5.200 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.141 -7.555 -5.836 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.779 -5.336 -7.119 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -20.124 -4.870 -6.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -19.846 -5.928 -8.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -19.649 -7.267 -7.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -21.133 -7.008 -8.511 1.00 0.00 H new ATOM 856 N GLU A 52 -20.151 -8.791 -1.914 1.00 0.00 N ATOM 857 CA GLU A 52 -19.043 -9.544 -1.330 1.00 0.00 C ATOM 858 C GLU A 52 -18.117 -10.079 -2.414 1.00 0.00 C ATOM 859 O GLU A 52 -18.552 -10.400 -3.520 1.00 0.00 O ATOM 860 CB GLU A 52 -19.577 -10.699 -0.477 1.00 0.00 C ATOM 861 CG GLU A 52 -19.604 -10.394 1.010 1.00 0.00 C ATOM 862 CD GLU A 52 -20.664 -11.187 1.748 1.00 0.00 C ATOM 863 OE1 GLU A 52 -20.435 -12.389 2.003 1.00 0.00 O ATOM 864 OE2 GLU A 52 -21.723 -10.609 2.071 1.00 0.00 O ATOM 0 H GLU A 52 -20.688 -9.305 -2.612 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.471 -8.868 -0.694 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -20.586 -10.947 -0.807 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -18.960 -11.581 -0.647 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -18.627 -10.613 1.440 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -19.785 -9.329 1.156 1.00 0.00 H new ATOM 871 N MET A 53 -16.835 -10.163 -2.084 1.00 0.00 N ATOM 872 CA MET A 53 -15.832 -10.650 -3.017 1.00 0.00 C ATOM 873 C MET A 53 -14.955 -11.712 -2.362 1.00 0.00 C ATOM 874 O MET A 53 -14.230 -11.429 -1.409 1.00 0.00 O ATOM 875 CB MET A 53 -14.972 -9.486 -3.506 1.00 0.00 C ATOM 876 CG MET A 53 -13.738 -9.918 -4.283 1.00 0.00 C ATOM 877 SD MET A 53 -13.646 -9.180 -5.921 1.00 0.00 S ATOM 878 CE MET A 53 -13.918 -7.466 -5.504 1.00 0.00 C ATOM 0 H MET A 53 -16.465 -9.898 -1.171 1.00 0.00 H new ATOM 0 HA MET A 53 -16.340 -11.104 -3.868 1.00 0.00 H new ATOM 0 HB2 MET A 53 -15.579 -8.838 -4.138 1.00 0.00 H new ATOM 0 HB3 MET A 53 -14.660 -8.892 -2.647 1.00 0.00 H new ATOM 0 HG2 MET A 53 -12.846 -9.647 -3.718 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.737 -11.004 -4.379 1.00 0.00 H new ATOM 0 HE1 MET A 53 -13.600 -6.835 -6.334 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.978 -7.303 -5.309 1.00 0.00 H new ATOM 0 HE3 MET A 53 -13.342 -7.212 -4.614 1.00 0.00 H new ATOM 888 N ASP A 54 -15.018 -12.935 -2.881 1.00 0.00 N ATOM 889 CA ASP A 54 -14.220 -14.030 -2.344 1.00 0.00 C ATOM 890 C ASP A 54 -12.739 -13.670 -2.369 1.00 0.00 C ATOM 891 O ASP A 54 -12.198 -13.300 -3.410 1.00 0.00 O ATOM 892 CB ASP A 54 -14.463 -15.311 -3.145 1.00 0.00 C ATOM 893 CG ASP A 54 -14.160 -15.135 -4.620 1.00 0.00 C ATOM 894 OD1 ASP A 54 -14.128 -13.977 -5.086 1.00 0.00 O ATOM 895 OD2 ASP A 54 -13.954 -16.157 -5.310 1.00 0.00 O ATOM 0 H ASP A 54 -15.612 -13.191 -3.670 1.00 0.00 H new ATOM 0 HA ASP A 54 -14.522 -14.201 -1.311 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -13.843 -16.112 -2.742 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -15.501 -15.621 -3.024 1.00 0.00 H new ATOM 900 N LEU A 55 -12.090 -13.769 -1.214 1.00 0.00 N ATOM 901 CA LEU A 55 -10.674 -13.440 -1.107 1.00 0.00 C ATOM 902 C LEU A 55 -9.797 -14.677 -1.279 1.00 0.00 C ATOM 903 O LEU A 55 -8.733 -14.778 -0.674 1.00 0.00 O ATOM 904 CB LEU A 55 -10.382 -12.783 0.242 1.00 0.00 C ATOM 905 CG LEU A 55 -10.925 -11.362 0.403 1.00 0.00 C ATOM 906 CD1 LEU A 55 -10.795 -10.903 1.848 1.00 0.00 C ATOM 907 CD2 LEU A 55 -10.197 -10.406 -0.529 1.00 0.00 C ATOM 0 H LEU A 55 -12.521 -14.074 -0.341 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.437 -12.741 -1.909 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.802 -13.407 1.031 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.303 -12.762 0.392 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.982 -11.364 0.137 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.186 -9.890 1.945 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.361 -11.574 2.495 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.745 -10.916 2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -10.596 -9.400 -0.402 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.133 -10.407 -0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -10.340 -10.725 -1.561 1.00 0.00 H new ATOM 919 N LEU A 56 -10.243 -15.615 -2.107 1.00 0.00 N ATOM 920 CA LEU A 56 -9.484 -16.835 -2.349 1.00 0.00 C ATOM 921 C LEU A 56 -8.413 -16.604 -3.411 1.00 0.00 C ATOM 922 O LEU A 56 -7.234 -16.878 -3.188 1.00 0.00 O ATOM 923 CB LEU A 56 -10.418 -17.970 -2.781 1.00 0.00 C ATOM 924 CG LEU A 56 -10.124 -19.327 -2.139 1.00 0.00 C ATOM 925 CD1 LEU A 56 -11.105 -20.376 -2.639 1.00 0.00 C ATOM 926 CD2 LEU A 56 -8.692 -19.751 -2.426 1.00 0.00 C ATOM 0 H LEU A 56 -11.123 -15.554 -2.620 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.993 -17.119 -1.418 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -11.444 -17.687 -2.544 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -10.359 -18.077 -3.864 1.00 0.00 H new ATOM 0 HG LEU A 56 -10.244 -19.233 -1.060 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -10.881 -21.335 -2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -12.121 -20.076 -2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -11.017 -20.470 -3.721 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -8.499 -20.718 -1.962 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.545 -19.829 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -8.004 -19.010 -2.019 1.00 0.00 H new ATOM 938 N ARG A 57 -8.833 -16.095 -4.565 1.00 0.00 N ATOM 939 CA ARG A 57 -7.911 -15.824 -5.661 1.00 0.00 C ATOM 940 C ARG A 57 -8.135 -14.421 -6.220 1.00 0.00 C ATOM 941 O ARG A 57 -8.352 -14.245 -7.418 1.00 0.00 O ATOM 942 CB ARG A 57 -8.079 -16.866 -6.769 1.00 0.00 C ATOM 943 CG ARG A 57 -9.503 -16.975 -7.291 1.00 0.00 C ATOM 944 CD ARG A 57 -10.226 -18.179 -6.705 1.00 0.00 C ATOM 945 NE ARG A 57 -10.781 -19.040 -7.746 1.00 0.00 N ATOM 946 CZ ARG A 57 -11.161 -20.299 -7.540 1.00 0.00 C ATOM 947 NH1 ARG A 57 -11.047 -20.846 -6.336 1.00 0.00 N ATOM 948 NH2 ARG A 57 -11.657 -21.013 -8.541 1.00 0.00 N ATOM 0 H ARG A 57 -9.806 -15.862 -4.765 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.894 -15.884 -5.274 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.416 -16.614 -7.597 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.764 -17.839 -6.392 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -10.052 -16.066 -7.045 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.487 -17.053 -8.378 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -9.534 -18.754 -6.089 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -11.028 -17.838 -6.050 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.883 -18.654 -8.685 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -10.666 -20.301 -5.562 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -11.340 -21.811 -6.185 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.747 -20.598 -9.468 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -11.948 -21.978 -8.384 1.00 0.00 H new ATOM 962 N THR A 58 -8.081 -13.429 -5.339 1.00 0.00 N ATOM 963 CA THR A 58 -8.277 -12.039 -5.735 1.00 0.00 C ATOM 964 C THR A 58 -6.939 -11.325 -5.883 1.00 0.00 C ATOM 965 O THR A 58 -5.918 -11.788 -5.375 1.00 0.00 O ATOM 966 CB THR A 58 -9.145 -11.309 -4.708 1.00 0.00 C ATOM 967 OG1 THR A 58 -9.099 -11.969 -3.457 1.00 0.00 O ATOM 968 CG2 THR A 58 -10.597 -11.201 -5.117 1.00 0.00 C ATOM 0 H THR A 58 -7.903 -13.562 -4.343 1.00 0.00 H new ATOM 0 HA THR A 58 -8.785 -12.031 -6.699 1.00 0.00 H new ATOM 0 HB THR A 58 -8.730 -10.303 -4.642 1.00 0.00 H new ATOM 0 HG1 THR A 58 -9.590 -12.815 -3.515 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.155 -10.673 -4.344 1.00 0.00 H new ATOM 0 HG22 THR A 58 -10.671 -10.653 -6.056 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.014 -12.200 -5.246 1.00 0.00 H new ATOM 976 N THR A 59 -6.950 -10.196 -6.581 1.00 0.00 N ATOM 977 CA THR A 59 -5.737 -9.420 -6.795 1.00 0.00 C ATOM 978 C THR A 59 -5.936 -7.968 -6.374 1.00 0.00 C ATOM 979 O THR A 59 -7.043 -7.555 -6.032 1.00 0.00 O ATOM 980 CB THR A 59 -5.318 -9.481 -8.264 1.00 0.00 C ATOM 981 OG1 THR A 59 -5.812 -10.661 -8.876 1.00 0.00 O ATOM 982 CG2 THR A 59 -3.820 -9.452 -8.464 1.00 0.00 C ATOM 0 H THR A 59 -7.786 -9.798 -7.008 1.00 0.00 H new ATOM 0 HA THR A 59 -4.948 -9.854 -6.180 1.00 0.00 H new ATOM 0 HB THR A 59 -5.744 -8.588 -8.722 1.00 0.00 H new ATOM 0 HG1 THR A 59 -5.536 -10.682 -9.816 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.594 -9.498 -9.529 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.415 -8.530 -8.047 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.369 -10.307 -7.960 1.00 0.00 H new ATOM 990 N VAL A 60 -4.854 -7.199 -6.407 1.00 0.00 N ATOM 991 CA VAL A 60 -4.902 -5.792 -6.037 1.00 0.00 C ATOM 992 C VAL A 60 -4.001 -4.966 -6.947 1.00 0.00 C ATOM 993 O VAL A 60 -2.820 -5.275 -7.106 1.00 0.00 O ATOM 994 CB VAL A 60 -4.472 -5.579 -4.574 1.00 0.00 C ATOM 995 CG1 VAL A 60 -4.705 -4.135 -4.153 1.00 0.00 C ATOM 996 CG2 VAL A 60 -5.216 -6.535 -3.655 1.00 0.00 C ATOM 0 H VAL A 60 -3.930 -7.529 -6.687 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.936 -5.465 -6.150 1.00 0.00 H new ATOM 0 HB VAL A 60 -3.405 -5.789 -4.494 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.395 -4.004 -3.116 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -4.123 -3.471 -4.792 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.764 -3.895 -4.248 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -4.899 -6.370 -2.625 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.288 -6.358 -3.738 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.994 -7.563 -3.943 1.00 0.00 H new ATOM 1006 N LYS A 61 -4.561 -3.924 -7.553 1.00 0.00 N ATOM 1007 CA LYS A 61 -3.787 -3.076 -8.455 1.00 0.00 C ATOM 1008 C LYS A 61 -4.308 -1.642 -8.475 1.00 0.00 C ATOM 1009 O LYS A 61 -5.420 -1.362 -8.028 1.00 0.00 O ATOM 1010 CB LYS A 61 -3.810 -3.654 -9.872 1.00 0.00 C ATOM 1011 CG LYS A 61 -5.195 -3.675 -10.496 1.00 0.00 C ATOM 1012 CD LYS A 61 -5.850 -5.040 -10.352 1.00 0.00 C ATOM 1013 CE LYS A 61 -5.260 -6.048 -11.329 1.00 0.00 C ATOM 1014 NZ LYS A 61 -4.531 -7.142 -10.627 1.00 0.00 N ATOM 0 H LYS A 61 -5.536 -3.648 -7.439 1.00 0.00 H new ATOM 0 HA LYS A 61 -2.762 -3.054 -8.084 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.144 -3.068 -10.505 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -3.416 -4.670 -9.848 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -5.820 -2.918 -10.022 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.124 -3.414 -11.552 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.720 -5.401 -9.332 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.923 -4.950 -10.524 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -6.058 -6.475 -11.936 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -4.580 -5.537 -12.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -3.602 -7.281 -11.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.401 -6.887 -9.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.081 -8.022 -10.691 1.00 0.00 H new ATOM 1028 N VAL A 62 -3.487 -0.738 -9.006 1.00 0.00 N ATOM 1029 CA VAL A 62 -3.844 0.673 -9.101 1.00 0.00 C ATOM 1030 C VAL A 62 -3.851 1.123 -10.563 1.00 0.00 C ATOM 1031 O VAL A 62 -3.008 0.694 -11.350 1.00 0.00 O ATOM 1032 CB VAL A 62 -2.862 1.557 -8.306 1.00 0.00 C ATOM 1033 CG1 VAL A 62 -3.454 2.936 -8.059 1.00 0.00 C ATOM 1034 CG2 VAL A 62 -2.483 0.894 -6.990 1.00 0.00 C ATOM 0 H VAL A 62 -2.564 -0.961 -9.379 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.841 0.787 -8.675 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.957 1.676 -8.902 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -2.743 3.542 -7.497 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.665 3.418 -9.014 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.378 2.839 -7.489 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.790 1.535 -6.446 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.379 0.737 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.008 -0.066 -7.190 1.00 0.00 H new ATOM 1044 N PRO A 63 -4.804 1.992 -10.953 1.00 0.00 N ATOM 1045 CA PRO A 63 -4.902 2.482 -12.332 1.00 0.00 C ATOM 1046 C PRO A 63 -3.580 3.039 -12.849 1.00 0.00 C ATOM 1047 O PRO A 63 -3.293 4.226 -12.698 1.00 0.00 O ATOM 1048 CB PRO A 63 -5.950 3.594 -12.242 1.00 0.00 C ATOM 1049 CG PRO A 63 -6.785 3.229 -11.065 1.00 0.00 C ATOM 1050 CD PRO A 63 -5.858 2.558 -10.089 1.00 0.00 C ATOM 0 HA PRO A 63 -5.164 1.684 -13.027 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -5.482 4.570 -12.109 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.549 3.649 -13.151 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.243 4.114 -10.623 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -7.596 2.561 -11.355 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.450 3.268 -9.369 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.369 1.783 -9.518 1.00 0.00 H new ATOM 1058 N GLY A 64 -2.778 2.172 -13.459 1.00 0.00 N ATOM 1059 CA GLY A 64 -1.494 2.594 -13.992 1.00 0.00 C ATOM 1060 C GLY A 64 -0.639 3.304 -12.960 1.00 0.00 C ATOM 1061 O GLY A 64 -0.030 4.334 -13.251 1.00 0.00 O ATOM 0 H GLY A 64 -2.994 1.184 -13.594 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -0.956 1.723 -14.367 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.658 3.257 -14.841 1.00 0.00 H new ATOM 1065 N LYS A 65 -0.594 2.754 -11.751 1.00 0.00 N ATOM 1066 CA LYS A 65 0.190 3.342 -10.674 1.00 0.00 C ATOM 1067 C LYS A 65 0.998 2.275 -9.941 1.00 0.00 C ATOM 1068 O LYS A 65 0.439 1.327 -9.390 1.00 0.00 O ATOM 1069 CB LYS A 65 -0.724 4.077 -9.690 1.00 0.00 C ATOM 1070 CG LYS A 65 -0.252 5.482 -9.357 1.00 0.00 C ATOM 1071 CD LYS A 65 -0.702 5.907 -7.969 1.00 0.00 C ATOM 1072 CE LYS A 65 -0.112 7.253 -7.576 1.00 0.00 C ATOM 1073 NZ LYS A 65 0.463 7.227 -6.202 1.00 0.00 N ATOM 0 H LYS A 65 -1.092 1.902 -11.494 1.00 0.00 H new ATOM 0 HA LYS A 65 0.885 4.057 -11.114 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.729 4.130 -10.110 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.793 3.498 -8.769 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.835 5.525 -9.417 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.640 6.182 -10.097 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.790 5.964 -7.940 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.403 5.152 -7.242 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.664 7.532 -8.289 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.886 8.019 -7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.855 8.162 -5.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.283 6.986 -5.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.219 6.514 -6.155 1.00 0.00 H new ATOM 1087 N ARG A 66 2.316 2.439 -9.937 1.00 0.00 N ATOM 1088 CA ARG A 66 3.206 1.494 -9.270 1.00 0.00 C ATOM 1089 C ARG A 66 2.855 1.373 -7.788 1.00 0.00 C ATOM 1090 O ARG A 66 2.127 2.205 -7.246 1.00 0.00 O ATOM 1091 CB ARG A 66 4.661 1.940 -9.429 1.00 0.00 C ATOM 1092 CG ARG A 66 4.950 3.302 -8.821 1.00 0.00 C ATOM 1093 CD ARG A 66 6.215 3.914 -9.400 1.00 0.00 C ATOM 1094 NE ARG A 66 6.087 4.187 -10.830 1.00 0.00 N ATOM 1095 CZ ARG A 66 6.884 5.015 -11.501 1.00 0.00 C ATOM 1096 NH1 ARG A 66 7.865 5.655 -10.876 1.00 0.00 N ATOM 1097 NH2 ARG A 66 6.700 5.204 -12.801 1.00 0.00 N ATOM 0 H ARG A 66 2.793 3.219 -10.389 1.00 0.00 H new ATOM 0 HA ARG A 66 3.079 0.516 -9.735 1.00 0.00 H new ATOM 0 HB2 ARG A 66 5.312 1.199 -8.965 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.911 1.965 -10.490 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.107 3.968 -9.002 1.00 0.00 H new ATOM 0 HG3 ARG A 66 5.054 3.205 -7.740 1.00 0.00 H new ATOM 0 HD2 ARG A 66 6.443 4.841 -8.873 1.00 0.00 H new ATOM 0 HD3 ARG A 66 7.054 3.238 -9.234 1.00 0.00 H new ATOM 0 HE ARG A 66 5.343 3.715 -11.344 1.00 0.00 H new ATOM 0 HH11 ARG A 66 8.011 5.513 -9.876 1.00 0.00 H new ATOM 0 HH12 ARG A 66 8.473 6.288 -11.395 1.00 0.00 H new ATOM 0 HH21 ARG A 66 5.948 4.715 -13.286 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.311 5.839 -13.316 1.00 0.00 H new ATOM 1111 N PRO A 67 3.367 0.331 -7.108 1.00 0.00 N ATOM 1112 CA PRO A 67 3.098 0.113 -5.682 1.00 0.00 C ATOM 1113 C PRO A 67 3.395 1.357 -4.843 1.00 0.00 C ATOM 1114 O PRO A 67 4.530 1.830 -4.809 1.00 0.00 O ATOM 1115 CB PRO A 67 4.056 -1.022 -5.313 1.00 0.00 C ATOM 1116 CG PRO A 67 4.271 -1.758 -6.590 1.00 0.00 C ATOM 1117 CD PRO A 67 4.242 -0.715 -7.672 1.00 0.00 C ATOM 0 HA PRO A 67 2.050 -0.117 -5.492 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.994 -0.636 -4.915 1.00 0.00 H new ATOM 0 HB3 PRO A 67 3.628 -1.670 -4.548 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.224 -2.286 -6.581 1.00 0.00 H new ATOM 0 HG3 PRO A 67 3.493 -2.506 -6.746 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.239 -0.332 -7.889 1.00 0.00 H new ATOM 0 HD3 PRO A 67 3.844 -1.114 -8.605 1.00 0.00 H new ATOM 1125 N PRO A 68 2.372 1.912 -4.162 1.00 0.00 N ATOM 1126 CA PRO A 68 2.531 3.115 -3.332 1.00 0.00 C ATOM 1127 C PRO A 68 3.409 2.880 -2.101 1.00 0.00 C ATOM 1128 O PRO A 68 2.966 3.066 -0.969 1.00 0.00 O ATOM 1129 CB PRO A 68 1.093 3.460 -2.904 1.00 0.00 C ATOM 1130 CG PRO A 68 0.209 2.664 -3.801 1.00 0.00 C ATOM 1131 CD PRO A 68 0.983 1.429 -4.157 1.00 0.00 C ATOM 0 HA PRO A 68 3.030 3.912 -3.884 1.00 0.00 H new ATOM 0 HB2 PRO A 68 0.923 3.205 -1.858 1.00 0.00 H new ATOM 0 HB3 PRO A 68 0.898 4.527 -3.007 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -0.725 2.408 -3.301 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.053 3.231 -4.694 1.00 0.00 H new ATOM 0 HD2 PRO A 68 0.833 0.633 -3.428 1.00 0.00 H new ATOM 0 HD3 PRO A 68 0.688 1.032 -5.128 1.00 0.00 H new ATOM 1139 N ARG A 69 4.655 2.477 -2.330 1.00 0.00 N ATOM 1140 CA ARG A 69 5.590 2.228 -1.241 1.00 0.00 C ATOM 1141 C ARG A 69 6.289 3.519 -0.823 1.00 0.00 C ATOM 1142 O ARG A 69 7.459 3.733 -1.141 1.00 0.00 O ATOM 1143 CB ARG A 69 6.624 1.185 -1.663 1.00 0.00 C ATOM 1144 CG ARG A 69 6.138 -0.246 -1.512 1.00 0.00 C ATOM 1145 CD ARG A 69 4.999 -0.560 -2.468 1.00 0.00 C ATOM 1146 NE ARG A 69 3.759 -0.869 -1.759 1.00 0.00 N ATOM 1147 CZ ARG A 69 3.536 -2.016 -1.121 1.00 0.00 C ATOM 1148 NH1 ARG A 69 4.464 -2.964 -1.102 1.00 0.00 N ATOM 1149 NH2 ARG A 69 2.381 -2.215 -0.500 1.00 0.00 N ATOM 0 H ARG A 69 5.040 2.316 -3.261 1.00 0.00 H new ATOM 0 HA ARG A 69 5.029 1.848 -0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 69 6.900 1.359 -2.703 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.527 1.318 -1.067 1.00 0.00 H new ATOM 0 HG2 ARG A 69 6.965 -0.932 -1.695 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.808 -0.411 -0.486 1.00 0.00 H new ATOM 0 HD2 ARG A 69 4.836 0.291 -3.130 1.00 0.00 H new ATOM 0 HD3 ARG A 69 5.277 -1.405 -3.098 1.00 0.00 H new ATOM 0 HE ARG A 69 3.021 -0.165 -1.753 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.354 -2.816 -1.578 1.00 0.00 H new ATOM 0 HH12 ARG A 69 4.287 -3.841 -0.612 1.00 0.00 H new ATOM 0 HH21 ARG A 69 1.664 -1.489 -0.511 1.00 0.00 H new ATOM 0 HH22 ARG A 69 2.210 -3.094 -0.011 1.00 0.00 H new ATOM 1163 N ALA A 70 5.564 4.374 -0.112 1.00 0.00 N ATOM 1164 CA ALA A 70 6.112 5.646 0.347 1.00 0.00 C ATOM 1165 C ALA A 70 7.379 5.438 1.171 1.00 0.00 C ATOM 1166 O ALA A 70 8.279 6.279 1.165 1.00 0.00 O ATOM 1167 CB ALA A 70 5.073 6.406 1.157 1.00 0.00 C ATOM 0 H ALA A 70 4.595 4.210 0.160 1.00 0.00 H new ATOM 0 HA ALA A 70 6.376 6.235 -0.531 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.495 7.353 1.493 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.198 6.599 0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.780 5.812 2.023 1.00 0.00 H new ATOM 1173 N ILE A 71 7.443 4.317 1.879 1.00 0.00 N ATOM 1174 CA ILE A 71 8.601 4.001 2.707 1.00 0.00 C ATOM 1175 C ILE A 71 9.719 3.388 1.874 1.00 0.00 C ATOM 1176 O ILE A 71 10.778 3.991 1.697 1.00 0.00 O ATOM 1177 CB ILE A 71 8.230 3.034 3.848 1.00 0.00 C ATOM 1178 CG1 ILE A 71 6.981 3.529 4.581 1.00 0.00 C ATOM 1179 CG2 ILE A 71 9.396 2.885 4.815 1.00 0.00 C ATOM 1180 CD1 ILE A 71 5.716 2.800 4.182 1.00 0.00 C ATOM 0 H ILE A 71 6.707 3.611 1.897 1.00 0.00 H new ATOM 0 HA ILE A 71 8.948 4.940 3.139 1.00 0.00 H new ATOM 0 HB ILE A 71 8.011 2.056 3.419 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.132 3.417 5.655 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.854 4.594 4.386 1.00 0.00 H new ATOM 0 HG21 ILE A 71 9.119 2.199 5.616 1.00 0.00 H new ATOM 0 HG22 ILE A 71 10.262 2.491 4.283 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.643 3.858 5.240 1.00 0.00 H new ATOM 0 HD11 ILE A 71 4.872 3.203 4.741 1.00 0.00 H new ATOM 0 HD12 ILE A 71 5.541 2.933 3.114 1.00 0.00 H new ATOM 0 HD13 ILE A 71 5.823 1.738 4.403 1.00 0.00 H new ATOM 1192 N SER A 72 9.475 2.189 1.365 1.00 0.00 N ATOM 1193 CA SER A 72 10.457 1.488 0.545 1.00 0.00 C ATOM 1194 C SER A 72 11.745 1.237 1.324 1.00 0.00 C ATOM 1195 O SER A 72 12.566 2.138 1.492 1.00 0.00 O ATOM 1196 CB SER A 72 10.764 2.292 -0.719 1.00 0.00 C ATOM 1197 OG SER A 72 10.936 1.441 -1.838 1.00 0.00 O ATOM 0 H SER A 72 8.603 1.679 1.505 1.00 0.00 H new ATOM 0 HA SER A 72 10.032 0.525 0.264 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.952 2.993 -0.913 1.00 0.00 H new ATOM 0 HB3 SER A 72 11.667 2.884 -0.567 1.00 0.00 H new ATOM 0 HG SER A 72 11.129 1.981 -2.633 1.00 0.00 H new ATOM 1203 N ALA A 73 11.913 0.006 1.800 1.00 0.00 N ATOM 1204 CA ALA A 73 13.100 -0.363 2.562 1.00 0.00 C ATOM 1205 C ALA A 73 14.186 -0.946 1.669 1.00 0.00 C ATOM 1206 O ALA A 73 15.114 -1.602 2.144 1.00 0.00 O ATOM 1207 CB ALA A 73 12.740 -1.340 3.673 1.00 0.00 C ATOM 0 H ALA A 73 11.242 -0.751 1.671 1.00 0.00 H new ATOM 0 HA ALA A 73 13.498 0.548 3.010 1.00 0.00 H new ATOM 0 HB1 ALA A 73 13.639 -1.604 4.231 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.018 -0.876 4.346 1.00 0.00 H new ATOM 0 HB3 ALA A 73 12.305 -2.240 3.239 1.00 0.00 H new ATOM 1213 N PHE A 74 14.066 -0.702 0.374 1.00 0.00 N ATOM 1214 CA PHE A 74 15.036 -1.200 -0.595 1.00 0.00 C ATOM 1215 C PHE A 74 16.355 -0.443 -0.482 1.00 0.00 C ATOM 1216 O PHE A 74 16.625 0.474 -1.258 1.00 0.00 O ATOM 1217 CB PHE A 74 14.483 -1.076 -2.016 1.00 0.00 C ATOM 1218 CG PHE A 74 14.917 -2.189 -2.928 1.00 0.00 C ATOM 1219 CD1 PHE A 74 14.200 -3.373 -2.987 1.00 0.00 C ATOM 1220 CD2 PHE A 74 16.042 -2.050 -3.726 1.00 0.00 C ATOM 1221 CE1 PHE A 74 14.597 -4.399 -3.824 1.00 0.00 C ATOM 1222 CE2 PHE A 74 16.444 -3.073 -4.563 1.00 0.00 C ATOM 1223 CZ PHE A 74 15.721 -4.249 -4.613 1.00 0.00 C ATOM 0 H PHE A 74 13.304 -0.160 -0.034 1.00 0.00 H new ATOM 0 HA PHE A 74 15.221 -2.252 -0.377 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.394 -1.056 -1.973 1.00 0.00 H new ATOM 0 HB3 PHE A 74 14.803 -0.124 -2.440 1.00 0.00 H new ATOM 0 HD1 PHE A 74 13.321 -3.496 -2.372 1.00 0.00 H new ATOM 0 HD2 PHE A 74 16.610 -1.132 -3.693 1.00 0.00 H new ATOM 0 HE1 PHE A 74 14.029 -5.317 -3.861 1.00 0.00 H new ATOM 0 HE2 PHE A 74 17.324 -2.953 -5.178 1.00 0.00 H new ATOM 0 HZ PHE A 74 16.034 -5.049 -5.267 1.00 0.00 H new ATOM 1233 N GLY A 75 17.172 -0.834 0.492 1.00 0.00 N ATOM 1234 CA GLY A 75 18.454 -0.181 0.688 1.00 0.00 C ATOM 1235 C GLY A 75 18.307 1.244 1.190 1.00 0.00 C ATOM 1236 O GLY A 75 17.209 1.667 1.547 1.00 0.00 O ATOM 0 H GLY A 75 16.970 -1.589 1.147 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.046 -0.755 1.401 1.00 0.00 H new ATOM 0 HA3 GLY A 75 19.004 -0.177 -0.253 1.00 0.00 H new ATOM 1240 N PRO A 76 19.408 2.014 1.226 1.00 0.00 N ATOM 1241 CA PRO A 76 19.381 3.404 1.691 1.00 0.00 C ATOM 1242 C PRO A 76 18.664 4.329 0.712 1.00 0.00 C ATOM 1243 O PRO A 76 18.043 3.870 -0.248 1.00 0.00 O ATOM 1244 CB PRO A 76 20.863 3.775 1.788 1.00 0.00 C ATOM 1245 CG PRO A 76 21.541 2.879 0.811 1.00 0.00 C ATOM 1246 CD PRO A 76 20.761 1.593 0.817 1.00 0.00 C ATOM 0 HA PRO A 76 18.839 3.509 2.631 1.00 0.00 H new ATOM 0 HB2 PRO A 76 21.026 4.824 1.542 1.00 0.00 H new ATOM 0 HB3 PRO A 76 21.245 3.621 2.797 1.00 0.00 H new ATOM 0 HG2 PRO A 76 21.552 3.324 -0.184 1.00 0.00 H new ATOM 0 HG3 PRO A 76 22.579 2.707 1.095 1.00 0.00 H new ATOM 0 HD2 PRO A 76 20.755 1.122 -0.166 1.00 0.00 H new ATOM 0 HD3 PRO A 76 21.184 0.870 1.514 1.00 0.00 H new ATOM 1254 N SER A 77 18.752 5.630 0.961 1.00 0.00 N ATOM 1255 CA SER A 77 18.111 6.618 0.101 1.00 0.00 C ATOM 1256 C SER A 77 19.141 7.334 -0.765 1.00 0.00 C ATOM 1257 O SER A 77 20.256 7.607 -0.320 1.00 0.00 O ATOM 1258 CB SER A 77 17.339 7.633 0.944 1.00 0.00 C ATOM 1259 OG SER A 77 16.024 7.180 1.213 1.00 0.00 O ATOM 0 H SER A 77 19.261 6.026 1.751 1.00 0.00 H new ATOM 0 HA SER A 77 17.413 6.096 -0.554 1.00 0.00 H new ATOM 0 HB2 SER A 77 17.866 7.806 1.882 1.00 0.00 H new ATOM 0 HB3 SER A 77 17.298 8.588 0.421 1.00 0.00 H new ATOM 0 HG SER A 77 15.553 7.847 1.755 1.00 0.00 H new ATOM 1265 N ALA A 78 18.762 7.636 -2.002 1.00 0.00 N ATOM 1266 CA ALA A 78 19.654 8.321 -2.929 1.00 0.00 C ATOM 1267 C ALA A 78 19.794 9.795 -2.570 1.00 0.00 C ATOM 1268 O ALA A 78 20.894 10.342 -2.563 1.00 0.00 O ATOM 1269 CB ALA A 78 19.150 8.169 -4.358 1.00 0.00 C ATOM 0 H ALA A 78 17.843 7.417 -2.386 1.00 0.00 H new ATOM 0 HA ALA A 78 20.639 7.861 -2.852 1.00 0.00 H new ATOM 0 HB1 ALA A 78 19.826 8.686 -5.039 1.00 0.00 H new ATOM 0 HB2 ALA A 78 19.110 7.112 -4.619 1.00 0.00 H new ATOM 0 HB3 ALA A 78 18.153 8.601 -4.440 1.00 0.00 H new ATOM 1275 N SER A 79 18.667 10.429 -2.272 1.00 0.00 N ATOM 1276 CA SER A 79 18.654 11.843 -1.909 1.00 0.00 C ATOM 1277 C SER A 79 19.289 12.694 -3.005 1.00 0.00 C ATOM 1278 O SER A 79 20.472 13.028 -2.938 1.00 0.00 O ATOM 1279 CB SER A 79 19.394 12.057 -0.587 1.00 0.00 C ATOM 1280 OG SER A 79 18.907 11.185 0.417 1.00 0.00 O ATOM 0 H SER A 79 17.748 9.987 -2.274 1.00 0.00 H new ATOM 0 HA SER A 79 17.616 12.153 -1.791 1.00 0.00 H new ATOM 0 HB2 SER A 79 20.461 11.889 -0.733 1.00 0.00 H new ATOM 0 HB3 SER A 79 19.275 13.091 -0.264 1.00 0.00 H new ATOM 0 HG SER A 79 19.397 11.340 1.251 1.00 0.00 H new ATOM 1286 N GLY A 80 18.496 13.040 -4.013 1.00 0.00 N ATOM 1287 CA GLY A 80 18.999 13.848 -5.108 1.00 0.00 C ATOM 1288 C GLY A 80 18.000 13.976 -6.239 1.00 0.00 C ATOM 1289 O GLY A 80 16.857 14.384 -6.026 1.00 0.00 O ATOM 0 H GLY A 80 17.514 12.775 -4.091 1.00 0.00 H new ATOM 0 HA2 GLY A 80 19.252 14.841 -4.737 1.00 0.00 H new ATOM 0 HA3 GLY A 80 19.920 13.406 -5.489 1.00 0.00 H new ATOM 1293 N SER A 81 18.428 13.626 -7.448 1.00 0.00 N ATOM 1294 CA SER A 81 17.563 13.704 -8.618 1.00 0.00 C ATOM 1295 C SER A 81 16.783 12.405 -8.804 1.00 0.00 C ATOM 1296 O SER A 81 17.351 11.315 -8.740 1.00 0.00 O ATOM 1297 CB SER A 81 18.388 14.001 -9.870 1.00 0.00 C ATOM 1298 OG SER A 81 19.380 13.010 -10.077 1.00 0.00 O ATOM 0 H SER A 81 19.370 13.285 -7.642 1.00 0.00 H new ATOM 0 HA SER A 81 16.852 14.515 -8.460 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.731 14.049 -10.739 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.861 14.978 -9.774 1.00 0.00 H new ATOM 0 HG SER A 81 19.085 12.164 -9.679 1.00 0.00 H new ATOM 1304 N ALA A 82 15.481 12.532 -9.036 1.00 0.00 N ATOM 1305 CA ALA A 82 14.624 11.368 -9.233 1.00 0.00 C ATOM 1306 C ALA A 82 13.202 11.789 -9.585 1.00 0.00 C ATOM 1307 O ALA A 82 12.918 12.976 -9.752 1.00 0.00 O ATOM 1308 CB ALA A 82 14.624 10.498 -7.986 1.00 0.00 C ATOM 0 H ALA A 82 14.996 13.428 -9.092 1.00 0.00 H new ATOM 0 HA ALA A 82 15.022 10.790 -10.067 1.00 0.00 H new ATOM 0 HB1 ALA A 82 13.981 9.633 -8.146 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.639 10.161 -7.777 1.00 0.00 H new ATOM 0 HB3 ALA A 82 14.252 11.075 -7.140 1.00 0.00 H new ATOM 1314 N GLY A 83 12.310 10.810 -9.696 1.00 0.00 N ATOM 1315 CA GLY A 83 10.926 11.100 -10.028 1.00 0.00 C ATOM 1316 C GLY A 83 10.272 12.023 -9.018 1.00 0.00 C ATOM 1317 O GLY A 83 10.373 11.804 -7.811 1.00 0.00 O ATOM 0 H GLY A 83 12.520 9.821 -9.562 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.880 11.556 -11.017 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.365 10.167 -10.081 1.00 0.00 H new ATOM 1321 N GLN A 84 9.598 13.055 -9.513 1.00 0.00 N ATOM 1322 CA GLN A 84 8.923 14.015 -8.645 1.00 0.00 C ATOM 1323 C GLN A 84 7.428 14.056 -8.938 1.00 0.00 C ATOM 1324 O GLN A 84 6.923 15.016 -9.521 1.00 0.00 O ATOM 1325 CB GLN A 84 9.530 15.408 -8.823 1.00 0.00 C ATOM 1326 CG GLN A 84 9.167 16.376 -7.708 1.00 0.00 C ATOM 1327 CD GLN A 84 10.307 17.309 -7.352 1.00 0.00 C ATOM 1328 OE1 GLN A 84 11.126 17.662 -8.202 1.00 0.00 O ATOM 1329 NE2 GLN A 84 10.369 17.714 -6.089 1.00 0.00 N ATOM 0 H GLN A 84 9.504 13.249 -10.510 1.00 0.00 H new ATOM 0 HA GLN A 84 9.062 13.695 -7.612 1.00 0.00 H new ATOM 0 HB2 GLN A 84 10.615 15.318 -8.876 1.00 0.00 H new ATOM 0 HB3 GLN A 84 9.197 15.822 -9.775 1.00 0.00 H new ATOM 0 HG2 GLN A 84 8.301 16.965 -8.011 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.874 15.811 -6.823 1.00 0.00 H new ATOM 0 HE21 GLN A 84 9.670 17.397 -5.417 1.00 0.00 H new ATOM 0 HE22 GLN A 84 11.116 18.342 -5.791 1.00 0.00 H new ATOM 1338 N ALA A 85 6.722 13.006 -8.529 1.00 0.00 N ATOM 1339 CA ALA A 85 5.284 12.921 -8.746 1.00 0.00 C ATOM 1340 C ALA A 85 4.513 13.364 -7.508 1.00 0.00 C ATOM 1341 O ALA A 85 4.597 12.733 -6.455 1.00 0.00 O ATOM 1342 CB ALA A 85 4.894 11.504 -9.135 1.00 0.00 C ATOM 0 H ALA A 85 7.124 12.203 -8.046 1.00 0.00 H new ATOM 0 HA ALA A 85 5.024 13.595 -9.562 1.00 0.00 H new ATOM 0 HB1 ALA A 85 3.817 11.454 -9.294 1.00 0.00 H new ATOM 0 HB2 ALA A 85 5.410 11.224 -10.053 1.00 0.00 H new ATOM 0 HB3 ALA A 85 5.175 10.817 -8.337 1.00 0.00 H new ATOM 1348 N GLU A 86 3.762 14.452 -7.642 1.00 0.00 N ATOM 1349 CA GLU A 86 2.975 14.979 -6.534 1.00 0.00 C ATOM 1350 C GLU A 86 1.520 14.533 -6.642 1.00 0.00 C ATOM 1351 O GLU A 86 0.607 15.247 -6.230 1.00 0.00 O ATOM 1352 CB GLU A 86 3.056 16.507 -6.505 1.00 0.00 C ATOM 1353 CG GLU A 86 4.046 17.045 -5.486 1.00 0.00 C ATOM 1354 CD GLU A 86 4.132 18.558 -5.498 1.00 0.00 C ATOM 1355 OE1 GLU A 86 3.120 19.212 -5.171 1.00 0.00 O ATOM 1356 OE2 GLU A 86 5.212 19.089 -5.834 1.00 0.00 O ATOM 0 H GLU A 86 3.682 14.986 -8.507 1.00 0.00 H new ATOM 0 HA GLU A 86 3.388 14.585 -5.605 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.336 16.866 -7.495 1.00 0.00 H new ATOM 0 HB3 GLU A 86 2.067 16.911 -6.287 1.00 0.00 H new ATOM 0 HG2 GLU A 86 3.755 16.709 -4.491 1.00 0.00 H new ATOM 0 HG3 GLU A 86 5.032 16.627 -5.688 1.00 0.00 H new ATOM 1363 N GLU A 87 1.312 13.345 -7.204 1.00 0.00 N ATOM 1364 CA GLU A 87 -0.031 12.802 -7.369 1.00 0.00 C ATOM 1365 C GLU A 87 -0.667 12.499 -6.016 1.00 0.00 C ATOM 1366 O GLU A 87 -1.761 12.974 -5.714 1.00 0.00 O ATOM 1367 CB GLU A 87 0.013 11.531 -8.221 1.00 0.00 C ATOM 1368 CG GLU A 87 0.686 11.725 -9.570 1.00 0.00 C ATOM 1369 CD GLU A 87 0.092 10.842 -10.649 1.00 0.00 C ATOM 1370 OE1 GLU A 87 -0.018 9.618 -10.422 1.00 0.00 O ATOM 1371 OE2 GLU A 87 -0.267 11.374 -11.720 1.00 0.00 O ATOM 0 H GLU A 87 2.057 12.741 -7.552 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.639 13.551 -7.875 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.541 10.752 -7.670 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.005 11.175 -8.380 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.597 12.769 -9.870 1.00 0.00 H new ATOM 0 HG3 GLU A 87 1.750 11.511 -9.475 1.00 0.00 H new ATOM 1378 N GLU A 88 0.026 11.702 -5.207 1.00 0.00 N ATOM 1379 CA GLU A 88 -0.471 11.332 -3.886 1.00 0.00 C ATOM 1380 C GLU A 88 -1.877 10.741 -3.975 1.00 0.00 C ATOM 1381 O GLU A 88 -2.649 10.801 -3.017 1.00 0.00 O ATOM 1382 CB GLU A 88 -0.472 12.551 -2.960 1.00 0.00 C ATOM 1383 CG GLU A 88 0.707 12.586 -2.001 1.00 0.00 C ATOM 1384 CD GLU A 88 0.448 13.466 -0.794 1.00 0.00 C ATOM 1385 OE1 GLU A 88 -0.266 14.480 -0.940 1.00 0.00 O ATOM 1386 OE2 GLU A 88 0.961 13.141 0.299 1.00 0.00 O ATOM 0 H GLU A 88 0.933 11.300 -5.444 1.00 0.00 H new ATOM 0 HA GLU A 88 0.194 10.572 -3.475 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.464 13.457 -3.566 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.398 12.560 -2.385 1.00 0.00 H new ATOM 0 HG2 GLU A 88 0.929 11.573 -1.667 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.589 12.949 -2.528 1.00 0.00 H new ATOM 1393 N ASN A 89 -2.201 10.171 -5.132 1.00 0.00 N ATOM 1394 CA ASN A 89 -3.511 9.570 -5.348 1.00 0.00 C ATOM 1395 C ASN A 89 -3.568 8.169 -4.748 1.00 0.00 C ATOM 1396 O ASN A 89 -2.982 7.229 -5.284 1.00 0.00 O ATOM 1397 CB ASN A 89 -3.823 9.513 -6.845 1.00 0.00 C ATOM 1398 CG ASN A 89 -4.553 10.750 -7.331 1.00 0.00 C ATOM 1399 OD1 ASN A 89 -3.984 11.583 -8.034 1.00 0.00 O ATOM 1400 ND2 ASN A 89 -5.820 10.875 -6.956 1.00 0.00 N ATOM 0 H ASN A 89 -1.573 10.113 -5.934 1.00 0.00 H new ATOM 0 HA ASN A 89 -4.259 10.188 -4.851 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -2.893 9.400 -7.403 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -4.429 8.631 -7.054 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -6.362 11.687 -7.252 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -6.252 10.159 -6.372 1.00 0.00 H new ATOM 1407 N PHE A 90 -4.271 8.037 -3.627 1.00 0.00 N ATOM 1408 CA PHE A 90 -4.397 6.749 -2.952 1.00 0.00 C ATOM 1409 C PHE A 90 -5.674 6.025 -3.372 1.00 0.00 C ATOM 1410 O PHE A 90 -6.769 6.366 -2.927 1.00 0.00 O ATOM 1411 CB PHE A 90 -4.382 6.947 -1.434 1.00 0.00 C ATOM 1412 CG PHE A 90 -3.005 7.155 -0.870 1.00 0.00 C ATOM 1413 CD1 PHE A 90 -2.142 8.081 -1.434 1.00 0.00 C ATOM 1414 CD2 PHE A 90 -2.573 6.421 0.224 1.00 0.00 C ATOM 1415 CE1 PHE A 90 -0.875 8.273 -0.917 1.00 0.00 C ATOM 1416 CE2 PHE A 90 -1.306 6.609 0.745 1.00 0.00 C ATOM 1417 CZ PHE A 90 -0.456 7.536 0.173 1.00 0.00 C ATOM 0 H PHE A 90 -4.761 8.804 -3.167 1.00 0.00 H new ATOM 0 HA PHE A 90 -3.547 6.132 -3.244 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.003 7.807 -1.182 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.833 6.077 -0.958 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.463 8.659 -2.288 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.233 5.694 0.674 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.213 8.999 -1.365 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.981 6.032 1.598 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.534 7.684 0.578 1.00 0.00 H new ATOM 1427 N GLU A 91 -5.517 5.021 -4.228 1.00 0.00 N ATOM 1428 CA GLU A 91 -6.647 4.234 -4.717 1.00 0.00 C ATOM 1429 C GLU A 91 -6.196 2.814 -5.054 1.00 0.00 C ATOM 1430 O GLU A 91 -5.117 2.615 -5.612 1.00 0.00 O ATOM 1431 CB GLU A 91 -7.271 4.895 -5.949 1.00 0.00 C ATOM 1432 CG GLU A 91 -7.465 6.397 -5.811 1.00 0.00 C ATOM 1433 CD GLU A 91 -6.191 7.179 -6.049 1.00 0.00 C ATOM 1434 OE1 GLU A 91 -5.239 6.605 -6.622 1.00 0.00 O ATOM 1435 OE2 GLU A 91 -6.141 8.364 -5.662 1.00 0.00 O ATOM 0 H GLU A 91 -4.613 4.731 -4.600 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.400 4.188 -3.930 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.638 4.698 -6.814 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.237 4.431 -6.148 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.226 6.727 -6.519 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.841 6.620 -4.812 1.00 0.00 H new ATOM 1442 N PHE A 92 -7.020 1.828 -4.707 1.00 0.00 N ATOM 1443 CA PHE A 92 -6.685 0.431 -4.972 1.00 0.00 C ATOM 1444 C PHE A 92 -7.866 -0.316 -5.589 1.00 0.00 C ATOM 1445 O PHE A 92 -9.024 -0.046 -5.268 1.00 0.00 O ATOM 1446 CB PHE A 92 -6.237 -0.264 -3.681 1.00 0.00 C ATOM 1447 CG PHE A 92 -7.318 -0.378 -2.641 1.00 0.00 C ATOM 1448 CD1 PHE A 92 -7.876 0.756 -2.071 1.00 0.00 C ATOM 1449 CD2 PHE A 92 -7.774 -1.621 -2.233 1.00 0.00 C ATOM 1450 CE1 PHE A 92 -8.869 0.651 -1.115 1.00 0.00 C ATOM 1451 CE2 PHE A 92 -8.768 -1.731 -1.278 1.00 0.00 C ATOM 1452 CZ PHE A 92 -9.316 -0.594 -0.719 1.00 0.00 C ATOM 0 H PHE A 92 -7.918 1.969 -4.245 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.864 0.415 -5.688 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.875 -1.263 -3.925 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.396 0.285 -3.258 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.531 1.732 -2.377 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.348 -2.514 -2.666 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.295 1.542 -0.678 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.115 -2.706 -0.970 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.093 -0.678 0.027 1.00 0.00 H new ATOM 1462 N LEU A 93 -7.559 -1.259 -6.480 1.00 0.00 N ATOM 1463 CA LEU A 93 -8.587 -2.050 -7.149 1.00 0.00 C ATOM 1464 C LEU A 93 -8.583 -3.491 -6.648 1.00 0.00 C ATOM 1465 O LEU A 93 -7.522 -4.080 -6.441 1.00 0.00 O ATOM 1466 CB LEU A 93 -8.366 -2.039 -8.663 1.00 0.00 C ATOM 1467 CG LEU A 93 -8.828 -0.767 -9.381 1.00 0.00 C ATOM 1468 CD1 LEU A 93 -7.711 -0.202 -10.243 1.00 0.00 C ATOM 1469 CD2 LEU A 93 -10.062 -1.050 -10.226 1.00 0.00 C ATOM 0 H LEU A 93 -6.605 -1.492 -6.754 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.553 -1.601 -6.919 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.304 -2.183 -8.860 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.889 -2.892 -9.096 1.00 0.00 H new ATOM 0 HG LEU A 93 -9.088 -0.024 -8.627 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.060 0.701 -10.744 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.853 0.040 -9.615 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.418 -0.941 -10.989 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.376 -0.135 -10.729 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.827 -1.811 -10.970 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -10.868 -1.407 -9.585 1.00 0.00 H new ATOM 1481 N ILE A 94 -9.779 -4.051 -6.466 1.00 0.00 N ATOM 1482 CA ILE A 94 -9.927 -5.426 -6.000 1.00 0.00 C ATOM 1483 C ILE A 94 -10.466 -6.305 -7.124 1.00 0.00 C ATOM 1484 O ILE A 94 -11.629 -6.186 -7.500 1.00 0.00 O ATOM 1485 CB ILE A 94 -10.891 -5.500 -4.797 1.00 0.00 C ATOM 1486 CG1 ILE A 94 -10.606 -4.366 -3.809 1.00 0.00 C ATOM 1487 CG2 ILE A 94 -10.790 -6.848 -4.103 1.00 0.00 C ATOM 1488 CD1 ILE A 94 -9.248 -4.466 -3.153 1.00 0.00 C ATOM 0 H ILE A 94 -10.662 -3.569 -6.636 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.945 -5.782 -5.690 1.00 0.00 H new ATOM 0 HB ILE A 94 -11.908 -5.386 -5.171 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -10.679 -3.412 -4.332 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.375 -4.366 -3.036 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -11.479 -6.875 -3.259 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -11.047 -7.640 -4.807 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.771 -6.997 -3.745 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.113 -3.631 -2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -9.178 -5.404 -2.602 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -8.472 -4.436 -3.917 1.00 0.00 H new ATOM 1500 N VAL A 95 -9.623 -7.174 -7.669 1.00 0.00 N ATOM 1501 CA VAL A 95 -10.041 -8.045 -8.765 1.00 0.00 C ATOM 1502 C VAL A 95 -10.302 -9.472 -8.298 1.00 0.00 C ATOM 1503 O VAL A 95 -9.509 -10.057 -7.562 1.00 0.00 O ATOM 1504 CB VAL A 95 -8.995 -8.073 -9.897 1.00 0.00 C ATOM 1505 CG1 VAL A 95 -9.420 -9.029 -11.006 1.00 0.00 C ATOM 1506 CG2 VAL A 95 -8.774 -6.676 -10.453 1.00 0.00 C ATOM 0 H VAL A 95 -8.654 -7.295 -7.375 1.00 0.00 H new ATOM 0 HA VAL A 95 -10.973 -7.624 -9.143 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.054 -8.433 -9.481 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.666 -9.031 -11.793 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.523 -10.035 -10.599 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -10.375 -8.705 -11.419 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.033 -6.715 -11.251 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.713 -6.289 -10.849 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.418 -6.020 -9.658 1.00 0.00 H new ATOM 1516 N SER A 96 -11.418 -10.029 -8.759 1.00 0.00 N ATOM 1517 CA SER A 96 -11.794 -11.395 -8.424 1.00 0.00 C ATOM 1518 C SER A 96 -11.486 -12.320 -9.597 1.00 0.00 C ATOM 1519 O SER A 96 -10.998 -11.874 -10.635 1.00 0.00 O ATOM 1520 CB SER A 96 -13.285 -11.460 -8.061 1.00 0.00 C ATOM 1521 OG SER A 96 -13.947 -12.515 -8.740 1.00 0.00 O ATOM 0 H SER A 96 -12.080 -9.550 -9.369 1.00 0.00 H new ATOM 0 HA SER A 96 -11.216 -11.723 -7.560 1.00 0.00 H new ATOM 0 HB2 SER A 96 -13.391 -11.597 -6.985 1.00 0.00 H new ATOM 0 HB3 SER A 96 -13.761 -10.512 -8.310 1.00 0.00 H new ATOM 0 HG SER A 96 -14.446 -13.057 -8.094 1.00 0.00 H new ATOM 1527 N SER A 97 -11.764 -13.607 -9.430 1.00 0.00 N ATOM 1528 CA SER A 97 -11.505 -14.578 -10.486 1.00 0.00 C ATOM 1529 C SER A 97 -12.614 -14.572 -11.537 1.00 0.00 C ATOM 1530 O SER A 97 -12.503 -15.241 -12.564 1.00 0.00 O ATOM 1531 CB SER A 97 -11.349 -15.983 -9.895 1.00 0.00 C ATOM 1532 OG SER A 97 -11.749 -16.014 -8.536 1.00 0.00 O ATOM 0 H SER A 97 -12.166 -14.001 -8.579 1.00 0.00 H new ATOM 0 HA SER A 97 -10.575 -14.291 -10.976 1.00 0.00 H new ATOM 0 HB2 SER A 97 -11.947 -16.690 -10.469 1.00 0.00 H new ATOM 0 HB3 SER A 97 -10.310 -16.302 -9.979 1.00 0.00 H new ATOM 0 HG SER A 97 -12.100 -16.903 -8.318 1.00 0.00 H new ATOM 1538 N THR A 98 -13.678 -13.817 -11.283 1.00 0.00 N ATOM 1539 CA THR A 98 -14.787 -13.738 -12.225 1.00 0.00 C ATOM 1540 C THR A 98 -14.823 -12.385 -12.921 1.00 0.00 C ATOM 1541 O THR A 98 -15.861 -11.963 -13.435 1.00 0.00 O ATOM 1542 CB THR A 98 -16.115 -13.998 -11.513 1.00 0.00 C ATOM 1543 OG1 THR A 98 -17.185 -14.031 -12.441 1.00 0.00 O ATOM 1544 CG2 THR A 98 -16.448 -12.957 -10.466 1.00 0.00 C ATOM 0 H THR A 98 -13.795 -13.256 -10.440 1.00 0.00 H new ATOM 0 HA THR A 98 -14.635 -14.507 -12.982 1.00 0.00 H new ATOM 0 HB THR A 98 -15.992 -14.961 -11.018 1.00 0.00 H new ATOM 0 HG1 THR A 98 -17.115 -13.265 -13.048 1.00 0.00 H new ATOM 0 HG21 THR A 98 -17.402 -13.202 -10.000 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.666 -12.942 -9.706 1.00 0.00 H new ATOM 0 HG23 THR A 98 -16.515 -11.976 -10.937 1.00 0.00 H new ATOM 1552 N GLY A 99 -13.679 -11.712 -12.945 1.00 0.00 N ATOM 1553 CA GLY A 99 -13.595 -10.413 -13.591 1.00 0.00 C ATOM 1554 C GLY A 99 -14.069 -9.272 -12.708 1.00 0.00 C ATOM 1555 O GLY A 99 -13.711 -8.118 -12.938 1.00 0.00 O ATOM 0 H GLY A 99 -12.808 -12.041 -12.529 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.563 -10.229 -13.888 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.191 -10.429 -14.503 1.00 0.00 H new ATOM 1559 N GLN A 100 -14.875 -9.587 -11.695 1.00 0.00 N ATOM 1560 CA GLN A 100 -15.391 -8.568 -10.785 1.00 0.00 C ATOM 1561 C GLN A 100 -14.255 -7.716 -10.229 1.00 0.00 C ATOM 1562 O GLN A 100 -13.311 -8.237 -9.638 1.00 0.00 O ATOM 1563 CB GLN A 100 -16.162 -9.222 -9.636 1.00 0.00 C ATOM 1564 CG GLN A 100 -17.321 -8.383 -9.126 1.00 0.00 C ATOM 1565 CD GLN A 100 -18.613 -8.666 -9.867 1.00 0.00 C ATOM 1566 OE1 GLN A 100 -19.282 -7.610 -10.315 1.00 0.00 O flip ATOM 1567 NE2 GLN A 100 -19.007 -9.820 -10.036 1.00 0.00 N flip ATOM 0 H GLN A 100 -15.183 -10.536 -11.485 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.068 -7.923 -11.345 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.542 -10.188 -9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.475 -9.416 -8.812 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.466 -8.577 -8.063 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.072 -7.327 -9.226 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.462 -10.603 -9.675 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -19.878 -9.993 -10.537 1.00 0.00 H new ATOM 1576 N THR A 101 -14.347 -6.405 -10.430 1.00 0.00 N ATOM 1577 CA THR A 101 -13.312 -5.497 -9.951 1.00 0.00 C ATOM 1578 C THR A 101 -13.902 -4.361 -9.120 1.00 0.00 C ATOM 1579 O THR A 101 -14.634 -3.515 -9.633 1.00 0.00 O ATOM 1580 CB THR A 101 -12.531 -4.921 -11.131 1.00 0.00 C ATOM 1581 OG1 THR A 101 -12.181 -5.942 -12.047 1.00 0.00 O ATOM 1582 CG2 THR A 101 -11.254 -4.219 -10.717 1.00 0.00 C ATOM 0 H THR A 101 -15.120 -5.951 -10.917 1.00 0.00 H new ATOM 0 HA THR A 101 -12.640 -6.070 -9.312 1.00 0.00 H new ATOM 0 HB THR A 101 -13.197 -4.190 -11.590 1.00 0.00 H new ATOM 0 HG1 THR A 101 -12.978 -6.466 -12.273 1.00 0.00 H new ATOM 0 HG21 THR A 101 -10.748 -3.833 -11.602 1.00 0.00 H new ATOM 0 HG22 THR A 101 -11.494 -3.393 -10.047 1.00 0.00 H new ATOM 0 HG23 THR A 101 -10.601 -4.925 -10.204 1.00 0.00 H new ATOM 1590 N TRP A 102 -13.560 -4.339 -7.835 1.00 0.00 N ATOM 1591 CA TRP A 102 -14.031 -3.300 -6.931 1.00 0.00 C ATOM 1592 C TRP A 102 -12.974 -2.218 -6.774 1.00 0.00 C ATOM 1593 O TRP A 102 -11.952 -2.437 -6.123 1.00 0.00 O ATOM 1594 CB TRP A 102 -14.335 -3.872 -5.552 1.00 0.00 C ATOM 1595 CG TRP A 102 -15.415 -4.902 -5.524 1.00 0.00 C ATOM 1596 CD1 TRP A 102 -16.073 -5.452 -6.584 1.00 0.00 C ATOM 1597 CD2 TRP A 102 -15.960 -5.503 -4.353 1.00 0.00 C ATOM 1598 NE1 TRP A 102 -16.989 -6.376 -6.136 1.00 0.00 N ATOM 1599 CE2 TRP A 102 -16.944 -6.418 -4.766 1.00 0.00 C ATOM 1600 CE3 TRP A 102 -15.704 -5.357 -2.989 1.00 0.00 C ATOM 1601 CZ2 TRP A 102 -17.673 -7.183 -3.855 1.00 0.00 C ATOM 1602 CZ3 TRP A 102 -16.431 -6.116 -2.096 1.00 0.00 C ATOM 1603 CH2 TRP A 102 -17.398 -7.011 -2.531 1.00 0.00 C ATOM 0 H TRP A 102 -12.955 -5.034 -7.397 1.00 0.00 H new ATOM 0 HA TRP A 102 -14.941 -2.881 -7.361 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -13.423 -4.311 -5.148 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -14.616 -3.054 -4.889 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -15.901 -5.200 -7.620 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.602 -6.938 -6.727 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.952 -4.664 -2.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -18.425 -7.884 -4.186 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -16.244 -6.012 -1.037 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -17.948 -7.587 -1.801 1.00 0.00 H new ATOM 1614 N HIS A 103 -13.215 -1.053 -7.352 1.00 0.00 N ATOM 1615 CA HIS A 103 -12.261 0.037 -7.237 1.00 0.00 C ATOM 1616 C HIS A 103 -12.673 0.999 -6.131 1.00 0.00 C ATOM 1617 O HIS A 103 -13.721 1.638 -6.209 1.00 0.00 O ATOM 1618 CB HIS A 103 -12.128 0.791 -8.559 1.00 0.00 C ATOM 1619 CG HIS A 103 -10.915 1.660 -8.598 1.00 0.00 C ATOM 1620 ND1 HIS A 103 -10.100 1.838 -7.503 1.00 0.00 N ATOM 1621 CD2 HIS A 103 -10.378 2.410 -9.590 1.00 0.00 C ATOM 1622 CE1 HIS A 103 -9.120 2.659 -7.812 1.00 0.00 C ATOM 1623 NE2 HIS A 103 -9.261 3.021 -9.075 1.00 0.00 N ATOM 0 H HIS A 103 -14.050 -0.839 -7.898 1.00 0.00 H new ATOM 0 HA HIS A 103 -11.293 -0.396 -6.986 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -12.085 0.075 -9.380 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -13.016 1.404 -8.716 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -10.235 1.400 -6.592 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.757 2.509 -10.596 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.333 2.982 -7.146 1.00 0.00 H new ATOM 1632 N PHE A 104 -11.845 1.102 -5.096 1.00 0.00 N ATOM 1633 CA PHE A 104 -12.142 1.991 -3.983 1.00 0.00 C ATOM 1634 C PHE A 104 -11.022 2.996 -3.753 1.00 0.00 C ATOM 1635 O PHE A 104 -9.917 2.852 -4.274 1.00 0.00 O ATOM 1636 CB PHE A 104 -12.368 1.195 -2.695 1.00 0.00 C ATOM 1637 CG PHE A 104 -13.397 0.104 -2.802 1.00 0.00 C ATOM 1638 CD1 PHE A 104 -14.633 0.349 -3.376 1.00 0.00 C ATOM 1639 CD2 PHE A 104 -13.127 -1.164 -2.314 1.00 0.00 C ATOM 1640 CE1 PHE A 104 -15.582 -0.654 -3.462 1.00 0.00 C ATOM 1641 CE2 PHE A 104 -14.072 -2.169 -2.394 1.00 0.00 C ATOM 1642 CZ PHE A 104 -15.301 -1.913 -2.970 1.00 0.00 C ATOM 0 H PHE A 104 -10.971 0.585 -5.007 1.00 0.00 H new ATOM 0 HA PHE A 104 -13.052 2.532 -4.244 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.421 0.753 -2.386 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.670 1.884 -1.906 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.858 1.333 -3.760 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.166 -1.370 -1.866 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.542 -0.452 -3.914 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -13.850 -3.153 -2.007 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.041 -2.697 -3.035 1.00 0.00 H new ATOM 1652 N GLU A 105 -11.324 4.007 -2.945 1.00 0.00 N ATOM 1653 CA GLU A 105 -10.360 5.043 -2.606 1.00 0.00 C ATOM 1654 C GLU A 105 -10.355 5.276 -1.100 1.00 0.00 C ATOM 1655 O GLU A 105 -11.289 5.859 -0.549 1.00 0.00 O ATOM 1656 CB GLU A 105 -10.691 6.345 -3.339 1.00 0.00 C ATOM 1657 CG GLU A 105 -9.668 7.446 -3.114 1.00 0.00 C ATOM 1658 CD GLU A 105 -10.255 8.658 -2.415 1.00 0.00 C ATOM 1659 OE1 GLU A 105 -10.270 8.672 -1.166 1.00 0.00 O ATOM 1660 OE2 GLU A 105 -10.700 9.590 -3.116 1.00 0.00 O ATOM 0 H GLU A 105 -12.238 4.129 -2.510 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.369 4.713 -2.919 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.765 6.142 -4.407 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.670 6.697 -3.013 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.843 7.053 -2.520 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.252 7.752 -4.074 1.00 0.00 H new ATOM 1667 N ALA A 106 -9.304 4.801 -0.439 1.00 0.00 N ATOM 1668 CA ALA A 106 -9.178 4.940 1.007 1.00 0.00 C ATOM 1669 C ALA A 106 -9.357 6.389 1.451 1.00 0.00 C ATOM 1670 O ALA A 106 -8.699 7.293 0.938 1.00 0.00 O ATOM 1671 CB ALA A 106 -7.827 4.411 1.467 1.00 0.00 C ATOM 0 H ALA A 106 -8.525 4.315 -0.884 1.00 0.00 H new ATOM 0 HA ALA A 106 -9.971 4.352 1.469 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.743 4.519 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.738 3.358 1.200 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -7.031 4.976 0.983 1.00 0.00 H new ATOM 1677 N ALA A 107 -10.250 6.599 2.415 1.00 0.00 N ATOM 1678 CA ALA A 107 -10.510 7.935 2.935 1.00 0.00 C ATOM 1679 C ALA A 107 -9.243 8.537 3.536 1.00 0.00 C ATOM 1680 O ALA A 107 -9.075 9.756 3.566 1.00 0.00 O ATOM 1681 CB ALA A 107 -11.625 7.891 3.971 1.00 0.00 C ATOM 0 H ALA A 107 -10.804 5.861 2.850 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.828 8.570 2.109 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.809 8.896 4.351 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.535 7.505 3.510 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.331 7.240 4.794 1.00 0.00 H new ATOM 1687 N SER A 108 -8.352 7.669 4.010 1.00 0.00 N ATOM 1688 CA SER A 108 -7.097 8.107 4.605 1.00 0.00 C ATOM 1689 C SER A 108 -5.910 7.497 3.868 1.00 0.00 C ATOM 1690 O SER A 108 -6.044 6.478 3.191 1.00 0.00 O ATOM 1691 CB SER A 108 -7.048 7.725 6.085 1.00 0.00 C ATOM 1692 OG SER A 108 -7.456 8.804 6.907 1.00 0.00 O ATOM 0 H SER A 108 -8.479 6.657 3.992 1.00 0.00 H new ATOM 0 HA SER A 108 -7.039 9.192 4.519 1.00 0.00 H new ATOM 0 HB2 SER A 108 -7.694 6.865 6.263 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.035 7.424 6.352 1.00 0.00 H new ATOM 0 HG SER A 108 -7.417 8.532 7.848 1.00 0.00 H new ATOM 1698 N PHE A 109 -4.747 8.126 4.000 1.00 0.00 N ATOM 1699 CA PHE A 109 -3.538 7.644 3.341 1.00 0.00 C ATOM 1700 C PHE A 109 -3.105 6.295 3.909 1.00 0.00 C ATOM 1701 O PHE A 109 -2.732 5.390 3.163 1.00 0.00 O ATOM 1702 CB PHE A 109 -2.408 8.664 3.498 1.00 0.00 C ATOM 1703 CG PHE A 109 -2.322 9.641 2.360 1.00 0.00 C ATOM 1704 CD1 PHE A 109 -3.467 10.229 1.847 1.00 0.00 C ATOM 1705 CD2 PHE A 109 -1.096 9.971 1.804 1.00 0.00 C ATOM 1706 CE1 PHE A 109 -3.391 11.127 0.799 1.00 0.00 C ATOM 1707 CE2 PHE A 109 -1.015 10.869 0.757 1.00 0.00 C ATOM 1708 CZ PHE A 109 -2.164 11.448 0.254 1.00 0.00 C ATOM 0 H PHE A 109 -4.616 8.970 4.557 1.00 0.00 H new ATOM 0 HA PHE A 109 -3.759 7.515 2.282 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -2.552 9.213 4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.460 8.134 3.584 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -4.429 9.983 2.271 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.194 9.521 2.193 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -4.291 11.577 0.407 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -0.054 11.118 0.332 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.102 12.150 -0.564 1.00 0.00 H new ATOM 1718 N GLU A 110 -3.156 6.167 5.229 1.00 0.00 N ATOM 1719 CA GLU A 110 -2.768 4.928 5.895 1.00 0.00 C ATOM 1720 C GLU A 110 -3.822 3.845 5.692 1.00 0.00 C ATOM 1721 O GLU A 110 -3.502 2.659 5.614 1.00 0.00 O ATOM 1722 CB GLU A 110 -2.550 5.175 7.388 1.00 0.00 C ATOM 1723 CG GLU A 110 -1.296 4.514 7.939 1.00 0.00 C ATOM 1724 CD GLU A 110 -0.868 5.094 9.272 1.00 0.00 C ATOM 1725 OE1 GLU A 110 -1.750 5.345 10.121 1.00 0.00 O ATOM 1726 OE2 GLU A 110 0.348 5.298 9.469 1.00 0.00 O ATOM 0 H GLU A 110 -3.463 6.907 5.861 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.834 4.584 5.451 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.492 6.249 7.565 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.416 4.807 7.939 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.474 3.445 8.053 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.484 4.628 7.220 1.00 0.00 H new ATOM 1733 N GLU A 111 -5.081 4.261 5.610 1.00 0.00 N ATOM 1734 CA GLU A 111 -6.186 3.327 5.420 1.00 0.00 C ATOM 1735 C GLU A 111 -6.041 2.561 4.109 1.00 0.00 C ATOM 1736 O GLU A 111 -6.330 1.367 4.043 1.00 0.00 O ATOM 1737 CB GLU A 111 -7.521 4.075 5.442 1.00 0.00 C ATOM 1738 CG GLU A 111 -8.731 3.167 5.283 1.00 0.00 C ATOM 1739 CD GLU A 111 -10.011 3.810 5.781 1.00 0.00 C ATOM 1740 OE1 GLU A 111 -10.279 3.730 6.998 1.00 0.00 O ATOM 1741 OE2 GLU A 111 -10.743 4.392 4.954 1.00 0.00 O ATOM 0 H GLU A 111 -5.362 5.239 5.672 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.163 2.609 6.240 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.607 4.620 6.382 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -7.526 4.816 4.643 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -8.847 2.902 4.232 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.559 2.239 5.828 1.00 0.00 H new ATOM 1748 N ARG A 112 -5.594 3.253 3.066 1.00 0.00 N ATOM 1749 CA ARG A 112 -5.420 2.630 1.758 1.00 0.00 C ATOM 1750 C ARG A 112 -4.487 1.426 1.842 1.00 0.00 C ATOM 1751 O ARG A 112 -4.806 0.348 1.343 1.00 0.00 O ATOM 1752 CB ARG A 112 -4.868 3.644 0.755 1.00 0.00 C ATOM 1753 CG ARG A 112 -4.978 3.186 -0.692 1.00 0.00 C ATOM 1754 CD ARG A 112 -3.734 3.547 -1.490 1.00 0.00 C ATOM 1755 NE ARG A 112 -3.549 2.668 -2.643 1.00 0.00 N ATOM 1756 CZ ARG A 112 -2.987 1.462 -2.577 1.00 0.00 C ATOM 1757 NH1 ARG A 112 -2.561 0.984 -1.413 1.00 0.00 N ATOM 1758 NH2 ARG A 112 -2.854 0.733 -3.675 1.00 0.00 N ATOM 0 H ARG A 112 -5.346 4.242 3.100 1.00 0.00 H new ATOM 0 HA ARG A 112 -6.397 2.286 1.419 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -5.403 4.587 0.871 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -3.821 3.841 0.987 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.130 2.107 -0.722 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -5.853 3.644 -1.154 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -3.808 4.580 -1.830 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.858 3.486 -0.844 1.00 0.00 H new ATOM 0 HE ARG A 112 -3.870 2.998 -3.553 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -2.664 1.541 -0.565 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.131 0.060 -1.368 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.182 1.095 -4.570 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.424 -0.190 -3.625 1.00 0.00 H new ATOM 1772 N ASP A 113 -3.333 1.615 2.472 1.00 0.00 N ATOM 1773 CA ASP A 113 -2.361 0.538 2.613 1.00 0.00 C ATOM 1774 C ASP A 113 -2.939 -0.615 3.423 1.00 0.00 C ATOM 1775 O ASP A 113 -2.831 -1.776 3.027 1.00 0.00 O ATOM 1776 CB ASP A 113 -1.083 1.058 3.275 1.00 0.00 C ATOM 1777 CG ASP A 113 0.170 0.519 2.614 1.00 0.00 C ATOM 1778 OD1 ASP A 113 0.522 -0.652 2.872 1.00 0.00 O ATOM 1779 OD2 ASP A 113 0.802 1.267 1.838 1.00 0.00 O ATOM 0 H ASP A 113 -3.049 2.500 2.892 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.118 0.169 1.617 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -1.073 2.147 3.233 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.083 0.779 4.329 1.00 0.00 H new ATOM 1784 N ALA A 114 -3.558 -0.294 4.554 1.00 0.00 N ATOM 1785 CA ALA A 114 -4.154 -1.316 5.407 1.00 0.00 C ATOM 1786 C ALA A 114 -5.105 -2.193 4.606 1.00 0.00 C ATOM 1787 O ALA A 114 -4.988 -3.415 4.613 1.00 0.00 O ATOM 1788 CB ALA A 114 -4.879 -0.674 6.581 1.00 0.00 C ATOM 0 H ALA A 114 -3.660 0.660 4.900 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.355 -1.946 5.799 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.318 -1.451 7.207 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.172 -0.090 7.170 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.668 -0.020 6.208 1.00 0.00 H new ATOM 1794 N TRP A 115 -6.036 -1.557 3.904 1.00 0.00 N ATOM 1795 CA TRP A 115 -6.998 -2.273 3.078 1.00 0.00 C ATOM 1796 C TRP A 115 -6.291 -3.153 2.057 1.00 0.00 C ATOM 1797 O TRP A 115 -6.564 -4.351 1.966 1.00 0.00 O ATOM 1798 CB TRP A 115 -7.903 -1.277 2.373 1.00 0.00 C ATOM 1799 CG TRP A 115 -9.070 -0.882 3.211 1.00 0.00 C ATOM 1800 CD1 TRP A 115 -9.187 0.229 3.990 1.00 0.00 C ATOM 1801 CD2 TRP A 115 -10.276 -1.618 3.379 1.00 0.00 C ATOM 1802 NE1 TRP A 115 -10.408 0.243 4.607 1.00 0.00 N ATOM 1803 CE2 TRP A 115 -11.097 -0.882 4.247 1.00 0.00 C ATOM 1804 CE3 TRP A 115 -10.748 -2.824 2.867 1.00 0.00 C ATOM 1805 CZ2 TRP A 115 -12.362 -1.317 4.613 1.00 0.00 C ATOM 1806 CZ3 TRP A 115 -12.005 -3.250 3.241 1.00 0.00 C ATOM 1807 CH2 TRP A 115 -12.795 -2.502 4.097 1.00 0.00 C ATOM 0 H TRP A 115 -6.144 -0.543 3.891 1.00 0.00 H new ATOM 0 HA TRP A 115 -7.598 -2.918 3.721 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -7.328 -0.388 2.112 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -8.260 -1.711 1.439 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -8.427 0.988 4.104 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -10.749 0.973 5.233 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -10.143 -3.412 2.192 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -12.981 -0.738 5.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -12.381 -4.187 2.858 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.777 -2.866 4.362 1.00 0.00 H new ATOM 1818 N VAL A 116 -5.372 -2.564 1.297 1.00 0.00 N ATOM 1819 CA VAL A 116 -4.629 -3.317 0.296 1.00 0.00 C ATOM 1820 C VAL A 116 -3.940 -4.518 0.940 1.00 0.00 C ATOM 1821 O VAL A 116 -3.858 -5.595 0.346 1.00 0.00 O ATOM 1822 CB VAL A 116 -3.584 -2.432 -0.419 1.00 0.00 C ATOM 1823 CG1 VAL A 116 -2.674 -3.268 -1.310 1.00 0.00 C ATOM 1824 CG2 VAL A 116 -4.278 -1.346 -1.229 1.00 0.00 C ATOM 0 H VAL A 116 -5.127 -1.576 1.355 1.00 0.00 H new ATOM 0 HA VAL A 116 -5.342 -3.667 -0.450 1.00 0.00 H new ATOM 0 HB VAL A 116 -2.963 -1.958 0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.949 -2.619 -1.800 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.149 -4.006 -0.703 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -3.273 -3.778 -2.065 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -3.530 -0.730 -1.728 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.925 -1.806 -1.976 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.877 -0.723 -0.565 1.00 0.00 H new ATOM 1834 N GLN A 117 -3.463 -4.330 2.167 1.00 0.00 N ATOM 1835 CA GLN A 117 -2.800 -5.403 2.895 1.00 0.00 C ATOM 1836 C GLN A 117 -3.826 -6.361 3.485 1.00 0.00 C ATOM 1837 O GLN A 117 -3.558 -7.551 3.642 1.00 0.00 O ATOM 1838 CB GLN A 117 -1.914 -4.831 4.004 1.00 0.00 C ATOM 1839 CG GLN A 117 -0.620 -4.219 3.493 1.00 0.00 C ATOM 1840 CD GLN A 117 0.517 -5.221 3.437 1.00 0.00 C ATOM 1841 OE1 GLN A 117 1.089 -5.586 4.465 1.00 0.00 O ATOM 1842 NE2 GLN A 117 0.849 -5.672 2.233 1.00 0.00 N ATOM 0 H GLN A 117 -3.524 -3.448 2.675 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.171 -5.953 2.195 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.474 -4.072 4.550 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -1.676 -5.624 4.713 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.786 -3.807 2.498 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.336 -3.388 4.139 1.00 0.00 H new ATOM 0 HE21 GLN A 117 0.347 -5.342 1.409 1.00 0.00 H new ATOM 0 HE22 GLN A 117 1.606 -6.349 2.133 1.00 0.00 H new ATOM 1851 N ALA A 118 -5.007 -5.836 3.798 1.00 0.00 N ATOM 1852 CA ALA A 118 -6.075 -6.648 4.358 1.00 0.00 C ATOM 1853 C ALA A 118 -6.574 -7.648 3.330 1.00 0.00 C ATOM 1854 O ALA A 118 -6.702 -8.838 3.610 1.00 0.00 O ATOM 1855 CB ALA A 118 -7.215 -5.764 4.841 1.00 0.00 C ATOM 0 H ALA A 118 -5.246 -4.852 3.672 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.681 -7.200 5.212 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -8.007 -6.387 5.258 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.847 -5.083 5.608 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.609 -5.188 4.003 1.00 0.00 H new ATOM 1861 N ILE A 119 -6.841 -7.154 2.129 1.00 0.00 N ATOM 1862 CA ILE A 119 -7.310 -8.002 1.046 1.00 0.00 C ATOM 1863 C ILE A 119 -6.240 -9.025 0.680 1.00 0.00 C ATOM 1864 O ILE A 119 -6.516 -10.221 0.603 1.00 0.00 O ATOM 1865 CB ILE A 119 -7.699 -7.167 -0.198 1.00 0.00 C ATOM 1866 CG1 ILE A 119 -9.020 -6.436 0.048 1.00 0.00 C ATOM 1867 CG2 ILE A 119 -7.808 -8.050 -1.436 1.00 0.00 C ATOM 1868 CD1 ILE A 119 -8.863 -5.108 0.752 1.00 0.00 C ATOM 0 H ILE A 119 -6.740 -6.170 1.882 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.203 -8.524 1.391 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.914 -6.431 -0.373 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.517 -6.273 -0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.673 -7.076 0.642 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -8.082 -7.439 -2.296 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.849 -8.532 -1.625 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.571 -8.811 -1.274 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.843 -4.651 0.890 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -8.395 -5.265 1.724 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.237 -4.449 0.150 1.00 0.00 H new ATOM 1880 N GLU A 120 -5.014 -8.552 0.473 1.00 0.00 N ATOM 1881 CA GLU A 120 -3.911 -9.443 0.134 1.00 0.00 C ATOM 1882 C GLU A 120 -3.634 -10.400 1.287 1.00 0.00 C ATOM 1883 O GLU A 120 -3.234 -11.545 1.077 1.00 0.00 O ATOM 1884 CB GLU A 120 -2.654 -8.636 -0.195 1.00 0.00 C ATOM 1885 CG GLU A 120 -2.586 -8.180 -1.643 1.00 0.00 C ATOM 1886 CD GLU A 120 -1.236 -7.599 -2.008 1.00 0.00 C ATOM 1887 OE1 GLU A 120 -0.570 -7.033 -1.115 1.00 0.00 O ATOM 1888 OE2 GLU A 120 -0.841 -7.709 -3.189 1.00 0.00 O ATOM 0 H GLU A 120 -4.762 -7.566 0.534 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.192 -10.023 -0.745 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.613 -7.762 0.455 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.775 -9.241 0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.802 -9.025 -2.297 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.359 -7.433 -1.821 1.00 0.00 H new ATOM 1895 N SER A 121 -3.853 -9.921 2.510 1.00 0.00 N ATOM 1896 CA SER A 121 -3.632 -10.735 3.699 1.00 0.00 C ATOM 1897 C SER A 121 -4.597 -11.911 3.735 1.00 0.00 C ATOM 1898 O SER A 121 -4.204 -13.041 4.026 1.00 0.00 O ATOM 1899 CB SER A 121 -3.794 -9.891 4.964 1.00 0.00 C ATOM 1900 OG SER A 121 -2.601 -9.187 5.265 1.00 0.00 O ATOM 0 H SER A 121 -4.183 -8.975 2.701 1.00 0.00 H new ATOM 0 HA SER A 121 -2.613 -11.121 3.659 1.00 0.00 H new ATOM 0 HB2 SER A 121 -4.613 -9.184 4.831 1.00 0.00 H new ATOM 0 HB3 SER A 121 -4.061 -10.534 5.802 1.00 0.00 H new ATOM 0 HG SER A 121 -2.431 -8.519 4.568 1.00 0.00 H new ATOM 1906 N GLN A 122 -5.861 -11.642 3.435 1.00 0.00 N ATOM 1907 CA GLN A 122 -6.879 -12.684 3.432 1.00 0.00 C ATOM 1908 C GLN A 122 -6.640 -13.667 2.291 1.00 0.00 C ATOM 1909 O GLN A 122 -6.917 -14.859 2.417 1.00 0.00 O ATOM 1910 CB GLN A 122 -8.275 -12.067 3.320 1.00 0.00 C ATOM 1911 CG GLN A 122 -9.004 -11.964 4.651 1.00 0.00 C ATOM 1912 CD GLN A 122 -8.120 -11.435 5.764 1.00 0.00 C ATOM 1913 OE1 GLN A 122 -7.915 -12.100 6.780 1.00 0.00 O ATOM 1914 NE2 GLN A 122 -7.587 -10.234 5.577 1.00 0.00 N ATOM 0 H GLN A 122 -6.205 -10.713 3.191 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.814 -13.229 4.374 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.189 -11.072 2.884 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.873 -12.665 2.633 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.868 -11.310 4.537 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -9.383 -12.947 4.930 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.783 -9.717 4.720 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -6.981 -9.828 6.290 1.00 0.00 H new ATOM 1923 N ILE A 123 -6.114 -13.161 1.181 1.00 0.00 N ATOM 1924 CA ILE A 123 -5.828 -13.998 0.024 1.00 0.00 C ATOM 1925 C ILE A 123 -4.597 -14.861 0.272 1.00 0.00 C ATOM 1926 O ILE A 123 -4.535 -16.013 -0.159 1.00 0.00 O ATOM 1927 CB ILE A 123 -5.611 -13.154 -1.249 1.00 0.00 C ATOM 1928 CG1 ILE A 123 -6.812 -12.238 -1.495 1.00 0.00 C ATOM 1929 CG2 ILE A 123 -5.381 -14.054 -2.451 1.00 0.00 C ATOM 1930 CD1 ILE A 123 -6.469 -10.990 -2.277 1.00 0.00 C ATOM 0 H ILE A 123 -5.878 -12.176 1.059 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.696 -14.639 -0.128 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.726 -12.535 -1.104 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.579 -12.795 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -7.241 -11.949 -0.536 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -5.230 -13.442 -3.340 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.498 -14.670 -2.280 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -6.250 -14.696 -2.596 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.367 -10.388 -2.414 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.724 -10.411 -1.730 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.068 -11.270 -3.251 1.00 0.00 H new ATOM 1942 N LEU A 124 -3.619 -14.298 0.973 1.00 0.00 N ATOM 1943 CA LEU A 124 -2.391 -15.017 1.283 1.00 0.00 C ATOM 1944 C LEU A 124 -2.664 -16.148 2.271 1.00 0.00 C ATOM 1945 O LEU A 124 -2.046 -17.212 2.199 1.00 0.00 O ATOM 1946 CB LEU A 124 -1.343 -14.059 1.854 1.00 0.00 C ATOM 1947 CG LEU A 124 -0.082 -13.897 1.002 1.00 0.00 C ATOM 1948 CD1 LEU A 124 0.495 -12.499 1.160 1.00 0.00 C ATOM 1949 CD2 LEU A 124 0.951 -14.948 1.378 1.00 0.00 C ATOM 0 H LEU A 124 -3.654 -13.346 1.337 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.005 -15.450 0.360 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -1.802 -13.079 1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.052 -14.411 2.844 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.353 -14.038 -0.044 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.391 -12.404 0.547 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -0.243 -11.763 0.842 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.751 -12.327 2.205 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.842 -14.819 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.217 -14.837 2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.536 -15.942 1.212 1.00 0.00 H new ATOM 1961 N ALA A 125 -3.596 -15.914 3.189 1.00 0.00 N ATOM 1962 CA ALA A 125 -3.953 -16.914 4.189 1.00 0.00 C ATOM 1963 C ALA A 125 -4.827 -18.005 3.581 1.00 0.00 C ATOM 1964 O ALA A 125 -4.747 -19.169 3.973 1.00 0.00 O ATOM 1965 CB ALA A 125 -4.664 -16.258 5.363 1.00 0.00 C ATOM 0 H ALA A 125 -4.118 -15.041 3.261 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.035 -17.377 4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -4.924 -17.017 6.101 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.006 -15.518 5.819 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -5.572 -15.768 5.011 1.00 0.00 H new ATOM 1971 N SER A 126 -5.661 -17.620 2.620 1.00 0.00 N ATOM 1972 CA SER A 126 -6.551 -18.564 1.956 1.00 0.00 C ATOM 1973 C SER A 126 -5.792 -19.395 0.927 1.00 0.00 C ATOM 1974 O SER A 126 -6.139 -20.547 0.667 1.00 0.00 O ATOM 1975 CB SER A 126 -7.703 -17.819 1.277 1.00 0.00 C ATOM 1976 OG SER A 126 -8.739 -18.713 0.906 1.00 0.00 O ATOM 0 H SER A 126 -5.739 -16.660 2.284 1.00 0.00 H new ATOM 0 HA SER A 126 -6.957 -19.236 2.712 1.00 0.00 H new ATOM 0 HB2 SER A 126 -8.098 -17.060 1.952 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.333 -17.299 0.393 1.00 0.00 H new ATOM 0 HG SER A 126 -9.572 -18.213 0.778 1.00 0.00 H new ATOM 1982 N LEU A 127 -4.753 -18.805 0.345 1.00 0.00 N ATOM 1983 CA LEU A 127 -3.946 -19.492 -0.655 1.00 0.00 C ATOM 1984 C LEU A 127 -3.129 -20.611 -0.018 1.00 0.00 C ATOM 1985 O LEU A 127 -3.046 -21.718 -0.551 1.00 0.00 O ATOM 1986 CB LEU A 127 -3.016 -18.501 -1.359 1.00 0.00 C ATOM 1987 CG LEU A 127 -3.374 -18.202 -2.815 1.00 0.00 C ATOM 1988 CD1 LEU A 127 -2.609 -16.985 -3.314 1.00 0.00 C ATOM 1989 CD2 LEU A 127 -3.086 -19.412 -3.692 1.00 0.00 C ATOM 0 H LEU A 127 -4.451 -17.852 0.549 1.00 0.00 H new ATOM 0 HA LEU A 127 -4.619 -19.932 -1.391 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.017 -17.565 -0.801 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -1.999 -18.892 -1.323 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.440 -17.982 -2.870 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.877 -16.787 -4.352 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.864 -16.119 -2.703 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.538 -17.175 -3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -3.346 -19.183 -4.725 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -2.027 -19.661 -3.631 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.679 -20.260 -3.348 1.00 0.00 H new ATOM 2001 N GLN A 128 -2.532 -20.314 1.127 1.00 0.00 N ATOM 2002 CA GLN A 128 -1.721 -21.289 1.847 1.00 0.00 C ATOM 2003 C GLN A 128 -2.549 -22.514 2.222 1.00 0.00 C ATOM 2004 O GLN A 128 -3.742 -22.556 1.855 1.00 0.00 O ATOM 2005 CB GLN A 128 -1.123 -20.659 3.106 1.00 0.00 C ATOM 2006 CG GLN A 128 -0.420 -19.336 2.847 1.00 0.00 C ATOM 2007 CD GLN A 128 1.080 -19.418 3.061 1.00 0.00 C ATOM 2008 OE1 GLN A 128 1.570 -20.303 3.762 1.00 0.00 O ATOM 2009 NE2 GLN A 128 1.815 -18.492 2.456 1.00 0.00 N ATOM 2010 OXT GLN A 128 -1.997 -23.421 2.881 1.00 0.00 O ATOM 0 H GLN A 128 -2.594 -19.402 1.580 1.00 0.00 H new ATOM 0 HA GLN A 128 -0.912 -21.606 1.189 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -1.917 -20.503 3.837 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -0.414 -21.357 3.550 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -0.620 -19.017 1.824 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -0.836 -18.573 3.506 1.00 0.00 H new ATOM 0 HE21 GLN A 128 1.365 -17.777 1.884 1.00 0.00 H new ATOM 0 HE22 GLN A 128 2.829 -18.496 2.563 1.00 0.00 H new TER 2019 GLN A 128