USER MOD reduce.3.24.130724 H: found=0, std=0, add=1022, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1020 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 132 THR OG1 : rot -178:sc= -0.455 USER MOD Set 1.2: A 134 LYS NZ :NH3+ -107:sc= -0.128 (180deg=-0.444) USER MOD Set 2.1: A 109 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Set 3.1: A 55 THR OG1 : rot 33:sc= -1.78! USER MOD Set 3.2: A 58 SER OG : rot -6:sc= -1.22! USER MOD Set 4.1: A 39 ASN :FLIP amide:sc= -0.0108 F(o=-2,f=-0.011) USER MOD Set 4.2: A 48 GLN : amide:sc= 0 K(o=-0.011,f=-1.1) USER MOD Set 5.1: A 12 TYR OH : rot -38:sc= 0.544 USER MOD Set 5.2: A 16 HIS : no HD1:sc= -4.82! C(o=-4.3!,f=-5.4!) USER MOD Set 6.1: A 6 LYS NZ :NH3+ -162:sc= -0.0328 (180deg=-0.48) USER MOD Set 6.2: A 10 GLN :FLIP amide:sc= 0 F(o=-0.69,f=-0.033) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN :FLIP amide:sc= -0.0452 F(o=-1.8!,f=-0.045) USER MOD Single : A 15 GLN : amide:sc=-0.00567 K(o=-0.0057,f=-1.6!) USER MOD Single : A 17 ASN : amide:sc= -0.256 K(o=-0.26,f=-2.9!) USER MOD Single : A 23 TYR OH : rot 0:sc= -0.0957 USER MOD Single : A 25 ASN : amide:sc= -1.61 X(o=-1.6,f=-1.1!) USER MOD Single : A 32 HIS : no HD1:sc=-0.00184 X(o=-0.0018,f=-0.35) USER MOD Single : A 38 CYS SG : rot -5:sc= -1.44! USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.506 USER MOD Single : A 43 CYS SG : rot -47:sc= 0.435! USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 46:sc= 0.731 USER MOD Single : A 49 SER OG : rot 180:sc= -0.119 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -162:sc= -0.0226 (180deg=-0.353) USER MOD Single : A 61 HIS : no HD1:sc= -5.24! C(o=-5.2!,f=-10!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 140:sc= -0.0978 (180deg=-2.25!) USER MOD Single : A 85 ASN : amide:sc= -1.97! C(o=-2!,f=-2.9!) USER MOD Single : A 88 GLN : amide:sc= -0.116 K(o=-0.12,f=-2.9!) USER MOD Single : A 92 GLN : amide:sc= -0.275 K(o=-0.27,f=-0.89) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= -0.025 USER MOD Single : A 96 SER OG : rot 180:sc= -0.388 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.661 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 16:sc= 0.178! USER MOD Single : A 106 SER OG : rot 180:sc= -0.421 USER MOD Single : A 113 THR OG1 : rot -46:sc= 0.0526 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.446 USER MOD Single : A 116 SER OG : rot -13:sc= -0.814! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 165:sc= -0.013 (180deg=-0.279) USER MOD Single : A 133 LYS NZ :NH3+ -157:sc= -0.071 (180deg=-0.456) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 75:sc= 0.0794 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 139:sc= -0.248 USER MOD ----------------------------------------------------------------- ATOM 49 N VAL A 4 -9.843 53.408 10.381 1.00 0.00 N ATOM 50 CA VAL A 4 -8.747 54.332 10.135 1.00 0.00 C ATOM 51 C VAL A 4 -7.858 53.825 9.002 1.00 0.00 C ATOM 52 O VAL A 4 -7.281 54.610 8.251 1.00 0.00 O ATOM 53 CB VAL A 4 -7.908 54.491 11.406 1.00 0.00 C ATOM 54 CG1 VAL A 4 -8.798 54.982 12.549 1.00 0.00 C ATOM 55 CG2 VAL A 4 -7.287 53.144 11.784 1.00 0.00 C ATOM 0 HA VAL A 4 -9.167 55.296 9.848 1.00 0.00 H new ATOM 0 HB VAL A 4 -7.115 55.217 11.226 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -8.200 55.095 13.453 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -9.236 55.943 12.282 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -9.593 54.258 12.728 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.690 53.260 12.689 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -8.078 52.416 11.962 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -6.650 52.796 10.971 1.00 0.00 H new ATOM 65 N TYR A 5 -7.747 52.506 8.892 1.00 0.00 N ATOM 66 CA TYR A 5 -6.912 51.899 7.858 1.00 0.00 C ATOM 67 C TYR A 5 -7.477 52.188 6.474 1.00 0.00 C ATOM 68 O TYR A 5 -6.731 52.410 5.523 1.00 0.00 O ATOM 69 CB TYR A 5 -6.824 50.389 8.078 1.00 0.00 C ATOM 70 CG TYR A 5 -6.157 50.110 9.406 1.00 0.00 C ATOM 71 CD1 TYR A 5 -6.882 50.255 10.594 1.00 0.00 C ATOM 72 CD2 TYR A 5 -4.819 49.702 9.451 1.00 0.00 C ATOM 73 CE1 TYR A 5 -6.270 49.995 11.826 1.00 0.00 C ATOM 74 CE2 TYR A 5 -4.206 49.440 10.681 1.00 0.00 C ATOM 75 CZ TYR A 5 -4.933 49.589 11.869 1.00 0.00 C ATOM 76 OH TYR A 5 -4.328 49.331 13.083 1.00 0.00 O ATOM 0 H TYR A 5 -8.221 51.839 9.501 1.00 0.00 H new ATOM 0 HA TYR A 5 -5.913 52.331 7.923 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -7.821 49.950 8.061 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -6.258 49.926 7.270 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -7.915 50.568 10.560 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -4.259 49.589 8.535 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -6.830 50.108 12.742 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -3.174 49.123 10.714 1.00 0.00 H new ATOM 0 HH TYR A 5 -3.398 49.059 12.934 1.00 0.00 H new ATOM 86 N LYS A 6 -8.801 52.179 6.371 1.00 0.00 N ATOM 87 CA LYS A 6 -9.458 52.437 5.095 1.00 0.00 C ATOM 88 C LYS A 6 -9.086 53.824 4.576 1.00 0.00 C ATOM 89 O LYS A 6 -8.923 54.021 3.373 1.00 0.00 O ATOM 90 CB LYS A 6 -10.977 52.345 5.263 1.00 0.00 C ATOM 91 CG LYS A 6 -11.651 52.494 3.898 1.00 0.00 C ATOM 92 CD LYS A 6 -13.163 52.319 4.054 1.00 0.00 C ATOM 93 CE LYS A 6 -13.834 52.439 2.684 1.00 0.00 C ATOM 94 NZ LYS A 6 -13.585 53.796 2.123 1.00 0.00 N1+ ATOM 0 H LYS A 6 -9.436 51.998 7.148 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.126 51.688 4.376 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.247 51.389 5.711 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -11.327 53.124 5.940 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -11.429 53.474 3.476 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.258 51.752 3.203 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -13.384 51.347 4.495 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -13.559 53.074 4.732 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -13.443 51.678 2.009 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -14.906 52.264 2.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -14.269 53.989 1.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -13.692 54.507 2.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.620 53.841 1.738 1.00 0.00 H new ATOM 108 N GLY A 7 -8.956 54.778 5.491 1.00 0.00 N ATOM 109 CA GLY A 7 -8.601 56.140 5.112 1.00 0.00 C ATOM 110 C GLY A 7 -7.169 56.209 4.593 1.00 0.00 C ATOM 111 O GLY A 7 -6.831 57.076 3.788 1.00 0.00 O ATOM 0 H GLY A 7 -9.090 54.635 6.492 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.287 56.498 4.344 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.712 56.801 5.972 1.00 0.00 H new ATOM 115 N GLN A 8 -6.333 55.289 5.060 1.00 0.00 N ATOM 116 CA GLN A 8 -4.936 55.252 4.638 1.00 0.00 C ATOM 117 C GLN A 8 -4.804 54.627 3.252 1.00 0.00 C ATOM 118 O GLN A 8 -4.173 55.193 2.362 1.00 0.00 O ATOM 119 CB GLN A 8 -4.103 54.454 5.644 1.00 0.00 C ATOM 120 CG GLN A 8 -2.620 54.773 5.447 1.00 0.00 C ATOM 121 CD GLN A 8 -2.223 55.964 6.310 1.00 0.00 C ATOM 122 OE1 GLN A 8 -2.729 57.140 6.056 1.00 0.00 O flip ATOM 123 NE2 GLN A 8 -1.431 55.821 7.241 1.00 0.00 N flip ATOM 0 H GLN A 8 -6.595 54.563 5.727 1.00 0.00 H new ATOM 0 HA GLN A 8 -4.567 56.277 4.595 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -4.407 54.702 6.661 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.277 53.386 5.510 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.015 53.905 5.710 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -2.423 54.992 4.398 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.036 54.901 7.438 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -1.169 56.622 7.815 1.00 0.00 H new ATOM 132 N LEU A 9 -5.413 53.458 3.079 1.00 0.00 N ATOM 133 CA LEU A 9 -5.366 52.762 1.795 1.00 0.00 C ATOM 134 C LEU A 9 -6.012 53.625 0.710 1.00 0.00 C ATOM 135 O LEU A 9 -5.501 53.711 -0.405 1.00 0.00 O ATOM 136 CB LEU A 9 -6.087 51.422 1.902 1.00 0.00 C ATOM 137 CG LEU A 9 -6.022 50.701 0.553 1.00 0.00 C ATOM 138 CD1 LEU A 9 -4.558 50.485 0.152 1.00 0.00 C ATOM 139 CD2 LEU A 9 -6.724 49.346 0.667 1.00 0.00 C ATOM 0 H LEU A 9 -5.942 52.974 3.805 1.00 0.00 H new ATOM 0 HA LEU A 9 -4.325 52.580 1.526 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -5.626 50.809 2.677 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -7.126 51.578 2.194 1.00 0.00 H new ATOM 0 HG LEU A 9 -6.517 51.308 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -4.516 49.972 -0.809 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -4.057 51.450 0.070 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.059 49.880 0.909 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.679 48.831 -0.293 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.228 48.742 1.427 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -7.766 49.499 0.948 1.00 0.00 H new ATOM 151 N GLN A 10 -7.149 54.236 1.042 1.00 0.00 N ATOM 152 CA GLN A 10 -7.858 55.076 0.087 1.00 0.00 C ATOM 153 C GLN A 10 -6.972 56.246 -0.338 1.00 0.00 C ATOM 154 O GLN A 10 -6.981 56.653 -1.500 1.00 0.00 O ATOM 155 CB GLN A 10 -9.145 55.602 0.712 1.00 0.00 C ATOM 156 CG GLN A 10 -9.891 56.464 -0.306 1.00 0.00 C ATOM 157 CD GLN A 10 -11.261 56.849 0.242 1.00 0.00 C ATOM 158 OE1 GLN A 10 -12.117 55.916 0.551 1.00 0.00 O flip ATOM 159 NE2 GLN A 10 -11.557 58.035 0.394 1.00 0.00 N flip ATOM 0 H GLN A 10 -7.593 54.164 1.958 1.00 0.00 H new ATOM 0 HA GLN A 10 -8.106 54.480 -0.792 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -9.774 54.770 1.030 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -8.916 56.188 1.602 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -9.313 57.361 -0.528 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -10.005 55.919 -1.243 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -10.885 58.763 0.151 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -12.474 58.289 0.762 1.00 0.00 H new ATOM 168 N ALA A 11 -6.215 56.785 0.613 1.00 0.00 N ATOM 169 CA ALA A 11 -5.325 57.905 0.325 1.00 0.00 C ATOM 170 C ALA A 11 -4.217 57.469 -0.634 1.00 0.00 C ATOM 171 O ALA A 11 -3.838 58.210 -1.539 1.00 0.00 O ATOM 172 CB ALA A 11 -4.704 58.428 1.621 1.00 0.00 C ATOM 0 H ALA A 11 -6.199 56.468 1.582 1.00 0.00 H new ATOM 0 HA ALA A 11 -5.907 58.699 -0.142 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -4.041 59.264 1.396 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.494 58.762 2.294 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -4.134 57.631 2.099 1.00 0.00 H new ATOM 178 N TYR A 12 -3.699 56.261 -0.424 1.00 0.00 N ATOM 179 CA TYR A 12 -2.634 55.736 -1.275 1.00 0.00 C ATOM 180 C TYR A 12 -3.111 55.646 -2.724 1.00 0.00 C ATOM 181 O TYR A 12 -2.421 56.088 -3.643 1.00 0.00 O ATOM 182 CB TYR A 12 -2.213 54.352 -0.788 1.00 0.00 C ATOM 183 CG TYR A 12 -1.177 53.781 -1.727 1.00 0.00 C ATOM 184 CD1 TYR A 12 0.181 54.049 -1.513 1.00 0.00 C ATOM 185 CD2 TYR A 12 -1.573 52.988 -2.810 1.00 0.00 C ATOM 186 CE1 TYR A 12 1.142 53.522 -2.384 1.00 0.00 C ATOM 187 CE2 TYR A 12 -0.611 52.460 -3.680 1.00 0.00 C ATOM 188 CZ TYR A 12 0.746 52.727 -3.466 1.00 0.00 C ATOM 189 OH TYR A 12 1.694 52.206 -4.324 1.00 0.00 O ATOM 0 H TYR A 12 -3.996 55.632 0.322 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.781 56.412 -1.223 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.807 54.418 0.222 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.079 53.692 -0.741 1.00 0.00 H new ATOM 0 HD1 TYR A 12 0.486 54.661 -0.677 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -2.621 52.783 -2.975 1.00 0.00 H new ATOM 0 HE1 TYR A 12 2.189 53.729 -2.221 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -0.916 51.847 -4.515 1.00 0.00 H new ATOM 0 HH TYR A 12 2.405 52.866 -4.465 1.00 0.00 H new ATOM 199 N ALA A 13 -4.293 55.075 -2.920 1.00 0.00 N ATOM 200 CA ALA A 13 -4.850 54.942 -4.260 1.00 0.00 C ATOM 201 C ALA A 13 -4.924 56.308 -4.947 1.00 0.00 C ATOM 202 O ALA A 13 -4.695 56.417 -6.148 1.00 0.00 O ATOM 203 CB ALA A 13 -6.260 54.338 -4.182 1.00 0.00 C ATOM 0 H ALA A 13 -4.880 54.700 -2.175 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.201 54.286 -4.840 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.671 54.241 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.209 53.355 -3.715 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.902 54.989 -3.589 1.00 0.00 H new ATOM 209 N LEU A 14 -5.253 57.340 -4.172 1.00 0.00 N ATOM 210 CA LEU A 14 -5.363 58.680 -4.721 1.00 0.00 C ATOM 211 C LEU A 14 -4.016 59.150 -5.265 1.00 0.00 C ATOM 212 O LEU A 14 -3.947 59.745 -6.341 1.00 0.00 O ATOM 213 CB LEU A 14 -5.842 59.649 -3.635 1.00 0.00 C ATOM 214 CG LEU A 14 -6.015 61.048 -4.232 1.00 0.00 C ATOM 215 CD1 LEU A 14 -7.195 61.045 -5.212 1.00 0.00 C ATOM 216 CD2 LEU A 14 -6.284 62.051 -3.110 1.00 0.00 C ATOM 0 H LEU A 14 -5.445 57.271 -3.173 1.00 0.00 H new ATOM 0 HA LEU A 14 -6.085 58.660 -5.538 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -6.787 59.303 -3.216 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -5.122 59.679 -2.817 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.106 61.332 -4.762 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.318 62.041 -5.637 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -7.002 60.331 -6.012 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.105 60.761 -4.684 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.407 63.047 -3.534 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -7.193 61.768 -2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -5.444 62.054 -2.415 1.00 0.00 H new ATOM 228 N GLN A 15 -2.957 58.888 -4.512 1.00 0.00 N ATOM 229 CA GLN A 15 -1.623 59.299 -4.925 1.00 0.00 C ATOM 230 C GLN A 15 -1.171 58.514 -6.148 1.00 0.00 C ATOM 231 O GLN A 15 -0.546 59.062 -7.058 1.00 0.00 O ATOM 232 CB GLN A 15 -0.629 59.076 -3.780 1.00 0.00 C ATOM 233 CG GLN A 15 0.768 59.519 -4.219 1.00 0.00 C ATOM 234 CD GLN A 15 1.730 59.460 -3.036 1.00 0.00 C ATOM 235 OE1 GLN A 15 1.296 59.389 -1.885 1.00 0.00 O ATOM 236 NE2 GLN A 15 3.016 59.487 -3.251 1.00 0.00 N ATOM 0 H GLN A 15 -2.994 58.397 -3.619 1.00 0.00 H new ATOM 0 HA GLN A 15 -1.656 60.358 -5.180 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -0.940 59.639 -2.900 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -0.615 58.024 -3.497 1.00 0.00 H new ATOM 0 HG2 GLN A 15 1.127 58.876 -5.022 1.00 0.00 H new ATOM 0 HG3 GLN A 15 0.729 60.533 -4.616 1.00 0.00 H new ATOM 0 HE21 GLN A 15 3.372 59.546 -4.205 1.00 0.00 H new ATOM 0 HE22 GLN A 15 3.665 59.449 -2.465 1.00 0.00 H new ATOM 245 N HIS A 16 -1.483 57.223 -6.166 1.00 0.00 N ATOM 246 CA HIS A 16 -1.096 56.366 -7.281 1.00 0.00 C ATOM 247 C HIS A 16 -2.202 56.304 -8.324 1.00 0.00 C ATOM 248 O HIS A 16 -2.048 55.664 -9.366 1.00 0.00 O ATOM 249 CB HIS A 16 -0.793 54.952 -6.769 1.00 0.00 C ATOM 250 CG HIS A 16 0.536 54.947 -6.060 1.00 0.00 C ATOM 251 ND1 HIS A 16 0.703 55.497 -4.800 1.00 0.00 N ATOM 252 CD2 HIS A 16 1.768 54.462 -6.424 1.00 0.00 C ATOM 253 CE1 HIS A 16 1.992 55.332 -4.454 1.00 0.00 C ATOM 254 NE2 HIS A 16 2.686 54.706 -5.408 1.00 0.00 N ATOM 0 H HIS A 16 -2.000 56.749 -5.426 1.00 0.00 H new ATOM 0 HA HIS A 16 -0.204 56.787 -7.744 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -1.580 54.623 -6.090 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -0.775 54.249 -7.601 1.00 0.00 H new ATOM 0 HD2 HIS A 16 1.990 53.966 -7.357 1.00 0.00 H new ATOM 0 HE1 HIS A 16 2.415 55.665 -3.518 1.00 0.00 H new ATOM 0 HE2 HIS A 16 3.676 54.460 -5.394 1.00 0.00 H new ATOM 262 N ASN A 17 -3.314 56.971 -8.040 1.00 0.00 N ATOM 263 CA ASN A 17 -4.444 56.982 -8.964 1.00 0.00 C ATOM 264 C ASN A 17 -4.870 55.558 -9.296 1.00 0.00 C ATOM 265 O ASN A 17 -4.732 55.110 -10.435 1.00 0.00 O ATOM 266 CB ASN A 17 -4.066 57.716 -10.248 1.00 0.00 C ATOM 267 CG ASN A 17 -3.912 59.208 -9.966 1.00 0.00 C ATOM 268 OD1 ASN A 17 -4.403 59.704 -8.954 1.00 0.00 O ATOM 269 ND2 ASN A 17 -3.254 59.956 -10.808 1.00 0.00 N ATOM 0 H ASN A 17 -3.458 57.508 -7.185 1.00 0.00 H new ATOM 0 HA ASN A 17 -5.276 57.500 -8.486 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -3.134 57.314 -10.646 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -4.832 57.557 -11.007 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.146 60.954 -10.627 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -2.847 59.543 -11.647 1.00 0.00 H new ATOM 276 N LEU A 18 -5.389 54.846 -8.297 1.00 0.00 N ATOM 277 CA LEU A 18 -5.828 53.466 -8.495 1.00 0.00 C ATOM 278 C LEU A 18 -7.287 53.307 -8.083 1.00 0.00 C ATOM 279 O LEU A 18 -7.777 54.015 -7.202 1.00 0.00 O ATOM 280 CB LEU A 18 -4.956 52.522 -7.674 1.00 0.00 C ATOM 281 CG LEU A 18 -3.497 52.660 -8.118 1.00 0.00 C ATOM 282 CD1 LEU A 18 -2.600 51.847 -7.182 1.00 0.00 C ATOM 283 CD2 LEU A 18 -3.345 52.139 -9.551 1.00 0.00 C ATOM 0 H LEU A 18 -5.515 55.199 -7.348 1.00 0.00 H new ATOM 0 HA LEU A 18 -5.733 53.219 -9.552 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.048 52.755 -6.613 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.292 51.493 -7.805 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.205 53.710 -8.081 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.561 51.945 -7.498 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.706 52.219 -6.163 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.893 50.798 -7.218 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.306 52.238 -9.866 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.638 51.090 -9.590 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.983 52.718 -10.218 1.00 0.00 H new ATOM 295 N GLU A 19 -7.981 52.369 -8.724 1.00 0.00 N ATOM 296 CA GLU A 19 -9.387 52.127 -8.419 1.00 0.00 C ATOM 297 C GLU A 19 -9.621 52.163 -6.912 1.00 0.00 C ATOM 298 O GLU A 19 -8.828 51.628 -6.139 1.00 0.00 O ATOM 299 CB GLU A 19 -9.813 50.767 -8.974 1.00 0.00 C ATOM 300 CG GLU A 19 -9.703 50.779 -10.500 1.00 0.00 C ATOM 301 CD GLU A 19 -10.695 51.773 -11.089 1.00 0.00 C ATOM 302 OE1 GLU A 19 -11.639 52.117 -10.396 1.00 0.00 O ATOM 303 OE2 GLU A 19 -10.497 52.181 -12.222 1.00 0.00 O1- ATOM 0 H GLU A 19 -7.595 51.769 -9.453 1.00 0.00 H new ATOM 0 HA GLU A 19 -9.983 52.911 -8.885 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.183 49.980 -8.560 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -10.837 50.545 -8.675 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -8.689 51.046 -10.797 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.898 49.782 -10.894 1.00 0.00 H new ATOM 310 N LEU A 20 -10.713 52.793 -6.509 1.00 0.00 N ATOM 311 CA LEU A 20 -11.045 52.896 -5.092 1.00 0.00 C ATOM 312 C LEU A 20 -11.079 51.515 -4.447 1.00 0.00 C ATOM 313 O LEU A 20 -11.499 50.538 -5.070 1.00 0.00 O ATOM 314 CB LEU A 20 -12.404 53.578 -4.915 1.00 0.00 C ATOM 315 CG LEU A 20 -12.477 54.808 -5.822 1.00 0.00 C ATOM 316 CD1 LEU A 20 -13.763 55.583 -5.529 1.00 0.00 C ATOM 317 CD2 LEU A 20 -11.268 55.710 -5.559 1.00 0.00 C ATOM 0 H LEU A 20 -11.382 53.239 -7.136 1.00 0.00 H new ATOM 0 HA LEU A 20 -10.276 53.495 -4.604 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -13.207 52.883 -5.161 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -12.544 53.871 -3.874 1.00 0.00 H new ATOM 0 HG LEU A 20 -12.473 54.490 -6.865 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -13.815 56.459 -6.175 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -14.625 54.942 -5.716 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -13.767 55.900 -4.486 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -11.320 56.586 -6.205 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -11.271 56.028 -4.516 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -10.351 55.159 -5.768 1.00 0.00 H new ATOM 329 N PRO A 21 -10.655 51.419 -3.216 1.00 0.00 N ATOM 330 CA PRO A 21 -10.628 50.131 -2.468 1.00 0.00 C ATOM 331 C PRO A 21 -12.030 49.641 -2.123 1.00 0.00 C ATOM 332 O PRO A 21 -12.943 50.440 -1.910 1.00 0.00 O ATOM 333 CB PRO A 21 -9.834 50.463 -1.200 1.00 0.00 C ATOM 334 CG PRO A 21 -10.012 51.930 -0.999 1.00 0.00 C ATOM 335 CD PRO A 21 -10.144 52.532 -2.391 1.00 0.00 C ATOM 0 HA PRO A 21 -10.183 49.326 -3.053 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.206 49.900 -0.344 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.781 50.207 -1.316 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.898 52.137 -0.399 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.161 52.357 -0.468 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -10.829 53.379 -2.396 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.185 52.895 -2.761 1.00 0.00 H new ATOM 343 N VAL A 22 -12.193 48.322 -2.063 1.00 0.00 N ATOM 344 CA VAL A 22 -13.490 47.733 -1.734 1.00 0.00 C ATOM 345 C VAL A 22 -13.333 46.684 -0.641 1.00 0.00 C ATOM 346 O VAL A 22 -12.433 45.845 -0.697 1.00 0.00 O ATOM 347 CB VAL A 22 -14.108 47.101 -2.977 1.00 0.00 C ATOM 348 CG1 VAL A 22 -15.361 46.315 -2.583 1.00 0.00 C ATOM 349 CG2 VAL A 22 -14.486 48.201 -3.971 1.00 0.00 C ATOM 0 H VAL A 22 -11.450 47.645 -2.236 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.149 48.522 -1.371 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.388 46.425 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.802 45.864 -3.472 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.091 45.532 -1.874 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -16.083 46.989 -2.122 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.928 47.752 -4.860 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -15.206 48.876 -3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.593 48.760 -4.252 1.00 0.00 H new ATOM 359 N TYR A 23 -14.215 46.725 0.353 1.00 0.00 N ATOM 360 CA TYR A 23 -14.164 45.776 1.451 1.00 0.00 C ATOM 361 C TYR A 23 -15.341 44.820 1.400 1.00 0.00 C ATOM 362 O TYR A 23 -16.398 45.147 0.858 1.00 0.00 O ATOM 363 CB TYR A 23 -14.184 46.531 2.786 1.00 0.00 C ATOM 364 CG TYR A 23 -12.869 47.254 2.981 1.00 0.00 C ATOM 365 CD1 TYR A 23 -12.570 48.375 2.201 1.00 0.00 C ATOM 366 CD2 TYR A 23 -11.953 46.798 3.934 1.00 0.00 C ATOM 367 CE1 TYR A 23 -11.353 49.044 2.378 1.00 0.00 C ATOM 368 CE2 TYR A 23 -10.737 47.464 4.113 1.00 0.00 C ATOM 369 CZ TYR A 23 -10.435 48.589 3.333 1.00 0.00 C ATOM 370 OH TYR A 23 -9.235 49.248 3.508 1.00 0.00 O ATOM 0 H TYR A 23 -14.972 47.406 0.417 1.00 0.00 H new ATOM 0 HA TYR A 23 -13.243 45.200 1.361 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -15.008 47.244 2.799 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -14.352 45.834 3.607 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -13.277 48.724 1.463 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -12.185 45.930 4.533 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.122 49.912 1.778 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.031 47.112 4.851 1.00 0.00 H new ATOM 0 HH TYR A 23 -9.185 50.006 2.889 1.00 0.00 H new ATOM 380 N ALA A 24 -15.162 43.628 1.970 1.00 0.00 N ATOM 381 CA ALA A 24 -16.239 42.628 2.011 1.00 0.00 C ATOM 382 C ALA A 24 -16.466 42.197 3.462 1.00 0.00 C ATOM 383 O ALA A 24 -15.562 41.691 4.109 1.00 0.00 O ATOM 384 CB ALA A 24 -15.896 41.418 1.140 1.00 0.00 C ATOM 0 H ALA A 24 -14.290 43.329 2.407 1.00 0.00 H new ATOM 0 HA ALA A 24 -17.152 43.071 1.615 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -16.709 40.693 1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -15.757 41.740 0.108 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.977 40.957 1.503 1.00 0.00 H new ATOM 390 N ASN A 25 -17.690 42.391 3.960 1.00 0.00 N ATOM 391 CA ASN A 25 -18.003 42.038 5.336 1.00 0.00 C ATOM 392 C ASN A 25 -18.879 40.814 5.410 1.00 0.00 C ATOM 393 O ASN A 25 -19.817 40.654 4.633 1.00 0.00 O ATOM 394 CB ASN A 25 -18.737 43.228 6.000 1.00 0.00 C ATOM 395 CG ASN A 25 -19.884 43.699 5.111 1.00 0.00 C ATOM 396 OD1 ASN A 25 -20.746 42.906 4.738 1.00 0.00 O ATOM 397 ND2 ASN A 25 -19.941 44.950 4.743 1.00 0.00 N ATOM 0 H ASN A 25 -18.469 42.786 3.433 1.00 0.00 H new ATOM 0 HA ASN A 25 -17.070 41.817 5.855 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -19.122 42.930 6.975 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -18.038 44.047 6.170 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -20.702 45.271 4.145 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -19.225 45.606 5.054 1.00 0.00 H new ATOM 404 N GLU A 26 -18.561 39.927 6.358 1.00 0.00 N ATOM 405 CA GLU A 26 -19.336 38.701 6.530 1.00 0.00 C ATOM 406 C GLU A 26 -19.550 38.426 8.015 1.00 0.00 C ATOM 407 O GLU A 26 -18.653 38.637 8.835 1.00 0.00 O ATOM 408 CB GLU A 26 -18.623 37.527 5.883 1.00 0.00 C ATOM 409 CG GLU A 26 -18.488 37.779 4.380 1.00 0.00 C ATOM 410 CD GLU A 26 -19.867 37.822 3.731 1.00 0.00 C ATOM 411 OE1 GLU A 26 -20.799 37.309 4.331 1.00 0.00 O ATOM 412 OE2 GLU A 26 -19.973 38.369 2.646 1.00 0.00 O1- ATOM 0 H GLU A 26 -17.783 40.035 7.008 1.00 0.00 H new ATOM 0 HA GLU A 26 -20.304 38.830 6.046 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -17.638 37.394 6.330 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -19.180 36.607 6.060 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -17.966 38.720 4.206 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -17.887 36.992 3.924 1.00 0.00 H new ATOM 419 N ARG A 27 -20.742 37.946 8.364 1.00 0.00 N ATOM 420 CA ARG A 27 -21.060 37.639 9.753 1.00 0.00 C ATOM 421 C ARG A 27 -21.718 36.271 9.867 1.00 0.00 C ATOM 422 O ARG A 27 -22.772 36.028 9.278 1.00 0.00 O ATOM 423 CB ARG A 27 -21.999 38.715 10.318 1.00 0.00 C ATOM 424 CG ARG A 27 -22.495 38.291 11.703 1.00 0.00 C ATOM 425 CD ARG A 27 -23.358 39.399 12.299 1.00 0.00 C ATOM 426 NE ARG A 27 -24.024 38.924 13.508 1.00 0.00 N ATOM 427 CZ ARG A 27 -23.406 38.926 14.683 1.00 0.00 C ATOM 428 NH1 ARG A 27 -22.179 39.361 14.771 1.00 0.00 N ATOM 429 NH2 ARG A 27 -24.024 38.497 15.747 1.00 0.00 N1+ ATOM 0 H ARG A 27 -21.499 37.763 7.706 1.00 0.00 H new ATOM 0 HA ARG A 27 -20.133 37.625 10.326 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -21.476 39.669 10.385 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -22.845 38.862 9.647 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -23.071 37.369 11.627 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -21.647 38.085 12.357 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -22.740 40.266 12.532 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -24.100 39.724 11.570 1.00 0.00 H new ATOM 0 HE ARG A 27 -24.984 38.584 13.449 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -21.697 39.699 13.938 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -21.702 39.363 15.673 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -24.984 38.159 15.678 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -23.548 38.499 16.649 1.00 0.00 H new ATOM 443 N GLU A 28 -21.099 35.393 10.640 1.00 0.00 N ATOM 444 CA GLU A 28 -21.643 34.053 10.833 1.00 0.00 C ATOM 445 C GLU A 28 -21.045 33.399 12.074 1.00 0.00 C ATOM 446 O GLU A 28 -19.828 33.385 12.261 1.00 0.00 O ATOM 447 CB GLU A 28 -21.328 33.181 9.609 1.00 0.00 C ATOM 448 CG GLU A 28 -22.158 31.895 9.666 1.00 0.00 C ATOM 449 CD GLU A 28 -23.628 32.214 9.409 1.00 0.00 C ATOM 450 OE1 GLU A 28 -23.915 33.346 9.055 1.00 0.00 O ATOM 451 OE2 GLU A 28 -24.444 31.323 9.572 1.00 0.00 O1- ATOM 0 H GLU A 28 -20.229 35.578 11.140 1.00 0.00 H new ATOM 0 HA GLU A 28 -22.722 34.140 10.962 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -21.550 33.729 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -20.265 32.939 9.586 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -21.796 31.185 8.923 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -22.045 31.422 10.641 1.00 0.00 H new ATOM 458 N GLY A 29 -21.910 32.868 12.932 1.00 0.00 N ATOM 459 CA GLY A 29 -21.454 32.218 14.154 1.00 0.00 C ATOM 460 C GLY A 29 -22.485 32.361 15.270 1.00 0.00 C ATOM 461 O GLY A 29 -23.125 33.405 15.404 1.00 0.00 O ATOM 0 H GLY A 29 -22.922 32.875 12.805 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -21.268 31.162 13.960 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -20.507 32.656 14.471 1.00 0.00 H new ATOM 465 N PRO A 30 -22.655 31.337 16.065 1.00 0.00 N ATOM 466 CA PRO A 30 -23.611 31.355 17.200 1.00 0.00 C ATOM 467 C PRO A 30 -23.567 32.667 17.979 1.00 0.00 C ATOM 468 O PRO A 30 -22.622 33.447 17.844 1.00 0.00 O ATOM 469 CB PRO A 30 -23.152 30.187 18.079 1.00 0.00 C ATOM 470 CG PRO A 30 -22.437 29.246 17.160 1.00 0.00 C ATOM 471 CD PRO A 30 -21.943 30.053 15.971 1.00 0.00 C ATOM 0 HA PRO A 30 -24.643 31.265 16.861 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -22.493 30.532 18.876 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -24.002 29.699 18.556 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -21.602 28.770 17.673 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -23.105 28.450 16.832 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -20.863 30.196 16.011 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -22.163 29.547 15.031 1.00 0.00 H new ATOM 479 N PRO A 31 -24.566 32.919 18.779 1.00 0.00 N ATOM 480 CA PRO A 31 -24.647 34.166 19.595 1.00 0.00 C ATOM 481 C PRO A 31 -23.397 34.383 20.439 1.00 0.00 C ATOM 482 O PRO A 31 -22.777 35.443 20.388 1.00 0.00 O ATOM 483 CB PRO A 31 -25.876 33.939 20.488 1.00 0.00 C ATOM 484 CG PRO A 31 -26.696 32.901 19.793 1.00 0.00 C ATOM 485 CD PRO A 31 -25.726 32.042 18.993 1.00 0.00 C ATOM 0 HA PRO A 31 -24.726 35.057 18.972 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -25.581 33.603 21.482 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -26.441 34.862 20.618 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -27.246 32.295 20.514 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -27.433 33.365 19.138 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -25.449 31.140 19.538 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -26.163 31.721 18.048 1.00 0.00 H new ATOM 493 N HIS A 32 -23.035 33.371 21.221 1.00 0.00 N ATOM 494 CA HIS A 32 -21.860 33.466 22.081 1.00 0.00 C ATOM 495 C HIS A 32 -20.602 33.076 21.316 1.00 0.00 C ATOM 496 O HIS A 32 -19.511 33.025 21.881 1.00 0.00 O ATOM 497 CB HIS A 32 -22.023 32.540 23.292 1.00 0.00 C ATOM 498 CG HIS A 32 -23.109 33.069 24.187 1.00 0.00 C ATOM 499 ND1 HIS A 32 -24.452 32.864 23.921 1.00 0.00 N ATOM 500 CD2 HIS A 32 -23.064 33.798 25.352 1.00 0.00 C ATOM 501 CE1 HIS A 32 -25.157 33.457 24.902 1.00 0.00 C ATOM 502 NE2 HIS A 32 -24.359 34.042 25.800 1.00 0.00 N ATOM 0 H HIS A 32 -23.533 32.483 21.277 1.00 0.00 H new ATOM 0 HA HIS A 32 -21.764 34.498 22.418 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -22.270 31.531 22.961 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -21.084 32.474 23.842 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -22.162 34.130 25.844 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -26.236 33.460 24.957 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -24.639 34.557 26.635 1.00 0.00 H new ATOM 510 N ALA A 33 -20.761 32.817 20.013 1.00 0.00 N ATOM 511 CA ALA A 33 -19.630 32.455 19.176 1.00 0.00 C ATOM 512 C ALA A 33 -19.728 33.139 17.817 1.00 0.00 C ATOM 513 O ALA A 33 -19.797 32.469 16.783 1.00 0.00 O ATOM 514 CB ALA A 33 -19.589 30.941 18.995 1.00 0.00 C ATOM 0 H ALA A 33 -21.657 32.853 19.526 1.00 0.00 H new ATOM 0 HA ALA A 33 -18.713 32.786 19.664 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -18.740 30.673 18.367 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -19.487 30.461 19.968 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -20.511 30.606 18.521 1.00 0.00 H new ATOM 520 N PRO A 34 -19.731 34.441 17.798 1.00 0.00 N ATOM 521 CA PRO A 34 -19.793 35.229 16.539 1.00 0.00 C ATOM 522 C PRO A 34 -18.432 35.363 15.871 1.00 0.00 C ATOM 523 O PRO A 34 -17.408 35.488 16.547 1.00 0.00 O ATOM 524 CB PRO A 34 -20.318 36.593 16.997 1.00 0.00 C ATOM 525 CG PRO A 34 -19.842 36.736 18.413 1.00 0.00 C ATOM 526 CD PRO A 34 -19.672 35.319 18.981 1.00 0.00 C ATOM 0 HA PRO A 34 -20.423 34.753 15.788 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -19.933 37.396 16.368 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -21.406 36.637 16.940 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -18.898 37.280 18.448 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -20.560 37.304 19.005 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.724 35.213 19.508 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -20.461 35.079 19.694 1.00 0.00 H new ATOM 534 N ARG A 35 -18.422 35.348 14.539 1.00 0.00 N ATOM 535 CA ARG A 35 -17.179 35.490 13.795 1.00 0.00 C ATOM 536 C ARG A 35 -17.342 36.520 12.688 1.00 0.00 C ATOM 537 O ARG A 35 -18.309 36.476 11.916 1.00 0.00 O ATOM 538 CB ARG A 35 -16.772 34.146 13.193 1.00 0.00 C ATOM 539 CG ARG A 35 -16.432 33.167 14.318 1.00 0.00 C ATOM 540 CD ARG A 35 -16.039 31.817 13.718 1.00 0.00 C ATOM 541 NE ARG A 35 -15.716 30.869 14.779 1.00 0.00 N ATOM 542 CZ ARG A 35 -16.662 30.136 15.358 1.00 0.00 C ATOM 543 NH1 ARG A 35 -17.906 30.260 14.977 1.00 0.00 N ATOM 544 NH2 ARG A 35 -16.351 29.295 16.304 1.00 0.00 N1+ ATOM 0 H ARG A 35 -19.255 35.240 13.960 1.00 0.00 H new ATOM 0 HA ARG A 35 -16.400 35.826 14.480 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -17.583 33.748 12.583 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -15.912 34.275 12.536 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -15.614 33.560 14.922 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -17.289 33.047 14.981 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -16.856 31.429 13.110 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -15.181 31.940 13.057 1.00 0.00 H new ATOM 0 HE ARG A 35 -14.747 30.767 15.082 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -18.149 30.918 14.237 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -18.633 29.699 15.420 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -15.380 29.198 16.601 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -17.078 28.734 16.747 1.00 0.00 H new ATOM 558 N PHE A 36 -16.388 37.444 12.596 1.00 0.00 N ATOM 559 CA PHE A 36 -16.440 38.455 11.558 1.00 0.00 C ATOM 560 C PHE A 36 -15.312 38.298 10.554 1.00 0.00 C ATOM 561 O PHE A 36 -14.168 38.642 10.812 1.00 0.00 O ATOM 562 CB PHE A 36 -16.318 39.857 12.198 1.00 0.00 C ATOM 563 CG PHE A 36 -17.447 40.058 13.181 1.00 0.00 C ATOM 564 CD1 PHE A 36 -18.686 40.530 12.732 1.00 0.00 C ATOM 565 CD2 PHE A 36 -17.256 39.767 14.535 1.00 0.00 C ATOM 566 CE1 PHE A 36 -19.735 40.713 13.642 1.00 0.00 C ATOM 567 CE2 PHE A 36 -18.304 39.949 15.442 1.00 0.00 C ATOM 568 CZ PHE A 36 -19.545 40.424 14.999 1.00 0.00 C ATOM 0 H PHE A 36 -15.584 37.509 13.220 1.00 0.00 H new ATOM 0 HA PHE A 36 -17.391 38.337 11.038 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -15.358 39.956 12.704 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -16.352 40.626 11.426 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -18.833 40.753 11.685 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -16.300 39.402 14.880 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -20.691 41.077 13.297 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -18.156 39.723 16.488 1.00 0.00 H new ATOM 0 HZ PHE A 36 -20.353 40.567 15.702 1.00 0.00 H new ATOM 578 N ARG A 37 -15.643 37.734 9.393 1.00 0.00 N ATOM 579 CA ARG A 37 -14.644 37.526 8.344 1.00 0.00 C ATOM 580 C ARG A 37 -14.785 38.607 7.285 1.00 0.00 C ATOM 581 O ARG A 37 -15.702 38.589 6.464 1.00 0.00 O ATOM 582 CB ARG A 37 -14.836 36.149 7.688 1.00 0.00 C ATOM 583 CG ARG A 37 -14.474 35.054 8.691 1.00 0.00 C ATOM 584 CD ARG A 37 -14.726 33.685 8.064 1.00 0.00 C ATOM 585 NE ARG A 37 -14.453 32.628 9.032 1.00 0.00 N ATOM 586 CZ ARG A 37 -14.544 31.346 8.693 1.00 0.00 C ATOM 587 NH1 ARG A 37 -14.880 31.013 7.476 1.00 0.00 N ATOM 588 NH2 ARG A 37 -14.296 30.419 9.578 1.00 0.00 N1+ ATOM 0 H ARG A 37 -16.583 37.416 9.156 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.652 37.573 8.792 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.869 36.031 7.361 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.209 36.066 6.800 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -13.428 35.145 8.983 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -15.069 35.166 9.598 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.759 33.618 7.723 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.092 33.557 7.187 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.188 32.877 9.985 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.073 31.737 6.784 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.949 30.029 7.217 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.033 30.679 10.529 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.366 29.435 9.319 1.00 0.00 H new ATOM 602 N CYS A 38 -13.864 39.572 7.306 1.00 0.00 N ATOM 603 CA CYS A 38 -13.893 40.671 6.350 1.00 0.00 C ATOM 604 C CYS A 38 -12.657 40.651 5.470 1.00 0.00 C ATOM 605 O CYS A 38 -11.536 40.513 5.962 1.00 0.00 O ATOM 606 CB CYS A 38 -13.972 42.011 7.094 1.00 0.00 C ATOM 607 SG CYS A 38 -14.512 43.307 5.953 1.00 0.00 S ATOM 0 H CYS A 38 -13.093 39.612 7.973 1.00 0.00 H new ATOM 0 HA CYS A 38 -14.774 40.552 5.719 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -14.668 41.934 7.929 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -12.998 42.264 7.513 1.00 0.00 H new ATOM 0 HG CYS A 38 -14.603 42.818 4.752 1.00 0.00 H new ATOM 613 N ASN A 39 -12.862 40.792 4.161 1.00 0.00 N ATOM 614 CA ASN A 39 -11.751 40.795 3.216 1.00 0.00 C ATOM 615 C ASN A 39 -11.609 42.166 2.574 1.00 0.00 C ATOM 616 O ASN A 39 -12.555 42.960 2.552 1.00 0.00 O ATOM 617 CB ASN A 39 -11.976 39.741 2.137 1.00 0.00 C ATOM 618 CG ASN A 39 -12.008 38.353 2.765 1.00 0.00 C ATOM 619 OD1 ASN A 39 -11.529 38.179 3.967 1.00 0.00 O flip ATOM 620 ND2 ASN A 39 -12.485 37.402 2.146 1.00 0.00 N flip ATOM 0 H ASN A 39 -13.782 40.905 3.735 1.00 0.00 H new ATOM 0 HA ASN A 39 -10.834 40.561 3.757 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -12.914 39.936 1.616 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -11.181 39.795 1.393 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -12.859 37.540 1.207 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -12.507 36.475 2.572 1.00 0.00 H new ATOM 627 N VAL A 40 -10.423 42.446 2.039 1.00 0.00 N ATOM 628 CA VAL A 40 -10.173 43.734 1.387 1.00 0.00 C ATOM 629 C VAL A 40 -9.673 43.512 -0.040 1.00 0.00 C ATOM 630 O VAL A 40 -8.643 42.881 -0.257 1.00 0.00 O ATOM 631 CB VAL A 40 -9.129 44.523 2.176 1.00 0.00 C ATOM 632 CG1 VAL A 40 -7.874 43.668 2.372 1.00 0.00 C ATOM 633 CG2 VAL A 40 -8.766 45.798 1.411 1.00 0.00 C ATOM 0 H VAL A 40 -9.627 41.808 2.042 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.105 44.298 1.356 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.539 44.788 3.151 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.132 44.234 2.935 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.133 42.763 2.921 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.463 43.397 1.400 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.021 46.361 1.974 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.359 45.533 0.435 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.659 46.409 1.278 1.00 0.00 H new ATOM 643 N THR A 41 -10.410 44.052 -1.012 1.00 0.00 N ATOM 644 CA THR A 41 -10.033 43.907 -2.411 1.00 0.00 C ATOM 645 C THR A 41 -9.266 45.128 -2.892 1.00 0.00 C ATOM 646 O THR A 41 -9.760 46.255 -2.818 1.00 0.00 O ATOM 647 CB THR A 41 -11.290 43.720 -3.267 1.00 0.00 C ATOM 648 OG1 THR A 41 -11.990 42.561 -2.832 1.00 0.00 O ATOM 649 CG2 THR A 41 -10.889 43.556 -4.734 1.00 0.00 C ATOM 0 H THR A 41 -11.263 44.588 -0.854 1.00 0.00 H new ATOM 0 HA THR A 41 -9.389 43.033 -2.507 1.00 0.00 H new ATOM 0 HB THR A 41 -11.934 44.593 -3.164 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.795 42.441 -3.378 1.00 0.00 H new ATOM 0 HG21 THR A 41 -11.783 43.423 -5.343 1.00 0.00 H new ATOM 0 HG22 THR A 41 -10.353 44.445 -5.066 1.00 0.00 H new ATOM 0 HG23 THR A 41 -10.245 42.683 -4.840 1.00 0.00 H new ATOM 657 N PHE A 42 -8.050 44.902 -3.387 1.00 0.00 N ATOM 658 CA PHE A 42 -7.227 45.997 -3.882 1.00 0.00 C ATOM 659 C PHE A 42 -6.387 45.540 -5.075 1.00 0.00 C ATOM 660 O PHE A 42 -5.716 44.510 -5.012 1.00 0.00 O ATOM 661 CB PHE A 42 -6.304 46.499 -2.766 1.00 0.00 C ATOM 662 CG PHE A 42 -5.998 47.965 -2.980 1.00 0.00 C ATOM 663 CD1 PHE A 42 -7.041 48.902 -2.944 1.00 0.00 C ATOM 664 CD2 PHE A 42 -4.689 48.387 -3.212 1.00 0.00 C ATOM 665 CE1 PHE A 42 -6.769 50.258 -3.143 1.00 0.00 C ATOM 666 CE2 PHE A 42 -4.415 49.744 -3.410 1.00 0.00 C ATOM 667 CZ PHE A 42 -5.454 50.679 -3.374 1.00 0.00 C ATOM 0 H PHE A 42 -7.619 43.980 -3.454 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.883 46.806 -4.204 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.779 46.354 -1.795 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -5.379 45.922 -2.758 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.054 48.575 -2.762 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.886 47.665 -3.239 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.572 50.980 -3.119 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.401 50.070 -3.591 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.242 51.727 -3.525 1.00 0.00 H new ATOM 677 N CYS A 43 -6.423 46.314 -6.149 1.00 0.00 N ATOM 678 CA CYS A 43 -5.656 45.981 -7.340 1.00 0.00 C ATOM 679 C CYS A 43 -5.938 44.550 -7.782 1.00 0.00 C ATOM 680 O CYS A 43 -5.051 43.855 -8.278 1.00 0.00 O ATOM 681 CB CYS A 43 -4.160 46.150 -7.067 1.00 0.00 C ATOM 682 SG CYS A 43 -3.224 45.800 -8.576 1.00 0.00 S ATOM 0 H CYS A 43 -6.971 47.171 -6.221 1.00 0.00 H new ATOM 0 HA CYS A 43 -5.956 46.659 -8.139 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -3.955 47.165 -6.727 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -3.847 45.477 -6.269 1.00 0.00 H new ATOM 0 HG CYS A 43 -3.657 44.697 -9.109 1.00 0.00 H new ATOM 688 N GLY A 44 -7.180 44.114 -7.601 1.00 0.00 N ATOM 689 CA GLY A 44 -7.568 42.766 -7.996 1.00 0.00 C ATOM 690 C GLY A 44 -6.955 41.726 -7.077 1.00 0.00 C ATOM 691 O GLY A 44 -6.625 40.617 -7.506 1.00 0.00 O ATOM 0 H GLY A 44 -7.929 44.669 -7.187 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.654 42.677 -7.976 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.251 42.580 -9.022 1.00 0.00 H new ATOM 695 N GLN A 45 -6.790 42.084 -5.806 1.00 0.00 N ATOM 696 CA GLN A 45 -6.207 41.168 -4.831 1.00 0.00 C ATOM 697 C GLN A 45 -6.967 41.242 -3.516 1.00 0.00 C ATOM 698 O GLN A 45 -7.196 42.328 -2.977 1.00 0.00 O ATOM 699 CB GLN A 45 -4.739 41.515 -4.597 1.00 0.00 C ATOM 700 CG GLN A 45 -3.948 41.284 -5.886 1.00 0.00 C ATOM 701 CD GLN A 45 -2.483 41.647 -5.671 1.00 0.00 C ATOM 702 OE1 GLN A 45 -2.170 42.785 -5.321 1.00 0.00 O ATOM 703 NE2 GLN A 45 -1.563 40.743 -5.859 1.00 0.00 N ATOM 0 H GLN A 45 -7.050 42.996 -5.430 1.00 0.00 H new ATOM 0 HA GLN A 45 -6.277 40.154 -5.224 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.646 42.554 -4.282 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.333 40.901 -3.793 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -4.032 40.241 -6.192 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.366 41.887 -6.692 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.825 39.801 -6.149 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.581 40.978 -5.716 1.00 0.00 H new ATOM 712 N THR A 46 -7.361 40.082 -2.993 1.00 0.00 N ATOM 713 CA THR A 46 -8.098 40.033 -1.737 1.00 0.00 C ATOM 714 C THR A 46 -7.217 39.513 -0.611 1.00 0.00 C ATOM 715 O THR A 46 -6.888 38.329 -0.557 1.00 0.00 O ATOM 716 CB THR A 46 -9.319 39.116 -1.889 1.00 0.00 C ATOM 717 OG1 THR A 46 -8.896 37.834 -2.329 1.00 0.00 O ATOM 718 CG2 THR A 46 -10.286 39.715 -2.911 1.00 0.00 C ATOM 0 H THR A 46 -7.183 39.172 -3.417 1.00 0.00 H new ATOM 0 HA THR A 46 -8.421 41.044 -1.490 1.00 0.00 H new ATOM 0 HB THR A 46 -9.823 39.022 -0.927 1.00 0.00 H new ATOM 0 HG1 THR A 46 -8.124 37.544 -1.799 1.00 0.00 H new ATOM 0 HG21 THR A 46 -11.153 39.063 -3.018 1.00 0.00 H new ATOM 0 HG22 THR A 46 -10.612 40.698 -2.571 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.784 39.812 -3.874 1.00 0.00 H new ATOM 726 N PHE A 47 -6.830 40.413 0.292 1.00 0.00 N ATOM 727 CA PHE A 47 -5.984 40.036 1.422 1.00 0.00 C ATOM 728 C PHE A 47 -6.842 39.688 2.633 1.00 0.00 C ATOM 729 O PHE A 47 -7.857 40.343 2.900 1.00 0.00 O ATOM 730 CB PHE A 47 -5.041 41.185 1.776 1.00 0.00 C ATOM 731 CG PHE A 47 -3.944 41.273 0.741 1.00 0.00 C ATOM 732 CD1 PHE A 47 -4.200 41.868 -0.499 1.00 0.00 C ATOM 733 CD2 PHE A 47 -2.672 40.759 1.025 1.00 0.00 C ATOM 734 CE1 PHE A 47 -3.183 41.950 -1.457 1.00 0.00 C ATOM 735 CE2 PHE A 47 -1.656 40.843 0.066 1.00 0.00 C ATOM 736 CZ PHE A 47 -1.911 41.438 -1.175 1.00 0.00 C ATOM 0 H PHE A 47 -7.086 41.400 0.264 1.00 0.00 H new ATOM 0 HA PHE A 47 -5.397 39.162 1.139 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.593 42.124 1.817 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -4.611 41.025 2.765 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.181 42.264 -0.717 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.476 40.299 1.982 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -3.380 42.409 -2.415 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -0.675 40.448 0.284 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.127 41.502 -1.915 1.00 0.00 H new ATOM 746 N GLN A 48 -6.439 38.651 3.361 1.00 0.00 N ATOM 747 CA GLN A 48 -7.182 38.216 4.538 1.00 0.00 C ATOM 748 C GLN A 48 -6.268 37.482 5.507 1.00 0.00 C ATOM 749 O GLN A 48 -5.187 37.022 5.131 1.00 0.00 O ATOM 750 CB GLN A 48 -8.335 37.304 4.122 1.00 0.00 C ATOM 751 CG GLN A 48 -7.778 36.076 3.400 1.00 0.00 C ATOM 752 CD GLN A 48 -8.922 35.183 2.935 1.00 0.00 C ATOM 753 OE1 GLN A 48 -10.015 35.223 3.503 1.00 0.00 O ATOM 754 NE2 GLN A 48 -8.737 34.370 1.931 1.00 0.00 N ATOM 0 H GLN A 48 -5.606 38.099 3.158 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.584 39.098 5.037 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.904 36.996 4.999 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.022 37.843 3.469 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -7.178 36.387 2.545 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -7.119 35.520 4.066 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.832 34.337 1.461 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -9.497 33.767 1.616 1.00 0.00 H new ATOM 763 N SER A 49 -6.704 37.366 6.756 1.00 0.00 N ATOM 764 CA SER A 49 -5.913 36.680 7.772 1.00 0.00 C ATOM 765 C SER A 49 -6.381 35.241 7.940 1.00 0.00 C ATOM 766 O SER A 49 -7.458 34.869 7.472 1.00 0.00 O ATOM 767 CB SER A 49 -6.035 37.414 9.109 1.00 0.00 C ATOM 768 OG SER A 49 -5.376 36.663 10.121 1.00 0.00 O ATOM 0 H SER A 49 -7.595 37.735 7.089 1.00 0.00 H new ATOM 0 HA SER A 49 -4.872 36.675 7.450 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.594 38.408 9.033 1.00 0.00 H new ATOM 0 HB3 SER A 49 -7.085 37.550 9.367 1.00 0.00 H new ATOM 0 HG SER A 49 -5.451 37.132 10.978 1.00 0.00 H new ATOM 774 N SER A 50 -5.566 34.432 8.611 1.00 0.00 N ATOM 775 CA SER A 50 -5.908 33.031 8.838 1.00 0.00 C ATOM 776 C SER A 50 -6.677 32.881 10.147 1.00 0.00 C ATOM 777 O SER A 50 -7.079 31.777 10.518 1.00 0.00 O ATOM 778 CB SER A 50 -4.643 32.181 8.888 1.00 0.00 C ATOM 779 OG SER A 50 -3.920 32.481 10.074 1.00 0.00 O ATOM 0 H SER A 50 -4.670 34.720 9.005 1.00 0.00 H new ATOM 0 HA SER A 50 -6.535 32.690 8.014 1.00 0.00 H new ATOM 0 HB2 SER A 50 -4.902 31.122 8.864 1.00 0.00 H new ATOM 0 HB3 SER A 50 -4.025 32.378 8.012 1.00 0.00 H new ATOM 0 HG SER A 50 -3.107 31.934 10.109 1.00 0.00 H new ATOM 785 N GLU A 51 -6.876 33.998 10.851 1.00 0.00 N ATOM 786 CA GLU A 51 -7.600 33.974 12.117 1.00 0.00 C ATOM 787 C GLU A 51 -8.766 34.959 12.083 1.00 0.00 C ATOM 788 O GLU A 51 -8.619 36.095 11.631 1.00 0.00 O ATOM 789 CB GLU A 51 -6.658 34.339 13.262 1.00 0.00 C ATOM 790 CG GLU A 51 -5.608 33.240 13.429 1.00 0.00 C ATOM 791 CD GLU A 51 -4.605 33.637 14.506 1.00 0.00 C ATOM 792 OE1 GLU A 51 -4.779 34.695 15.089 1.00 0.00 O ATOM 793 OE2 GLU A 51 -3.676 32.878 14.732 1.00 0.00 O1- ATOM 0 H GLU A 51 -6.548 34.921 10.566 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.990 32.968 12.274 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.172 35.293 13.057 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.222 34.461 14.187 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.092 32.301 13.699 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -5.092 33.072 12.484 1.00 0.00 H new ATOM 800 N PHE A 52 -9.923 34.515 12.555 1.00 0.00 N ATOM 801 CA PHE A 52 -11.111 35.361 12.569 1.00 0.00 C ATOM 802 C PHE A 52 -11.085 36.290 13.776 1.00 0.00 C ATOM 803 O PHE A 52 -10.527 35.954 14.820 1.00 0.00 O ATOM 804 CB PHE A 52 -12.375 34.493 12.619 1.00 0.00 C ATOM 805 CG PHE A 52 -12.007 33.048 12.367 1.00 0.00 C ATOM 806 CD1 PHE A 52 -11.559 32.255 13.426 1.00 0.00 C ATOM 807 CD2 PHE A 52 -12.111 32.513 11.081 1.00 0.00 C ATOM 808 CE1 PHE A 52 -11.214 30.914 13.200 1.00 0.00 C ATOM 809 CE2 PHE A 52 -11.765 31.175 10.851 1.00 0.00 C ATOM 810 CZ PHE A 52 -11.319 30.375 11.911 1.00 0.00 C ATOM 0 H PHE A 52 -10.065 33.578 12.932 1.00 0.00 H new ATOM 0 HA PHE A 52 -11.120 35.960 11.658 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -12.858 34.592 13.591 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -13.091 34.832 11.871 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -11.478 32.674 14.418 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.458 33.130 10.265 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -10.868 30.299 14.018 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -11.842 30.760 9.857 1.00 0.00 H new ATOM 0 HZ PHE A 52 -11.056 29.342 11.735 1.00 0.00 H new ATOM 820 N PHE A 53 -11.686 37.459 13.622 1.00 0.00 N ATOM 821 CA PHE A 53 -11.721 38.444 14.702 1.00 0.00 C ATOM 822 C PHE A 53 -13.081 38.445 15.392 1.00 0.00 C ATOM 823 O PHE A 53 -14.110 38.248 14.748 1.00 0.00 O ATOM 824 CB PHE A 53 -11.416 39.840 14.151 1.00 0.00 C ATOM 825 CG PHE A 53 -10.601 39.719 12.885 1.00 0.00 C ATOM 826 CD1 PHE A 53 -11.236 39.431 11.671 1.00 0.00 C ATOM 827 CD2 PHE A 53 -9.213 39.891 12.926 1.00 0.00 C ATOM 828 CE1 PHE A 53 -10.482 39.315 10.498 1.00 0.00 C ATOM 829 CE2 PHE A 53 -8.461 39.774 11.755 1.00 0.00 C ATOM 830 CZ PHE A 53 -9.092 39.488 10.538 1.00 0.00 C ATOM 0 H PHE A 53 -12.156 37.752 12.765 1.00 0.00 H new ATOM 0 HA PHE A 53 -10.962 38.173 15.436 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -12.345 40.373 13.948 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -10.870 40.423 14.892 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -12.307 39.298 11.640 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -8.724 40.114 13.863 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -10.971 39.092 9.561 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -7.389 39.905 11.788 1.00 0.00 H new ATOM 0 HZ PHE A 53 -8.509 39.401 9.633 1.00 0.00 H new ATOM 840 N PRO A 54 -13.098 38.667 16.677 1.00 0.00 N ATOM 841 CA PRO A 54 -14.354 38.683 17.474 1.00 0.00 C ATOM 842 C PRO A 54 -15.166 39.953 17.247 1.00 0.00 C ATOM 843 O PRO A 54 -16.268 40.096 17.775 1.00 0.00 O ATOM 844 CB PRO A 54 -13.863 38.601 18.924 1.00 0.00 C ATOM 845 CG PRO A 54 -12.494 39.201 18.909 1.00 0.00 C ATOM 846 CD PRO A 54 -11.914 38.930 17.524 1.00 0.00 C ATOM 0 HA PRO A 54 -15.023 37.868 17.197 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.525 39.148 19.595 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -13.837 37.569 19.273 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.538 40.272 19.108 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.869 38.758 19.684 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.344 39.784 17.157 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.236 38.076 17.537 1.00 0.00 H new ATOM 854 N THR A 55 -14.610 40.877 16.471 1.00 0.00 N ATOM 855 CA THR A 55 -15.282 42.144 16.188 1.00 0.00 C ATOM 856 C THR A 55 -15.290 42.430 14.692 1.00 0.00 C ATOM 857 O THR A 55 -14.512 41.848 13.939 1.00 0.00 O ATOM 858 CB THR A 55 -14.583 43.280 16.937 1.00 0.00 C ATOM 859 OG1 THR A 55 -13.191 43.021 16.985 1.00 0.00 O ATOM 860 CG2 THR A 55 -15.133 43.386 18.360 1.00 0.00 C ATOM 0 H THR A 55 -13.698 40.775 16.027 1.00 0.00 H new ATOM 0 HA THR A 55 -16.315 42.072 16.527 1.00 0.00 H new ATOM 0 HB THR A 55 -14.765 44.220 16.416 1.00 0.00 H new ATOM 0 HG1 THR A 55 -12.918 42.546 16.172 1.00 0.00 H new ATOM 0 HG21 THR A 55 -14.629 44.197 18.885 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.204 43.588 18.322 1.00 0.00 H new ATOM 0 HG23 THR A 55 -14.959 42.449 18.888 1.00 0.00 H new ATOM 868 N LEU A 56 -16.185 43.327 14.270 1.00 0.00 N ATOM 869 CA LEU A 56 -16.289 43.660 12.857 1.00 0.00 C ATOM 870 C LEU A 56 -15.127 44.527 12.434 1.00 0.00 C ATOM 871 O LEU A 56 -14.303 44.138 11.605 1.00 0.00 O ATOM 872 CB LEU A 56 -17.616 44.383 12.605 1.00 0.00 C ATOM 873 CG LEU A 56 -18.167 43.991 11.229 1.00 0.00 C ATOM 874 CD1 LEU A 56 -19.481 44.719 10.973 1.00 0.00 C ATOM 875 CD2 LEU A 56 -17.148 44.368 10.149 1.00 0.00 C ATOM 0 H LEU A 56 -16.835 43.825 14.878 1.00 0.00 H new ATOM 0 HA LEU A 56 -16.261 42.744 12.267 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.335 44.124 13.382 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -17.468 45.462 12.654 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.345 42.916 11.202 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -19.868 44.437 9.994 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -20.204 44.446 11.742 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -19.312 45.795 11.000 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.537 44.091 9.169 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -16.969 45.443 10.177 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.212 43.839 10.331 1.00 0.00 H new ATOM 887 N LYS A 57 -15.088 45.744 12.955 1.00 0.00 N ATOM 888 CA LYS A 57 -14.032 46.689 12.584 1.00 0.00 C ATOM 889 C LYS A 57 -12.671 46.055 12.673 1.00 0.00 C ATOM 890 O LYS A 57 -11.787 46.324 11.857 1.00 0.00 O ATOM 891 CB LYS A 57 -14.087 47.922 13.505 1.00 0.00 C ATOM 892 CG LYS A 57 -15.376 48.709 13.258 1.00 0.00 C ATOM 893 CD LYS A 57 -15.441 49.900 14.215 1.00 0.00 C ATOM 894 CE LYS A 57 -16.744 50.668 13.987 1.00 0.00 C ATOM 895 NZ LYS A 57 -16.713 51.304 12.639 1.00 0.00 N1+ ATOM 0 H LYS A 57 -15.764 46.103 13.629 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.200 46.991 11.550 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.038 47.609 14.548 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.222 48.560 13.323 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.409 49.057 12.226 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -16.242 48.064 13.405 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -15.386 49.554 15.247 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.586 50.557 14.053 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -17.596 49.992 14.063 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -16.871 51.428 14.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -17.429 52.057 12.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -15.771 51.711 12.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -16.917 50.588 11.913 1.00 0.00 H new ATOM 909 N SER A 58 -12.499 45.183 13.660 1.00 0.00 N ATOM 910 CA SER A 58 -11.227 44.489 13.842 1.00 0.00 C ATOM 911 C SER A 58 -10.827 43.757 12.569 1.00 0.00 C ATOM 912 O SER A 58 -9.642 43.641 12.254 1.00 0.00 O ATOM 913 CB SER A 58 -11.339 43.496 15.001 1.00 0.00 C ATOM 914 OG SER A 58 -12.471 42.661 14.793 1.00 0.00 O ATOM 0 H SER A 58 -13.217 44.940 14.342 1.00 0.00 H new ATOM 0 HA SER A 58 -10.459 45.227 14.072 1.00 0.00 H new ATOM 0 HB2 SER A 58 -10.434 42.892 15.067 1.00 0.00 H new ATOM 0 HB3 SER A 58 -11.435 44.031 15.946 1.00 0.00 H new ATOM 0 HG SER A 58 -12.968 42.973 14.008 1.00 0.00 H new ATOM 920 N ALA A 59 -11.819 43.253 11.846 1.00 0.00 N ATOM 921 CA ALA A 59 -11.559 42.532 10.603 1.00 0.00 C ATOM 922 C ALA A 59 -11.140 43.502 9.501 1.00 0.00 C ATOM 923 O ALA A 59 -10.129 43.298 8.833 1.00 0.00 O ATOM 924 CB ALA A 59 -12.811 41.771 10.166 1.00 0.00 C ATOM 0 H ALA A 59 -12.805 43.328 12.095 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.749 41.824 10.778 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -12.607 41.237 9.238 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -13.092 41.058 10.941 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -13.628 42.475 10.007 1.00 0.00 H new ATOM 930 N GLU A 60 -11.925 44.561 9.325 1.00 0.00 N ATOM 931 CA GLU A 60 -11.623 45.561 8.304 1.00 0.00 C ATOM 932 C GLU A 60 -10.255 46.184 8.558 1.00 0.00 C ATOM 933 O GLU A 60 -9.478 46.397 7.625 1.00 0.00 O ATOM 934 CB GLU A 60 -12.692 46.654 8.312 1.00 0.00 C ATOM 935 CG GLU A 60 -14.013 46.083 7.793 1.00 0.00 C ATOM 936 CD GLU A 60 -15.112 47.134 7.892 1.00 0.00 C ATOM 937 OE1 GLU A 60 -14.802 48.254 8.265 1.00 0.00 O ATOM 938 OE2 GLU A 60 -16.249 46.804 7.597 1.00 0.00 O1- ATOM 0 H GLU A 60 -12.767 44.749 9.870 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.613 45.070 7.331 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.823 47.041 9.322 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -12.376 47.491 7.689 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.898 45.762 6.758 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.289 45.201 8.371 1.00 0.00 H new ATOM 945 N HIS A 61 -9.964 46.471 9.822 1.00 0.00 N ATOM 946 CA HIS A 61 -8.682 47.060 10.177 1.00 0.00 C ATOM 947 C HIS A 61 -7.541 46.083 9.892 1.00 0.00 C ATOM 948 O HIS A 61 -6.533 46.446 9.307 1.00 0.00 O ATOM 949 CB HIS A 61 -8.684 47.444 11.668 1.00 0.00 C ATOM 950 CG HIS A 61 -7.758 46.535 12.438 1.00 0.00 C ATOM 951 ND1 HIS A 61 -8.229 45.536 13.265 1.00 0.00 N ATOM 952 CD2 HIS A 61 -6.387 46.451 12.482 1.00 0.00 C ATOM 953 CE1 HIS A 61 -7.161 44.900 13.778 1.00 0.00 C ATOM 954 NE2 HIS A 61 -6.014 45.418 13.332 1.00 0.00 N ATOM 0 H HIS A 61 -10.592 46.307 10.609 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.529 47.954 9.572 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -8.369 48.481 11.785 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -9.695 47.371 12.069 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -5.705 47.089 11.940 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -7.223 44.071 14.467 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -5.067 45.119 13.565 1.00 0.00 H new ATOM 962 N ALA A 62 -7.713 44.842 10.350 1.00 0.00 N ATOM 963 CA ALA A 62 -6.688 43.829 10.164 1.00 0.00 C ATOM 964 C ALA A 62 -6.483 43.545 8.682 1.00 0.00 C ATOM 965 O ALA A 62 -5.351 43.380 8.221 1.00 0.00 O ATOM 966 CB ALA A 62 -7.091 42.537 10.881 1.00 0.00 C ATOM 0 H ALA A 62 -8.545 44.522 10.846 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.755 44.202 10.586 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.317 41.784 10.736 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.210 42.734 11.946 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.033 42.172 10.472 1.00 0.00 H new ATOM 972 N ALA A 63 -7.584 43.485 7.939 1.00 0.00 N ATOM 973 CA ALA A 63 -7.507 43.209 6.508 1.00 0.00 C ATOM 974 C ALA A 63 -6.663 44.251 5.803 1.00 0.00 C ATOM 975 O ALA A 63 -5.698 43.923 5.106 1.00 0.00 O ATOM 976 CB ALA A 63 -8.917 43.202 5.908 1.00 0.00 C ATOM 0 H ALA A 63 -8.529 43.622 8.298 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.042 42.233 6.370 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.857 42.996 4.839 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -9.515 42.431 6.393 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.384 44.175 6.064 1.00 0.00 H new ATOM 982 N ALA A 64 -7.016 45.512 5.987 1.00 0.00 N ATOM 983 CA ALA A 64 -6.268 46.614 5.366 1.00 0.00 C ATOM 984 C ALA A 64 -4.860 46.697 5.943 1.00 0.00 C ATOM 985 O ALA A 64 -3.898 46.954 5.222 1.00 0.00 O ATOM 986 CB ALA A 64 -6.995 47.940 5.593 1.00 0.00 C ATOM 0 H ALA A 64 -7.810 45.806 6.556 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.200 46.420 4.295 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.431 48.749 5.128 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.990 47.890 5.150 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.084 48.128 6.663 1.00 0.00 H new ATOM 992 N LYS A 65 -4.747 46.466 7.246 1.00 0.00 N ATOM 993 CA LYS A 65 -3.447 46.503 7.911 1.00 0.00 C ATOM 994 C LYS A 65 -2.462 45.593 7.183 1.00 0.00 C ATOM 995 O LYS A 65 -1.275 45.906 7.076 1.00 0.00 O ATOM 996 CB LYS A 65 -3.590 46.047 9.363 1.00 0.00 C ATOM 997 CG LYS A 65 -2.242 46.173 10.073 1.00 0.00 C ATOM 998 CD LYS A 65 -2.401 45.792 11.545 1.00 0.00 C ATOM 999 CE LYS A 65 -1.054 45.928 12.257 1.00 0.00 C ATOM 1000 NZ LYS A 65 -1.211 45.564 13.691 1.00 0.00 N1+ ATOM 0 H LYS A 65 -5.533 46.252 7.860 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.071 47.526 7.892 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.339 46.652 9.873 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.936 45.014 9.398 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.506 45.525 9.596 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.869 47.194 9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -3.142 46.435 12.020 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.767 44.769 11.629 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.315 45.281 11.785 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.686 46.950 12.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.295 45.657 14.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.904 46.199 14.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.544 44.582 13.765 1.00 0.00 H new ATOM 1014 N ILE A 66 -2.952 44.463 6.697 1.00 0.00 N ATOM 1015 CA ILE A 66 -2.106 43.524 5.971 1.00 0.00 C ATOM 1016 C ILE A 66 -1.755 44.078 4.587 1.00 0.00 C ATOM 1017 O ILE A 66 -0.669 43.828 4.067 1.00 0.00 O ATOM 1018 CB ILE A 66 -2.823 42.176 5.821 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -2.949 41.517 7.196 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -2.018 41.264 4.892 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -3.941 40.354 7.114 1.00 0.00 C ATOM 0 H ILE A 66 -3.926 44.173 6.790 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.186 43.381 6.537 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.814 42.337 5.397 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.976 41.156 7.529 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.287 42.247 7.932 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.530 40.307 4.788 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.924 41.734 3.913 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.026 41.100 5.313 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.032 39.883 8.093 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.915 40.728 6.800 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.583 39.621 6.391 1.00 0.00 H new ATOM 1033 N ALA A 67 -2.696 44.806 3.993 1.00 0.00 N ATOM 1034 CA ALA A 67 -2.487 45.363 2.668 1.00 0.00 C ATOM 1035 C ALA A 67 -1.521 46.539 2.715 1.00 0.00 C ATOM 1036 O ALA A 67 -0.527 46.568 1.995 1.00 0.00 O ATOM 1037 CB ALA A 67 -3.822 45.821 2.076 1.00 0.00 C ATOM 0 H ALA A 67 -3.603 45.021 4.407 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.055 44.585 2.039 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.656 46.237 1.082 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -4.499 44.970 2.004 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -4.263 46.582 2.719 1.00 0.00 H new ATOM 1043 N VAL A 68 -1.822 47.505 3.580 1.00 0.00 N ATOM 1044 CA VAL A 68 -0.980 48.688 3.710 1.00 0.00 C ATOM 1045 C VAL A 68 0.453 48.297 4.040 1.00 0.00 C ATOM 1046 O VAL A 68 1.400 48.968 3.629 1.00 0.00 O ATOM 1047 CB VAL A 68 -1.534 49.604 4.801 1.00 0.00 C ATOM 1048 CG1 VAL A 68 -1.483 48.878 6.146 1.00 0.00 C ATOM 1049 CG2 VAL A 68 -0.685 50.875 4.875 1.00 0.00 C ATOM 0 H VAL A 68 -2.635 47.491 4.195 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.982 49.219 2.758 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.566 49.868 4.569 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.878 49.529 6.926 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.084 47.970 6.093 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.451 48.616 6.379 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.078 51.530 5.652 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.346 50.611 5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.718 51.391 3.915 1.00 0.00 H new ATOM 1059 N ALA A 69 0.606 47.207 4.784 1.00 0.00 N ATOM 1060 CA ALA A 69 1.931 46.734 5.161 1.00 0.00 C ATOM 1061 C ALA A 69 2.582 45.990 3.999 1.00 0.00 C ATOM 1062 O ALA A 69 3.801 45.836 3.950 1.00 0.00 O ATOM 1063 CB ALA A 69 1.830 45.805 6.372 1.00 0.00 C ATOM 0 H ALA A 69 -0.165 46.639 5.135 1.00 0.00 H new ATOM 0 HA ALA A 69 2.546 47.597 5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.825 45.456 6.647 1.00 0.00 H new ATOM 0 HB2 ALA A 69 1.391 46.346 7.210 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.202 44.950 6.123 1.00 0.00 H new ATOM 1069 N SER A 70 1.757 45.522 3.068 1.00 0.00 N ATOM 1070 CA SER A 70 2.263 44.792 1.910 1.00 0.00 C ATOM 1071 C SER A 70 2.712 45.757 0.819 1.00 0.00 C ATOM 1072 O SER A 70 3.657 45.483 0.081 1.00 0.00 O ATOM 1073 CB SER A 70 1.177 43.864 1.360 1.00 0.00 C ATOM 1074 OG SER A 70 1.709 43.107 0.281 1.00 0.00 O ATOM 0 H SER A 70 0.743 45.634 3.091 1.00 0.00 H new ATOM 0 HA SER A 70 3.121 44.199 2.227 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.820 43.198 2.145 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.320 44.447 1.023 1.00 0.00 H new ATOM 0 HG SER A 70 1.017 42.510 -0.073 1.00 0.00 H new ATOM 1080 N LEU A 71 2.023 46.889 0.719 1.00 0.00 N ATOM 1081 CA LEU A 71 2.357 47.892 -0.281 1.00 0.00 C ATOM 1082 C LEU A 71 3.631 48.631 0.102 1.00 0.00 C ATOM 1083 O LEU A 71 4.391 49.077 -0.758 1.00 0.00 O ATOM 1084 CB LEU A 71 1.209 48.893 -0.424 1.00 0.00 C ATOM 1085 CG LEU A 71 -0.055 48.156 -0.880 1.00 0.00 C ATOM 1086 CD1 LEU A 71 -1.226 49.141 -0.941 1.00 0.00 C ATOM 1087 CD2 LEU A 71 0.175 47.546 -2.267 1.00 0.00 C ATOM 0 H LEU A 71 1.233 47.133 1.317 1.00 0.00 H new ATOM 0 HA LEU A 71 2.518 47.385 -1.232 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.028 49.394 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.473 49.666 -1.146 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.285 47.361 -0.171 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.125 48.617 -1.265 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.392 49.570 0.047 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.995 49.938 -1.648 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.726 47.023 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.408 48.338 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.007 46.843 -2.222 1.00 0.00 H new ATOM 1248 N TYR A 83 14.443 61.539 11.358 1.00 0.00 N ATOM 1249 CA TYR A 83 13.273 62.244 10.833 1.00 0.00 C ATOM 1250 C TYR A 83 13.709 63.203 9.710 1.00 0.00 C ATOM 1251 O TYR A 83 12.882 63.654 8.929 1.00 0.00 O ATOM 1252 CB TYR A 83 12.580 63.012 11.945 1.00 0.00 C ATOM 1253 CG TYR A 83 12.598 62.191 13.212 1.00 0.00 C ATOM 1254 CD1 TYR A 83 12.276 60.829 13.166 1.00 0.00 C ATOM 1255 CD2 TYR A 83 12.936 62.789 14.431 1.00 0.00 C ATOM 1256 CE1 TYR A 83 12.292 60.068 14.339 1.00 0.00 C ATOM 1257 CE2 TYR A 83 12.952 62.028 15.605 1.00 0.00 C ATOM 1258 CZ TYR A 83 12.629 60.667 15.560 1.00 0.00 C ATOM 1259 OH TYR A 83 12.645 59.915 16.717 1.00 0.00 O ATOM 0 HA TYR A 83 12.569 61.517 10.427 1.00 0.00 H new ATOM 0 HB2 TYR A 83 13.082 63.966 12.110 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.552 63.237 11.660 1.00 0.00 H new ATOM 0 HD1 TYR A 83 12.016 60.367 12.225 1.00 0.00 H new ATOM 0 HD2 TYR A 83 13.185 63.839 14.466 1.00 0.00 H new ATOM 0 HE1 TYR A 83 12.044 59.017 14.304 1.00 0.00 H new ATOM 0 HE2 TYR A 83 13.213 62.491 16.545 1.00 0.00 H new ATOM 0 HH TYR A 83 12.900 60.484 17.473 1.00 0.00 H new ATOM 1269 N LYS A 84 15.018 63.519 9.664 1.00 0.00 N ATOM 1270 CA LYS A 84 15.546 64.401 8.639 1.00 0.00 C ATOM 1271 C LYS A 84 15.078 63.907 7.265 1.00 0.00 C ATOM 1272 O LYS A 84 14.787 64.711 6.377 1.00 0.00 O ATOM 1273 CB LYS A 84 17.058 64.416 8.709 1.00 0.00 C ATOM 1274 CG LYS A 84 17.499 65.086 10.010 1.00 0.00 C ATOM 1275 CD LYS A 84 19.027 65.116 10.076 1.00 0.00 C ATOM 1276 CE LYS A 84 19.467 65.834 11.352 1.00 0.00 C ATOM 1277 NZ LYS A 84 20.956 65.882 11.407 1.00 0.00 N1+ ATOM 0 H LYS A 84 15.714 63.173 10.325 1.00 0.00 H new ATOM 0 HA LYS A 84 15.182 65.416 8.798 1.00 0.00 H new ATOM 0 HB2 LYS A 84 17.445 63.398 8.662 1.00 0.00 H new ATOM 0 HB3 LYS A 84 17.467 64.953 7.853 1.00 0.00 H new ATOM 0 HG2 LYS A 84 17.102 66.100 10.062 1.00 0.00 H new ATOM 0 HG3 LYS A 84 17.098 64.542 10.866 1.00 0.00 H new ATOM 0 HD2 LYS A 84 19.422 64.100 10.062 1.00 0.00 H new ATOM 0 HD3 LYS A 84 19.430 65.627 9.201 1.00 0.00 H new ATOM 0 HE2 LYS A 84 19.059 66.845 11.373 1.00 0.00 H new ATOM 0 HE3 LYS A 84 19.077 65.315 12.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 21.260 66.809 11.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 21.304 65.133 12.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 21.343 65.738 10.453 1.00 0.00 H new ATOM 1291 N ASN A 85 15.033 62.587 7.092 1.00 0.00 N ATOM 1292 CA ASN A 85 14.593 62.013 5.825 1.00 0.00 C ATOM 1293 C ASN A 85 13.146 62.432 5.537 1.00 0.00 C ATOM 1294 O ASN A 85 12.789 62.724 4.403 1.00 0.00 O ATOM 1295 CB ASN A 85 14.683 60.486 5.883 1.00 0.00 C ATOM 1296 CG ASN A 85 13.368 59.869 5.418 1.00 0.00 C ATOM 1297 OD1 ASN A 85 12.862 60.215 4.352 1.00 0.00 O ATOM 1298 ND2 ASN A 85 12.783 58.969 6.161 1.00 0.00 N ATOM 0 H ASN A 85 15.292 61.904 7.804 1.00 0.00 H new ATOM 0 HA ASN A 85 15.240 62.380 5.028 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.501 60.137 5.253 1.00 0.00 H new ATOM 0 HB3 ASN A 85 14.905 60.165 6.901 1.00 0.00 H new ATOM 0 HD21 ASN A 85 11.904 58.551 5.858 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.205 58.684 7.045 1.00 0.00 H new ATOM 1305 N LEU A 86 12.319 62.443 6.585 1.00 0.00 N ATOM 1306 CA LEU A 86 10.917 62.816 6.434 1.00 0.00 C ATOM 1307 C LEU A 86 10.800 64.282 6.016 1.00 0.00 C ATOM 1308 O LEU A 86 10.040 64.624 5.116 1.00 0.00 O ATOM 1309 CB LEU A 86 10.176 62.588 7.747 1.00 0.00 C ATOM 1310 CG LEU A 86 8.672 62.801 7.528 1.00 0.00 C ATOM 1311 CD1 LEU A 86 7.892 62.125 8.662 1.00 0.00 C ATOM 1312 CD2 LEU A 86 8.354 64.301 7.509 1.00 0.00 C ATOM 0 H LEU A 86 12.595 62.200 7.536 1.00 0.00 H new ATOM 0 HA LEU A 86 10.470 62.195 5.658 1.00 0.00 H new ATOM 0 HB2 LEU A 86 10.362 61.578 8.111 1.00 0.00 H new ATOM 0 HB3 LEU A 86 10.544 63.275 8.509 1.00 0.00 H new ATOM 0 HG LEU A 86 8.382 62.363 6.573 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.823 62.275 8.508 1.00 0.00 H new ATOM 0 HD12 LEU A 86 8.111 61.057 8.668 1.00 0.00 H new ATOM 0 HD13 LEU A 86 8.186 62.561 9.617 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.285 64.444 7.353 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.645 64.747 8.460 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.906 64.780 6.700 1.00 0.00 H new ATOM 1324 N LEU A 87 11.562 65.143 6.681 1.00 0.00 N ATOM 1325 CA LEU A 87 11.536 66.571 6.373 1.00 0.00 C ATOM 1326 C LEU A 87 11.834 66.800 4.896 1.00 0.00 C ATOM 1327 O LEU A 87 11.380 67.778 4.306 1.00 0.00 O ATOM 1328 CB LEU A 87 12.569 67.306 7.226 1.00 0.00 C ATOM 1329 CG LEU A 87 12.360 66.953 8.701 1.00 0.00 C ATOM 1330 CD1 LEU A 87 13.435 67.638 9.547 1.00 0.00 C ATOM 1331 CD2 LEU A 87 10.975 67.434 9.150 1.00 0.00 C ATOM 0 H LEU A 87 12.201 64.882 7.432 1.00 0.00 H new ATOM 0 HA LEU A 87 10.542 66.958 6.597 1.00 0.00 H new ATOM 0 HB2 LEU A 87 13.576 67.029 6.914 1.00 0.00 H new ATOM 0 HB3 LEU A 87 12.475 68.382 7.082 1.00 0.00 H new ATOM 0 HG LEU A 87 12.430 65.873 8.829 1.00 0.00 H new ATOM 0 HD11 LEU A 87 13.286 67.387 10.597 1.00 0.00 H new ATOM 0 HD12 LEU A 87 14.420 67.298 9.228 1.00 0.00 H new ATOM 0 HD13 LEU A 87 13.365 68.718 9.419 1.00 0.00 H new ATOM 0 HD21 LEU A 87 10.825 67.183 10.200 1.00 0.00 H new ATOM 0 HD22 LEU A 87 10.906 68.514 9.022 1.00 0.00 H new ATOM 0 HD23 LEU A 87 10.208 66.947 8.548 1.00 0.00 H new ATOM 1343 N GLN A 88 12.601 65.892 4.304 1.00 0.00 N ATOM 1344 CA GLN A 88 12.942 65.995 2.891 1.00 0.00 C ATOM 1345 C GLN A 88 11.764 65.547 2.019 1.00 0.00 C ATOM 1346 O GLN A 88 11.615 65.998 0.885 1.00 0.00 O ATOM 1347 CB GLN A 88 14.163 65.127 2.579 1.00 0.00 C ATOM 1348 CG GLN A 88 15.396 65.727 3.255 1.00 0.00 C ATOM 1349 CD GLN A 88 16.606 64.826 3.027 1.00 0.00 C ATOM 1350 OE1 GLN A 88 16.607 63.668 3.447 1.00 0.00 O ATOM 1351 NE2 GLN A 88 17.640 65.290 2.382 1.00 0.00 N ATOM 0 H GLN A 88 12.997 65.080 4.778 1.00 0.00 H new ATOM 0 HA GLN A 88 13.171 67.038 2.670 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.000 64.109 2.933 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.317 65.069 1.501 1.00 0.00 H new ATOM 0 HG2 GLN A 88 15.592 66.722 2.855 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.215 65.843 4.324 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.636 66.249 2.035 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.452 64.694 2.224 1.00 0.00 H new ATOM 1360 N GLU A 89 10.932 64.658 2.564 1.00 0.00 N ATOM 1361 CA GLU A 89 9.779 64.157 1.826 1.00 0.00 C ATOM 1362 C GLU A 89 8.763 65.272 1.600 1.00 0.00 C ATOM 1363 O GLU A 89 8.243 65.431 0.497 1.00 0.00 O ATOM 1364 CB GLU A 89 9.128 63.016 2.602 1.00 0.00 C ATOM 1365 CG GLU A 89 10.084 61.821 2.660 1.00 0.00 C ATOM 1366 CD GLU A 89 10.245 61.214 1.272 1.00 0.00 C ATOM 1367 OE1 GLU A 89 9.391 61.464 0.436 1.00 0.00 O ATOM 1368 OE2 GLU A 89 11.212 60.501 1.066 1.00 0.00 O1- ATOM 0 H GLU A 89 11.036 64.275 3.504 1.00 0.00 H new ATOM 0 HA GLU A 89 10.117 63.791 0.856 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.880 63.345 3.611 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.194 62.724 2.123 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.054 62.139 3.041 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.700 61.071 3.352 1.00 0.00 H new ATOM 1375 N ILE A 90 8.488 66.039 2.648 1.00 0.00 N ATOM 1376 CA ILE A 90 7.538 67.145 2.554 1.00 0.00 C ATOM 1377 C ILE A 90 8.118 68.268 1.696 1.00 0.00 C ATOM 1378 O ILE A 90 7.394 68.938 0.965 1.00 0.00 O ATOM 1379 CB ILE A 90 7.200 67.666 3.945 1.00 0.00 C ATOM 1380 CG1 ILE A 90 8.493 68.032 4.678 1.00 0.00 C ATOM 1381 CG2 ILE A 90 6.454 66.589 4.729 1.00 0.00 C ATOM 1382 CD1 ILE A 90 8.152 68.668 6.028 1.00 0.00 C ATOM 0 H ILE A 90 8.907 65.918 3.570 1.00 0.00 H new ATOM 0 HA ILE A 90 6.624 66.783 2.084 1.00 0.00 H new ATOM 0 HB ILE A 90 6.568 68.550 3.858 1.00 0.00 H new ATOM 0 HG12 ILE A 90 9.103 67.141 4.827 1.00 0.00 H new ATOM 0 HG13 ILE A 90 9.081 68.724 4.076 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.213 66.964 5.724 1.00 0.00 H new ATOM 0 HG22 ILE A 90 5.533 66.330 4.206 1.00 0.00 H new ATOM 0 HG23 ILE A 90 7.082 65.703 4.818 1.00 0.00 H new ATOM 0 HD11 ILE A 90 9.073 68.929 6.550 1.00 0.00 H new ATOM 0 HD12 ILE A 90 7.559 69.568 5.867 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.581 67.961 6.630 1.00 0.00 H new ATOM 1394 N ALA A 91 9.428 68.476 1.808 1.00 0.00 N ATOM 1395 CA ALA A 91 10.091 69.524 1.047 1.00 0.00 C ATOM 1396 C ALA A 91 9.800 69.359 -0.443 1.00 0.00 C ATOM 1397 O ALA A 91 9.427 70.315 -1.122 1.00 0.00 O ATOM 1398 CB ALA A 91 11.602 69.459 1.281 1.00 0.00 C ATOM 0 H ALA A 91 10.045 67.935 2.414 1.00 0.00 H new ATOM 0 HA ALA A 91 9.712 70.490 1.380 1.00 0.00 H new ATOM 0 HB1 ALA A 91 12.093 70.246 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 91 11.812 69.597 2.342 1.00 0.00 H new ATOM 0 HB3 ALA A 91 11.979 68.488 0.960 1.00 0.00 H new ATOM 1404 N GLN A 92 9.976 68.141 -0.945 1.00 0.00 N ATOM 1405 CA GLN A 92 9.732 67.866 -2.355 1.00 0.00 C ATOM 1406 C GLN A 92 8.252 68.030 -2.685 1.00 0.00 C ATOM 1407 O GLN A 92 7.895 68.578 -3.729 1.00 0.00 O ATOM 1408 CB GLN A 92 10.182 66.443 -2.697 1.00 0.00 C ATOM 1409 CG GLN A 92 10.076 66.219 -4.207 1.00 0.00 C ATOM 1410 CD GLN A 92 11.072 67.113 -4.939 1.00 0.00 C ATOM 1411 OE1 GLN A 92 12.208 67.270 -4.493 1.00 0.00 O ATOM 1412 NE2 GLN A 92 10.711 67.713 -6.039 1.00 0.00 N ATOM 0 H GLN A 92 10.284 67.335 -0.401 1.00 0.00 H new ATOM 0 HA GLN A 92 10.305 68.578 -2.949 1.00 0.00 H new ATOM 0 HB2 GLN A 92 11.209 66.287 -2.367 1.00 0.00 H new ATOM 0 HB3 GLN A 92 9.564 65.718 -2.168 1.00 0.00 H new ATOM 0 HG2 GLN A 92 10.273 65.173 -4.442 1.00 0.00 H new ATOM 0 HG3 GLN A 92 9.063 66.437 -4.545 1.00 0.00 H new ATOM 0 HE21 GLN A 92 9.769 67.581 -6.406 1.00 0.00 H new ATOM 0 HE22 GLN A 92 11.371 68.314 -6.532 1.00 0.00 H new ATOM 1421 N LYS A 93 7.396 67.544 -1.791 1.00 0.00 N ATOM 1422 CA LYS A 93 5.954 67.634 -2.001 1.00 0.00 C ATOM 1423 C LYS A 93 5.518 69.094 -2.063 1.00 0.00 C ATOM 1424 O LYS A 93 4.758 69.487 -2.948 1.00 0.00 O ATOM 1425 CB LYS A 93 5.217 66.921 -0.869 1.00 0.00 C ATOM 1426 CG LYS A 93 3.717 66.911 -1.164 1.00 0.00 C ATOM 1427 CD LYS A 93 2.983 66.158 -0.052 1.00 0.00 C ATOM 1428 CE LYS A 93 1.486 66.122 -0.362 1.00 0.00 C ATOM 1429 NZ LYS A 93 0.732 65.746 0.868 1.00 0.00 N1+ ATOM 0 H LYS A 93 7.672 67.088 -0.922 1.00 0.00 H new ATOM 0 HA LYS A 93 5.708 67.153 -2.948 1.00 0.00 H new ATOM 0 HB2 LYS A 93 5.585 65.900 -0.767 1.00 0.00 H new ATOM 0 HB3 LYS A 93 5.409 67.425 0.078 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.343 67.932 -1.235 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.528 66.435 -2.126 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.372 65.143 0.033 1.00 0.00 H new ATOM 0 HD3 LYS A 93 3.155 66.646 0.907 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.155 67.096 -0.721 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.286 65.404 -1.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.286 65.722 0.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.041 64.807 1.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.914 66.447 1.615 1.00 0.00 H new ATOM 1443 N GLU A 94 5.999 69.890 -1.116 1.00 0.00 N ATOM 1444 CA GLU A 94 5.654 71.308 -1.073 1.00 0.00 C ATOM 1445 C GLU A 94 6.508 72.092 -2.067 1.00 0.00 C ATOM 1446 O GLU A 94 6.310 73.290 -2.257 1.00 0.00 O ATOM 1447 CB GLU A 94 5.873 71.860 0.335 1.00 0.00 C ATOM 1448 CG GLU A 94 4.860 71.229 1.292 1.00 0.00 C ATOM 1449 CD GLU A 94 5.125 71.704 2.717 1.00 0.00 C ATOM 1450 OE1 GLU A 94 6.011 72.521 2.894 1.00 0.00 O ATOM 1451 OE2 GLU A 94 4.435 71.243 3.612 1.00 0.00 O1- ATOM 0 H GLU A 94 6.625 69.582 -0.372 1.00 0.00 H new ATOM 0 HA GLU A 94 4.603 71.416 -1.343 1.00 0.00 H new ATOM 0 HB2 GLU A 94 6.888 71.644 0.668 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.762 72.944 0.334 1.00 0.00 H new ATOM 0 HG2 GLU A 94 3.847 71.498 0.992 1.00 0.00 H new ATOM 0 HG3 GLU A 94 4.929 70.142 1.243 1.00 0.00 H new ATOM 1458 N SER A 95 7.460 71.407 -2.693 1.00 0.00 N ATOM 1459 CA SER A 95 8.339 72.050 -3.664 1.00 0.00 C ATOM 1460 C SER A 95 9.248 73.062 -2.974 1.00 0.00 C ATOM 1461 O SER A 95 9.930 73.848 -3.633 1.00 0.00 O ATOM 1462 CB SER A 95 7.506 72.754 -4.735 1.00 0.00 C ATOM 1463 OG SER A 95 6.388 71.942 -5.069 1.00 0.00 O ATOM 0 H SER A 95 7.642 70.414 -2.547 1.00 0.00 H new ATOM 0 HA SER A 95 8.957 71.284 -4.132 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.169 73.725 -4.371 1.00 0.00 H new ATOM 0 HB3 SER A 95 8.113 72.939 -5.621 1.00 0.00 H new ATOM 0 HG SER A 95 5.851 72.391 -5.754 1.00 0.00 H new ATOM 1469 N SER A 96 9.253 73.037 -1.646 1.00 0.00 N ATOM 1470 CA SER A 96 10.084 73.958 -0.879 1.00 0.00 C ATOM 1471 C SER A 96 11.531 73.472 -0.851 1.00 0.00 C ATOM 1472 O SER A 96 11.802 72.284 -1.028 1.00 0.00 O ATOM 1473 CB SER A 96 9.555 74.072 0.551 1.00 0.00 C ATOM 1474 OG SER A 96 9.776 72.847 1.233 1.00 0.00 O ATOM 0 H SER A 96 8.696 72.395 -1.082 1.00 0.00 H new ATOM 0 HA SER A 96 10.048 74.937 -1.357 1.00 0.00 H new ATOM 0 HB2 SER A 96 10.057 74.887 1.072 1.00 0.00 H new ATOM 0 HB3 SER A 96 8.491 74.308 0.539 1.00 0.00 H new ATOM 0 HG SER A 96 9.439 72.918 2.151 1.00 0.00 H new ATOM 1480 N LEU A 97 12.457 74.399 -0.621 1.00 0.00 N ATOM 1481 CA LEU A 97 13.870 74.051 -0.571 1.00 0.00 C ATOM 1482 C LEU A 97 14.143 73.090 0.583 1.00 0.00 C ATOM 1483 O LEU A 97 13.726 73.330 1.715 1.00 0.00 O ATOM 1484 CB LEU A 97 14.711 75.319 -0.390 1.00 0.00 C ATOM 1485 CG LEU A 97 16.192 74.941 -0.290 1.00 0.00 C ATOM 1486 CD1 LEU A 97 16.612 74.160 -1.539 1.00 0.00 C ATOM 1487 CD2 LEU A 97 17.034 76.215 -0.179 1.00 0.00 C ATOM 0 H LEU A 97 12.255 75.387 -0.468 1.00 0.00 H new ATOM 0 HA LEU A 97 14.141 73.564 -1.508 1.00 0.00 H new ATOM 0 HB2 LEU A 97 14.553 75.995 -1.230 1.00 0.00 H new ATOM 0 HB3 LEU A 97 14.399 75.850 0.509 1.00 0.00 H new ATOM 0 HG LEU A 97 16.348 74.320 0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 97 17.666 73.893 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 97 16.013 73.253 -1.620 1.00 0.00 H new ATOM 0 HD13 LEU A 97 16.456 74.777 -2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 97 18.089 75.949 -0.108 1.00 0.00 H new ATOM 0 HD22 LEU A 97 16.875 76.834 -1.062 1.00 0.00 H new ATOM 0 HD23 LEU A 97 16.739 76.770 0.712 1.00 0.00 H new ATOM 1499 N LEU A 98 14.855 72.005 0.286 1.00 0.00 N ATOM 1500 CA LEU A 98 15.179 71.018 1.301 1.00 0.00 C ATOM 1501 C LEU A 98 15.679 71.702 2.574 1.00 0.00 C ATOM 1502 O LEU A 98 16.213 72.809 2.526 1.00 0.00 O ATOM 1503 CB LEU A 98 16.251 70.057 0.781 1.00 0.00 C ATOM 1504 CG LEU A 98 15.596 68.979 -0.084 1.00 0.00 C ATOM 1505 CD1 LEU A 98 14.845 69.640 -1.242 1.00 0.00 C ATOM 1506 CD2 LEU A 98 16.671 68.047 -0.638 1.00 0.00 C ATOM 0 H LEU A 98 15.214 71.792 -0.645 1.00 0.00 H new ATOM 0 HA LEU A 98 14.274 70.456 1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 98 16.993 70.604 0.199 1.00 0.00 H new ATOM 0 HB3 LEU A 98 16.778 69.597 1.617 1.00 0.00 H new ATOM 0 HG LEU A 98 14.895 68.404 0.521 1.00 0.00 H new ATOM 0 HD11 LEU A 98 14.378 68.872 -1.859 1.00 0.00 H new ATOM 0 HD12 LEU A 98 14.077 70.304 -0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 98 15.545 70.216 -1.848 1.00 0.00 H new ATOM 0 HD21 LEU A 98 16.204 67.279 -1.254 1.00 0.00 H new ATOM 0 HD22 LEU A 98 17.373 68.621 -1.243 1.00 0.00 H new ATOM 0 HD23 LEU A 98 17.204 67.575 0.187 1.00 0.00 H new ATOM 1518 N PRO A 99 15.519 71.059 3.692 1.00 0.00 N ATOM 1519 CA PRO A 99 15.970 71.599 5.009 1.00 0.00 C ATOM 1520 C PRO A 99 17.461 71.911 5.023 1.00 0.00 C ATOM 1521 O PRO A 99 18.194 71.534 4.108 1.00 0.00 O ATOM 1522 CB PRO A 99 15.630 70.482 6.003 1.00 0.00 C ATOM 1523 CG PRO A 99 14.603 69.642 5.326 1.00 0.00 C ATOM 1524 CD PRO A 99 14.895 69.734 3.836 1.00 0.00 C ATOM 0 HA PRO A 99 15.484 72.545 5.249 1.00 0.00 H new ATOM 0 HB2 PRO A 99 16.515 69.895 6.251 1.00 0.00 H new ATOM 0 HB3 PRO A 99 15.247 70.892 6.937 1.00 0.00 H new ATOM 0 HG2 PRO A 99 14.656 68.609 5.670 1.00 0.00 H new ATOM 0 HG3 PRO A 99 13.598 70.001 5.549 1.00 0.00 H new ATOM 0 HD2 PRO A 99 15.563 68.938 3.507 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.985 69.652 3.242 1.00 0.00 H new ATOM 1532 N PHE A 100 17.911 72.597 6.074 1.00 0.00 N ATOM 1533 CA PHE A 100 19.329 72.941 6.200 1.00 0.00 C ATOM 1534 C PHE A 100 19.794 72.704 7.635 1.00 0.00 C ATOM 1535 O PHE A 100 19.490 73.487 8.535 1.00 0.00 O ATOM 1536 CB PHE A 100 19.547 74.396 5.816 1.00 0.00 C ATOM 1537 CG PHE A 100 21.026 74.694 5.806 1.00 0.00 C ATOM 1538 CD1 PHE A 100 21.829 74.199 4.771 1.00 0.00 C ATOM 1539 CD2 PHE A 100 21.595 75.463 6.827 1.00 0.00 C ATOM 1540 CE1 PHE A 100 23.201 74.475 4.758 1.00 0.00 C ATOM 1541 CE2 PHE A 100 22.966 75.739 6.813 1.00 0.00 C ATOM 1542 CZ PHE A 100 23.770 75.246 5.779 1.00 0.00 C ATOM 0 H PHE A 100 17.324 72.922 6.842 1.00 0.00 H new ATOM 0 HA PHE A 100 19.910 72.308 5.529 1.00 0.00 H new ATOM 0 HB2 PHE A 100 19.118 74.593 4.833 1.00 0.00 H new ATOM 0 HB3 PHE A 100 19.037 75.051 6.523 1.00 0.00 H new ATOM 0 HD1 PHE A 100 21.390 73.605 3.983 1.00 0.00 H new ATOM 0 HD2 PHE A 100 20.976 75.843 7.626 1.00 0.00 H new ATOM 0 HE1 PHE A 100 23.821 74.093 3.960 1.00 0.00 H new ATOM 0 HE2 PHE A 100 23.405 76.333 7.601 1.00 0.00 H new ATOM 0 HZ PHE A 100 24.829 75.460 5.769 1.00 0.00 H new ATOM 1552 N TYR A 101 20.544 71.625 7.841 1.00 0.00 N ATOM 1553 CA TYR A 101 21.031 71.298 9.173 1.00 0.00 C ATOM 1554 C TYR A 101 22.371 71.951 9.444 1.00 0.00 C ATOM 1555 O TYR A 101 23.332 71.770 8.694 1.00 0.00 O ATOM 1556 CB TYR A 101 21.182 69.772 9.306 1.00 0.00 C ATOM 1557 CG TYR A 101 19.889 69.099 8.905 1.00 0.00 C ATOM 1558 CD1 TYR A 101 18.755 69.220 9.713 1.00 0.00 C ATOM 1559 CD2 TYR A 101 19.826 68.355 7.719 1.00 0.00 C ATOM 1560 CE1 TYR A 101 17.558 68.598 9.338 1.00 0.00 C ATOM 1561 CE2 TYR A 101 18.631 67.736 7.342 1.00 0.00 C ATOM 1562 CZ TYR A 101 17.497 67.855 8.152 1.00 0.00 C ATOM 1563 OH TYR A 101 16.317 67.243 7.781 1.00 0.00 O ATOM 0 H TYR A 101 20.824 70.970 7.111 1.00 0.00 H new ATOM 0 HA TYR A 101 20.308 71.672 9.898 1.00 0.00 H new ATOM 0 HB2 TYR A 101 21.998 69.421 8.675 1.00 0.00 H new ATOM 0 HB3 TYR A 101 21.438 69.510 10.333 1.00 0.00 H new ATOM 0 HD1 TYR A 101 18.802 69.793 10.627 1.00 0.00 H new ATOM 0 HD2 TYR A 101 20.702 68.260 7.095 1.00 0.00 H new ATOM 0 HE1 TYR A 101 16.682 68.691 9.963 1.00 0.00 H new ATOM 0 HE2 TYR A 101 18.583 67.166 6.426 1.00 0.00 H new ATOM 0 HH TYR A 101 16.447 66.770 6.933 1.00 0.00 H new ATOM 1573 N ALA A 102 22.438 72.728 10.524 1.00 0.00 N ATOM 1574 CA ALA A 102 23.678 73.414 10.894 1.00 0.00 C ATOM 1575 C ALA A 102 23.991 73.166 12.363 1.00 0.00 C ATOM 1576 O ALA A 102 23.163 73.416 13.238 1.00 0.00 O ATOM 1577 CB ALA A 102 23.549 74.917 10.637 1.00 0.00 C ATOM 0 H ALA A 102 21.655 72.898 11.155 1.00 0.00 H new ATOM 0 HA ALA A 102 24.491 73.021 10.284 1.00 0.00 H new ATOM 0 HB1 ALA A 102 24.478 75.415 10.916 1.00 0.00 H new ATOM 0 HB2 ALA A 102 23.349 75.089 9.580 1.00 0.00 H new ATOM 0 HB3 ALA A 102 22.729 75.319 11.232 1.00 0.00 H new ATOM 1583 N THR A 103 25.204 72.678 12.634 1.00 0.00 N ATOM 1584 CA THR A 103 25.615 72.402 14.005 1.00 0.00 C ATOM 1585 C THR A 103 26.627 73.430 14.482 1.00 0.00 C ATOM 1586 O THR A 103 27.725 73.541 13.936 1.00 0.00 O ATOM 1587 CB THR A 103 26.234 71.002 14.085 1.00 0.00 C ATOM 1588 OG1 THR A 103 25.262 70.034 13.712 1.00 0.00 O ATOM 1589 CG2 THR A 103 26.703 70.731 15.517 1.00 0.00 C ATOM 0 H THR A 103 25.909 72.469 11.928 1.00 0.00 H new ATOM 0 HA THR A 103 24.735 72.455 14.646 1.00 0.00 H new ATOM 0 HB THR A 103 27.086 70.942 13.408 1.00 0.00 H new ATOM 0 HG1 THR A 103 25.657 69.138 13.761 1.00 0.00 H new ATOM 0 HG21 THR A 103 27.143 69.735 15.573 1.00 0.00 H new ATOM 0 HG22 THR A 103 27.448 71.474 15.803 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.852 70.791 16.196 1.00 0.00 H new ATOM 1597 N ALA A 104 26.252 74.190 15.510 1.00 0.00 N ATOM 1598 CA ALA A 104 27.137 75.212 16.054 1.00 0.00 C ATOM 1599 C ALA A 104 27.676 74.787 17.410 1.00 0.00 C ATOM 1600 O ALA A 104 26.925 74.347 18.283 1.00 0.00 O ATOM 1601 CB ALA A 104 26.377 76.535 16.202 1.00 0.00 C ATOM 0 H ALA A 104 25.349 74.117 15.978 1.00 0.00 H new ATOM 0 HA ALA A 104 27.973 75.344 15.367 1.00 0.00 H new ATOM 0 HB1 ALA A 104 27.044 77.294 16.609 1.00 0.00 H new ATOM 0 HB2 ALA A 104 26.013 76.857 15.226 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.532 76.396 16.876 1.00 0.00 H new ATOM 1607 N THR A 105 28.992 74.915 17.591 1.00 0.00 N ATOM 1608 CA THR A 105 29.625 74.543 18.853 1.00 0.00 C ATOM 1609 C THR A 105 29.988 75.788 19.655 1.00 0.00 C ATOM 1610 O THR A 105 30.596 76.721 19.132 1.00 0.00 O ATOM 1611 CB THR A 105 30.884 73.722 18.578 1.00 0.00 C ATOM 1612 OG1 THR A 105 31.890 74.566 18.037 1.00 0.00 O ATOM 1613 CG2 THR A 105 30.564 72.604 17.582 1.00 0.00 C ATOM 0 H THR A 105 29.635 75.271 16.883 1.00 0.00 H new ATOM 0 HA THR A 105 28.922 73.945 19.433 1.00 0.00 H new ATOM 0 HB THR A 105 31.239 73.283 19.510 1.00 0.00 H new ATOM 0 HG1 THR A 105 31.648 75.503 18.190 1.00 0.00 H new ATOM 0 HG21 THR A 105 31.464 72.021 17.388 1.00 0.00 H new ATOM 0 HG22 THR A 105 29.794 71.955 17.999 1.00 0.00 H new ATOM 0 HG23 THR A 105 30.206 73.039 16.649 1.00 0.00 H new ATOM 1621 N SER A 106 29.609 75.795 20.929 1.00 0.00 N ATOM 1622 CA SER A 106 29.894 76.931 21.794 1.00 0.00 C ATOM 1623 C SER A 106 29.708 76.551 23.254 1.00 0.00 C ATOM 1624 O SER A 106 29.159 75.492 23.567 1.00 0.00 O ATOM 1625 CB SER A 106 28.968 78.097 21.446 1.00 0.00 C ATOM 1626 OG SER A 106 29.166 79.151 22.380 1.00 0.00 O ATOM 0 H SER A 106 29.107 75.031 21.382 1.00 0.00 H new ATOM 0 HA SER A 106 30.930 77.231 21.638 1.00 0.00 H new ATOM 0 HB2 SER A 106 29.172 78.449 20.435 1.00 0.00 H new ATOM 0 HB3 SER A 106 27.929 77.769 21.466 1.00 0.00 H new ATOM 0 HG SER A 106 28.575 79.900 22.158 1.00 0.00 H new ATOM 1632 N GLY A 107 30.163 77.420 24.152 1.00 0.00 N ATOM 1633 CA GLY A 107 30.041 77.164 25.584 1.00 0.00 C ATOM 1634 C GLY A 107 31.410 77.190 26.259 1.00 0.00 C ATOM 1635 O GLY A 107 32.431 77.409 25.610 1.00 0.00 O ATOM 0 H GLY A 107 30.617 78.302 23.916 1.00 0.00 H new ATOM 0 HA2 GLY A 107 29.393 77.914 26.038 1.00 0.00 H new ATOM 0 HA3 GLY A 107 29.569 76.195 25.746 1.00 0.00 H new ATOM 1639 N PRO A 108 31.438 76.968 27.540 1.00 0.00 N ATOM 1640 CA PRO A 108 32.705 76.963 28.330 1.00 0.00 C ATOM 1641 C PRO A 108 33.667 75.869 27.867 1.00 0.00 C ATOM 1642 O PRO A 108 33.244 74.827 27.374 1.00 0.00 O ATOM 1643 CB PRO A 108 32.237 76.701 29.771 1.00 0.00 C ATOM 1644 CG PRO A 108 30.878 76.103 29.647 1.00 0.00 C ATOM 1645 CD PRO A 108 30.267 76.697 28.382 1.00 0.00 C ATOM 0 HA PRO A 108 33.258 77.896 28.219 1.00 0.00 H new ATOM 0 HB2 PRO A 108 32.918 76.024 30.287 1.00 0.00 H new ATOM 0 HB3 PRO A 108 32.208 77.625 30.348 1.00 0.00 H new ATOM 0 HG2 PRO A 108 30.935 75.017 29.579 1.00 0.00 H new ATOM 0 HG3 PRO A 108 30.269 76.336 30.520 1.00 0.00 H new ATOM 0 HD2 PRO A 108 29.578 76.001 27.902 1.00 0.00 H new ATOM 0 HD3 PRO A 108 29.705 77.606 28.595 1.00 0.00 H new ATOM 1653 N SER A 109 34.962 76.118 28.037 1.00 0.00 N ATOM 1654 CA SER A 109 35.976 75.147 27.645 1.00 0.00 C ATOM 1655 C SER A 109 35.855 73.884 28.487 1.00 0.00 C ATOM 1656 O SER A 109 36.375 72.828 28.124 1.00 0.00 O ATOM 1657 CB SER A 109 37.369 75.747 27.815 1.00 0.00 C ATOM 1658 OG SER A 109 37.548 76.144 29.169 1.00 0.00 O ATOM 0 H SER A 109 35.332 76.979 28.441 1.00 0.00 H new ATOM 0 HA SER A 109 35.822 74.889 26.597 1.00 0.00 H new ATOM 0 HB2 SER A 109 38.128 75.017 27.535 1.00 0.00 H new ATOM 0 HB3 SER A 109 37.491 76.605 27.153 1.00 0.00 H new ATOM 0 HG SER A 109 38.442 76.528 29.282 1.00 0.00 H new ATOM 1664 N HIS A 110 35.165 73.995 29.623 1.00 0.00 N ATOM 1665 CA HIS A 110 34.980 72.849 30.510 1.00 0.00 C ATOM 1666 C HIS A 110 33.705 72.100 30.150 1.00 0.00 C ATOM 1667 O HIS A 110 33.666 70.867 30.169 1.00 0.00 O ATOM 1668 CB HIS A 110 34.904 73.318 31.961 1.00 0.00 C ATOM 1669 CG HIS A 110 36.276 73.721 32.428 1.00 0.00 C ATOM 1670 ND1 HIS A 110 36.790 74.988 32.209 1.00 0.00 N ATOM 1671 CD2 HIS A 110 37.254 73.032 33.104 1.00 0.00 C ATOM 1672 CE1 HIS A 110 38.024 75.024 32.742 1.00 0.00 C ATOM 1673 NE2 HIS A 110 38.358 73.858 33.301 1.00 0.00 N ATOM 0 H HIS A 110 34.729 74.858 29.947 1.00 0.00 H new ATOM 0 HA HIS A 110 35.831 72.179 30.391 1.00 0.00 H new ATOM 0 HB2 HIS A 110 34.217 74.160 32.047 1.00 0.00 H new ATOM 0 HB3 HIS A 110 34.512 72.521 32.593 1.00 0.00 H new ATOM 0 HD2 HIS A 110 37.178 72.006 33.433 1.00 0.00 H new ATOM 0 HE1 HIS A 110 38.667 75.891 32.721 1.00 0.00 H new ATOM 0 HE2 HIS A 110 39.232 73.623 33.771 1.00 0.00 H new ATOM 1681 N ALA A 111 32.653 72.848 29.816 1.00 0.00 N ATOM 1682 CA ALA A 111 31.377 72.241 29.442 1.00 0.00 C ATOM 1683 C ALA A 111 30.932 72.754 28.071 1.00 0.00 C ATOM 1684 O ALA A 111 30.069 73.634 27.979 1.00 0.00 O ATOM 1685 CB ALA A 111 30.315 72.563 30.493 1.00 0.00 C ATOM 0 H ALA A 111 32.659 73.868 29.797 1.00 0.00 H new ATOM 0 HA ALA A 111 31.504 71.160 29.389 1.00 0.00 H new ATOM 0 HB1 ALA A 111 29.368 72.106 30.205 1.00 0.00 H new ATOM 0 HB2 ALA A 111 30.629 72.169 31.460 1.00 0.00 H new ATOM 0 HB3 ALA A 111 30.190 73.643 30.565 1.00 0.00 H new ATOM 1691 N PRO A 112 31.485 72.220 27.021 1.00 0.00 N ATOM 1692 CA PRO A 112 31.135 72.629 25.635 1.00 0.00 C ATOM 1693 C PRO A 112 29.843 71.989 25.149 1.00 0.00 C ATOM 1694 O PRO A 112 29.676 70.771 25.225 1.00 0.00 O ATOM 1695 CB PRO A 112 32.329 72.142 24.806 1.00 0.00 C ATOM 1696 CG PRO A 112 32.901 70.985 25.571 1.00 0.00 C ATOM 1697 CD PRO A 112 32.505 71.163 27.039 1.00 0.00 C ATOM 0 HA PRO A 112 30.960 73.702 25.559 1.00 0.00 H new ATOM 0 HB2 PRO A 112 32.015 71.836 23.808 1.00 0.00 H new ATOM 0 HB3 PRO A 112 33.068 72.933 24.680 1.00 0.00 H new ATOM 0 HG2 PRO A 112 32.518 70.041 25.182 1.00 0.00 H new ATOM 0 HG3 PRO A 112 33.986 70.956 25.467 1.00 0.00 H new ATOM 0 HD2 PRO A 112 32.110 70.238 27.458 1.00 0.00 H new ATOM 0 HD3 PRO A 112 33.362 71.449 27.649 1.00 0.00 H new ATOM 1705 N THR A 113 28.927 72.816 24.652 1.00 0.00 N ATOM 1706 CA THR A 113 27.644 72.324 24.159 1.00 0.00 C ATOM 1707 C THR A 113 27.528 72.561 22.663 1.00 0.00 C ATOM 1708 O THR A 113 28.378 73.215 22.056 1.00 0.00 O ATOM 1709 CB THR A 113 26.495 73.015 24.890 1.00 0.00 C ATOM 1710 OG1 THR A 113 26.237 74.268 24.273 1.00 0.00 O ATOM 1711 CG2 THR A 113 26.874 73.230 26.354 1.00 0.00 C ATOM 0 H THR A 113 29.049 73.826 24.580 1.00 0.00 H new ATOM 0 HA THR A 113 27.587 71.252 24.350 1.00 0.00 H new ATOM 0 HB THR A 113 25.602 72.393 24.841 1.00 0.00 H new ATOM 0 HG1 THR A 113 27.083 74.738 24.120 1.00 0.00 H new ATOM 0 HG21 THR A 113 26.053 73.723 26.874 1.00 0.00 H new ATOM 0 HG22 THR A 113 27.074 72.267 26.823 1.00 0.00 H new ATOM 0 HG23 THR A 113 27.766 73.854 26.411 1.00 0.00 H new ATOM 1719 N PHE A 114 26.464 72.029 22.064 1.00 0.00 N ATOM 1720 CA PHE A 114 26.247 72.189 20.626 1.00 0.00 C ATOM 1721 C PHE A 114 24.788 72.521 20.340 1.00 0.00 C ATOM 1722 O PHE A 114 23.892 72.120 21.085 1.00 0.00 O ATOM 1723 CB PHE A 114 26.638 70.901 19.902 1.00 0.00 C ATOM 1724 CG PHE A 114 27.730 70.197 20.676 1.00 0.00 C ATOM 1725 CD1 PHE A 114 29.042 70.683 20.638 1.00 0.00 C ATOM 1726 CD2 PHE A 114 27.426 69.061 21.437 1.00 0.00 C ATOM 1727 CE1 PHE A 114 30.048 70.032 21.357 1.00 0.00 C ATOM 1728 CE2 PHE A 114 28.432 68.412 22.156 1.00 0.00 C ATOM 1729 CZ PHE A 114 29.744 68.894 22.115 1.00 0.00 C ATOM 0 H PHE A 114 25.745 71.489 22.545 1.00 0.00 H new ATOM 0 HA PHE A 114 26.867 73.011 20.266 1.00 0.00 H new ATOM 0 HB2 PHE A 114 25.770 70.249 19.803 1.00 0.00 H new ATOM 0 HB3 PHE A 114 26.982 71.129 18.893 1.00 0.00 H new ATOM 0 HD1 PHE A 114 29.277 71.560 20.054 1.00 0.00 H new ATOM 0 HD2 PHE A 114 26.413 68.687 21.468 1.00 0.00 H new ATOM 0 HE1 PHE A 114 31.061 70.407 21.328 1.00 0.00 H new ATOM 0 HE2 PHE A 114 28.197 67.537 22.744 1.00 0.00 H new ATOM 0 HZ PHE A 114 30.523 68.389 22.668 1.00 0.00 H new ATOM 1739 N THR A 115 24.552 73.242 19.247 1.00 0.00 N ATOM 1740 CA THR A 115 23.195 73.621 18.871 1.00 0.00 C ATOM 1741 C THR A 115 22.929 73.287 17.413 1.00 0.00 C ATOM 1742 O THR A 115 23.709 73.648 16.528 1.00 0.00 O ATOM 1743 CB THR A 115 22.997 75.122 19.097 1.00 0.00 C ATOM 1744 OG1 THR A 115 23.290 75.438 20.452 1.00 0.00 O ATOM 1745 CG2 THR A 115 21.547 75.501 18.788 1.00 0.00 C ATOM 0 H THR A 115 25.277 73.573 18.611 1.00 0.00 H new ATOM 0 HA THR A 115 22.495 73.061 19.491 1.00 0.00 H new ATOM 0 HB THR A 115 23.664 75.679 18.439 1.00 0.00 H new ATOM 0 HG1 THR A 115 23.165 76.399 20.598 1.00 0.00 H new ATOM 0 HG21 THR A 115 21.408 76.570 18.950 1.00 0.00 H new ATOM 0 HG22 THR A 115 21.321 75.258 17.750 1.00 0.00 H new ATOM 0 HG23 THR A 115 20.878 74.945 19.444 1.00 0.00 H new ATOM 1753 N SER A 116 21.819 72.597 17.158 1.00 0.00 N ATOM 1754 CA SER A 116 21.459 72.220 15.794 1.00 0.00 C ATOM 1755 C SER A 116 20.273 73.039 15.313 1.00 0.00 C ATOM 1756 O SER A 116 19.271 73.182 16.017 1.00 0.00 O ATOM 1757 CB SER A 116 21.108 70.733 15.741 1.00 0.00 C ATOM 1758 OG SER A 116 19.732 70.564 16.052 1.00 0.00 O ATOM 0 H SER A 116 21.159 72.290 17.872 1.00 0.00 H new ATOM 0 HA SER A 116 22.311 72.416 15.143 1.00 0.00 H new ATOM 0 HB2 SER A 116 21.320 70.333 14.750 1.00 0.00 H new ATOM 0 HB3 SER A 116 21.723 70.177 16.448 1.00 0.00 H new ATOM 0 HG SER A 116 19.377 71.397 16.427 1.00 0.00 H new ATOM 1764 N THR A 117 20.387 73.586 14.106 1.00 0.00 N ATOM 1765 CA THR A 117 19.318 74.400 13.536 1.00 0.00 C ATOM 1766 C THR A 117 18.861 73.834 12.202 1.00 0.00 C ATOM 1767 O THR A 117 19.675 73.391 11.390 1.00 0.00 O ATOM 1768 CB THR A 117 19.805 75.842 13.339 1.00 0.00 C ATOM 1769 OG1 THR A 117 20.075 76.426 14.605 1.00 0.00 O ATOM 1770 CG2 THR A 117 18.729 76.653 12.618 1.00 0.00 C ATOM 0 H THR A 117 21.205 73.481 13.506 1.00 0.00 H new ATOM 0 HA THR A 117 18.476 74.389 14.228 1.00 0.00 H new ATOM 0 HB THR A 117 20.715 75.839 12.739 1.00 0.00 H new ATOM 0 HG1 THR A 117 20.388 77.346 14.481 1.00 0.00 H new ATOM 0 HG21 THR A 117 19.077 77.677 12.479 1.00 0.00 H new ATOM 0 HG22 THR A 117 18.525 76.204 11.646 1.00 0.00 H new ATOM 0 HG23 THR A 117 17.816 76.658 13.214 1.00 0.00 H new ATOM 1778 N VAL A 118 17.548 73.846 11.976 1.00 0.00 N ATOM 1779 CA VAL A 118 16.995 73.331 10.729 1.00 0.00 C ATOM 1780 C VAL A 118 16.107 74.372 10.066 1.00 0.00 C ATOM 1781 O VAL A 118 15.098 74.805 10.632 1.00 0.00 O ATOM 1782 CB VAL A 118 16.173 72.068 11.005 1.00 0.00 C ATOM 1783 CG1 VAL A 118 14.892 72.440 11.758 1.00 0.00 C ATOM 1784 CG2 VAL A 118 15.808 71.398 9.678 1.00 0.00 C ATOM 0 H VAL A 118 16.855 74.203 12.634 1.00 0.00 H new ATOM 0 HA VAL A 118 17.822 73.093 10.060 1.00 0.00 H new ATOM 0 HB VAL A 118 16.761 71.380 11.612 1.00 0.00 H new ATOM 0 HG11 VAL A 118 14.310 71.539 11.953 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.151 72.916 12.704 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.302 73.130 11.154 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.223 70.499 9.873 1.00 0.00 H new ATOM 0 HG22 VAL A 118 15.222 72.088 9.071 1.00 0.00 H new ATOM 0 HG23 VAL A 118 16.719 71.129 9.143 1.00 0.00 H new ATOM 1794 N GLU A 119 16.483 74.783 8.862 1.00 0.00 N ATOM 1795 CA GLU A 119 15.711 75.781 8.126 1.00 0.00 C ATOM 1796 C GLU A 119 15.021 75.148 6.929 1.00 0.00 C ATOM 1797 O GLU A 119 15.668 74.762 5.953 1.00 0.00 O ATOM 1798 CB GLU A 119 16.630 76.909 7.641 1.00 0.00 C ATOM 1799 CG GLU A 119 15.791 78.008 6.985 1.00 0.00 C ATOM 1800 CD GLU A 119 16.688 79.167 6.564 1.00 0.00 C ATOM 1801 OE1 GLU A 119 17.818 79.214 7.022 1.00 0.00 O ATOM 1802 OE2 GLU A 119 16.232 79.992 5.790 1.00 0.00 O1- ATOM 0 H GLU A 119 17.313 74.444 8.375 1.00 0.00 H new ATOM 0 HA GLU A 119 14.956 76.189 8.798 1.00 0.00 H new ATOM 0 HB2 GLU A 119 17.193 77.319 8.479 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.357 76.519 6.929 1.00 0.00 H new ATOM 0 HG2 GLU A 119 15.268 77.608 6.116 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.030 78.361 7.681 1.00 0.00 H new ATOM 1809 N PHE A 120 13.696 75.025 7.011 1.00 0.00 N ATOM 1810 CA PHE A 120 12.923 74.429 5.924 1.00 0.00 C ATOM 1811 C PHE A 120 11.670 75.246 5.653 1.00 0.00 C ATOM 1812 O PHE A 120 10.913 75.562 6.572 1.00 0.00 O ATOM 1813 CB PHE A 120 12.529 72.994 6.283 1.00 0.00 C ATOM 1814 CG PHE A 120 11.567 73.011 7.445 1.00 0.00 C ATOM 1815 CD1 PHE A 120 12.050 72.965 8.758 1.00 0.00 C ATOM 1816 CD2 PHE A 120 10.187 73.076 7.210 1.00 0.00 C ATOM 1817 CE1 PHE A 120 11.157 72.981 9.835 1.00 0.00 C ATOM 1818 CE2 PHE A 120 9.293 73.091 8.287 1.00 0.00 C ATOM 1819 CZ PHE A 120 9.779 73.045 9.600 1.00 0.00 C ATOM 0 H PHE A 120 13.141 75.327 7.811 1.00 0.00 H new ATOM 0 HA PHE A 120 13.542 74.420 5.027 1.00 0.00 H new ATOM 0 HB2 PHE A 120 12.069 72.506 5.424 1.00 0.00 H new ATOM 0 HB3 PHE A 120 13.416 72.416 6.540 1.00 0.00 H new ATOM 0 HD1 PHE A 120 13.113 72.917 8.940 1.00 0.00 H new ATOM 0 HD2 PHE A 120 9.813 73.115 6.198 1.00 0.00 H new ATOM 0 HE1 PHE A 120 11.531 72.944 10.847 1.00 0.00 H new ATOM 0 HE2 PHE A 120 8.229 73.138 8.106 1.00 0.00 H new ATOM 0 HZ PHE A 120 9.090 73.059 10.431 1.00 0.00 H new ATOM 1829 N ALA A 121 11.460 75.596 4.392 1.00 0.00 N ATOM 1830 CA ALA A 121 10.293 76.388 4.011 1.00 0.00 C ATOM 1831 C ALA A 121 10.486 77.852 4.399 1.00 0.00 C ATOM 1832 O ALA A 121 9.530 78.629 4.425 1.00 0.00 O ATOM 1833 CB ALA A 121 9.040 75.837 4.689 1.00 0.00 C ATOM 0 H ALA A 121 12.076 75.348 3.618 1.00 0.00 H new ATOM 0 HA ALA A 121 10.175 76.325 2.929 1.00 0.00 H new ATOM 0 HB1 ALA A 121 8.176 76.435 4.398 1.00 0.00 H new ATOM 0 HB2 ALA A 121 8.885 74.803 4.382 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.163 75.880 5.771 1.00 0.00 H new ATOM 1839 N GLY A 122 11.723 78.221 4.706 1.00 0.00 N ATOM 1840 CA GLY A 122 12.029 79.596 5.092 1.00 0.00 C ATOM 1841 C GLY A 122 11.939 79.773 6.595 1.00 0.00 C ATOM 1842 O GLY A 122 12.308 80.818 7.136 1.00 0.00 O ATOM 0 H GLY A 122 12.527 77.594 4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 122 13.030 79.859 4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.336 80.278 4.600 1.00 0.00 H new ATOM 1846 N LYS A 123 11.437 78.751 7.278 1.00 0.00 N ATOM 1847 CA LYS A 123 11.295 78.810 8.735 1.00 0.00 C ATOM 1848 C LYS A 123 12.455 78.104 9.411 1.00 0.00 C ATOM 1849 O LYS A 123 12.789 76.968 9.075 1.00 0.00 O ATOM 1850 CB LYS A 123 9.978 78.152 9.160 1.00 0.00 C ATOM 1851 CG LYS A 123 8.808 79.085 8.837 1.00 0.00 C ATOM 1852 CD LYS A 123 7.493 78.406 9.220 1.00 0.00 C ATOM 1853 CE LYS A 123 6.322 79.319 8.848 1.00 0.00 C ATOM 1854 NZ LYS A 123 5.039 78.643 9.188 1.00 0.00 N1+ ATOM 0 H LYS A 123 11.123 77.878 6.855 1.00 0.00 H new ATOM 0 HA LYS A 123 11.293 79.857 9.039 1.00 0.00 H new ATOM 0 HB2 LYS A 123 9.851 77.201 8.642 1.00 0.00 H new ATOM 0 HB3 LYS A 123 9.997 77.933 10.228 1.00 0.00 H new ATOM 0 HG2 LYS A 123 8.917 80.023 9.381 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.807 79.330 7.775 1.00 0.00 H new ATOM 0 HD2 LYS A 123 7.401 77.450 8.705 1.00 0.00 H new ATOM 0 HD3 LYS A 123 7.478 78.194 10.289 1.00 0.00 H new ATOM 0 HE2 LYS A 123 6.400 80.265 9.383 1.00 0.00 H new ATOM 0 HE3 LYS A 123 6.352 79.552 7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 4.243 79.263 8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 4.965 77.751 8.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 5.012 78.443 10.208 1.00 0.00 H new ATOM 1868 N VAL A 124 13.081 78.785 10.369 1.00 0.00 N ATOM 1869 CA VAL A 124 14.217 78.212 11.078 1.00 0.00 C ATOM 1870 C VAL A 124 13.850 77.856 12.507 1.00 0.00 C ATOM 1871 O VAL A 124 13.452 78.716 13.295 1.00 0.00 O ATOM 1872 CB VAL A 124 15.377 79.223 11.097 1.00 0.00 C ATOM 1873 CG1 VAL A 124 14.996 80.425 11.966 1.00 0.00 C ATOM 1874 CG2 VAL A 124 16.629 78.553 11.674 1.00 0.00 C ATOM 0 H VAL A 124 12.822 79.725 10.668 1.00 0.00 H new ATOM 0 HA VAL A 124 14.516 77.302 10.557 1.00 0.00 H new ATOM 0 HB VAL A 124 15.580 79.560 10.081 1.00 0.00 H new ATOM 0 HG11 VAL A 124 15.818 81.140 11.979 1.00 0.00 H new ATOM 0 HG12 VAL A 124 14.106 80.903 11.556 1.00 0.00 H new ATOM 0 HG13 VAL A 124 14.792 80.089 12.983 1.00 0.00 H new ATOM 0 HG21 VAL A 124 17.451 79.269 11.688 1.00 0.00 H new ATOM 0 HG22 VAL A 124 16.425 78.215 12.690 1.00 0.00 H new ATOM 0 HG23 VAL A 124 16.902 77.698 11.055 1.00 0.00 H new ATOM 1884 N PHE A 125 13.965 76.574 12.841 1.00 0.00 N ATOM 1885 CA PHE A 125 13.630 76.102 14.182 1.00 0.00 C ATOM 1886 C PHE A 125 14.906 75.835 14.966 1.00 0.00 C ATOM 1887 O PHE A 125 15.936 75.458 14.395 1.00 0.00 O ATOM 1888 CB PHE A 125 12.791 74.831 14.102 1.00 0.00 C ATOM 1889 CG PHE A 125 11.571 75.089 13.256 1.00 0.00 C ATOM 1890 CD1 PHE A 125 11.706 75.279 11.875 1.00 0.00 C ATOM 1891 CD2 PHE A 125 10.300 75.133 13.846 1.00 0.00 C ATOM 1892 CE1 PHE A 125 10.574 75.512 11.085 1.00 0.00 C ATOM 1893 CE2 PHE A 125 9.171 75.367 13.054 1.00 0.00 C ATOM 1894 CZ PHE A 125 9.306 75.557 11.675 1.00 0.00 C ATOM 0 H PHE A 125 14.287 75.845 12.204 1.00 0.00 H new ATOM 0 HA PHE A 125 13.049 76.871 14.692 1.00 0.00 H new ATOM 0 HB2 PHE A 125 13.380 74.020 13.673 1.00 0.00 H new ATOM 0 HB3 PHE A 125 12.494 74.515 15.102 1.00 0.00 H new ATOM 0 HD1 PHE A 125 12.684 75.246 11.419 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.193 74.986 14.911 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.679 75.657 10.020 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.192 75.401 13.509 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.433 75.738 11.066 1.00 0.00 H new ATOM 1904 N SER A 126 14.840 76.018 16.282 1.00 0.00 N ATOM 1905 CA SER A 126 15.998 75.786 17.140 1.00 0.00 C ATOM 1906 C SER A 126 15.732 74.645 18.115 1.00 0.00 C ATOM 1907 O SER A 126 14.762 74.673 18.871 1.00 0.00 O ATOM 1908 CB SER A 126 16.324 77.059 17.922 1.00 0.00 C ATOM 1909 OG SER A 126 17.287 76.762 18.923 1.00 0.00 O ATOM 0 H SER A 126 14.002 76.325 16.775 1.00 0.00 H new ATOM 0 HA SER A 126 16.844 75.514 16.509 1.00 0.00 H new ATOM 0 HB2 SER A 126 16.708 77.825 17.248 1.00 0.00 H new ATOM 0 HB3 SER A 126 15.420 77.460 18.379 1.00 0.00 H new ATOM 0 HG SER A 126 17.499 77.577 19.425 1.00 0.00 H new ATOM 1915 N GLY A 127 16.601 73.641 18.094 1.00 0.00 N ATOM 1916 CA GLY A 127 16.452 72.496 18.986 1.00 0.00 C ATOM 1917 C GLY A 127 16.918 72.842 20.394 1.00 0.00 C ATOM 1918 O GLY A 127 17.338 73.969 20.662 1.00 0.00 O ATOM 0 H GLY A 127 17.410 73.596 17.475 1.00 0.00 H new ATOM 0 HA2 GLY A 127 15.408 72.182 19.011 1.00 0.00 H new ATOM 0 HA3 GLY A 127 17.029 71.654 18.604 1.00 0.00 H new ATOM 1922 N GLU A 128 16.842 71.870 21.296 1.00 0.00 N ATOM 1923 CA GLU A 128 17.261 72.083 22.669 1.00 0.00 C ATOM 1924 C GLU A 128 18.763 71.864 22.823 1.00 0.00 C ATOM 1925 O GLU A 128 19.278 70.799 22.485 1.00 0.00 O ATOM 1926 CB GLU A 128 16.508 71.124 23.605 1.00 0.00 C ATOM 1927 CG GLU A 128 17.288 70.946 24.912 1.00 0.00 C ATOM 1928 CD GLU A 128 16.396 70.343 25.982 1.00 0.00 C ATOM 1929 OE1 GLU A 128 15.329 69.866 25.633 1.00 0.00 O ATOM 1930 OE2 GLU A 128 16.789 70.374 27.135 1.00 0.00 O1- ATOM 0 H GLU A 128 16.495 70.931 21.099 1.00 0.00 H new ATOM 0 HA GLU A 128 17.029 73.114 22.935 1.00 0.00 H new ATOM 0 HB2 GLU A 128 15.513 71.516 23.816 1.00 0.00 H new ATOM 0 HB3 GLU A 128 16.374 70.158 23.118 1.00 0.00 H new ATOM 0 HG2 GLU A 128 18.151 70.302 24.743 1.00 0.00 H new ATOM 0 HG3 GLU A 128 17.671 71.909 25.249 1.00 0.00 H new ATOM 1937 N GLU A 129 19.447 72.871 23.334 1.00 0.00 N ATOM 1938 CA GLU A 129 20.894 72.778 23.533 1.00 0.00 C ATOM 1939 C GLU A 129 21.232 71.601 24.444 1.00 0.00 C ATOM 1940 O GLU A 129 20.462 71.264 25.345 1.00 0.00 O ATOM 1941 CB GLU A 129 21.424 74.073 24.151 1.00 0.00 C ATOM 1942 CG GLU A 129 21.263 75.220 23.152 1.00 0.00 C ATOM 1943 CD GLU A 129 21.731 76.528 23.780 1.00 0.00 C ATOM 1944 OE1 GLU A 129 22.183 76.490 24.913 1.00 0.00 O ATOM 1945 OE2 GLU A 129 21.629 77.550 23.120 1.00 0.00 O1- ATOM 0 H GLU A 129 19.034 73.759 23.619 1.00 0.00 H new ATOM 0 HA GLU A 129 21.366 72.622 22.563 1.00 0.00 H new ATOM 0 HB2 GLU A 129 20.882 74.298 25.069 1.00 0.00 H new ATOM 0 HB3 GLU A 129 22.474 73.956 24.421 1.00 0.00 H new ATOM 0 HG2 GLU A 129 21.841 75.012 22.251 1.00 0.00 H new ATOM 0 HG3 GLU A 129 20.219 75.305 22.849 1.00 0.00 H new ATOM 1952 N ALA A 130 22.383 70.981 24.203 1.00 0.00 N ATOM 1953 CA ALA A 130 22.811 69.848 25.009 1.00 0.00 C ATOM 1954 C ALA A 130 24.253 69.473 24.681 1.00 0.00 C ATOM 1955 O ALA A 130 24.778 69.843 23.633 1.00 0.00 O ATOM 1956 CB ALA A 130 21.896 68.649 24.752 1.00 0.00 C ATOM 0 H ALA A 130 23.031 71.244 23.460 1.00 0.00 H new ATOM 0 HA ALA A 130 22.752 70.129 26.060 1.00 0.00 H new ATOM 0 HB1 ALA A 130 22.223 67.805 25.359 1.00 0.00 H new ATOM 0 HB2 ALA A 130 20.871 68.910 25.016 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.941 68.376 23.698 1.00 0.00 H new ATOM 1962 N LYS A 131 24.884 68.728 25.579 1.00 0.00 N ATOM 1963 CA LYS A 131 26.262 68.292 25.376 1.00 0.00 C ATOM 1964 C LYS A 131 26.304 67.085 24.449 1.00 0.00 C ATOM 1965 O LYS A 131 27.136 66.190 24.613 1.00 0.00 O ATOM 1966 CB LYS A 131 26.907 67.935 26.714 1.00 0.00 C ATOM 1967 CG LYS A 131 27.194 69.218 27.499 1.00 0.00 C ATOM 1968 CD LYS A 131 27.823 68.858 28.848 1.00 0.00 C ATOM 1969 CE LYS A 131 28.184 70.140 29.600 1.00 0.00 C ATOM 1970 NZ LYS A 131 26.935 70.860 29.983 1.00 0.00 N1+ ATOM 0 H LYS A 131 24.466 68.413 26.454 1.00 0.00 H new ATOM 0 HA LYS A 131 26.818 69.111 24.919 1.00 0.00 H new ATOM 0 HB2 LYS A 131 26.246 67.285 27.287 1.00 0.00 H new ATOM 0 HB3 LYS A 131 27.832 67.382 26.548 1.00 0.00 H new ATOM 0 HG2 LYS A 131 27.866 69.862 26.932 1.00 0.00 H new ATOM 0 HG3 LYS A 131 26.271 69.777 27.653 1.00 0.00 H new ATOM 0 HD2 LYS A 131 27.127 68.261 29.438 1.00 0.00 H new ATOM 0 HD3 LYS A 131 28.715 68.250 28.695 1.00 0.00 H new ATOM 0 HE2 LYS A 131 28.766 69.901 30.490 1.00 0.00 H new ATOM 0 HE3 LYS A 131 28.807 70.778 28.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 27.156 71.581 30.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 26.528 71.320 29.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 26.249 70.182 30.373 1.00 0.00 H new ATOM 1984 N THR A 132 25.405 67.059 23.473 1.00 0.00 N ATOM 1985 CA THR A 132 25.342 65.947 22.526 1.00 0.00 C ATOM 1986 C THR A 132 24.770 66.412 21.189 1.00 0.00 C ATOM 1987 O THR A 132 23.856 67.234 21.149 1.00 0.00 O ATOM 1988 CB THR A 132 24.474 64.823 23.099 1.00 0.00 C ATOM 1989 OG1 THR A 132 23.691 64.254 22.061 1.00 0.00 O ATOM 1990 CG2 THR A 132 23.553 65.384 24.185 1.00 0.00 C ATOM 0 H THR A 132 24.712 67.790 23.315 1.00 0.00 H new ATOM 0 HA THR A 132 26.353 65.574 22.361 1.00 0.00 H new ATOM 0 HB THR A 132 25.117 64.057 23.533 1.00 0.00 H new ATOM 0 HG1 THR A 132 23.113 63.555 22.433 1.00 0.00 H new ATOM 0 HG21 THR A 132 22.937 64.581 24.590 1.00 0.00 H new ATOM 0 HG22 THR A 132 24.155 65.818 24.984 1.00 0.00 H new ATOM 0 HG23 THR A 132 22.911 66.153 23.756 1.00 0.00 H new ATOM 1998 N LYS A 133 25.306 65.871 20.102 1.00 0.00 N ATOM 1999 CA LYS A 133 24.836 66.229 18.774 1.00 0.00 C ATOM 2000 C LYS A 133 23.541 65.504 18.437 1.00 0.00 C ATOM 2001 O LYS A 133 22.599 66.100 17.919 1.00 0.00 O ATOM 2002 CB LYS A 133 25.904 65.883 17.732 1.00 0.00 C ATOM 2003 CG LYS A 133 27.025 66.928 17.772 1.00 0.00 C ATOM 2004 CD LYS A 133 27.899 66.690 19.006 1.00 0.00 C ATOM 2005 CE LYS A 133 29.169 67.531 18.900 1.00 0.00 C ATOM 2006 NZ LYS A 133 30.052 66.965 17.840 1.00 0.00 N1+ ATOM 0 H LYS A 133 26.062 65.187 20.115 1.00 0.00 H new ATOM 0 HA LYS A 133 24.644 67.302 18.760 1.00 0.00 H new ATOM 0 HB2 LYS A 133 26.311 64.892 17.930 1.00 0.00 H new ATOM 0 HB3 LYS A 133 25.459 65.852 16.738 1.00 0.00 H new ATOM 0 HG2 LYS A 133 27.629 66.864 16.867 1.00 0.00 H new ATOM 0 HG3 LYS A 133 26.601 67.932 17.801 1.00 0.00 H new ATOM 0 HD2 LYS A 133 27.350 66.953 19.910 1.00 0.00 H new ATOM 0 HD3 LYS A 133 28.155 65.633 19.085 1.00 0.00 H new ATOM 0 HE2 LYS A 133 28.915 68.564 18.664 1.00 0.00 H new ATOM 0 HE3 LYS A 133 29.692 67.542 19.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 31.035 67.258 18.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 29.992 65.927 17.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 29.746 67.315 16.910 1.00 0.00 H new ATOM 2020 N LYS A 134 23.506 64.209 18.730 1.00 0.00 N ATOM 2021 CA LYS A 134 22.326 63.403 18.438 1.00 0.00 C ATOM 2022 C LYS A 134 21.099 63.971 19.125 1.00 0.00 C ATOM 2023 O LYS A 134 20.046 64.137 18.506 1.00 0.00 O ATOM 2024 CB LYS A 134 22.556 61.960 18.896 1.00 0.00 C ATOM 2025 CG LYS A 134 23.038 61.956 20.348 1.00 0.00 C ATOM 2026 CD LYS A 134 23.422 60.534 20.756 1.00 0.00 C ATOM 2027 CE LYS A 134 23.970 60.544 22.185 1.00 0.00 C ATOM 2028 NZ LYS A 134 22.905 60.996 23.124 1.00 0.00 N1+ ATOM 0 H LYS A 134 24.274 63.698 19.166 1.00 0.00 H new ATOM 0 HA LYS A 134 22.156 63.420 17.361 1.00 0.00 H new ATOM 0 HB2 LYS A 134 21.633 61.387 18.807 1.00 0.00 H new ATOM 0 HB3 LYS A 134 23.294 61.477 18.255 1.00 0.00 H new ATOM 0 HG2 LYS A 134 23.894 62.621 20.459 1.00 0.00 H new ATOM 0 HG3 LYS A 134 22.253 62.334 21.003 1.00 0.00 H new ATOM 0 HD2 LYS A 134 22.553 59.879 20.693 1.00 0.00 H new ATOM 0 HD3 LYS A 134 24.171 60.137 20.071 1.00 0.00 H new ATOM 0 HE2 LYS A 134 24.313 59.547 22.461 1.00 0.00 H new ATOM 0 HE3 LYS A 134 24.832 61.207 22.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 23.116 61.961 23.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 21.986 60.988 22.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 22.868 60.355 23.942 1.00 0.00 H new ATOM 2042 N LEU A 135 21.233 64.267 20.404 1.00 0.00 N ATOM 2043 CA LEU A 135 20.120 64.815 21.174 1.00 0.00 C ATOM 2044 C LEU A 135 19.711 66.181 20.636 1.00 0.00 C ATOM 2045 O LEU A 135 18.526 66.472 20.490 1.00 0.00 O ATOM 2046 CB LEU A 135 20.522 64.954 22.651 1.00 0.00 C ATOM 2047 CG LEU A 135 19.263 64.974 23.527 1.00 0.00 C ATOM 2048 CD1 LEU A 135 18.623 63.576 23.533 1.00 0.00 C ATOM 2049 CD2 LEU A 135 19.641 65.370 24.956 1.00 0.00 C ATOM 0 H LEU A 135 22.095 64.140 20.934 1.00 0.00 H new ATOM 0 HA LEU A 135 19.276 64.132 21.084 1.00 0.00 H new ATOM 0 HB2 LEU A 135 21.167 64.125 22.942 1.00 0.00 H new ATOM 0 HB3 LEU A 135 21.094 65.870 22.798 1.00 0.00 H new ATOM 0 HG LEU A 135 18.553 65.698 23.127 1.00 0.00 H new ATOM 0 HD11 LEU A 135 17.728 63.588 24.155 1.00 0.00 H new ATOM 0 HD12 LEU A 135 18.353 63.295 22.515 1.00 0.00 H new ATOM 0 HD13 LEU A 135 19.333 62.852 23.933 1.00 0.00 H new ATOM 0 HD21 LEU A 135 18.746 65.384 25.578 1.00 0.00 H new ATOM 0 HD22 LEU A 135 20.351 64.647 25.358 1.00 0.00 H new ATOM 0 HD23 LEU A 135 20.095 66.361 24.951 1.00 0.00 H new ATOM 2061 N ALA A 136 20.705 67.015 20.340 1.00 0.00 N ATOM 2062 CA ALA A 136 20.435 68.350 19.822 1.00 0.00 C ATOM 2063 C ALA A 136 19.615 68.276 18.543 1.00 0.00 C ATOM 2064 O ALA A 136 18.596 68.956 18.405 1.00 0.00 O ATOM 2065 CB ALA A 136 21.754 69.078 19.545 1.00 0.00 C ATOM 0 H ALA A 136 21.694 66.792 20.449 1.00 0.00 H new ATOM 0 HA ALA A 136 19.865 68.900 20.571 1.00 0.00 H new ATOM 0 HB1 ALA A 136 21.545 70.075 19.158 1.00 0.00 H new ATOM 0 HB2 ALA A 136 22.325 69.160 20.470 1.00 0.00 H new ATOM 0 HB3 ALA A 136 22.332 68.517 18.810 1.00 0.00 H new ATOM 2071 N GLU A 137 20.062 67.448 17.608 1.00 0.00 N ATOM 2072 CA GLU A 137 19.359 67.296 16.338 1.00 0.00 C ATOM 2073 C GLU A 137 17.950 66.766 16.564 1.00 0.00 C ATOM 2074 O GLU A 137 16.996 67.216 15.928 1.00 0.00 O ATOM 2075 CB GLU A 137 20.132 66.337 15.426 1.00 0.00 C ATOM 2076 CG GLU A 137 21.455 66.980 15.007 1.00 0.00 C ATOM 2077 CD GLU A 137 22.279 65.992 14.188 1.00 0.00 C ATOM 2078 OE1 GLU A 137 21.832 64.867 14.030 1.00 0.00 O ATOM 2079 OE2 GLU A 137 23.341 66.376 13.725 1.00 0.00 O1- ATOM 0 H GLU A 137 20.901 66.875 17.702 1.00 0.00 H new ATOM 0 HA GLU A 137 19.291 68.274 15.862 1.00 0.00 H new ATOM 0 HB2 GLU A 137 20.321 65.398 15.946 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.537 66.099 14.544 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.262 67.879 14.421 1.00 0.00 H new ATOM 0 HG3 GLU A 137 22.015 67.289 15.890 1.00 0.00 H new ATOM 2086 N MET A 138 17.825 65.798 17.468 1.00 0.00 N ATOM 2087 CA MET A 138 16.525 65.209 17.760 1.00 0.00 C ATOM 2088 C MET A 138 15.546 66.274 18.239 1.00 0.00 C ATOM 2089 O MET A 138 14.401 66.325 17.789 1.00 0.00 O ATOM 2090 CB MET A 138 16.674 64.131 18.839 1.00 0.00 C ATOM 2091 CG MET A 138 15.320 63.468 19.090 1.00 0.00 C ATOM 2092 SD MET A 138 15.515 62.129 20.291 1.00 0.00 S ATOM 2093 CE MET A 138 15.271 63.121 21.783 1.00 0.00 C ATOM 0 H MET A 138 18.600 65.409 18.005 1.00 0.00 H new ATOM 0 HA MET A 138 16.137 64.762 16.845 1.00 0.00 H new ATOM 0 HB2 MET A 138 17.403 63.385 18.524 1.00 0.00 H new ATOM 0 HB3 MET A 138 17.050 64.574 19.761 1.00 0.00 H new ATOM 0 HG2 MET A 138 14.607 64.203 19.462 1.00 0.00 H new ATOM 0 HG3 MET A 138 14.916 63.077 18.156 1.00 0.00 H new ATOM 0 HE1 MET A 138 15.351 62.482 22.662 1.00 0.00 H new ATOM 0 HE2 MET A 138 16.032 63.900 21.830 1.00 0.00 H new ATOM 0 HE3 MET A 138 14.283 63.580 21.757 1.00 0.00 H new ATOM 2103 N SER A 139 16.004 67.123 19.148 1.00 0.00 N ATOM 2104 CA SER A 139 15.160 68.187 19.679 1.00 0.00 C ATOM 2105 C SER A 139 14.755 69.155 18.577 1.00 0.00 C ATOM 2106 O SER A 139 13.654 69.704 18.593 1.00 0.00 O ATOM 2107 CB SER A 139 15.903 68.946 20.781 1.00 0.00 C ATOM 2108 OG SER A 139 16.204 68.054 21.847 1.00 0.00 O ATOM 0 H SER A 139 16.949 67.098 19.532 1.00 0.00 H new ATOM 0 HA SER A 139 14.260 67.733 20.094 1.00 0.00 H new ATOM 0 HB2 SER A 139 16.821 69.379 20.384 1.00 0.00 H new ATOM 0 HB3 SER A 139 15.292 69.772 21.145 1.00 0.00 H new ATOM 0 HG SER A 139 16.948 67.472 21.586 1.00 0.00 H new ATOM 2114 N ALA A 140 15.655 69.366 17.623 1.00 0.00 N ATOM 2115 CA ALA A 140 15.384 70.280 16.516 1.00 0.00 C ATOM 2116 C ALA A 140 14.265 69.739 15.633 1.00 0.00 C ATOM 2117 O ALA A 140 13.338 70.463 15.273 1.00 0.00 O ATOM 2118 CB ALA A 140 16.649 70.478 15.681 1.00 0.00 C ATOM 0 H ALA A 140 16.572 68.921 17.592 1.00 0.00 H new ATOM 0 HA ALA A 140 15.070 71.238 16.930 1.00 0.00 H new ATOM 0 HB1 ALA A 140 16.438 71.161 14.858 1.00 0.00 H new ATOM 0 HB2 ALA A 140 17.437 70.897 16.307 1.00 0.00 H new ATOM 0 HB3 ALA A 140 16.975 69.518 15.282 1.00 0.00 H new ATOM 2124 N ALA A 141 14.362 68.463 15.282 1.00 0.00 N ATOM 2125 CA ALA A 141 13.351 67.836 14.444 1.00 0.00 C ATOM 2126 C ALA A 141 12.058 67.623 15.222 1.00 0.00 C ATOM 2127 O ALA A 141 10.978 67.521 14.642 1.00 0.00 O ATOM 2128 CB ALA A 141 13.858 66.481 13.936 1.00 0.00 C ATOM 0 H ALA A 141 15.125 67.847 15.563 1.00 0.00 H new ATOM 0 HA ALA A 141 13.153 68.498 13.601 1.00 0.00 H new ATOM 0 HB1 ALA A 141 13.095 66.019 13.310 1.00 0.00 H new ATOM 0 HB2 ALA A 141 14.767 66.628 13.352 1.00 0.00 H new ATOM 0 HB3 ALA A 141 14.073 65.832 14.785 1.00 0.00 H new ATOM 2134 N LYS A 142 12.175 67.575 16.544 1.00 0.00 N ATOM 2135 CA LYS A 142 11.010 67.377 17.395 1.00 0.00 C ATOM 2136 C LYS A 142 10.122 68.625 17.410 1.00 0.00 C ATOM 2137 O LYS A 142 8.907 68.533 17.247 1.00 0.00 O ATOM 2138 CB LYS A 142 11.453 67.059 18.827 1.00 0.00 C ATOM 2139 CG LYS A 142 10.228 66.735 19.685 1.00 0.00 C ATOM 2140 CD LYS A 142 10.679 66.361 21.100 1.00 0.00 C ATOM 2141 CE LYS A 142 9.456 66.010 21.949 1.00 0.00 C ATOM 2142 NZ LYS A 142 9.897 65.657 23.328 1.00 0.00 N1+ ATOM 0 H LYS A 142 13.058 67.670 17.046 1.00 0.00 H new ATOM 0 HA LYS A 142 10.438 66.542 16.991 1.00 0.00 H new ATOM 0 HB2 LYS A 142 12.142 66.214 18.826 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.990 67.908 19.249 1.00 0.00 H new ATOM 0 HG2 LYS A 142 9.558 67.594 19.721 1.00 0.00 H new ATOM 0 HG3 LYS A 142 9.667 65.912 19.241 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.364 65.514 21.063 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.222 67.191 21.551 1.00 0.00 H new ATOM 0 HE2 LYS A 142 8.767 66.854 21.980 1.00 0.00 H new ATOM 0 HE3 LYS A 142 8.917 65.175 21.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 9.067 65.418 23.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.539 64.840 23.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 10.393 66.467 23.752 1.00 0.00 H new ATOM 2156 N VAL A 143 10.745 69.786 17.604 1.00 0.00 N ATOM 2157 CA VAL A 143 10.008 71.041 17.642 1.00 0.00 C ATOM 2158 C VAL A 143 9.498 71.408 16.261 1.00 0.00 C ATOM 2159 O VAL A 143 8.407 71.962 16.112 1.00 0.00 O ATOM 2160 CB VAL A 143 10.904 72.153 18.182 1.00 0.00 C ATOM 2161 CG1 VAL A 143 12.148 72.273 17.301 1.00 0.00 C ATOM 2162 CG2 VAL A 143 10.137 73.479 18.158 1.00 0.00 C ATOM 0 H VAL A 143 11.752 69.881 17.736 1.00 0.00 H new ATOM 0 HA VAL A 143 9.150 70.918 18.303 1.00 0.00 H new ATOM 0 HB VAL A 143 11.200 71.920 19.205 1.00 0.00 H new ATOM 0 HG11 VAL A 143 12.790 73.066 17.684 1.00 0.00 H new ATOM 0 HG12 VAL A 143 12.693 71.329 17.310 1.00 0.00 H new ATOM 0 HG13 VAL A 143 11.849 72.509 16.280 1.00 0.00 H new ATOM 0 HG21 VAL A 143 10.774 74.275 18.543 1.00 0.00 H new ATOM 0 HG22 VAL A 143 9.844 73.712 17.134 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.246 73.395 18.780 1.00 0.00 H new ATOM 2172 N ALA A 144 10.293 71.103 15.248 1.00 0.00 N ATOM 2173 CA ALA A 144 9.912 71.408 13.871 1.00 0.00 C ATOM 2174 C ALA A 144 8.746 70.528 13.427 1.00 0.00 C ATOM 2175 O ALA A 144 7.759 71.019 12.885 1.00 0.00 O ATOM 2176 CB ALA A 144 11.106 71.185 12.933 1.00 0.00 C ATOM 0 H ALA A 144 11.200 70.648 15.348 1.00 0.00 H new ATOM 0 HA ALA A 144 9.603 72.452 13.825 1.00 0.00 H new ATOM 0 HB1 ALA A 144 10.812 71.415 11.909 1.00 0.00 H new ATOM 0 HB2 ALA A 144 11.928 71.836 13.229 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.427 70.145 12.994 1.00 0.00 H new ATOM 2182 N PHE A 145 8.876 69.227 13.656 1.00 0.00 N ATOM 2183 CA PHE A 145 7.833 68.292 13.260 1.00 0.00 C ATOM 2184 C PHE A 145 6.505 68.652 13.907 1.00 0.00 C ATOM 2185 O PHE A 145 5.475 68.711 13.237 1.00 0.00 O ATOM 2186 CB PHE A 145 8.229 66.868 13.676 1.00 0.00 C ATOM 2187 CG PHE A 145 7.216 65.883 13.140 1.00 0.00 C ATOM 2188 CD1 PHE A 145 7.339 65.393 11.833 1.00 0.00 C ATOM 2189 CD2 PHE A 145 6.150 65.467 13.946 1.00 0.00 C ATOM 2190 CE1 PHE A 145 6.401 64.481 11.337 1.00 0.00 C ATOM 2191 CE2 PHE A 145 5.210 64.555 13.447 1.00 0.00 C ATOM 2192 CZ PHE A 145 5.337 64.062 12.144 1.00 0.00 C ATOM 0 H PHE A 145 9.684 68.800 14.109 1.00 0.00 H new ATOM 0 HA PHE A 145 7.720 68.346 12.177 1.00 0.00 H new ATOM 0 HB2 PHE A 145 9.221 66.629 13.293 1.00 0.00 H new ATOM 0 HB3 PHE A 145 8.281 66.797 14.762 1.00 0.00 H new ATOM 0 HD1 PHE A 145 8.158 65.719 11.209 1.00 0.00 H new ATOM 0 HD2 PHE A 145 6.052 65.848 14.952 1.00 0.00 H new ATOM 0 HE1 PHE A 145 6.498 64.100 10.331 1.00 0.00 H new ATOM 0 HE2 PHE A 145 4.388 64.233 14.068 1.00 0.00 H new ATOM 0 HZ PHE A 145 4.614 63.358 11.761 1.00 0.00 H new ATOM 2202 N MET A 146 6.537 68.900 15.211 1.00 0.00 N ATOM 2203 CA MET A 146 5.322 69.252 15.938 1.00 0.00 C ATOM 2204 C MET A 146 4.776 70.596 15.472 1.00 0.00 C ATOM 2205 O MET A 146 3.564 70.800 15.428 1.00 0.00 O ATOM 2206 CB MET A 146 5.612 69.311 17.439 1.00 0.00 C ATOM 2207 CG MET A 146 5.638 67.893 18.011 1.00 0.00 C ATOM 2208 SD MET A 146 4.611 67.824 19.500 1.00 0.00 S ATOM 2209 CE MET A 146 4.008 66.132 19.282 1.00 0.00 C ATOM 0 H MET A 146 7.381 68.865 15.782 1.00 0.00 H new ATOM 0 HA MET A 146 4.573 68.486 15.738 1.00 0.00 H new ATOM 0 HB2 MET A 146 6.568 69.803 17.616 1.00 0.00 H new ATOM 0 HB3 MET A 146 4.850 69.904 17.944 1.00 0.00 H new ATOM 0 HG2 MET A 146 5.270 67.184 17.270 1.00 0.00 H new ATOM 0 HG3 MET A 146 6.662 67.604 18.249 1.00 0.00 H new ATOM 0 HE1 MET A 146 3.342 65.874 20.106 1.00 0.00 H new ATOM 0 HE2 MET A 146 3.465 66.058 18.340 1.00 0.00 H new ATOM 0 HE3 MET A 146 4.853 65.443 19.269 1.00 0.00 H new ATOM 2219 N SER A 147 5.680 71.507 15.130 1.00 0.00 N ATOM 2220 CA SER A 147 5.281 72.829 14.664 1.00 0.00 C ATOM 2221 C SER A 147 4.552 72.728 13.324 1.00 0.00 C ATOM 2222 O SER A 147 3.567 73.427 13.090 1.00 0.00 O ATOM 2223 CB SER A 147 6.505 73.724 14.517 1.00 0.00 C ATOM 2224 OG SER A 147 6.083 75.025 14.128 1.00 0.00 O ATOM 0 H SER A 147 6.688 71.356 15.166 1.00 0.00 H new ATOM 0 HA SER A 147 4.605 73.264 15.400 1.00 0.00 H new ATOM 0 HB2 SER A 147 7.052 73.771 15.459 1.00 0.00 H new ATOM 0 HB3 SER A 147 7.186 73.311 13.773 1.00 0.00 H new ATOM 0 HG SER A 147 6.602 75.697 14.617 1.00 0.00 H new ATOM 2230 N ILE A 148 5.044 71.849 12.453 1.00 0.00 N ATOM 2231 CA ILE A 148 4.430 71.655 11.146 1.00 0.00 C ATOM 2232 C ILE A 148 3.018 71.098 11.303 1.00 0.00 C ATOM 2233 O ILE A 148 2.134 71.382 10.491 1.00 0.00 O ATOM 2234 CB ILE A 148 5.272 70.700 10.308 1.00 0.00 C ATOM 2235 CG1 ILE A 148 6.598 71.375 9.949 1.00 0.00 C ATOM 2236 CG2 ILE A 148 4.520 70.340 9.024 1.00 0.00 C ATOM 2237 CD1 ILE A 148 7.556 70.337 9.360 1.00 0.00 C ATOM 0 H ILE A 148 5.861 71.264 12.629 1.00 0.00 H new ATOM 0 HA ILE A 148 4.376 72.619 10.640 1.00 0.00 H new ATOM 0 HB ILE A 148 5.465 69.792 10.879 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.427 72.177 9.231 1.00 0.00 H new ATOM 0 HG13 ILE A 148 7.039 71.830 10.836 1.00 0.00 H new ATOM 0 HG21 ILE A 148 5.125 69.657 8.427 1.00 0.00 H new ATOM 0 HG22 ILE A 148 3.575 69.860 9.278 1.00 0.00 H new ATOM 0 HG23 ILE A 148 4.324 71.246 8.451 1.00 0.00 H new ATOM 0 HD11 ILE A 148 8.500 70.817 9.104 1.00 0.00 H new ATOM 0 HD12 ILE A 148 7.736 69.551 10.093 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.115 69.903 8.463 1.00 0.00 H new