USER MOD reduce.3.24.130724 H: found=0, std=0, add=1049, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1051 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: B 71 GLN : amide:sc= -1.09 K(o=0.17,f=-2.1) USER MOD Set 1.2: B 75 THR OG1 : rot 60:sc= 1.26 USER MOD Set 2.1: B 35 LYS NZ :NH3+ -135:sc= 3.26 (180deg=-1.42) USER MOD Set 2.2: B 66 GLN : amide:sc= 1.74 K(o=5,f=-14!) USER MOD Set 3.1: B 27 HIS : no HD1:sc= 0.487 K(o=3,f=-8!) USER MOD Set 3.2: B 28 THR OG1 : rot 22:sc= 1.28 USER MOD Set 3.3: B 30 SER OG : rot 83:sc= 1.19 USER MOD Set 4.1: B 20 SER OG : rot 133:sc= 1.19 USER MOD Set 4.2: B 32 LYS NZ :NH3+ 160:sc= 1.26 (180deg=0.681) USER MOD Set 5.1: A 71 GLN : amide:sc= -0.111 K(o=0.68,f=0.17) USER MOD Set 5.2: A 75 THR OG1 : rot 35:sc= 0.792 USER MOD Set 6.1: A 69 ASN : amide:sc= 1.51 K(o=1.5,f=-12!) USER MOD Set 6.2: B 82 MET CE :methyl -167:sc= -0.051 (180deg=-0.365) USER MOD Set 7.1: A 31 LYS NZ :NH3+ 150:sc= 2.27 (180deg=-0.316!) USER MOD Set 7.2: A 66 GLN : amide:sc= 0.504 K(o=2.8,f=-7.1!) USER MOD Set 8.1: A 19 TYR OH : rot -155:sc= 0.541 USER MOD Set 8.2: A 40 LYS NZ :NH3+ 162:sc= 1.05 (180deg=-0.552!) USER MOD Set 9.1: A 17 HIS : no HE2:sc= -1.21 K(o=0.95,f=-11!) USER MOD Set 9.2: A 20 SER OG : rot -54:sc= 2.15 USER MOD Single : A 18 LYS NZ :NH3+ 169:sc= -0.351 (180deg=-0.523) USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= 1.24 (180deg=0.49) USER MOD Single : A 27 HIS : no HE2:sc= -1.31 K(o=-1.3,f=-3.2!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.00677 USER MOD Single : A 30 SER OG : rot 150:sc= 1.19 USER MOD Single : A 32 LYS NZ :NH3+ 168:sc= 0.13 (180deg=-0.521) USER MOD Single : A 35 LYS NZ :NH3+ 176:sc= 3.1 (180deg=2.93) USER MOD Single : A 39 GLN : amide:sc= -0.427 X(o=-0.43,f=-0.42) USER MOD Single : A 43 THR OG1 : rot 58:sc= 0.677 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 LYS NZ :NH3+ -137:sc= 2.26 (180deg=1.42) USER MOD Single : A 73 TYR OH : rot 133:sc= 1.15 USER MOD Single : A 82 MET CE :methyl -166:sc= -0.0361 (180deg=-0.293) USER MOD Single : A 84 TYR OH : rot -40:sc= 1.05 USER MOD Single : A 85 ASN : amide:sc= 0.801 K(o=0.8,f=-0.3) USER MOD Single : B 17 HIS : no HE2:sc= -2.14 K(o=-1.6,f=-6.2!) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot -161:sc= 0.667 USER MOD Single : B 26 LYS NZ :NH3+ 174:sc=-0.00324 (180deg=-0.0497) USER MOD Single : B 31 LYS NZ :NH3+ 170:sc= 3.4 (180deg=3.04) USER MOD Single : B 39 GLN : amide:sc= 0.831 K(o=0.83,f=0) USER MOD Single : B 40 LYS NZ :NH3+ 165:sc= 0.562 (180deg=-0.773) USER MOD Single : B 43 THR OG1 : rot 58:sc= 0.935 USER MOD Single : B 63 ASN : amide:sc= 0.999 K(o=1,f=-0.042) USER MOD Single : B 64 LYS NZ :NH3+ -175:sc= 0.598 (180deg=0.278) USER MOD Single : B 69 ASN : amide:sc= 1 K(o=1,f=-0.84) USER MOD Single : B 73 TYR OH : rot -38:sc= 1.06 USER MOD Single : B 84 TYR OH : rot -137:sc= 1.04 USER MOD Single : B 85 ASN : amide:sc= 1.06 K(o=1.1,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 113 N ILE A 9 1.270 -6.498 -4.255 1.00 0.00 N ATOM 114 CA ILE A 9 1.189 -5.226 -3.555 1.00 0.00 C ATOM 115 C ILE A 9 2.401 -5.124 -2.626 1.00 0.00 C ATOM 116 O ILE A 9 3.110 -4.117 -2.626 1.00 0.00 O ATOM 117 CB ILE A 9 -0.147 -5.119 -2.792 1.00 0.00 C ATOM 118 CG1 ILE A 9 -1.343 -5.395 -3.726 1.00 0.00 C ATOM 119 CG2 ILE A 9 -0.272 -3.726 -2.162 1.00 0.00 C ATOM 120 CD1 ILE A 9 -2.693 -5.320 -3.004 1.00 0.00 C ATOM 0 HA ILE A 9 1.210 -4.391 -4.256 1.00 0.00 H new ATOM 0 HB ILE A 9 -0.158 -5.873 -2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -1.333 -4.674 -4.543 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -1.229 -6.383 -4.171 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -1.217 -3.654 -1.624 1.00 0.00 H new ATOM 0 HG22 ILE A 9 0.554 -3.565 -1.469 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -0.242 -2.968 -2.945 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -3.496 -5.523 -3.712 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -2.719 -6.060 -2.204 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -2.825 -4.324 -2.582 1.00 0.00 H new ATOM 132 N GLY A 10 2.660 -6.201 -1.879 1.00 0.00 N ATOM 133 CA GLY A 10 3.841 -6.376 -1.055 1.00 0.00 C ATOM 134 C GLY A 10 5.112 -5.959 -1.793 1.00 0.00 C ATOM 135 O GLY A 10 5.922 -5.218 -1.245 1.00 0.00 O ATOM 0 H GLY A 10 2.025 -6.998 -1.836 1.00 0.00 H new ATOM 0 HA2 GLY A 10 3.739 -5.787 -0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 10 3.922 -7.420 -0.752 1.00 0.00 H new ATOM 139 N LEU A 11 5.293 -6.408 -3.038 1.00 0.00 N ATOM 140 CA LEU A 11 6.453 -6.075 -3.850 1.00 0.00 C ATOM 141 C LEU A 11 6.446 -4.582 -4.177 1.00 0.00 C ATOM 142 O LEU A 11 7.439 -3.900 -3.933 1.00 0.00 O ATOM 143 CB LEU A 11 6.489 -6.982 -5.094 1.00 0.00 C ATOM 144 CG LEU A 11 7.739 -6.892 -5.991 1.00 0.00 C ATOM 145 CD1 LEU A 11 7.705 -5.704 -6.961 1.00 0.00 C ATOM 146 CD2 LEU A 11 9.049 -6.910 -5.194 1.00 0.00 C ATOM 0 H LEU A 11 4.627 -7.020 -3.510 1.00 0.00 H new ATOM 0 HA LEU A 11 7.376 -6.263 -3.301 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.384 -8.015 -4.763 1.00 0.00 H new ATOM 0 HB3 LEU A 11 5.616 -6.753 -5.705 1.00 0.00 H new ATOM 0 HG LEU A 11 7.712 -7.799 -6.595 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.614 -5.699 -7.563 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.838 -5.793 -7.615 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.639 -4.774 -6.396 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.893 -6.844 -5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 11 9.070 -6.062 -4.510 1.00 0.00 H new ATOM 0 HD23 LEU A 11 9.116 -7.837 -4.625 1.00 0.00 H new ATOM 158 N LEU A 12 5.335 -4.055 -4.707 1.00 0.00 N ATOM 159 CA LEU A 12 5.235 -2.634 -5.048 1.00 0.00 C ATOM 160 C LEU A 12 5.609 -1.744 -3.854 1.00 0.00 C ATOM 161 O LEU A 12 6.388 -0.798 -4.000 1.00 0.00 O ATOM 162 CB LEU A 12 3.828 -2.285 -5.565 1.00 0.00 C ATOM 163 CG LEU A 12 3.702 -2.382 -7.095 1.00 0.00 C ATOM 164 CD1 LEU A 12 3.881 -3.809 -7.621 1.00 0.00 C ATOM 165 CD2 LEU A 12 2.325 -1.864 -7.523 1.00 0.00 C ATOM 0 H LEU A 12 4.493 -4.594 -4.908 1.00 0.00 H new ATOM 0 HA LEU A 12 5.949 -2.440 -5.848 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.102 -2.955 -5.104 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.573 -1.273 -5.250 1.00 0.00 H new ATOM 0 HG LEU A 12 4.502 -1.776 -7.520 1.00 0.00 H new ATOM 0 HD11 LEU A 12 3.781 -3.812 -8.706 1.00 0.00 H new ATOM 0 HD12 LEU A 12 4.870 -4.177 -7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.120 -4.456 -7.185 1.00 0.00 H new ATOM 0 HD21 LEU A 12 2.232 -1.931 -8.607 1.00 0.00 H new ATOM 0 HD22 LEU A 12 1.548 -2.467 -7.054 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.215 -0.825 -7.213 1.00 0.00 H new ATOM 177 N ILE A 13 5.053 -2.037 -2.677 1.00 0.00 N ATOM 178 CA ILE A 13 5.395 -1.334 -1.446 1.00 0.00 C ATOM 179 C ILE A 13 6.855 -1.612 -1.089 1.00 0.00 C ATOM 180 O ILE A 13 7.582 -0.700 -0.707 1.00 0.00 O ATOM 181 CB ILE A 13 4.452 -1.742 -0.299 1.00 0.00 C ATOM 182 CG1 ILE A 13 3.000 -1.371 -0.656 1.00 0.00 C ATOM 183 CG2 ILE A 13 4.894 -1.051 1.006 1.00 0.00 C ATOM 184 CD1 ILE A 13 1.982 -1.972 0.318 1.00 0.00 C ATOM 0 H ILE A 13 4.353 -2.769 -2.554 1.00 0.00 H new ATOM 0 HA ILE A 13 5.270 -0.262 -1.601 1.00 0.00 H new ATOM 0 HB ILE A 13 4.501 -2.821 -0.152 1.00 0.00 H new ATOM 0 HG12 ILE A 13 2.897 -0.286 -0.660 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.779 -1.716 -1.666 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.225 -1.341 1.816 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.912 -1.353 1.251 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.858 0.031 0.875 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.976 -1.679 0.019 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.063 -3.059 0.304 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.182 -1.607 1.325 1.00 0.00 H new ATOM 196 N GLY A 14 7.275 -2.872 -1.195 1.00 0.00 N ATOM 197 CA GLY A 14 8.614 -3.337 -0.892 1.00 0.00 C ATOM 198 C GLY A 14 9.664 -2.486 -1.594 1.00 0.00 C ATOM 199 O GLY A 14 10.557 -1.962 -0.944 1.00 0.00 O ATOM 0 H GLY A 14 6.660 -3.623 -1.508 1.00 0.00 H new ATOM 0 HA2 GLY A 14 8.778 -3.306 0.185 1.00 0.00 H new ATOM 0 HA3 GLY A 14 8.719 -4.377 -1.201 1.00 0.00 H new ATOM 203 N ILE A 15 9.557 -2.325 -2.912 1.00 0.00 N ATOM 204 CA ILE A 15 10.477 -1.501 -3.685 1.00 0.00 C ATOM 205 C ILE A 15 10.465 -0.062 -3.150 1.00 0.00 C ATOM 206 O ILE A 15 11.492 0.429 -2.676 1.00 0.00 O ATOM 207 CB ILE A 15 10.106 -1.603 -5.175 1.00 0.00 C ATOM 208 CG1 ILE A 15 10.272 -3.035 -5.718 1.00 0.00 C ATOM 209 CG2 ILE A 15 10.872 -0.598 -6.046 1.00 0.00 C ATOM 210 CD1 ILE A 15 11.654 -3.664 -5.498 1.00 0.00 C ATOM 0 H ILE A 15 8.827 -2.765 -3.473 1.00 0.00 H new ATOM 0 HA ILE A 15 11.502 -1.857 -3.581 1.00 0.00 H new ATOM 0 HB ILE A 15 9.049 -1.343 -5.235 1.00 0.00 H new ATOM 0 HG12 ILE A 15 9.522 -3.673 -5.250 1.00 0.00 H new ATOM 0 HG13 ILE A 15 10.061 -3.027 -6.787 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.571 -0.715 -7.087 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.647 0.416 -5.715 1.00 0.00 H new ATOM 0 HG23 ILE A 15 11.943 -0.780 -5.956 1.00 0.00 H new ATOM 0 HD11 ILE A 15 11.666 -4.671 -5.916 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.413 -3.057 -5.991 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.866 -3.712 -4.430 1.00 0.00 H new ATOM 222 N PHE A 16 9.294 0.589 -3.204 1.00 0.00 N ATOM 223 CA PHE A 16 9.057 1.931 -2.675 1.00 0.00 C ATOM 224 C PHE A 16 9.789 2.146 -1.356 1.00 0.00 C ATOM 225 O PHE A 16 10.613 3.051 -1.238 1.00 0.00 O ATOM 226 CB PHE A 16 7.544 2.151 -2.526 1.00 0.00 C ATOM 227 CG PHE A 16 7.146 3.437 -1.837 1.00 0.00 C ATOM 228 CD1 PHE A 16 7.482 4.671 -2.418 1.00 0.00 C ATOM 229 CD2 PHE A 16 6.336 3.404 -0.687 1.00 0.00 C ATOM 230 CE1 PHE A 16 7.143 5.867 -1.769 1.00 0.00 C ATOM 231 CE2 PHE A 16 5.922 4.606 -0.088 1.00 0.00 C ATOM 232 CZ PHE A 16 6.414 5.834 -0.571 1.00 0.00 C ATOM 0 H PHE A 16 8.463 0.180 -3.631 1.00 0.00 H new ATOM 0 HA PHE A 16 9.455 2.667 -3.373 1.00 0.00 H new ATOM 0 HB2 PHE A 16 7.091 2.133 -3.517 1.00 0.00 H new ATOM 0 HB3 PHE A 16 7.124 1.314 -1.969 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.001 4.699 -3.364 1.00 0.00 H new ATOM 0 HD2 PHE A 16 6.033 2.457 -0.265 1.00 0.00 H new ATOM 0 HE1 PHE A 16 7.443 6.814 -2.192 1.00 0.00 H new ATOM 0 HE2 PHE A 16 5.229 4.588 0.740 1.00 0.00 H new ATOM 0 HZ PHE A 16 6.231 6.746 -0.022 1.00 0.00 H new ATOM 242 N HIS A 17 9.475 1.316 -0.361 1.00 0.00 N ATOM 243 CA HIS A 17 9.938 1.523 0.994 1.00 0.00 C ATOM 244 C HIS A 17 11.283 0.850 1.311 1.00 0.00 C ATOM 245 O HIS A 17 11.904 1.224 2.304 1.00 0.00 O ATOM 246 CB HIS A 17 8.770 1.339 1.993 1.00 0.00 C ATOM 247 CG HIS A 17 8.404 2.625 2.690 1.00 0.00 C ATOM 248 ND1 HIS A 17 9.311 3.637 2.914 1.00 0.00 N ATOM 249 CD2 HIS A 17 7.168 3.205 2.571 1.00 0.00 C ATOM 250 CE1 HIS A 17 8.672 4.797 2.779 1.00 0.00 C ATOM 251 NE2 HIS A 17 7.357 4.573 2.654 1.00 0.00 N ATOM 0 H HIS A 17 8.894 0.486 -0.480 1.00 0.00 H new ATOM 0 HA HIS A 17 10.235 2.564 1.120 1.00 0.00 H new ATOM 0 HB2 HIS A 17 7.898 0.955 1.463 1.00 0.00 H new ATOM 0 HB3 HIS A 17 9.045 0.591 2.737 1.00 0.00 H new ATOM 0 HD1 HIS A 17 10.298 3.519 3.143 1.00 0.00 H new ATOM 0 HD2 HIS A 17 6.227 2.692 2.438 1.00 0.00 H new ATOM 0 HE1 HIS A 17 9.142 5.770 2.771 1.00 0.00 H new ATOM 259 N LYS A 18 11.794 -0.054 0.464 1.00 0.00 N ATOM 260 CA LYS A 18 13.183 -0.511 0.561 1.00 0.00 C ATOM 261 C LYS A 18 14.065 0.711 0.337 1.00 0.00 C ATOM 262 O LYS A 18 15.030 0.935 1.067 1.00 0.00 O ATOM 263 CB LYS A 18 13.522 -1.600 -0.481 1.00 0.00 C ATOM 264 CG LYS A 18 15.033 -1.925 -0.526 1.00 0.00 C ATOM 265 CD LYS A 18 15.356 -3.094 -1.475 1.00 0.00 C ATOM 266 CE LYS A 18 16.873 -3.368 -1.588 1.00 0.00 C ATOM 267 NZ LYS A 18 17.602 -2.545 -2.588 1.00 0.00 N ATOM 0 H LYS A 18 11.264 -0.482 -0.295 1.00 0.00 H new ATOM 0 HA LYS A 18 13.348 -0.962 1.540 1.00 0.00 H new ATOM 0 HB2 LYS A 18 12.965 -2.508 -0.248 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.195 -1.270 -1.467 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.583 -1.039 -0.845 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.379 -2.170 0.478 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.854 -3.994 -1.120 1.00 0.00 H new ATOM 0 HD3 LYS A 18 14.956 -2.875 -2.465 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.327 -3.206 -0.610 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.016 -4.420 -1.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.627 -2.668 -2.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.336 -2.847 -3.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 17.355 -1.543 -2.460 1.00 0.00 H new ATOM 281 N TYR A 19 13.723 1.507 -0.680 1.00 0.00 N ATOM 282 CA TYR A 19 14.479 2.683 -1.089 1.00 0.00 C ATOM 283 C TYR A 19 14.187 3.861 -0.155 1.00 0.00 C ATOM 284 O TYR A 19 13.872 4.975 -0.572 1.00 0.00 O ATOM 285 CB TYR A 19 14.139 2.965 -2.569 1.00 0.00 C ATOM 286 CG TYR A 19 14.480 1.899 -3.596 1.00 0.00 C ATOM 287 CD1 TYR A 19 15.187 0.745 -3.220 1.00 0.00 C ATOM 288 CD2 TYR A 19 13.936 1.977 -4.896 1.00 0.00 C ATOM 289 CE1 TYR A 19 15.167 -0.381 -4.050 1.00 0.00 C ATOM 290 CE2 TYR A 19 14.051 0.890 -5.777 1.00 0.00 C ATOM 291 CZ TYR A 19 14.656 -0.295 -5.346 1.00 0.00 C ATOM 292 OH TYR A 19 14.783 -1.368 -6.168 1.00 0.00 O ATOM 0 H TYR A 19 12.894 1.344 -1.251 1.00 0.00 H new ATOM 0 HA TYR A 19 15.553 2.516 -1.011 1.00 0.00 H new ATOM 0 HB2 TYR A 19 13.069 3.161 -2.634 1.00 0.00 H new ATOM 0 HB3 TYR A 19 14.649 3.883 -2.859 1.00 0.00 H new ATOM 0 HD1 TYR A 19 15.743 0.727 -2.295 1.00 0.00 H new ATOM 0 HD2 TYR A 19 13.429 2.876 -5.214 1.00 0.00 H new ATOM 0 HE1 TYR A 19 15.549 -1.323 -3.686 1.00 0.00 H new ATOM 0 HE2 TYR A 19 13.673 0.969 -6.786 1.00 0.00 H new ATOM 0 HH TYR A 19 14.767 -1.069 -7.101 1.00 0.00 H new ATOM 302 N SER A 20 14.339 3.611 1.146 1.00 0.00 N ATOM 303 CA SER A 20 14.184 4.609 2.179 1.00 0.00 C ATOM 304 C SER A 20 14.860 4.125 3.461 1.00 0.00 C ATOM 305 O SER A 20 14.329 4.238 4.573 1.00 0.00 O ATOM 306 CB SER A 20 12.701 4.911 2.343 1.00 0.00 C ATOM 307 OG SER A 20 12.028 3.804 2.909 1.00 0.00 O ATOM 0 H SER A 20 14.578 2.688 1.508 1.00 0.00 H new ATOM 0 HA SER A 20 14.675 5.545 1.911 1.00 0.00 H new ATOM 0 HB2 SER A 20 12.571 5.787 2.979 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.264 5.153 1.374 1.00 0.00 H new ATOM 0 HG SER A 20 12.208 3.003 2.374 1.00 0.00 H new ATOM 376 N LYS A 26 11.113 5.657 6.531 1.00 0.00 N ATOM 377 CA LYS A 26 9.926 4.812 6.392 1.00 0.00 C ATOM 378 C LYS A 26 8.627 5.637 6.396 1.00 0.00 C ATOM 379 O LYS A 26 7.736 5.441 7.222 1.00 0.00 O ATOM 380 CB LYS A 26 9.956 3.672 7.420 1.00 0.00 C ATOM 381 CG LYS A 26 11.246 2.843 7.261 1.00 0.00 C ATOM 382 CD LYS A 26 12.209 3.046 8.441 1.00 0.00 C ATOM 383 CE LYS A 26 13.683 2.841 8.054 1.00 0.00 C ATOM 384 NZ LYS A 26 14.227 3.971 7.271 1.00 0.00 N ATOM 0 HA LYS A 26 9.943 4.338 5.411 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.900 4.081 8.429 1.00 0.00 H new ATOM 0 HB3 LYS A 26 9.085 3.031 7.288 1.00 0.00 H new ATOM 0 HG2 LYS A 26 10.990 1.787 7.179 1.00 0.00 H new ATOM 0 HG3 LYS A 26 11.745 3.123 6.333 1.00 0.00 H new ATOM 0 HD2 LYS A 26 12.080 4.052 8.839 1.00 0.00 H new ATOM 0 HD3 LYS A 26 11.948 2.351 9.239 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.278 2.711 8.958 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.778 1.923 7.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.235 4.096 7.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.121 3.773 6.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.708 4.840 7.510 1.00 0.00 H new ATOM 398 N HIS A 27 8.531 6.588 5.462 1.00 0.00 N ATOM 399 CA HIS A 27 7.400 7.445 5.148 1.00 0.00 C ATOM 400 C HIS A 27 7.457 7.661 3.630 1.00 0.00 C ATOM 401 O HIS A 27 6.592 7.181 2.896 1.00 0.00 O ATOM 402 CB HIS A 27 7.464 8.784 5.918 1.00 0.00 C ATOM 403 CG HIS A 27 8.232 8.743 7.221 1.00 0.00 C ATOM 404 ND1 HIS A 27 7.979 7.886 8.278 1.00 0.00 N ATOM 405 CD2 HIS A 27 9.453 9.325 7.431 1.00 0.00 C ATOM 406 CE1 HIS A 27 9.028 7.950 9.117 1.00 0.00 C ATOM 407 NE2 HIS A 27 9.929 8.818 8.625 1.00 0.00 N ATOM 0 H HIS A 27 9.323 6.791 4.852 1.00 0.00 H new ATOM 0 HA HIS A 27 6.459 6.986 5.450 1.00 0.00 H new ATOM 0 HB2 HIS A 27 7.917 9.535 5.271 1.00 0.00 H new ATOM 0 HB3 HIS A 27 6.446 9.114 6.125 1.00 0.00 H new ATOM 0 HD1 HIS A 27 7.146 7.309 8.399 1.00 0.00 H new ATOM 0 HD2 HIS A 27 9.947 10.040 6.790 1.00 0.00 H new ATOM 0 HE1 HIS A 27 9.130 7.394 10.037 1.00 0.00 H new ATOM 415 N THR A 28 8.547 8.285 3.171 1.00 0.00 N ATOM 416 CA THR A 28 8.788 8.751 1.809 1.00 0.00 C ATOM 417 C THR A 28 9.965 7.996 1.168 1.00 0.00 C ATOM 418 O THR A 28 10.757 7.364 1.858 1.00 0.00 O ATOM 419 CB THR A 28 9.048 10.267 1.884 1.00 0.00 C ATOM 420 OG1 THR A 28 9.473 10.648 3.185 1.00 0.00 O ATOM 421 CG2 THR A 28 7.754 11.035 1.602 1.00 0.00 C ATOM 0 H THR A 28 9.335 8.490 3.786 1.00 0.00 H new ATOM 0 HA THR A 28 7.924 8.555 1.174 1.00 0.00 H new ATOM 0 HB THR A 28 9.818 10.498 1.148 1.00 0.00 H new ATOM 0 HG1 THR A 28 9.633 11.615 3.207 1.00 0.00 H new ATOM 0 HG21 THR A 28 7.947 12.106 1.657 1.00 0.00 H new ATOM 0 HG22 THR A 28 7.391 10.783 0.606 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.001 10.764 2.342 1.00 0.00 H new ATOM 429 N LEU A 29 10.063 8.013 -0.159 1.00 0.00 N ATOM 430 CA LEU A 29 11.074 7.301 -0.931 1.00 0.00 C ATOM 431 C LEU A 29 12.225 8.268 -1.196 1.00 0.00 C ATOM 432 O LEU A 29 11.996 9.365 -1.700 1.00 0.00 O ATOM 433 CB LEU A 29 10.402 6.758 -2.202 1.00 0.00 C ATOM 434 CG LEU A 29 11.294 6.575 -3.434 1.00 0.00 C ATOM 435 CD1 LEU A 29 12.471 5.655 -3.148 1.00 0.00 C ATOM 436 CD2 LEU A 29 10.493 5.928 -4.564 1.00 0.00 C ATOM 0 H LEU A 29 9.417 8.542 -0.745 1.00 0.00 H new ATOM 0 HA LEU A 29 11.494 6.444 -0.405 1.00 0.00 H new ATOM 0 HB2 LEU A 29 9.952 5.794 -1.963 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.588 7.432 -2.470 1.00 0.00 H new ATOM 0 HG LEU A 29 11.656 7.565 -3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.079 5.551 -4.047 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.077 6.078 -2.347 1.00 0.00 H new ATOM 0 HD13 LEU A 29 12.102 4.675 -2.845 1.00 0.00 H new ATOM 0 HD21 LEU A 29 11.133 5.801 -5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.125 4.955 -4.239 1.00 0.00 H new ATOM 0 HD23 LEU A 29 9.649 6.567 -4.823 1.00 0.00 H new ATOM 448 N SER A 30 13.451 7.887 -0.829 1.00 0.00 N ATOM 449 CA SER A 30 14.612 8.743 -1.015 1.00 0.00 C ATOM 450 C SER A 30 14.883 8.950 -2.508 1.00 0.00 C ATOM 451 O SER A 30 14.998 7.972 -3.244 1.00 0.00 O ATOM 452 CB SER A 30 15.839 8.076 -0.401 1.00 0.00 C ATOM 453 OG SER A 30 15.615 7.634 0.921 1.00 0.00 O ATOM 0 H SER A 30 13.660 6.986 -0.400 1.00 0.00 H new ATOM 0 HA SER A 30 14.415 9.702 -0.536 1.00 0.00 H new ATOM 0 HB2 SER A 30 16.133 7.227 -1.018 1.00 0.00 H new ATOM 0 HB3 SER A 30 16.672 8.779 -0.408 1.00 0.00 H new ATOM 0 HG SER A 30 16.167 6.844 1.100 1.00 0.00 H new ATOM 459 N LYS A 31 15.082 10.190 -2.960 1.00 0.00 N ATOM 460 CA LYS A 31 15.431 10.458 -4.356 1.00 0.00 C ATOM 461 C LYS A 31 16.675 9.682 -4.803 1.00 0.00 C ATOM 462 O LYS A 31 16.813 9.328 -5.970 1.00 0.00 O ATOM 463 CB LYS A 31 15.621 11.968 -4.588 1.00 0.00 C ATOM 464 CG LYS A 31 16.776 12.560 -3.763 1.00 0.00 C ATOM 465 CD LYS A 31 17.052 14.021 -4.136 1.00 0.00 C ATOM 466 CE LYS A 31 18.129 14.613 -3.214 1.00 0.00 C ATOM 467 NZ LYS A 31 17.594 14.968 -1.884 1.00 0.00 N ATOM 0 H LYS A 31 15.007 11.025 -2.379 1.00 0.00 H new ATOM 0 HA LYS A 31 14.598 10.110 -4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 31 15.809 12.147 -5.647 1.00 0.00 H new ATOM 0 HB3 LYS A 31 14.697 12.488 -4.336 1.00 0.00 H new ATOM 0 HG2 LYS A 31 16.535 12.495 -2.702 1.00 0.00 H new ATOM 0 HG3 LYS A 31 17.677 11.968 -3.922 1.00 0.00 H new ATOM 0 HD2 LYS A 31 17.378 14.083 -5.174 1.00 0.00 H new ATOM 0 HD3 LYS A 31 16.134 14.604 -4.055 1.00 0.00 H new ATOM 0 HE2 LYS A 31 18.940 13.894 -3.097 1.00 0.00 H new ATOM 0 HE3 LYS A 31 18.556 15.501 -3.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 18.345 14.872 -1.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 17.253 15.951 -1.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 16.807 14.332 -1.646 1.00 0.00 H new ATOM 481 N LYS A 32 17.607 9.450 -3.876 1.00 0.00 N ATOM 482 CA LYS A 32 18.852 8.773 -4.173 1.00 0.00 C ATOM 483 C LYS A 32 18.587 7.277 -4.335 1.00 0.00 C ATOM 484 O LYS A 32 18.827 6.743 -5.413 1.00 0.00 O ATOM 485 CB LYS A 32 19.876 9.152 -3.099 1.00 0.00 C ATOM 486 CG LYS A 32 21.289 8.609 -3.374 1.00 0.00 C ATOM 487 CD LYS A 32 21.629 7.317 -2.616 1.00 0.00 C ATOM 488 CE LYS A 32 22.053 7.566 -1.159 1.00 0.00 C ATOM 489 NZ LYS A 32 20.948 8.076 -0.330 1.00 0.00 N ATOM 0 H LYS A 32 17.511 9.730 -2.900 1.00 0.00 H new ATOM 0 HA LYS A 32 19.285 9.086 -5.123 1.00 0.00 H new ATOM 0 HB2 LYS A 32 19.922 10.238 -3.021 1.00 0.00 H new ATOM 0 HB3 LYS A 32 19.534 8.777 -2.134 1.00 0.00 H new ATOM 0 HG2 LYS A 32 21.394 8.427 -4.444 1.00 0.00 H new ATOM 0 HG3 LYS A 32 22.018 9.375 -3.108 1.00 0.00 H new ATOM 0 HD2 LYS A 32 20.762 6.657 -2.628 1.00 0.00 H new ATOM 0 HD3 LYS A 32 22.432 6.797 -3.138 1.00 0.00 H new ATOM 0 HE2 LYS A 32 22.427 6.637 -0.729 1.00 0.00 H new ATOM 0 HE3 LYS A 32 22.876 8.280 -1.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 21.219 8.036 0.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 20.742 9.061 -0.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 20.101 7.492 -0.483 1.00 0.00 H new ATOM 503 N GLU A 33 18.054 6.593 -3.318 1.00 0.00 N ATOM 504 CA GLU A 33 17.651 5.201 -3.477 1.00 0.00 C ATOM 505 C GLU A 33 16.650 4.995 -4.630 1.00 0.00 C ATOM 506 O GLU A 33 16.625 3.913 -5.210 1.00 0.00 O ATOM 507 CB GLU A 33 17.118 4.603 -2.170 1.00 0.00 C ATOM 508 CG GLU A 33 18.114 4.568 -1.001 1.00 0.00 C ATOM 509 CD GLU A 33 18.113 5.843 -0.182 1.00 0.00 C ATOM 510 OE1 GLU A 33 18.633 6.854 -0.698 1.00 0.00 O ATOM 511 OE2 GLU A 33 17.619 5.816 0.971 1.00 0.00 O ATOM 0 H GLU A 33 17.895 6.979 -2.387 1.00 0.00 H new ATOM 0 HA GLU A 33 18.558 4.659 -3.745 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.242 5.174 -1.861 1.00 0.00 H new ATOM 0 HB3 GLU A 33 16.782 3.585 -2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 33 17.874 3.726 -0.352 1.00 0.00 H new ATOM 0 HG3 GLU A 33 19.117 4.394 -1.391 1.00 0.00 H new ATOM 518 N LEU A 34 15.848 5.999 -5.016 1.00 0.00 N ATOM 519 CA LEU A 34 15.023 5.904 -6.217 1.00 0.00 C ATOM 520 C LEU A 34 15.892 5.558 -7.425 1.00 0.00 C ATOM 521 O LEU A 34 15.479 4.794 -8.290 1.00 0.00 O ATOM 522 CB LEU A 34 14.219 7.199 -6.418 1.00 0.00 C ATOM 523 CG LEU A 34 13.115 7.116 -7.489 1.00 0.00 C ATOM 524 CD1 LEU A 34 12.043 8.156 -7.154 1.00 0.00 C ATOM 525 CD2 LEU A 34 13.613 7.430 -8.907 1.00 0.00 C ATOM 0 H LEU A 34 15.757 6.881 -4.512 1.00 0.00 H new ATOM 0 HA LEU A 34 14.299 5.097 -6.100 1.00 0.00 H new ATOM 0 HB2 LEU A 34 13.763 7.478 -5.468 1.00 0.00 H new ATOM 0 HB3 LEU A 34 14.908 7.999 -6.688 1.00 0.00 H new ATOM 0 HG LEU A 34 12.743 6.092 -7.479 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.250 8.115 -7.901 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.626 7.944 -6.170 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.489 9.151 -7.153 1.00 0.00 H new ATOM 0 HD21 LEU A 34 12.783 7.353 -9.610 1.00 0.00 H new ATOM 0 HD22 LEU A 34 14.019 8.441 -8.935 1.00 0.00 H new ATOM 0 HD23 LEU A 34 14.391 6.719 -9.185 1.00 0.00 H new ATOM 537 N LYS A 35 17.135 6.039 -7.484 1.00 0.00 N ATOM 538 CA LYS A 35 18.015 5.671 -8.582 1.00 0.00 C ATOM 539 C LYS A 35 18.440 4.183 -8.572 1.00 0.00 C ATOM 540 O LYS A 35 19.118 3.742 -9.498 1.00 0.00 O ATOM 541 CB LYS A 35 19.125 6.718 -8.755 1.00 0.00 C ATOM 542 CG LYS A 35 18.693 7.924 -9.623 1.00 0.00 C ATOM 543 CD LYS A 35 17.231 8.413 -9.500 1.00 0.00 C ATOM 544 CE LYS A 35 17.047 9.718 -10.294 1.00 0.00 C ATOM 545 NZ LYS A 35 15.642 10.029 -10.645 1.00 0.00 N ATOM 0 H LYS A 35 17.544 6.672 -6.797 1.00 0.00 H new ATOM 0 HA LYS A 35 17.451 5.709 -9.514 1.00 0.00 H new ATOM 0 HB2 LYS A 35 19.434 7.077 -7.773 1.00 0.00 H new ATOM 0 HB3 LYS A 35 19.995 6.244 -9.209 1.00 0.00 H new ATOM 0 HG2 LYS A 35 19.348 8.762 -9.383 1.00 0.00 H new ATOM 0 HG3 LYS A 35 18.874 7.667 -10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 35 16.550 7.649 -9.876 1.00 0.00 H new ATOM 0 HD3 LYS A 35 16.980 8.576 -8.452 1.00 0.00 H new ATOM 0 HE2 LYS A 35 17.454 10.544 -9.711 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.633 9.656 -11.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 15.599 10.954 -11.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 15.274 9.296 -11.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 15.066 10.055 -9.780 1.00 0.00 H new ATOM 559 N GLU A 36 18.011 3.378 -7.588 1.00 0.00 N ATOM 560 CA GLU A 36 18.081 1.921 -7.699 1.00 0.00 C ATOM 561 C GLU A 36 16.960 1.499 -8.664 1.00 0.00 C ATOM 562 O GLU A 36 17.178 0.748 -9.616 1.00 0.00 O ATOM 563 CB GLU A 36 17.958 1.238 -6.318 1.00 0.00 C ATOM 564 CG GLU A 36 18.121 -0.289 -6.437 1.00 0.00 C ATOM 565 CD GLU A 36 18.001 -1.057 -5.124 1.00 0.00 C ATOM 566 OE1 GLU A 36 18.247 -0.492 -4.036 1.00 0.00 O ATOM 567 OE2 GLU A 36 17.618 -2.252 -5.185 1.00 0.00 O ATOM 0 H GLU A 36 17.614 3.714 -6.711 1.00 0.00 H new ATOM 0 HA GLU A 36 19.050 1.605 -8.086 1.00 0.00 H new ATOM 0 HB2 GLU A 36 18.716 1.636 -5.643 1.00 0.00 H new ATOM 0 HB3 GLU A 36 16.987 1.470 -5.879 1.00 0.00 H new ATOM 0 HG2 GLU A 36 17.369 -0.666 -7.131 1.00 0.00 H new ATOM 0 HG3 GLU A 36 19.096 -0.502 -6.877 1.00 0.00 H new ATOM 574 N LEU A 37 15.766 2.052 -8.419 1.00 0.00 N ATOM 575 CA LEU A 37 14.539 1.865 -9.190 1.00 0.00 C ATOM 576 C LEU A 37 14.836 2.023 -10.682 1.00 0.00 C ATOM 577 O LEU A 37 14.488 1.155 -11.484 1.00 0.00 O ATOM 578 CB LEU A 37 13.464 2.880 -8.743 1.00 0.00 C ATOM 579 CG LEU A 37 12.003 2.422 -8.845 1.00 0.00 C ATOM 580 CD1 LEU A 37 11.121 3.572 -8.348 1.00 0.00 C ATOM 581 CD2 LEU A 37 11.558 2.095 -10.270 1.00 0.00 C ATOM 0 H LEU A 37 15.626 2.680 -7.628 1.00 0.00 H new ATOM 0 HA LEU A 37 14.157 0.860 -9.011 1.00 0.00 H new ATOM 0 HB2 LEU A 37 13.664 3.154 -7.707 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.580 3.785 -9.340 1.00 0.00 H new ATOM 0 HG LEU A 37 11.910 1.511 -8.254 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.073 3.279 -8.407 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.375 3.804 -7.314 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.287 4.452 -8.969 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.515 1.779 -10.262 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.664 2.981 -10.897 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.177 1.292 -10.669 1.00 0.00 H new ATOM 593 N ILE A 38 15.475 3.145 -11.051 1.00 0.00 N ATOM 594 CA ILE A 38 15.732 3.418 -12.466 1.00 0.00 C ATOM 595 C ILE A 38 16.595 2.331 -13.088 1.00 0.00 C ATOM 596 O ILE A 38 16.324 1.885 -14.204 1.00 0.00 O ATOM 597 CB ILE A 38 16.300 4.831 -12.730 1.00 0.00 C ATOM 598 CG1 ILE A 38 16.215 5.262 -14.209 1.00 0.00 C ATOM 599 CG2 ILE A 38 17.737 5.004 -12.238 1.00 0.00 C ATOM 600 CD1 ILE A 38 17.360 4.850 -15.147 1.00 0.00 C ATOM 0 H ILE A 38 15.814 3.858 -10.405 1.00 0.00 H new ATOM 0 HA ILE A 38 14.761 3.401 -12.961 1.00 0.00 H new ATOM 0 HB ILE A 38 15.652 5.485 -12.146 1.00 0.00 H new ATOM 0 HG12 ILE A 38 15.287 4.864 -14.620 1.00 0.00 H new ATOM 0 HG13 ILE A 38 16.136 6.349 -14.236 1.00 0.00 H new ATOM 0 HG21 ILE A 38 18.076 6.017 -12.454 1.00 0.00 H new ATOM 0 HG22 ILE A 38 17.777 4.829 -11.163 1.00 0.00 H new ATOM 0 HG23 ILE A 38 18.384 4.289 -12.746 1.00 0.00 H new ATOM 0 HD11 ILE A 38 17.160 5.224 -16.151 1.00 0.00 H new ATOM 0 HD12 ILE A 38 18.298 5.270 -14.783 1.00 0.00 H new ATOM 0 HD13 ILE A 38 17.436 3.763 -15.173 1.00 0.00 H new ATOM 612 N GLN A 39 17.649 1.921 -12.383 1.00 0.00 N ATOM 613 CA GLN A 39 18.566 0.929 -12.902 1.00 0.00 C ATOM 614 C GLN A 39 17.780 -0.359 -13.141 1.00 0.00 C ATOM 615 O GLN A 39 17.703 -0.827 -14.275 1.00 0.00 O ATOM 616 CB GLN A 39 19.757 0.782 -11.937 1.00 0.00 C ATOM 617 CG GLN A 39 20.968 0.076 -12.563 1.00 0.00 C ATOM 618 CD GLN A 39 20.770 -1.425 -12.741 1.00 0.00 C ATOM 619 OE1 GLN A 39 20.635 -1.914 -13.855 1.00 0.00 O ATOM 620 NE2 GLN A 39 20.763 -2.175 -11.642 1.00 0.00 N ATOM 0 H GLN A 39 17.882 2.266 -11.452 1.00 0.00 H new ATOM 0 HA GLN A 39 18.999 1.221 -13.859 1.00 0.00 H new ATOM 0 HB2 GLN A 39 20.060 1.771 -11.593 1.00 0.00 H new ATOM 0 HB3 GLN A 39 19.435 0.224 -11.058 1.00 0.00 H new ATOM 0 HG2 GLN A 39 21.179 0.525 -13.534 1.00 0.00 H new ATOM 0 HG3 GLN A 39 21.843 0.247 -11.936 1.00 0.00 H new ATOM 0 HE21 GLN A 39 20.878 -1.740 -10.727 1.00 0.00 H new ATOM 0 HE22 GLN A 39 20.643 -3.185 -11.715 1.00 0.00 H new ATOM 629 N LYS A 40 17.205 -0.914 -12.071 1.00 0.00 N ATOM 630 CA LYS A 40 16.549 -2.213 -12.114 1.00 0.00 C ATOM 631 C LYS A 40 15.037 -2.141 -12.390 1.00 0.00 C ATOM 632 O LYS A 40 14.601 -2.290 -13.533 1.00 0.00 O ATOM 633 CB LYS A 40 16.949 -3.105 -10.911 1.00 0.00 C ATOM 634 CG LYS A 40 17.714 -2.391 -9.782 1.00 0.00 C ATOM 635 CD LYS A 40 18.332 -3.361 -8.759 1.00 0.00 C ATOM 636 CE LYS A 40 17.298 -4.205 -8.008 1.00 0.00 C ATOM 637 NZ LYS A 40 16.352 -3.366 -7.255 1.00 0.00 N ATOM 0 H LYS A 40 17.184 -0.471 -11.152 1.00 0.00 H new ATOM 0 HA LYS A 40 16.935 -2.725 -12.996 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.045 -3.546 -10.491 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.563 -3.927 -11.279 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.505 -1.781 -10.218 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.036 -1.712 -9.265 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.025 -4.026 -9.275 1.00 0.00 H new ATOM 0 HD3 LYS A 40 18.916 -2.790 -8.037 1.00 0.00 H new ATOM 0 HE2 LYS A 40 16.750 -4.824 -8.718 1.00 0.00 H new ATOM 0 HE3 LYS A 40 17.809 -4.881 -7.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 15.507 -3.924 -7.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 16.805 -3.032 -6.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 16.075 -2.549 -7.835 1.00 0.00 H new ATOM 651 N GLU A 41 14.234 -1.925 -11.343 1.00 0.00 N ATOM 652 CA GLU A 41 12.792 -2.146 -11.349 1.00 0.00 C ATOM 653 C GLU A 41 12.047 -1.643 -12.580 1.00 0.00 C ATOM 654 O GLU A 41 11.356 -2.429 -13.228 1.00 0.00 O ATOM 655 CB GLU A 41 12.154 -1.628 -10.057 1.00 0.00 C ATOM 656 CG GLU A 41 12.296 -2.648 -8.922 1.00 0.00 C ATOM 657 CD GLU A 41 13.728 -2.903 -8.503 1.00 0.00 C ATOM 658 OE1 GLU A 41 14.571 -1.982 -8.647 1.00 0.00 O ATOM 659 OE2 GLU A 41 14.002 -3.992 -7.953 1.00 0.00 O ATOM 0 H GLU A 41 14.582 -1.583 -10.447 1.00 0.00 H new ATOM 0 HA GLU A 41 12.682 -3.229 -11.402 1.00 0.00 H new ATOM 0 HB2 GLU A 41 12.625 -0.689 -9.767 1.00 0.00 H new ATOM 0 HB3 GLU A 41 11.099 -1.416 -10.229 1.00 0.00 H new ATOM 0 HG2 GLU A 41 11.732 -2.297 -8.058 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.846 -3.590 -9.235 1.00 0.00 H new ATOM 666 N LEU A 42 12.138 -0.353 -12.914 1.00 0.00 N ATOM 667 CA LEU A 42 11.278 0.150 -13.983 1.00 0.00 C ATOM 668 C LEU A 42 11.641 -0.408 -15.371 1.00 0.00 C ATOM 669 O LEU A 42 10.948 -0.121 -16.345 1.00 0.00 O ATOM 670 CB LEU A 42 11.041 1.669 -13.917 1.00 0.00 C ATOM 671 CG LEU A 42 12.262 2.591 -13.882 1.00 0.00 C ATOM 672 CD1 LEU A 42 13.336 2.112 -14.853 1.00 0.00 C ATOM 673 CD2 LEU A 42 11.837 4.029 -14.195 1.00 0.00 C ATOM 0 H LEU A 42 12.763 0.329 -12.485 1.00 0.00 H new ATOM 0 HA LEU A 42 10.288 -0.264 -13.795 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.437 1.949 -14.780 1.00 0.00 H new ATOM 0 HB3 LEU A 42 10.443 1.874 -13.029 1.00 0.00 H new ATOM 0 HG LEU A 42 12.692 2.565 -12.881 1.00 0.00 H new ATOM 0 HD11 LEU A 42 14.193 2.784 -14.809 1.00 0.00 H new ATOM 0 HD12 LEU A 42 13.651 1.105 -14.580 1.00 0.00 H new ATOM 0 HD13 LEU A 42 12.933 2.104 -15.866 1.00 0.00 H new ATOM 0 HD21 LEU A 42 12.710 4.680 -14.169 1.00 0.00 H new ATOM 0 HD22 LEU A 42 11.386 4.067 -15.186 1.00 0.00 H new ATOM 0 HD23 LEU A 42 11.112 4.364 -13.453 1.00 0.00 H new ATOM 685 N THR A 43 12.693 -1.231 -15.488 1.00 0.00 N ATOM 686 CA THR A 43 12.965 -1.996 -16.697 1.00 0.00 C ATOM 687 C THR A 43 13.184 -1.050 -17.888 1.00 0.00 C ATOM 688 O THR A 43 14.143 -0.278 -17.872 1.00 0.00 O ATOM 689 CB THR A 43 11.857 -3.057 -16.878 1.00 0.00 C ATOM 690 OG1 THR A 43 11.658 -3.758 -15.665 1.00 0.00 O ATOM 691 CG2 THR A 43 12.240 -4.121 -17.913 1.00 0.00 C ATOM 0 H THR A 43 13.374 -1.380 -14.744 1.00 0.00 H new ATOM 0 HA THR A 43 13.899 -2.553 -16.621 1.00 0.00 H new ATOM 0 HB THR A 43 10.967 -2.516 -17.200 1.00 0.00 H new ATOM 0 HG1 THR A 43 11.419 -3.125 -14.957 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.431 -4.845 -18.007 1.00 0.00 H new ATOM 0 HG22 THR A 43 12.414 -3.644 -18.878 1.00 0.00 H new ATOM 0 HG23 THR A 43 13.148 -4.631 -17.592 1.00 0.00 H new ATOM 699 N ILE A 44 12.308 -1.067 -18.899 1.00 0.00 N ATOM 700 CA ILE A 44 12.386 -0.188 -20.064 1.00 0.00 C ATOM 701 C ILE A 44 12.178 1.280 -19.672 1.00 0.00 C ATOM 702 O ILE A 44 12.607 2.184 -20.389 1.00 0.00 O ATOM 703 CB ILE A 44 11.441 -0.705 -21.174 1.00 0.00 C ATOM 704 CG1 ILE A 44 12.037 -1.986 -21.788 1.00 0.00 C ATOM 705 CG2 ILE A 44 11.202 0.341 -22.275 1.00 0.00 C ATOM 706 CD1 ILE A 44 11.031 -2.767 -22.641 1.00 0.00 C ATOM 0 H ILE A 44 11.512 -1.704 -18.928 1.00 0.00 H new ATOM 0 HA ILE A 44 13.391 -0.215 -20.485 1.00 0.00 H new ATOM 0 HB ILE A 44 10.474 -0.915 -20.718 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.897 -1.721 -22.403 1.00 0.00 H new ATOM 0 HG13 ILE A 44 12.403 -2.629 -20.988 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.532 -0.072 -23.030 1.00 0.00 H new ATOM 0 HG22 ILE A 44 10.752 1.232 -21.838 1.00 0.00 H new ATOM 0 HG23 ILE A 44 12.152 0.605 -22.739 1.00 0.00 H new ATOM 0 HD11 ILE A 44 11.511 -3.658 -23.045 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.182 -3.061 -22.024 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.684 -2.138 -23.461 1.00 0.00 H new ATOM 888 N LEU A 56 16.849 13.702 -16.771 1.00 0.00 N ATOM 889 CA LEU A 56 15.849 14.709 -16.424 1.00 0.00 C ATOM 890 C LEU A 56 14.444 14.092 -16.444 1.00 0.00 C ATOM 891 O LEU A 56 13.644 14.360 -15.551 1.00 0.00 O ATOM 892 CB LEU A 56 15.931 15.954 -17.326 1.00 0.00 C ATOM 893 CG LEU A 56 17.085 16.935 -17.041 1.00 0.00 C ATOM 894 CD1 LEU A 56 17.083 17.455 -15.598 1.00 0.00 C ATOM 895 CD2 LEU A 56 18.465 16.372 -17.395 1.00 0.00 C ATOM 0 HA LEU A 56 16.064 15.051 -15.412 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.014 15.621 -18.361 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.991 16.499 -17.241 1.00 0.00 H new ATOM 0 HG LEU A 56 16.894 17.777 -17.706 1.00 0.00 H new ATOM 0 HD11 LEU A 56 17.918 18.141 -15.457 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.147 17.977 -15.401 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.183 16.616 -14.909 1.00 0.00 H new ATOM 0 HD21 LEU A 56 19.230 17.115 -17.169 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.651 15.471 -16.811 1.00 0.00 H new ATOM 0 HD23 LEU A 56 18.497 16.129 -18.457 1.00 0.00 H new ATOM 907 N MET A 57 14.143 13.252 -17.440 1.00 0.00 N ATOM 908 CA MET A 57 12.879 12.529 -17.498 1.00 0.00 C ATOM 909 C MET A 57 12.685 11.679 -16.238 1.00 0.00 C ATOM 910 O MET A 57 11.648 11.769 -15.586 1.00 0.00 O ATOM 911 CB MET A 57 12.802 11.681 -18.777 1.00 0.00 C ATOM 912 CG MET A 57 11.415 11.055 -18.960 1.00 0.00 C ATOM 913 SD MET A 57 11.252 10.020 -20.436 1.00 0.00 S ATOM 914 CE MET A 57 9.530 9.504 -20.254 1.00 0.00 C ATOM 0 H MET A 57 14.768 13.058 -18.222 1.00 0.00 H new ATOM 0 HA MET A 57 12.063 13.251 -17.533 1.00 0.00 H new ATOM 0 HB2 MET A 57 13.037 12.303 -19.641 1.00 0.00 H new ATOM 0 HB3 MET A 57 13.554 10.893 -18.737 1.00 0.00 H new ATOM 0 HG2 MET A 57 11.182 10.453 -18.081 1.00 0.00 H new ATOM 0 HG3 MET A 57 10.673 11.852 -19.006 1.00 0.00 H new ATOM 0 HE1 MET A 57 9.255 8.854 -21.085 1.00 0.00 H new ATOM 0 HE2 MET A 57 9.409 8.964 -19.315 1.00 0.00 H new ATOM 0 HE3 MET A 57 8.885 10.383 -20.252 1.00 0.00 H new ATOM 924 N ASP A 58 13.662 10.844 -15.879 1.00 0.00 N ATOM 925 CA ASP A 58 13.545 10.025 -14.675 1.00 0.00 C ATOM 926 C ASP A 58 13.414 10.877 -13.421 1.00 0.00 C ATOM 927 O ASP A 58 12.665 10.549 -12.504 1.00 0.00 O ATOM 928 CB ASP A 58 14.724 9.065 -14.563 1.00 0.00 C ATOM 929 CG ASP A 58 14.403 8.011 -13.522 1.00 0.00 C ATOM 930 OD1 ASP A 58 13.722 7.041 -13.921 1.00 0.00 O ATOM 931 OD2 ASP A 58 14.857 8.186 -12.369 1.00 0.00 O ATOM 0 H ASP A 58 14.531 10.719 -16.398 1.00 0.00 H new ATOM 0 HA ASP A 58 12.630 9.440 -14.763 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.920 8.595 -15.527 1.00 0.00 H new ATOM 0 HB3 ASP A 58 15.627 9.608 -14.283 1.00 0.00 H new ATOM 936 N ASP A 59 14.072 12.033 -13.413 1.00 0.00 N ATOM 937 CA ASP A 59 13.873 13.022 -12.375 1.00 0.00 C ATOM 938 C ASP A 59 12.477 13.661 -12.414 1.00 0.00 C ATOM 939 O ASP A 59 12.259 14.659 -11.733 1.00 0.00 O ATOM 940 CB ASP A 59 15.014 14.062 -12.393 1.00 0.00 C ATOM 941 CG ASP A 59 16.274 13.618 -11.670 1.00 0.00 C ATOM 942 OD1 ASP A 59 16.339 12.448 -11.229 1.00 0.00 O ATOM 943 OD2 ASP A 59 17.103 14.500 -11.361 1.00 0.00 O ATOM 0 H ASP A 59 14.752 12.303 -14.124 1.00 0.00 H new ATOM 0 HA ASP A 59 13.914 12.505 -11.416 1.00 0.00 H new ATOM 0 HB2 ASP A 59 15.265 14.291 -13.429 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.655 14.986 -11.940 1.00 0.00 H new ATOM 948 N LEU A 60 11.489 13.086 -13.115 1.00 0.00 N ATOM 949 CA LEU A 60 10.093 13.449 -12.907 1.00 0.00 C ATOM 950 C LEU A 60 9.759 13.259 -11.421 1.00 0.00 C ATOM 951 O LEU A 60 8.912 13.979 -10.898 1.00 0.00 O ATOM 952 CB LEU A 60 9.160 12.589 -13.776 1.00 0.00 C ATOM 953 CG LEU A 60 8.944 13.175 -15.182 1.00 0.00 C ATOM 954 CD1 LEU A 60 8.389 12.088 -16.110 1.00 0.00 C ATOM 955 CD2 LEU A 60 7.957 14.351 -15.151 1.00 0.00 C ATOM 0 H LEU A 60 11.637 12.371 -13.827 1.00 0.00 H new ATOM 0 HA LEU A 60 9.944 14.489 -13.198 1.00 0.00 H new ATOM 0 HB2 LEU A 60 9.577 11.586 -13.866 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.196 12.490 -13.277 1.00 0.00 H new ATOM 0 HG LEU A 60 9.905 13.535 -15.548 1.00 0.00 H new ATOM 0 HD11 LEU A 60 8.236 12.503 -17.106 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.097 11.261 -16.166 1.00 0.00 H new ATOM 0 HD13 LEU A 60 7.439 11.725 -15.718 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.826 14.743 -16.160 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.996 14.009 -14.767 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.348 15.137 -14.504 1.00 0.00 H new ATOM 967 N ASP A 61 10.455 12.342 -10.723 1.00 0.00 N ATOM 968 CA ASP A 61 10.386 12.237 -9.264 1.00 0.00 C ATOM 969 C ASP A 61 10.521 13.611 -8.605 1.00 0.00 C ATOM 970 O ASP A 61 9.817 13.947 -7.659 1.00 0.00 O ATOM 971 CB ASP A 61 11.425 11.235 -8.717 1.00 0.00 C ATOM 972 CG ASP A 61 12.867 11.712 -8.574 1.00 0.00 C ATOM 973 OD1 ASP A 61 13.145 12.652 -7.801 1.00 0.00 O ATOM 974 OD2 ASP A 61 13.773 11.120 -9.200 1.00 0.00 O ATOM 0 H ASP A 61 11.076 11.659 -11.157 1.00 0.00 H new ATOM 0 HA ASP A 61 9.401 11.846 -9.007 1.00 0.00 H new ATOM 0 HB2 ASP A 61 11.084 10.901 -7.737 1.00 0.00 H new ATOM 0 HB3 ASP A 61 11.424 10.362 -9.370 1.00 0.00 H new ATOM 979 N ARG A 62 11.396 14.435 -9.170 1.00 0.00 N ATOM 980 CA ARG A 62 11.701 15.757 -8.640 1.00 0.00 C ATOM 981 C ARG A 62 10.537 16.750 -8.772 1.00 0.00 C ATOM 982 O ARG A 62 10.612 17.836 -8.201 1.00 0.00 O ATOM 983 CB ARG A 62 12.972 16.300 -9.312 1.00 0.00 C ATOM 984 CG ARG A 62 13.898 17.061 -8.351 1.00 0.00 C ATOM 985 CD ARG A 62 14.416 16.200 -7.183 1.00 0.00 C ATOM 986 NE ARG A 62 14.670 14.797 -7.561 1.00 0.00 N ATOM 987 CZ ARG A 62 15.615 14.365 -8.406 1.00 0.00 C ATOM 988 NH1 ARG A 62 16.502 15.224 -8.914 1.00 0.00 N ATOM 989 NH2 ARG A 62 15.639 13.082 -8.758 1.00 0.00 N ATOM 0 H ARG A 62 11.917 14.202 -10.015 1.00 0.00 H new ATOM 0 HA ARG A 62 11.870 15.646 -7.569 1.00 0.00 H new ATOM 0 HB2 ARG A 62 13.523 15.469 -9.753 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.686 16.962 -10.129 1.00 0.00 H new ATOM 0 HG2 ARG A 62 14.749 17.449 -8.911 1.00 0.00 H new ATOM 0 HG3 ARG A 62 13.363 17.921 -7.948 1.00 0.00 H new ATOM 0 HD2 ARG A 62 15.337 16.638 -6.798 1.00 0.00 H new ATOM 0 HD3 ARG A 62 13.688 16.225 -6.372 1.00 0.00 H new ATOM 0 HE ARG A 62 14.069 14.089 -7.139 1.00 0.00 H new ATOM 0 HH11 ARG A 62 16.460 16.211 -8.659 1.00 0.00 H new ATOM 0 HH12 ARG A 62 17.221 14.894 -9.557 1.00 0.00 H new ATOM 0 HH21 ARG A 62 14.942 12.438 -8.385 1.00 0.00 H new ATOM 0 HH22 ARG A 62 16.355 12.743 -9.401 1.00 0.00 H new ATOM 1003 N ASN A 63 9.484 16.418 -9.530 1.00 0.00 N ATOM 1004 CA ASN A 63 8.376 17.322 -9.826 1.00 0.00 C ATOM 1005 C ASN A 63 7.711 17.889 -8.581 1.00 0.00 C ATOM 1006 O ASN A 63 7.335 19.058 -8.559 1.00 0.00 O ATOM 1007 CB ASN A 63 7.352 16.609 -10.717 1.00 0.00 C ATOM 1008 CG ASN A 63 6.120 17.473 -10.971 1.00 0.00 C ATOM 1009 OD1 ASN A 63 6.201 18.498 -11.639 1.00 0.00 O ATOM 1010 ND2 ASN A 63 4.963 17.064 -10.455 1.00 0.00 N ATOM 0 H ASN A 63 9.381 15.499 -9.959 1.00 0.00 H new ATOM 0 HA ASN A 63 8.793 18.178 -10.356 1.00 0.00 H new ATOM 0 HB2 ASN A 63 7.816 16.350 -11.669 1.00 0.00 H new ATOM 0 HB3 ASN A 63 7.049 15.674 -10.246 1.00 0.00 H new ATOM 0 HD21 ASN A 63 4.114 17.608 -10.612 1.00 0.00 H new ATOM 0 HD22 ASN A 63 4.925 16.207 -9.903 1.00 0.00 H new ATOM 1017 N LYS A 64 7.565 17.071 -7.545 1.00 0.00 N ATOM 1018 CA LYS A 64 7.137 17.541 -6.247 1.00 0.00 C ATOM 1019 C LYS A 64 7.716 16.591 -5.212 1.00 0.00 C ATOM 1020 O LYS A 64 8.165 15.500 -5.555 1.00 0.00 O ATOM 1021 CB LYS A 64 5.606 17.678 -6.174 1.00 0.00 C ATOM 1022 CG LYS A 64 4.864 16.399 -6.580 1.00 0.00 C ATOM 1023 CD LYS A 64 3.339 16.606 -6.622 1.00 0.00 C ATOM 1024 CE LYS A 64 2.672 16.723 -5.243 1.00 0.00 C ATOM 1025 NZ LYS A 64 2.992 15.575 -4.374 1.00 0.00 N ATOM 0 H LYS A 64 7.741 16.067 -7.588 1.00 0.00 H new ATOM 0 HA LYS A 64 7.508 18.547 -6.049 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.320 17.949 -5.158 1.00 0.00 H new ATOM 0 HB3 LYS A 64 5.290 18.495 -6.822 1.00 0.00 H new ATOM 0 HG2 LYS A 64 5.213 16.073 -7.560 1.00 0.00 H new ATOM 0 HG3 LYS A 64 5.103 15.602 -5.875 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.124 17.509 -7.193 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.887 15.773 -7.160 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.997 17.645 -4.760 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.591 16.793 -5.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.132 15.265 -3.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.359 14.793 -4.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.711 15.857 -3.677 1.00 0.00 H new ATOM 1039 N ASP A 65 7.751 17.048 -3.965 1.00 0.00 N ATOM 1040 CA ASP A 65 8.061 16.286 -2.754 1.00 0.00 C ATOM 1041 C ASP A 65 9.556 15.990 -2.606 1.00 0.00 C ATOM 1042 O ASP A 65 10.065 15.979 -1.488 1.00 0.00 O ATOM 1043 CB ASP A 65 7.237 14.993 -2.650 1.00 0.00 C ATOM 1044 CG ASP A 65 5.743 15.210 -2.492 1.00 0.00 C ATOM 1045 OD1 ASP A 65 5.205 16.158 -3.108 1.00 0.00 O ATOM 1046 OD2 ASP A 65 5.109 14.363 -1.832 1.00 0.00 O ATOM 0 H ASP A 65 7.551 18.026 -3.756 1.00 0.00 H new ATOM 0 HA ASP A 65 7.775 16.931 -1.923 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.412 14.393 -3.543 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.599 14.414 -1.801 1.00 0.00 H new ATOM 1051 N GLN A 66 10.261 15.748 -3.716 1.00 0.00 N ATOM 1052 CA GLN A 66 11.688 15.458 -3.772 1.00 0.00 C ATOM 1053 C GLN A 66 11.936 14.038 -3.280 1.00 0.00 C ATOM 1054 O GLN A 66 12.196 13.132 -4.067 1.00 0.00 O ATOM 1055 CB GLN A 66 12.519 16.541 -3.053 1.00 0.00 C ATOM 1056 CG GLN A 66 14.025 16.312 -3.219 1.00 0.00 C ATOM 1057 CD GLN A 66 14.896 17.316 -2.465 1.00 0.00 C ATOM 1058 OE1 GLN A 66 16.113 17.153 -2.420 1.00 0.00 O ATOM 1059 NE2 GLN A 66 14.318 18.360 -1.877 1.00 0.00 N ATOM 0 H GLN A 66 9.828 15.750 -4.639 1.00 0.00 H new ATOM 0 HA GLN A 66 12.035 15.497 -4.805 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.256 17.522 -3.448 1.00 0.00 H new ATOM 0 HB3 GLN A 66 12.268 16.546 -1.992 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.269 15.306 -2.876 1.00 0.00 H new ATOM 0 HG3 GLN A 66 14.274 16.356 -4.279 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.306 18.477 -1.926 1.00 0.00 H new ATOM 0 HE22 GLN A 66 14.887 19.043 -1.377 1.00 0.00 H new ATOM 1068 N GLU A 67 11.809 13.848 -1.973 1.00 0.00 N ATOM 1069 CA GLU A 67 11.785 12.525 -1.379 1.00 0.00 C ATOM 1070 C GLU A 67 10.350 12.027 -1.575 1.00 0.00 C ATOM 1071 O GLU A 67 9.505 12.141 -0.690 1.00 0.00 O ATOM 1072 CB GLU A 67 12.245 12.581 0.086 1.00 0.00 C ATOM 1073 CG GLU A 67 13.482 13.472 0.316 1.00 0.00 C ATOM 1074 CD GLU A 67 14.667 13.171 -0.596 1.00 0.00 C ATOM 1075 OE1 GLU A 67 14.871 11.994 -0.956 1.00 0.00 O ATOM 1076 OE2 GLU A 67 15.398 14.132 -0.920 1.00 0.00 O ATOM 0 H GLU A 67 11.720 14.608 -1.299 1.00 0.00 H new ATOM 0 HA GLU A 67 12.480 11.827 -1.845 1.00 0.00 H new ATOM 0 HB2 GLU A 67 11.424 12.949 0.701 1.00 0.00 H new ATOM 0 HB3 GLU A 67 12.469 11.570 0.426 1.00 0.00 H new ATOM 0 HG2 GLU A 67 13.192 14.514 0.179 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.803 13.364 1.352 1.00 0.00 H new ATOM 1083 N VAL A 68 10.061 11.567 -2.792 1.00 0.00 N ATOM 1084 CA VAL A 68 8.717 11.307 -3.278 1.00 0.00 C ATOM 1085 C VAL A 68 7.851 10.407 -2.396 1.00 0.00 C ATOM 1086 O VAL A 68 8.317 9.471 -1.752 1.00 0.00 O ATOM 1087 CB VAL A 68 8.747 10.788 -4.720 1.00 0.00 C ATOM 1088 CG1 VAL A 68 9.133 11.904 -5.688 1.00 0.00 C ATOM 1089 CG2 VAL A 68 9.676 9.589 -4.918 1.00 0.00 C ATOM 0 H VAL A 68 10.782 11.361 -3.484 1.00 0.00 H new ATOM 0 HA VAL A 68 8.225 12.279 -3.240 1.00 0.00 H new ATOM 0 HB VAL A 68 7.735 10.444 -4.934 1.00 0.00 H new ATOM 0 HG11 VAL A 68 9.148 11.514 -6.706 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.405 12.712 -5.620 1.00 0.00 H new ATOM 0 HG13 VAL A 68 10.122 12.284 -5.430 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.647 9.275 -5.961 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.695 9.870 -4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.349 8.766 -4.282 1.00 0.00 H new ATOM 1099 N ASN A 69 6.548 10.678 -2.421 1.00 0.00 N ATOM 1100 CA ASN A 69 5.519 9.830 -1.840 1.00 0.00 C ATOM 1101 C ASN A 69 5.166 8.687 -2.811 1.00 0.00 C ATOM 1102 O ASN A 69 5.643 8.642 -3.947 1.00 0.00 O ATOM 1103 CB ASN A 69 4.299 10.700 -1.520 1.00 0.00 C ATOM 1104 CG ASN A 69 3.660 11.184 -2.813 1.00 0.00 C ATOM 1105 OD1 ASN A 69 3.003 10.411 -3.497 1.00 0.00 O ATOM 1106 ND2 ASN A 69 3.899 12.422 -3.203 1.00 0.00 N ATOM 0 H ASN A 69 6.172 11.519 -2.859 1.00 0.00 H new ATOM 0 HA ASN A 69 5.876 9.371 -0.918 1.00 0.00 H new ATOM 0 HB2 ASN A 69 3.576 10.129 -0.937 1.00 0.00 H new ATOM 0 HB3 ASN A 69 4.598 11.552 -0.910 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.533 12.756 -4.095 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.450 13.045 -2.613 1.00 0.00 H new ATOM 1113 N PHE A 70 4.305 7.766 -2.361 1.00 0.00 N ATOM 1114 CA PHE A 70 3.916 6.584 -3.124 1.00 0.00 C ATOM 1115 C PHE A 70 3.215 6.940 -4.435 1.00 0.00 C ATOM 1116 O PHE A 70 3.412 6.252 -5.429 1.00 0.00 O ATOM 1117 CB PHE A 70 3.014 5.681 -2.279 1.00 0.00 C ATOM 1118 CG PHE A 70 2.665 4.345 -2.907 1.00 0.00 C ATOM 1119 CD1 PHE A 70 3.645 3.343 -3.012 1.00 0.00 C ATOM 1120 CD2 PHE A 70 1.357 4.086 -3.361 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.310 2.066 -3.496 1.00 0.00 C ATOM 1122 CE2 PHE A 70 1.027 2.818 -3.872 1.00 0.00 C ATOM 1123 CZ PHE A 70 1.999 1.803 -3.924 1.00 0.00 C ATOM 0 H PHE A 70 3.857 7.825 -1.447 1.00 0.00 H new ATOM 0 HA PHE A 70 4.833 6.053 -3.379 1.00 0.00 H new ATOM 0 HB2 PHE A 70 3.504 5.498 -1.323 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.089 6.216 -2.065 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.663 3.555 -2.719 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.607 4.862 -3.317 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.059 1.289 -3.538 1.00 0.00 H new ATOM 0 HE2 PHE A 70 0.025 2.623 -4.225 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.737 0.822 -4.293 1.00 0.00 H new ATOM 1133 N GLN A 71 2.389 7.989 -4.461 1.00 0.00 N ATOM 1134 CA GLN A 71 1.742 8.420 -5.692 1.00 0.00 C ATOM 1135 C GLN A 71 2.790 8.897 -6.691 1.00 0.00 C ATOM 1136 O GLN A 71 2.762 8.451 -7.834 1.00 0.00 O ATOM 1137 CB GLN A 71 0.655 9.467 -5.419 1.00 0.00 C ATOM 1138 CG GLN A 71 0.020 10.024 -6.700 1.00 0.00 C ATOM 1139 CD GLN A 71 0.646 11.351 -7.119 1.00 0.00 C ATOM 1140 OE1 GLN A 71 0.242 12.395 -6.616 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.613 11.333 -8.030 1.00 0.00 N ATOM 0 H GLN A 71 2.156 8.551 -3.643 1.00 0.00 H new ATOM 0 HA GLN A 71 1.228 7.570 -6.140 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.123 9.021 -4.799 1.00 0.00 H new ATOM 0 HB3 GLN A 71 1.086 10.289 -4.847 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.134 9.299 -7.506 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.050 10.161 -6.544 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.924 10.446 -8.427 1.00 0.00 H new ATOM 0 HE22 GLN A 71 2.045 12.206 -8.333 1.00 0.00 H new ATOM 1150 N GLU A 72 3.693 9.796 -6.287 1.00 0.00 N ATOM 1151 CA GLU A 72 4.743 10.285 -7.181 1.00 0.00 C ATOM 1152 C GLU A 72 5.561 9.110 -7.728 1.00 0.00 C ATOM 1153 O GLU A 72 5.750 8.987 -8.941 1.00 0.00 O ATOM 1154 CB GLU A 72 5.627 11.328 -6.483 1.00 0.00 C ATOM 1155 CG GLU A 72 5.363 12.757 -6.974 1.00 0.00 C ATOM 1156 CD GLU A 72 3.917 13.196 -6.827 1.00 0.00 C ATOM 1157 OE1 GLU A 72 3.478 13.353 -5.667 1.00 0.00 O ATOM 1158 OE2 GLU A 72 3.273 13.420 -7.873 1.00 0.00 O ATOM 0 H GLU A 72 3.717 10.198 -5.350 1.00 0.00 H new ATOM 0 HA GLU A 72 4.275 10.788 -8.027 1.00 0.00 H new ATOM 0 HB2 GLU A 72 5.456 11.281 -5.408 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.675 11.079 -6.650 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.001 13.446 -6.420 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.651 12.830 -8.023 1.00 0.00 H new ATOM 1165 N TYR A 73 6.007 8.227 -6.829 1.00 0.00 N ATOM 1166 CA TYR A 73 6.634 6.959 -7.185 1.00 0.00 C ATOM 1167 C TYR A 73 5.813 6.229 -8.256 1.00 0.00 C ATOM 1168 O TYR A 73 6.316 5.920 -9.332 1.00 0.00 O ATOM 1169 CB TYR A 73 6.772 6.120 -5.907 1.00 0.00 C ATOM 1170 CG TYR A 73 6.986 4.628 -6.095 1.00 0.00 C ATOM 1171 CD1 TYR A 73 8.261 4.115 -6.384 1.00 0.00 C ATOM 1172 CD2 TYR A 73 5.916 3.740 -5.881 1.00 0.00 C ATOM 1173 CE1 TYR A 73 8.475 2.726 -6.368 1.00 0.00 C ATOM 1174 CE2 TYR A 73 6.109 2.355 -5.966 1.00 0.00 C ATOM 1175 CZ TYR A 73 7.398 1.850 -6.183 1.00 0.00 C ATOM 1176 OH TYR A 73 7.632 0.524 -6.015 1.00 0.00 O ATOM 0 H TYR A 73 5.940 8.379 -5.823 1.00 0.00 H new ATOM 0 HA TYR A 73 7.622 7.132 -7.612 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.608 6.514 -5.329 1.00 0.00 H new ATOM 0 HB3 TYR A 73 5.874 6.263 -5.307 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.075 4.786 -6.618 1.00 0.00 H new ATOM 0 HD2 TYR A 73 4.936 4.130 -5.649 1.00 0.00 H new ATOM 0 HE1 TYR A 73 9.472 2.333 -6.499 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.271 1.682 -5.865 1.00 0.00 H new ATOM 0 HH TYR A 73 7.114 0.195 -5.251 1.00 0.00 H new ATOM 1186 N ILE A 74 4.547 5.947 -7.952 1.00 0.00 N ATOM 1187 CA ILE A 74 3.654 5.191 -8.814 1.00 0.00 C ATOM 1188 C ILE A 74 3.511 5.851 -10.192 1.00 0.00 C ATOM 1189 O ILE A 74 3.509 5.152 -11.207 1.00 0.00 O ATOM 1190 CB ILE A 74 2.290 4.993 -8.108 1.00 0.00 C ATOM 1191 CG1 ILE A 74 2.236 3.771 -7.176 1.00 0.00 C ATOM 1192 CG2 ILE A 74 1.103 4.929 -9.067 1.00 0.00 C ATOM 1193 CD1 ILE A 74 2.290 2.412 -7.887 1.00 0.00 C ATOM 0 H ILE A 74 4.109 6.246 -7.081 1.00 0.00 H new ATOM 0 HA ILE A 74 4.085 4.206 -8.995 1.00 0.00 H new ATOM 0 HB ILE A 74 2.203 5.894 -7.501 1.00 0.00 H new ATOM 0 HG12 ILE A 74 3.068 3.831 -6.474 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.319 3.821 -6.588 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.183 4.789 -8.499 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.042 5.859 -9.633 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.235 4.094 -9.754 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.246 1.612 -7.147 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.443 2.324 -8.568 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.219 2.333 -8.452 1.00 0.00 H new ATOM 1205 N THR A 75 3.350 7.176 -10.254 1.00 0.00 N ATOM 1206 CA THR A 75 2.943 7.849 -11.469 1.00 0.00 C ATOM 1207 C THR A 75 3.802 7.558 -12.697 1.00 0.00 C ATOM 1208 O THR A 75 3.234 7.187 -13.722 1.00 0.00 O ATOM 1209 CB THR A 75 2.731 9.345 -11.214 1.00 0.00 C ATOM 1210 OG1 THR A 75 3.523 9.840 -10.159 1.00 0.00 O ATOM 1211 CG2 THR A 75 1.280 9.586 -10.811 1.00 0.00 C ATOM 0 H THR A 75 3.500 7.801 -9.462 1.00 0.00 H new ATOM 0 HA THR A 75 1.983 7.412 -11.743 1.00 0.00 H new ATOM 0 HB THR A 75 3.005 9.855 -12.138 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.386 9.376 -10.153 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.125 10.649 -10.629 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.620 9.255 -11.613 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.057 9.026 -9.903 1.00 0.00 H new ATOM 1219 N PHE A 76 5.135 7.706 -12.655 1.00 0.00 N ATOM 1220 CA PHE A 76 5.885 7.437 -13.884 1.00 0.00 C ATOM 1221 C PHE A 76 5.789 5.966 -14.279 1.00 0.00 C ATOM 1222 O PHE A 76 5.572 5.660 -15.449 1.00 0.00 O ATOM 1223 CB PHE A 76 7.307 7.985 -13.946 1.00 0.00 C ATOM 1224 CG PHE A 76 8.217 7.731 -12.774 1.00 0.00 C ATOM 1225 CD1 PHE A 76 8.199 8.696 -11.762 1.00 0.00 C ATOM 1226 CD2 PHE A 76 9.359 6.931 -12.955 1.00 0.00 C ATOM 1227 CE1 PHE A 76 9.394 9.039 -11.108 1.00 0.00 C ATOM 1228 CE2 PHE A 76 10.559 7.259 -12.294 1.00 0.00 C ATOM 1229 CZ PHE A 76 10.597 8.389 -11.449 1.00 0.00 C ATOM 0 H PHE A 76 5.683 7.990 -11.843 1.00 0.00 H new ATOM 0 HA PHE A 76 5.380 8.031 -14.646 1.00 0.00 H new ATOM 0 HB2 PHE A 76 7.785 7.572 -14.835 1.00 0.00 H new ATOM 0 HB3 PHE A 76 7.243 9.063 -14.090 1.00 0.00 H new ATOM 0 HD1 PHE A 76 7.272 9.175 -11.485 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.316 6.066 -13.600 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.391 9.802 -10.343 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.441 6.652 -12.432 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.540 8.752 -11.067 1.00 0.00 H new ATOM 1239 N LEU A 77 5.915 5.065 -13.302 1.00 0.00 N ATOM 1240 CA LEU A 77 5.762 3.628 -13.512 1.00 0.00 C ATOM 1241 C LEU A 77 4.452 3.334 -14.249 1.00 0.00 C ATOM 1242 O LEU A 77 4.441 2.597 -15.238 1.00 0.00 O ATOM 1243 CB LEU A 77 5.805 2.870 -12.173 1.00 0.00 C ATOM 1244 CG LEU A 77 7.002 3.231 -11.280 1.00 0.00 C ATOM 1245 CD1 LEU A 77 6.925 2.448 -9.966 1.00 0.00 C ATOM 1246 CD2 LEU A 77 8.328 2.938 -11.978 1.00 0.00 C ATOM 0 H LEU A 77 6.128 5.316 -12.337 1.00 0.00 H new ATOM 0 HA LEU A 77 6.594 3.283 -14.125 1.00 0.00 H new ATOM 0 HB2 LEU A 77 4.884 3.071 -11.625 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.828 1.799 -12.376 1.00 0.00 H new ATOM 0 HG LEU A 77 6.957 4.300 -11.074 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.776 2.708 -9.337 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.000 2.699 -9.447 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.944 1.379 -10.178 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.153 3.205 -11.318 1.00 0.00 H new ATOM 0 HD22 LEU A 77 8.385 1.877 -12.219 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.393 3.523 -12.895 1.00 0.00 H new ATOM 1258 N GLY A 78 3.358 3.927 -13.761 1.00 0.00 N ATOM 1259 CA GLY A 78 2.044 3.838 -14.369 1.00 0.00 C ATOM 1260 C GLY A 78 2.061 4.400 -15.787 1.00 0.00 C ATOM 1261 O GLY A 78 1.743 3.689 -16.736 1.00 0.00 O ATOM 0 H GLY A 78 3.371 4.493 -12.913 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.718 2.798 -14.390 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.321 4.387 -13.765 1.00 0.00 H new ATOM 1265 N ALA A 79 2.431 5.673 -15.938 1.00 0.00 N ATOM 1266 CA ALA A 79 2.474 6.372 -17.216 1.00 0.00 C ATOM 1267 C ALA A 79 3.166 5.519 -18.277 1.00 0.00 C ATOM 1268 O ALA A 79 2.605 5.231 -19.335 1.00 0.00 O ATOM 1269 CB ALA A 79 3.210 7.706 -17.042 1.00 0.00 C ATOM 0 H ALA A 79 2.716 6.258 -15.152 1.00 0.00 H new ATOM 0 HA ALA A 79 1.454 6.562 -17.550 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.243 8.230 -17.997 1.00 0.00 H new ATOM 0 HB2 ALA A 79 2.684 8.319 -16.310 1.00 0.00 H new ATOM 0 HB3 ALA A 79 4.226 7.518 -16.696 1.00 0.00 H new ATOM 1275 N LEU A 80 4.385 5.083 -17.955 1.00 0.00 N ATOM 1276 CA LEU A 80 5.228 4.284 -18.824 1.00 0.00 C ATOM 1277 C LEU A 80 4.542 2.989 -19.262 1.00 0.00 C ATOM 1278 O LEU A 80 4.888 2.469 -20.320 1.00 0.00 O ATOM 1279 CB LEU A 80 6.562 4.001 -18.126 1.00 0.00 C ATOM 1280 CG LEU A 80 7.454 5.246 -17.976 1.00 0.00 C ATOM 1281 CD1 LEU A 80 8.497 4.992 -16.882 1.00 0.00 C ATOM 1282 CD2 LEU A 80 8.168 5.578 -19.294 1.00 0.00 C ATOM 0 H LEU A 80 4.819 5.286 -17.054 1.00 0.00 H new ATOM 0 HA LEU A 80 5.416 4.853 -19.734 1.00 0.00 H new ATOM 0 HB2 LEU A 80 6.365 3.584 -17.138 1.00 0.00 H new ATOM 0 HB3 LEU A 80 7.104 3.242 -18.690 1.00 0.00 H new ATOM 0 HG LEU A 80 6.823 6.092 -17.706 1.00 0.00 H new ATOM 0 HD11 LEU A 80 9.131 5.872 -16.773 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.992 4.789 -15.938 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.111 4.134 -17.157 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.791 6.462 -19.158 1.00 0.00 H new ATOM 0 HD22 LEU A 80 8.793 4.736 -19.591 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.428 5.772 -20.070 1.00 0.00 H new ATOM 1294 N ALA A 81 3.554 2.474 -18.519 1.00 0.00 N ATOM 1295 CA ALA A 81 2.780 1.320 -18.959 1.00 0.00 C ATOM 1296 C ALA A 81 2.179 1.552 -20.343 1.00 0.00 C ATOM 1297 O ALA A 81 2.245 0.663 -21.190 1.00 0.00 O ATOM 1298 CB ALA A 81 1.688 0.966 -17.954 1.00 0.00 C ATOM 0 H ALA A 81 3.276 2.843 -17.610 1.00 0.00 H new ATOM 0 HA ALA A 81 3.466 0.476 -19.023 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.130 0.101 -18.313 1.00 0.00 H new ATOM 0 HB2 ALA A 81 2.142 0.731 -16.991 1.00 0.00 H new ATOM 0 HB3 ALA A 81 1.011 1.813 -17.839 1.00 0.00 H new ATOM 1304 N MET A 82 1.640 2.753 -20.595 1.00 0.00 N ATOM 1305 CA MET A 82 1.084 3.071 -21.904 1.00 0.00 C ATOM 1306 C MET A 82 2.151 2.956 -23.006 1.00 0.00 C ATOM 1307 O MET A 82 1.790 2.823 -24.176 1.00 0.00 O ATOM 1308 CB MET A 82 0.402 4.451 -21.919 1.00 0.00 C ATOM 1309 CG MET A 82 -0.934 4.539 -21.149 1.00 0.00 C ATOM 1310 SD MET A 82 -1.684 6.193 -21.113 1.00 0.00 S ATOM 1311 CE MET A 82 -0.448 7.133 -20.189 1.00 0.00 C ATOM 0 H MET A 82 1.580 3.509 -19.913 1.00 0.00 H new ATOM 0 HA MET A 82 0.310 2.333 -22.115 1.00 0.00 H new ATOM 0 HB2 MET A 82 1.092 5.183 -21.500 1.00 0.00 H new ATOM 0 HB3 MET A 82 0.224 4.738 -22.955 1.00 0.00 H new ATOM 0 HG2 MET A 82 -1.643 3.844 -21.598 1.00 0.00 H new ATOM 0 HG3 MET A 82 -0.769 4.208 -20.124 1.00 0.00 H new ATOM 0 HE1 MET A 82 -0.875 8.085 -19.875 1.00 0.00 H new ATOM 0 HE2 MET A 82 -0.141 6.565 -19.310 1.00 0.00 H new ATOM 0 HE3 MET A 82 0.419 7.316 -20.824 1.00 0.00 H new ATOM 1321 N ILE A 83 3.443 3.025 -22.659 1.00 0.00 N ATOM 1322 CA ILE A 83 4.549 2.769 -23.569 1.00 0.00 C ATOM 1323 C ILE A 83 4.964 1.291 -23.511 1.00 0.00 C ATOM 1324 O ILE A 83 4.704 0.540 -24.448 1.00 0.00 O ATOM 1325 CB ILE A 83 5.722 3.729 -23.278 1.00 0.00 C ATOM 1326 CG1 ILE A 83 5.284 5.204 -23.181 1.00 0.00 C ATOM 1327 CG2 ILE A 83 6.828 3.560 -24.331 1.00 0.00 C ATOM 1328 CD1 ILE A 83 4.569 5.739 -24.428 1.00 0.00 C ATOM 0 H ILE A 83 3.747 3.266 -21.716 1.00 0.00 H new ATOM 0 HA ILE A 83 4.225 2.966 -24.591 1.00 0.00 H new ATOM 0 HB ILE A 83 6.114 3.457 -22.298 1.00 0.00 H new ATOM 0 HG12 ILE A 83 4.623 5.318 -22.322 1.00 0.00 H new ATOM 0 HG13 ILE A 83 6.163 5.819 -22.990 1.00 0.00 H new ATOM 0 HG21 ILE A 83 7.647 4.244 -24.111 1.00 0.00 H new ATOM 0 HG22 ILE A 83 7.196 2.534 -24.310 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.426 3.781 -25.320 1.00 0.00 H new ATOM 0 HD11 ILE A 83 4.297 6.783 -24.272 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.233 5.662 -25.289 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.668 5.153 -24.611 1.00 0.00 H new ATOM 1340 N TYR A 84 5.636 0.866 -22.432 1.00 0.00 N ATOM 1341 CA TYR A 84 6.292 -0.437 -22.392 1.00 0.00 C ATOM 1342 C TYR A 84 5.334 -1.628 -22.316 1.00 0.00 C ATOM 1343 O TYR A 84 5.727 -2.732 -22.683 1.00 0.00 O ATOM 1344 CB TYR A 84 7.451 -0.494 -21.371 1.00 0.00 C ATOM 1345 CG TYR A 84 7.239 -0.070 -19.920 1.00 0.00 C ATOM 1346 CD1 TYR A 84 6.051 -0.353 -19.223 1.00 0.00 C ATOM 1347 CD2 TYR A 84 8.333 0.458 -19.203 1.00 0.00 C ATOM 1348 CE1 TYR A 84 5.891 0.068 -17.889 1.00 0.00 C ATOM 1349 CE2 TYR A 84 8.185 0.853 -17.863 1.00 0.00 C ATOM 1350 CZ TYR A 84 6.942 0.719 -17.224 1.00 0.00 C ATOM 1351 OH TYR A 84 6.749 1.261 -15.988 1.00 0.00 O ATOM 0 H TYR A 84 5.736 1.411 -21.576 1.00 0.00 H new ATOM 0 HA TYR A 84 6.759 -0.548 -23.371 1.00 0.00 H new ATOM 0 HB2 TYR A 84 7.812 -1.522 -21.354 1.00 0.00 H new ATOM 0 HB3 TYR A 84 8.258 0.121 -21.769 1.00 0.00 H new ATOM 0 HD1 TYR A 84 5.257 -0.896 -19.714 1.00 0.00 H new ATOM 0 HD2 TYR A 84 9.292 0.559 -19.688 1.00 0.00 H new ATOM 0 HE1 TYR A 84 4.957 -0.110 -17.376 1.00 0.00 H new ATOM 0 HE2 TYR A 84 9.028 1.260 -17.324 1.00 0.00 H new ATOM 0 HH TYR A 84 5.872 1.696 -15.955 1.00 0.00 H new ATOM 1361 N ASN A 85 4.092 -1.440 -21.859 1.00 0.00 N ATOM 1362 CA ASN A 85 3.148 -2.543 -21.683 1.00 0.00 C ATOM 1363 C ASN A 85 2.301 -2.763 -22.944 1.00 0.00 C ATOM 1364 O ASN A 85 1.176 -3.252 -22.835 1.00 0.00 O ATOM 1365 CB ASN A 85 2.294 -2.307 -20.427 1.00 0.00 C ATOM 1366 CG ASN A 85 1.879 -3.608 -19.738 1.00 0.00 C ATOM 1367 OD1 ASN A 85 2.269 -3.859 -18.604 1.00 0.00 O ATOM 1368 ND2 ASN A 85 1.081 -4.440 -20.394 1.00 0.00 N ATOM 0 H ASN A 85 3.717 -0.527 -21.603 1.00 0.00 H new ATOM 0 HA ASN A 85 3.706 -3.467 -21.532 1.00 0.00 H new ATOM 0 HB2 ASN A 85 2.854 -1.691 -19.723 1.00 0.00 H new ATOM 0 HB3 ASN A 85 1.401 -1.746 -20.701 1.00 0.00 H new ATOM 0 HD21 ASN A 85 0.779 -5.310 -19.955 1.00 0.00 H new ATOM 0 HD22 ASN A 85 0.769 -4.210 -21.337 1.00 0.00 H new ATOM 1375 N GLU A 86 2.780 -2.323 -24.117 1.00 0.00 N ATOM 1376 CA GLU A 86 2.008 -2.272 -25.338 1.00 0.00 C ATOM 1377 C GLU A 86 1.251 -3.570 -25.619 1.00 0.00 C ATOM 1378 O GLU A 86 1.710 -4.681 -25.361 1.00 0.00 O ATOM 1379 CB GLU A 86 2.853 -1.816 -26.536 1.00 0.00 C ATOM 1380 CG GLU A 86 1.999 -1.541 -27.789 1.00 0.00 C ATOM 1381 CD GLU A 86 0.927 -0.484 -27.559 1.00 0.00 C ATOM 1382 OE1 GLU A 86 1.255 0.701 -27.758 1.00 0.00 O ATOM 1383 OE2 GLU A 86 -0.205 -0.851 -27.153 1.00 0.00 O ATOM 0 H GLU A 86 3.737 -1.989 -24.231 1.00 0.00 H new ATOM 0 HA GLU A 86 1.244 -1.510 -25.183 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.400 -0.912 -26.268 1.00 0.00 H new ATOM 0 HB3 GLU A 86 3.594 -2.581 -26.766 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.650 -1.219 -28.602 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.524 -2.468 -28.109 1.00 0.00 H new ATOM 1552 N ALA B 8 -3.142 -8.909 -12.429 1.00 0.00 N ATOM 1553 CA ALA B 8 -3.595 -7.656 -11.842 1.00 0.00 C ATOM 1554 C ALA B 8 -3.223 -6.462 -12.725 1.00 0.00 C ATOM 1555 O ALA B 8 -4.086 -5.656 -13.073 1.00 0.00 O ATOM 1556 CB ALA B 8 -3.021 -7.503 -10.430 1.00 0.00 C ATOM 0 HA ALA B 8 -4.683 -7.678 -11.774 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -3.364 -6.563 -9.998 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.358 -8.333 -9.809 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -1.932 -7.504 -10.478 1.00 0.00 H new ATOM 1562 N ILE B 9 -1.945 -6.348 -13.097 1.00 0.00 N ATOM 1563 CA ILE B 9 -1.466 -5.289 -13.979 1.00 0.00 C ATOM 1564 C ILE B 9 -2.307 -5.273 -15.260 1.00 0.00 C ATOM 1565 O ILE B 9 -2.850 -4.235 -15.632 1.00 0.00 O ATOM 1566 CB ILE B 9 0.046 -5.462 -14.231 1.00 0.00 C ATOM 1567 CG1 ILE B 9 0.820 -5.068 -12.958 1.00 0.00 C ATOM 1568 CG2 ILE B 9 0.524 -4.608 -15.415 1.00 0.00 C ATOM 1569 CD1 ILE B 9 2.270 -5.565 -12.967 1.00 0.00 C ATOM 0 H ILE B 9 -1.214 -6.991 -12.792 1.00 0.00 H new ATOM 0 HA ILE B 9 -1.588 -4.311 -13.513 1.00 0.00 H new ATOM 0 HB ILE B 9 0.235 -6.507 -14.478 1.00 0.00 H new ATOM 0 HG12 ILE B 9 0.813 -3.983 -12.855 1.00 0.00 H new ATOM 0 HG13 ILE B 9 0.307 -5.474 -12.086 1.00 0.00 H new ATOM 0 HG21 ILE B 9 1.594 -4.756 -15.562 1.00 0.00 H new ATOM 0 HG22 ILE B 9 -0.011 -4.905 -16.317 1.00 0.00 H new ATOM 0 HG23 ILE B 9 0.329 -3.556 -15.207 1.00 0.00 H new ATOM 0 HD11 ILE B 9 2.766 -5.258 -12.046 1.00 0.00 H new ATOM 0 HD12 ILE B 9 2.281 -6.652 -13.040 1.00 0.00 H new ATOM 0 HD13 ILE B 9 2.796 -5.138 -13.821 1.00 0.00 H new ATOM 1581 N GLY B 10 -2.449 -6.430 -15.910 1.00 0.00 N ATOM 1582 CA GLY B 10 -3.282 -6.601 -17.089 1.00 0.00 C ATOM 1583 C GLY B 10 -4.699 -6.083 -16.848 1.00 0.00 C ATOM 1584 O GLY B 10 -5.213 -5.289 -17.636 1.00 0.00 O ATOM 0 H GLY B 10 -1.977 -7.287 -15.621 1.00 0.00 H new ATOM 0 HA2 GLY B 10 -2.837 -6.071 -17.931 1.00 0.00 H new ATOM 0 HA3 GLY B 10 -3.320 -7.656 -17.360 1.00 0.00 H new ATOM 1588 N LEU B 11 -5.328 -6.517 -15.752 1.00 0.00 N ATOM 1589 CA LEU B 11 -6.674 -6.109 -15.381 1.00 0.00 C ATOM 1590 C LEU B 11 -6.745 -4.586 -15.322 1.00 0.00 C ATOM 1591 O LEU B 11 -7.557 -3.993 -16.028 1.00 0.00 O ATOM 1592 CB LEU B 11 -7.095 -6.797 -14.071 1.00 0.00 C ATOM 1593 CG LEU B 11 -8.597 -6.682 -13.746 1.00 0.00 C ATOM 1594 CD1 LEU B 11 -8.988 -7.815 -12.789 1.00 0.00 C ATOM 1595 CD2 LEU B 11 -8.965 -5.349 -13.081 1.00 0.00 C ATOM 0 H LEU B 11 -4.905 -7.170 -15.093 1.00 0.00 H new ATOM 0 HA LEU B 11 -7.393 -6.430 -16.135 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -6.827 -7.852 -14.127 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -6.524 -6.366 -13.249 1.00 0.00 H new ATOM 0 HG LEU B 11 -9.134 -6.744 -14.693 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -10.050 -7.742 -12.553 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -8.787 -8.776 -13.262 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -8.406 -7.733 -11.871 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -10.035 -5.328 -12.877 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -8.415 -5.245 -12.146 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -8.706 -4.526 -13.748 1.00 0.00 H new ATOM 1607 N LEU B 12 -5.882 -3.942 -14.530 1.00 0.00 N ATOM 1608 CA LEU B 12 -5.845 -2.483 -14.444 1.00 0.00 C ATOM 1609 C LEU B 12 -5.686 -1.863 -15.838 1.00 0.00 C ATOM 1610 O LEU B 12 -6.419 -0.945 -16.212 1.00 0.00 O ATOM 1611 CB LEU B 12 -4.715 -2.018 -13.509 1.00 0.00 C ATOM 1612 CG LEU B 12 -5.174 -1.841 -12.052 1.00 0.00 C ATOM 1613 CD1 LEU B 12 -5.578 -3.164 -11.394 1.00 0.00 C ATOM 1614 CD2 LEU B 12 -4.044 -1.200 -11.237 1.00 0.00 C ATOM 0 H LEU B 12 -5.198 -4.413 -13.938 1.00 0.00 H new ATOM 0 HA LEU B 12 -6.792 -2.143 -14.025 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -3.902 -2.743 -13.542 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -4.314 -1.073 -13.875 1.00 0.00 H new ATOM 0 HG LEU B 12 -6.056 -1.200 -12.067 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -5.893 -2.978 -10.367 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -6.402 -3.611 -11.951 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -4.727 -3.846 -11.395 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -4.367 -1.074 -10.204 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -3.164 -1.843 -11.266 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -3.796 -0.227 -11.661 1.00 0.00 H new ATOM 1626 N ILE B 13 -4.714 -2.348 -16.607 1.00 0.00 N ATOM 1627 CA ILE B 13 -4.380 -1.802 -17.914 1.00 0.00 C ATOM 1628 C ILE B 13 -5.524 -1.970 -18.924 1.00 0.00 C ATOM 1629 O ILE B 13 -5.665 -1.127 -19.814 1.00 0.00 O ATOM 1630 CB ILE B 13 -3.040 -2.399 -18.382 1.00 0.00 C ATOM 1631 CG1 ILE B 13 -1.914 -1.746 -17.559 1.00 0.00 C ATOM 1632 CG2 ILE B 13 -2.821 -2.163 -19.877 1.00 0.00 C ATOM 1633 CD1 ILE B 13 -0.532 -2.306 -17.891 1.00 0.00 C ATOM 0 H ILE B 13 -4.132 -3.140 -16.334 1.00 0.00 H new ATOM 0 HA ILE B 13 -4.251 -0.723 -17.835 1.00 0.00 H new ATOM 0 HB ILE B 13 -3.045 -3.478 -18.227 1.00 0.00 H new ATOM 0 HG12 ILE B 13 -1.917 -0.671 -17.738 1.00 0.00 H new ATOM 0 HG13 ILE B 13 -2.115 -1.893 -16.498 1.00 0.00 H new ATOM 0 HG21 ILE B 13 -1.867 -2.596 -20.178 1.00 0.00 H new ATOM 0 HG22 ILE B 13 -3.626 -2.633 -20.441 1.00 0.00 H new ATOM 0 HG23 ILE B 13 -2.813 -1.092 -20.079 1.00 0.00 H new ATOM 0 HD11 ILE B 13 0.219 -1.807 -17.279 1.00 0.00 H new ATOM 0 HD12 ILE B 13 -0.514 -3.376 -17.686 1.00 0.00 H new ATOM 0 HD13 ILE B 13 -0.314 -2.135 -18.945 1.00 0.00 H new ATOM 1645 N GLY B 14 -6.331 -3.028 -18.808 1.00 0.00 N ATOM 1646 CA GLY B 14 -7.464 -3.295 -19.688 1.00 0.00 C ATOM 1647 C GLY B 14 -8.722 -2.546 -19.238 1.00 0.00 C ATOM 1648 O GLY B 14 -9.370 -1.849 -20.027 1.00 0.00 O ATOM 0 H GLY B 14 -6.210 -3.736 -18.083 1.00 0.00 H new ATOM 0 HA2 GLY B 14 -7.211 -3.001 -20.706 1.00 0.00 H new ATOM 0 HA3 GLY B 14 -7.666 -4.366 -19.706 1.00 0.00 H new ATOM 1652 N ILE B 15 -9.074 -2.680 -17.958 1.00 0.00 N ATOM 1653 CA ILE B 15 -10.268 -2.064 -17.397 1.00 0.00 C ATOM 1654 C ILE B 15 -10.207 -0.540 -17.581 1.00 0.00 C ATOM 1655 O ILE B 15 -11.228 0.088 -17.856 1.00 0.00 O ATOM 1656 CB ILE B 15 -10.507 -2.560 -15.956 1.00 0.00 C ATOM 1657 CG1 ILE B 15 -11.998 -2.529 -15.606 1.00 0.00 C ATOM 1658 CG2 ILE B 15 -9.720 -1.747 -14.929 1.00 0.00 C ATOM 1659 CD1 ILE B 15 -12.299 -3.300 -14.316 1.00 0.00 C ATOM 0 H ILE B 15 -8.534 -3.221 -17.283 1.00 0.00 H new ATOM 0 HA ILE B 15 -11.160 -2.377 -17.940 1.00 0.00 H new ATOM 0 HB ILE B 15 -10.150 -3.589 -15.916 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -12.323 -1.495 -15.495 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -12.573 -2.957 -16.427 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -9.920 -2.133 -13.929 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -8.654 -1.826 -15.142 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -10.024 -0.702 -14.982 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -13.367 -3.253 -14.105 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -11.999 -4.341 -14.436 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.745 -2.855 -13.489 1.00 0.00 H new ATOM 1671 N PHE B 16 -8.985 0.016 -17.535 1.00 0.00 N ATOM 1672 CA PHE B 16 -8.647 1.384 -17.918 1.00 0.00 C ATOM 1673 C PHE B 16 -9.447 1.905 -19.109 1.00 0.00 C ATOM 1674 O PHE B 16 -9.882 3.052 -19.095 1.00 0.00 O ATOM 1675 CB PHE B 16 -7.132 1.521 -18.064 1.00 0.00 C ATOM 1676 CG PHE B 16 -6.690 2.836 -18.663 1.00 0.00 C ATOM 1677 CD1 PHE B 16 -7.214 4.060 -18.205 1.00 0.00 C ATOM 1678 CD2 PHE B 16 -6.022 2.796 -19.888 1.00 0.00 C ATOM 1679 CE1 PHE B 16 -7.269 5.160 -19.078 1.00 0.00 C ATOM 1680 CE2 PHE B 16 -6.243 3.816 -20.818 1.00 0.00 C ATOM 1681 CZ PHE B 16 -6.845 5.018 -20.410 1.00 0.00 C ATOM 0 H PHE B 16 -8.171 -0.508 -17.213 1.00 0.00 H new ATOM 0 HA PHE B 16 -8.957 2.049 -17.112 1.00 0.00 H new ATOM 0 HB2 PHE B 16 -6.671 1.407 -17.083 1.00 0.00 H new ATOM 0 HB3 PHE B 16 -6.762 0.707 -18.687 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -7.571 4.153 -17.190 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -5.343 1.987 -20.114 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -7.636 6.113 -18.726 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -5.951 3.680 -21.849 1.00 0.00 H new ATOM 0 HZ PHE B 16 -6.981 5.826 -21.114 1.00 0.00 H new ATOM 1691 N HIS B 17 -9.612 1.092 -20.151 1.00 0.00 N ATOM 1692 CA HIS B 17 -10.331 1.507 -21.344 1.00 0.00 C ATOM 1693 C HIS B 17 -11.802 1.094 -21.284 1.00 0.00 C ATOM 1694 O HIS B 17 -12.685 1.868 -21.631 1.00 0.00 O ATOM 1695 CB HIS B 17 -9.667 0.988 -22.627 1.00 0.00 C ATOM 1696 CG HIS B 17 -8.172 0.859 -22.650 1.00 0.00 C ATOM 1697 ND1 HIS B 17 -7.293 1.590 -23.418 1.00 0.00 N ATOM 1698 CD2 HIS B 17 -7.434 0.101 -21.799 1.00 0.00 C ATOM 1699 CE1 HIS B 17 -6.059 1.319 -22.947 1.00 0.00 C ATOM 1700 NE2 HIS B 17 -6.119 0.361 -22.016 1.00 0.00 N ATOM 0 H HIS B 17 -9.254 0.138 -20.188 1.00 0.00 H new ATOM 0 HA HIS B 17 -10.289 2.596 -21.374 1.00 0.00 H new ATOM 0 HB2 HIS B 17 -10.089 0.007 -22.847 1.00 0.00 H new ATOM 0 HB3 HIS B 17 -9.957 1.650 -23.443 1.00 0.00 H new ATOM 0 HD1 HIS B 17 -7.529 2.213 -24.190 1.00 0.00 H new ATOM 0 HD2 HIS B 17 -7.827 -0.593 -21.071 1.00 0.00 H new ATOM 0 HE1 HIS B 17 -5.152 1.806 -23.275 1.00 0.00 H new ATOM 1708 N LYS B 18 -12.043 -0.163 -20.896 1.00 0.00 N ATOM 1709 CA LYS B 18 -13.324 -0.856 -21.018 1.00 0.00 C ATOM 1710 C LYS B 18 -14.569 -0.120 -20.535 1.00 0.00 C ATOM 1711 O LYS B 18 -15.642 -0.352 -21.090 1.00 0.00 O ATOM 1712 CB LYS B 18 -13.219 -2.246 -20.385 1.00 0.00 C ATOM 1713 CG LYS B 18 -12.429 -3.186 -21.307 1.00 0.00 C ATOM 1714 CD LYS B 18 -13.334 -3.742 -22.424 1.00 0.00 C ATOM 1715 CE LYS B 18 -12.661 -3.744 -23.805 1.00 0.00 C ATOM 1716 NZ LYS B 18 -12.772 -2.443 -24.499 1.00 0.00 N ATOM 0 H LYS B 18 -11.321 -0.746 -20.472 1.00 0.00 H new ATOM 0 HA LYS B 18 -13.494 -0.921 -22.093 1.00 0.00 H new ATOM 0 HB2 LYS B 18 -12.727 -2.176 -19.415 1.00 0.00 H new ATOM 0 HB3 LYS B 18 -14.216 -2.650 -20.208 1.00 0.00 H new ATOM 0 HG2 LYS B 18 -11.588 -2.650 -21.747 1.00 0.00 H new ATOM 0 HG3 LYS B 18 -12.013 -4.009 -20.726 1.00 0.00 H new ATOM 0 HD2 LYS B 18 -13.630 -4.760 -22.170 1.00 0.00 H new ATOM 0 HD3 LYS B 18 -14.246 -3.148 -22.473 1.00 0.00 H new ATOM 0 HE2 LYS B 18 -11.608 -4.001 -23.690 1.00 0.00 H new ATOM 0 HE3 LYS B 18 -13.113 -4.520 -24.423 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 -12.301 -2.502 -25.424 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 -13.776 -2.207 -24.636 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 -12.317 -1.704 -23.926 1.00 0.00 H new ATOM 1730 N TYR B 19 -14.474 0.703 -19.493 1.00 0.00 N ATOM 1731 CA TYR B 19 -15.673 1.219 -18.848 1.00 0.00 C ATOM 1732 C TYR B 19 -16.613 1.947 -19.823 1.00 0.00 C ATOM 1733 O TYR B 19 -16.188 2.534 -20.822 1.00 0.00 O ATOM 1734 CB TYR B 19 -15.311 1.946 -17.545 1.00 0.00 C ATOM 1735 CG TYR B 19 -14.809 1.044 -16.424 1.00 0.00 C ATOM 1736 CD1 TYR B 19 -14.760 -0.355 -16.594 1.00 0.00 C ATOM 1737 CD2 TYR B 19 -14.618 1.574 -15.133 1.00 0.00 C ATOM 1738 CE1 TYR B 19 -14.892 -1.196 -15.489 1.00 0.00 C ATOM 1739 CE2 TYR B 19 -14.558 0.710 -14.022 1.00 0.00 C ATOM 1740 CZ TYR B 19 -14.821 -0.661 -14.195 1.00 0.00 C ATOM 1741 OH TYR B 19 -15.036 -1.478 -13.131 1.00 0.00 O ATOM 0 H TYR B 19 -13.595 1.021 -19.085 1.00 0.00 H new ATOM 0 HA TYR B 19 -16.301 0.388 -18.528 1.00 0.00 H new ATOM 0 HB2 TYR B 19 -14.545 2.691 -17.762 1.00 0.00 H new ATOM 0 HB3 TYR B 19 -16.189 2.486 -17.191 1.00 0.00 H new ATOM 0 HD1 TYR B 19 -14.620 -0.775 -17.579 1.00 0.00 H new ATOM 0 HD2 TYR B 19 -14.518 2.640 -14.995 1.00 0.00 H new ATOM 0 HE1 TYR B 19 -15.048 -2.255 -15.630 1.00 0.00 H new ATOM 0 HE2 TYR B 19 -14.312 1.097 -13.044 1.00 0.00 H new ATOM 0 HH TYR B 19 -15.259 -0.938 -12.344 1.00 0.00 H new ATOM 1751 N SER B 20 -17.919 1.772 -19.577 1.00 0.00 N ATOM 1752 CA SER B 20 -19.045 2.095 -20.451 1.00 0.00 C ATOM 1753 C SER B 20 -19.160 1.153 -21.657 1.00 0.00 C ATOM 1754 O SER B 20 -20.270 0.960 -22.146 1.00 0.00 O ATOM 1755 CB SER B 20 -19.113 3.571 -20.866 1.00 0.00 C ATOM 1756 OG SER B 20 -19.610 4.352 -19.790 1.00 0.00 O ATOM 0 H SER B 20 -18.235 1.370 -18.694 1.00 0.00 H new ATOM 0 HA SER B 20 -19.925 1.923 -19.831 1.00 0.00 H new ATOM 0 HB2 SER B 20 -18.123 3.923 -21.155 1.00 0.00 H new ATOM 0 HB3 SER B 20 -19.758 3.684 -21.737 1.00 0.00 H new ATOM 0 HG SER B 20 -19.042 5.142 -19.669 1.00 0.00 H new ATOM 1762 N GLY B 21 -18.060 0.570 -22.154 1.00 0.00 N ATOM 1763 CA GLY B 21 -18.084 -0.343 -23.292 1.00 0.00 C ATOM 1764 C GLY B 21 -18.788 0.271 -24.502 1.00 0.00 C ATOM 1765 O GLY B 21 -19.444 -0.430 -25.269 1.00 0.00 O ATOM 0 H GLY B 21 -17.127 0.723 -21.772 1.00 0.00 H new ATOM 0 HA2 GLY B 21 -17.063 -0.611 -23.564 1.00 0.00 H new ATOM 0 HA3 GLY B 21 -18.591 -1.265 -23.007 1.00 0.00 H new ATOM 1825 N LYS B 26 -12.216 1.831 -25.621 1.00 0.00 N ATOM 1826 CA LYS B 26 -10.918 1.688 -26.263 1.00 0.00 C ATOM 1827 C LYS B 26 -9.912 2.700 -25.701 1.00 0.00 C ATOM 1828 O LYS B 26 -8.723 2.398 -25.588 1.00 0.00 O ATOM 1829 CB LYS B 26 -11.075 1.894 -27.779 1.00 0.00 C ATOM 1830 CG LYS B 26 -12.227 1.060 -28.358 1.00 0.00 C ATOM 1831 CD LYS B 26 -12.320 1.196 -29.883 1.00 0.00 C ATOM 1832 CE LYS B 26 -13.379 0.258 -30.488 1.00 0.00 C ATOM 1833 NZ LYS B 26 -14.721 0.435 -29.890 1.00 0.00 N ATOM 0 HA LYS B 26 -10.538 0.686 -26.063 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -11.253 2.950 -27.985 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -10.145 1.624 -28.280 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -12.085 0.012 -28.095 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -13.167 1.377 -27.907 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -12.562 2.227 -30.140 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -11.348 0.977 -30.325 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -13.440 0.434 -31.562 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -13.061 -0.776 -30.352 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -15.410 -0.149 -30.405 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -14.698 0.143 -28.892 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -14.999 1.435 -29.952 1.00 0.00 H new ATOM 1847 N HIS B 27 -10.375 3.901 -25.337 1.00 0.00 N ATOM 1848 CA HIS B 27 -9.516 5.028 -24.991 1.00 0.00 C ATOM 1849 C HIS B 27 -9.789 5.505 -23.563 1.00 0.00 C ATOM 1850 O HIS B 27 -10.313 4.756 -22.744 1.00 0.00 O ATOM 1851 CB HIS B 27 -9.725 6.135 -26.046 1.00 0.00 C ATOM 1852 CG HIS B 27 -11.121 6.722 -26.051 1.00 0.00 C ATOM 1853 ND1 HIS B 27 -11.606 7.699 -25.196 1.00 0.00 N ATOM 1854 CD2 HIS B 27 -12.180 6.222 -26.756 1.00 0.00 C ATOM 1855 CE1 HIS B 27 -12.938 7.774 -25.367 1.00 0.00 C ATOM 1856 NE2 HIS B 27 -13.303 6.889 -26.311 1.00 0.00 N ATOM 0 H HIS B 27 -11.370 4.116 -25.275 1.00 0.00 H new ATOM 0 HA HIS B 27 -8.468 4.730 -25.006 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -9.006 6.934 -25.867 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -9.509 5.727 -27.034 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -12.145 5.454 -27.514 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -13.604 8.436 -24.834 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -14.255 6.736 -26.644 1.00 0.00 H new ATOM 1864 N THR B 28 -9.420 6.757 -23.285 1.00 0.00 N ATOM 1865 CA THR B 28 -9.721 7.495 -22.071 1.00 0.00 C ATOM 1866 C THR B 28 -11.183 7.317 -21.663 1.00 0.00 C ATOM 1867 O THR B 28 -12.061 7.316 -22.524 1.00 0.00 O ATOM 1868 CB THR B 28 -9.436 8.975 -22.361 1.00 0.00 C ATOM 1869 OG1 THR B 28 -10.007 9.325 -23.614 1.00 0.00 O ATOM 1870 CG2 THR B 28 -7.934 9.236 -22.464 1.00 0.00 C ATOM 0 H THR B 28 -8.871 7.309 -23.944 1.00 0.00 H new ATOM 0 HA THR B 28 -9.109 7.126 -21.248 1.00 0.00 H new ATOM 0 HB THR B 28 -9.860 9.562 -21.546 1.00 0.00 H new ATOM 0 HG1 THR B 28 -10.718 8.689 -23.839 1.00 0.00 H new ATOM 0 HG21 THR B 28 -7.762 10.292 -22.670 1.00 0.00 H new ATOM 0 HG22 THR B 28 -7.453 8.966 -21.524 1.00 0.00 H new ATOM 0 HG23 THR B 28 -7.515 8.636 -23.272 1.00 0.00 H new ATOM 1878 N LEU B 29 -11.453 7.188 -20.364 1.00 0.00 N ATOM 1879 CA LEU B 29 -12.818 7.028 -19.890 1.00 0.00 C ATOM 1880 C LEU B 29 -13.571 8.347 -20.072 1.00 0.00 C ATOM 1881 O LEU B 29 -13.122 9.387 -19.592 1.00 0.00 O ATOM 1882 CB LEU B 29 -12.818 6.548 -18.429 1.00 0.00 C ATOM 1883 CG LEU B 29 -12.137 5.178 -18.254 1.00 0.00 C ATOM 1884 CD1 LEU B 29 -12.325 4.690 -16.813 1.00 0.00 C ATOM 1885 CD2 LEU B 29 -12.691 4.126 -19.228 1.00 0.00 C ATOM 0 H LEU B 29 -10.746 7.192 -19.629 1.00 0.00 H new ATOM 0 HA LEU B 29 -13.334 6.265 -20.473 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -12.308 7.285 -17.809 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -13.846 6.487 -18.071 1.00 0.00 H new ATOM 0 HG LEU B 29 -11.077 5.308 -18.475 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -11.842 3.720 -16.691 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -11.877 5.407 -16.125 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -13.389 4.595 -16.597 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -12.180 3.177 -19.067 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -13.760 3.997 -19.055 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -12.526 4.457 -20.253 1.00 0.00 H new ATOM 1897 N SER B 30 -14.706 8.326 -20.778 1.00 0.00 N ATOM 1898 CA SER B 30 -15.481 9.512 -21.118 1.00 0.00 C ATOM 1899 C SER B 30 -16.355 9.922 -19.930 1.00 0.00 C ATOM 1900 O SER B 30 -17.582 9.973 -20.015 1.00 0.00 O ATOM 1901 CB SER B 30 -16.299 9.265 -22.398 1.00 0.00 C ATOM 1902 OG SER B 30 -15.704 8.237 -23.164 1.00 0.00 O ATOM 0 H SER B 30 -15.116 7.463 -21.134 1.00 0.00 H new ATOM 0 HA SER B 30 -14.809 10.344 -21.327 1.00 0.00 H new ATOM 0 HB2 SER B 30 -17.321 8.990 -22.138 1.00 0.00 H new ATOM 0 HB3 SER B 30 -16.355 10.181 -22.986 1.00 0.00 H new ATOM 0 HG SER B 30 -15.989 7.365 -22.819 1.00 0.00 H new ATOM 1908 N LYS B 31 -15.702 10.235 -18.812 1.00 0.00 N ATOM 1909 CA LYS B 31 -16.320 10.804 -17.630 1.00 0.00 C ATOM 1910 C LYS B 31 -17.244 9.827 -16.916 1.00 0.00 C ATOM 1911 O LYS B 31 -16.856 9.317 -15.867 1.00 0.00 O ATOM 1912 CB LYS B 31 -16.976 12.168 -17.941 1.00 0.00 C ATOM 1913 CG LYS B 31 -15.965 13.138 -18.575 1.00 0.00 C ATOM 1914 CD LYS B 31 -16.611 14.446 -19.058 1.00 0.00 C ATOM 1915 CE LYS B 31 -16.726 15.529 -17.976 1.00 0.00 C ATOM 1916 NZ LYS B 31 -15.425 16.161 -17.678 1.00 0.00 N ATOM 0 H LYS B 31 -14.697 10.093 -18.707 1.00 0.00 H new ATOM 0 HA LYS B 31 -15.525 11.003 -16.911 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -17.819 12.024 -18.617 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -17.374 12.601 -17.023 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -15.187 13.370 -17.848 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -15.478 12.647 -19.417 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -16.028 14.840 -19.890 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -17.607 14.226 -19.443 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -17.432 16.292 -18.302 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -17.131 15.088 -17.065 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -15.574 16.993 -17.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -14.813 15.480 -17.185 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -14.971 16.456 -18.566 1.00 0.00 H new ATOM 1930 N LYS B 32 -18.455 9.585 -17.416 1.00 0.00 N ATOM 1931 CA LYS B 32 -19.448 8.816 -16.667 1.00 0.00 C ATOM 1932 C LYS B 32 -18.884 7.454 -16.261 1.00 0.00 C ATOM 1933 O LYS B 32 -18.976 7.081 -15.091 1.00 0.00 O ATOM 1934 CB LYS B 32 -20.790 8.743 -17.418 1.00 0.00 C ATOM 1935 CG LYS B 32 -20.667 8.027 -18.765 1.00 0.00 C ATOM 1936 CD LYS B 32 -21.998 7.905 -19.514 1.00 0.00 C ATOM 1937 CE LYS B 32 -21.772 7.421 -20.956 1.00 0.00 C ATOM 1938 NZ LYS B 32 -20.730 6.377 -21.065 1.00 0.00 N ATOM 0 H LYS B 32 -18.771 9.908 -18.331 1.00 0.00 H new ATOM 0 HA LYS B 32 -19.671 9.338 -15.737 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -21.522 8.224 -16.799 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -21.168 9.752 -17.579 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -19.955 8.565 -19.390 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -20.258 7.030 -18.602 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -22.652 7.208 -18.990 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -22.504 8.870 -19.525 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -22.710 7.032 -21.353 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -21.491 8.271 -21.578 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -20.850 5.859 -21.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -19.790 6.821 -21.046 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -20.816 5.716 -20.267 1.00 0.00 H new ATOM 1952 N GLU B 33 -18.226 6.761 -17.198 1.00 0.00 N ATOM 1953 CA GLU B 33 -17.502 5.531 -16.933 1.00 0.00 C ATOM 1954 C GLU B 33 -16.640 5.610 -15.668 1.00 0.00 C ATOM 1955 O GLU B 33 -16.578 4.640 -14.915 1.00 0.00 O ATOM 1956 CB GLU B 33 -16.668 5.111 -18.157 1.00 0.00 C ATOM 1957 CG GLU B 33 -16.217 6.221 -19.117 1.00 0.00 C ATOM 1958 CD GLU B 33 -17.173 6.483 -20.263 1.00 0.00 C ATOM 1959 OE1 GLU B 33 -18.375 6.639 -19.963 1.00 0.00 O ATOM 1960 OE2 GLU B 33 -16.701 6.508 -21.421 1.00 0.00 O ATOM 0 H GLU B 33 -18.186 7.051 -18.175 1.00 0.00 H new ATOM 0 HA GLU B 33 -18.248 4.759 -16.745 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -15.778 4.594 -17.797 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -17.249 4.387 -18.728 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -16.086 7.143 -18.551 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -15.242 5.957 -19.526 1.00 0.00 H new ATOM 1967 N LEU B 34 -15.979 6.744 -15.400 1.00 0.00 N ATOM 1968 CA LEU B 34 -15.126 6.856 -14.222 1.00 0.00 C ATOM 1969 C LEU B 34 -15.919 6.547 -12.944 1.00 0.00 C ATOM 1970 O LEU B 34 -15.399 5.914 -12.027 1.00 0.00 O ATOM 1971 CB LEU B 34 -14.483 8.251 -14.194 1.00 0.00 C ATOM 1972 CG LEU B 34 -13.116 8.386 -13.497 1.00 0.00 C ATOM 1973 CD1 LEU B 34 -13.151 8.153 -11.988 1.00 0.00 C ATOM 1974 CD2 LEU B 34 -12.051 7.492 -14.132 1.00 0.00 C ATOM 0 H LEU B 34 -16.021 7.584 -15.978 1.00 0.00 H new ATOM 0 HA LEU B 34 -14.326 6.118 -14.272 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -14.372 8.592 -15.223 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -15.179 8.933 -13.706 1.00 0.00 H new ATOM 0 HG LEU B 34 -12.845 9.431 -13.649 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -12.147 8.268 -11.579 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -13.817 8.879 -11.523 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -13.513 7.145 -11.784 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -11.105 7.623 -13.606 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -12.363 6.450 -14.064 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -11.924 7.765 -15.180 1.00 0.00 H new ATOM 1986 N LYS B 35 -17.197 6.943 -12.871 1.00 0.00 N ATOM 1987 CA LYS B 35 -17.952 6.720 -11.644 1.00 0.00 C ATOM 1988 C LYS B 35 -18.120 5.233 -11.301 1.00 0.00 C ATOM 1989 O LYS B 35 -18.298 4.905 -10.125 1.00 0.00 O ATOM 1990 CB LYS B 35 -19.296 7.460 -11.652 1.00 0.00 C ATOM 1991 CG LYS B 35 -19.177 8.982 -11.833 1.00 0.00 C ATOM 1992 CD LYS B 35 -18.087 9.611 -10.943 1.00 0.00 C ATOM 1993 CE LYS B 35 -18.365 11.083 -10.595 1.00 0.00 C ATOM 1994 NZ LYS B 35 -17.137 11.830 -10.250 1.00 0.00 N ATOM 0 H LYS B 35 -17.710 7.403 -13.622 1.00 0.00 H new ATOM 0 HA LYS B 35 -17.351 7.149 -10.842 1.00 0.00 H new ATOM 0 HB2 LYS B 35 -19.915 7.057 -12.454 1.00 0.00 H new ATOM 0 HB3 LYS B 35 -19.816 7.256 -10.716 1.00 0.00 H new ATOM 0 HG2 LYS B 35 -18.957 9.202 -12.878 1.00 0.00 H new ATOM 0 HG3 LYS B 35 -20.137 9.446 -11.605 1.00 0.00 H new ATOM 0 HD2 LYS B 35 -18.003 9.036 -10.021 1.00 0.00 H new ATOM 0 HD3 LYS B 35 -17.126 9.540 -11.452 1.00 0.00 H new ATOM 0 HE2 LYS B 35 -18.853 11.566 -11.441 1.00 0.00 H new ATOM 0 HE3 LYS B 35 -19.061 11.129 -9.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 -17.308 12.405 -9.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 -16.363 11.160 -10.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 -16.875 12.451 -11.042 1.00 0.00 H new ATOM 2008 N GLU B 36 -18.054 4.333 -12.289 1.00 0.00 N ATOM 2009 CA GLU B 36 -18.044 2.897 -12.025 1.00 0.00 C ATOM 2010 C GLU B 36 -16.827 2.557 -11.163 1.00 0.00 C ATOM 2011 O GLU B 36 -16.924 1.922 -10.113 1.00 0.00 O ATOM 2012 CB GLU B 36 -18.068 2.131 -13.360 1.00 0.00 C ATOM 2013 CG GLU B 36 -17.844 0.616 -13.252 1.00 0.00 C ATOM 2014 CD GLU B 36 -18.966 -0.166 -12.590 1.00 0.00 C ATOM 2015 OE1 GLU B 36 -19.905 0.461 -12.061 1.00 0.00 O ATOM 2016 OE2 GLU B 36 -18.819 -1.409 -12.581 1.00 0.00 O ATOM 0 H GLU B 36 -18.007 4.578 -13.278 1.00 0.00 H new ATOM 0 HA GLU B 36 -18.931 2.594 -11.469 1.00 0.00 H new ATOM 0 HB2 GLU B 36 -19.029 2.306 -13.843 1.00 0.00 H new ATOM 0 HB3 GLU B 36 -17.302 2.549 -14.014 1.00 0.00 H new ATOM 0 HG2 GLU B 36 -17.689 0.217 -14.254 1.00 0.00 H new ATOM 0 HG3 GLU B 36 -16.924 0.441 -12.694 1.00 0.00 H new ATOM 2023 N LEU B 37 -15.675 3.050 -11.608 1.00 0.00 N ATOM 2024 CA LEU B 37 -14.404 2.895 -10.922 1.00 0.00 C ATOM 2025 C LEU B 37 -14.547 3.391 -9.484 1.00 0.00 C ATOM 2026 O LEU B 37 -14.242 2.655 -8.543 1.00 0.00 O ATOM 2027 CB LEU B 37 -13.311 3.655 -11.693 1.00 0.00 C ATOM 2028 CG LEU B 37 -11.895 3.089 -11.524 1.00 0.00 C ATOM 2029 CD1 LEU B 37 -10.939 3.960 -12.341 1.00 0.00 C ATOM 2030 CD2 LEU B 37 -11.400 3.096 -10.077 1.00 0.00 C ATOM 0 H LEU B 37 -15.602 3.580 -12.476 1.00 0.00 H new ATOM 0 HA LEU B 37 -14.111 1.846 -10.885 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -13.565 3.652 -12.753 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.313 4.695 -11.368 1.00 0.00 H new ATOM 0 HG LEU B 37 -11.923 2.051 -11.856 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -9.923 3.579 -12.239 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.232 3.936 -13.391 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -10.980 4.986 -11.976 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -10.393 2.682 -10.035 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -11.388 4.119 -9.702 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -12.067 2.492 -9.461 1.00 0.00 H new ATOM 2042 N ILE B 38 -15.017 4.635 -9.311 1.00 0.00 N ATOM 2043 CA ILE B 38 -15.038 5.203 -7.969 1.00 0.00 C ATOM 2044 C ILE B 38 -15.970 4.434 -7.044 1.00 0.00 C ATOM 2045 O ILE B 38 -15.621 4.175 -5.894 1.00 0.00 O ATOM 2046 CB ILE B 38 -15.208 6.736 -7.894 1.00 0.00 C ATOM 2047 CG1 ILE B 38 -16.661 7.220 -7.746 1.00 0.00 C ATOM 2048 CG2 ILE B 38 -14.489 7.428 -9.056 1.00 0.00 C ATOM 2049 CD1 ILE B 38 -16.739 8.736 -7.532 1.00 0.00 C ATOM 0 H ILE B 38 -15.372 5.239 -10.052 1.00 0.00 H new ATOM 0 HA ILE B 38 -14.025 5.063 -7.591 1.00 0.00 H new ATOM 0 HB ILE B 38 -14.729 7.033 -6.961 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -17.226 6.950 -8.638 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -17.130 6.710 -6.904 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -14.626 8.507 -8.978 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -13.425 7.193 -9.017 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -14.904 7.077 -10.001 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -17.782 9.036 -7.432 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -16.196 9.004 -6.626 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -16.294 9.247 -8.386 1.00 0.00 H new ATOM 2061 N GLN B 39 -17.162 4.065 -7.524 1.00 0.00 N ATOM 2062 CA GLN B 39 -18.084 3.370 -6.645 1.00 0.00 C ATOM 2063 C GLN B 39 -17.563 1.975 -6.291 1.00 0.00 C ATOM 2064 O GLN B 39 -17.645 1.596 -5.122 1.00 0.00 O ATOM 2065 CB GLN B 39 -19.525 3.418 -7.170 1.00 0.00 C ATOM 2066 CG GLN B 39 -19.802 2.524 -8.381 1.00 0.00 C ATOM 2067 CD GLN B 39 -21.079 2.952 -9.092 1.00 0.00 C ATOM 2068 OE1 GLN B 39 -22.133 2.348 -8.926 1.00 0.00 O ATOM 2069 NE2 GLN B 39 -20.993 4.028 -9.866 1.00 0.00 N ATOM 0 H GLN B 39 -17.494 4.230 -8.474 1.00 0.00 H new ATOM 0 HA GLN B 39 -18.133 3.902 -5.695 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -20.199 3.131 -6.363 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -19.765 4.448 -7.435 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -18.962 2.573 -9.074 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -19.890 1.486 -8.059 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -20.098 4.504 -9.980 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -21.822 4.378 -10.347 1.00 0.00 H new ATOM 2078 N LYS B 40 -17.082 1.215 -7.282 1.00 0.00 N ATOM 2079 CA LYS B 40 -16.561 -0.137 -7.102 1.00 0.00 C ATOM 2080 C LYS B 40 -15.035 -0.226 -6.904 1.00 0.00 C ATOM 2081 O LYS B 40 -14.547 -0.233 -5.773 1.00 0.00 O ATOM 2082 CB LYS B 40 -17.040 -1.014 -8.265 1.00 0.00 C ATOM 2083 CG LYS B 40 -18.483 -1.494 -8.081 1.00 0.00 C ATOM 2084 CD LYS B 40 -19.058 -2.115 -9.363 1.00 0.00 C ATOM 2085 CE LYS B 40 -18.130 -3.159 -10.009 1.00 0.00 C ATOM 2086 NZ LYS B 40 -17.156 -2.557 -10.945 1.00 0.00 N ATOM 0 H LYS B 40 -17.045 1.533 -8.250 1.00 0.00 H new ATOM 0 HA LYS B 40 -16.963 -0.508 -6.159 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -16.963 -0.452 -9.196 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -16.382 -1.878 -8.359 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -18.520 -2.228 -7.276 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -19.107 -0.654 -7.775 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -20.015 -2.584 -9.133 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -19.257 -1.322 -10.084 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -17.592 -3.694 -9.227 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -18.733 -3.894 -10.542 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -16.405 -3.245 -11.154 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -17.640 -2.294 -11.827 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -16.738 -1.708 -10.513 1.00 0.00 H new ATOM 2100 N GLU B 41 -14.293 -0.365 -8.010 1.00 0.00 N ATOM 2101 CA GLU B 41 -12.890 -0.773 -8.055 1.00 0.00 C ATOM 2102 C GLU B 41 -11.937 -0.062 -7.095 1.00 0.00 C ATOM 2103 O GLU B 41 -10.957 -0.675 -6.672 1.00 0.00 O ATOM 2104 CB GLU B 41 -12.365 -0.741 -9.496 1.00 0.00 C ATOM 2105 CG GLU B 41 -12.775 -1.994 -10.286 1.00 0.00 C ATOM 2106 CD GLU B 41 -14.276 -2.164 -10.423 1.00 0.00 C ATOM 2107 OE1 GLU B 41 -14.981 -1.132 -10.546 1.00 0.00 O ATOM 2108 OE2 GLU B 41 -14.760 -3.316 -10.468 1.00 0.00 O ATOM 0 H GLU B 41 -14.676 -0.187 -8.939 1.00 0.00 H new ATOM 0 HA GLU B 41 -12.898 -1.796 -7.680 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -12.746 0.147 -10.001 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -11.278 -0.659 -9.484 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -12.331 -1.947 -11.280 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -12.362 -2.874 -9.794 1.00 0.00 H new ATOM 2115 N LEU B 42 -12.189 1.193 -6.717 1.00 0.00 N ATOM 2116 CA LEU B 42 -11.344 1.833 -5.707 1.00 0.00 C ATOM 2117 C LEU B 42 -11.243 1.022 -4.407 1.00 0.00 C ATOM 2118 O LEU B 42 -10.264 1.176 -3.678 1.00 0.00 O ATOM 2119 CB LEU B 42 -11.790 3.270 -5.435 1.00 0.00 C ATOM 2120 CG LEU B 42 -11.580 4.190 -6.645 1.00 0.00 C ATOM 2121 CD1 LEU B 42 -12.007 5.598 -6.234 1.00 0.00 C ATOM 2122 CD2 LEU B 42 -10.119 4.260 -7.103 1.00 0.00 C ATOM 0 H LEU B 42 -12.946 1.771 -7.081 1.00 0.00 H new ATOM 0 HA LEU B 42 -10.338 1.865 -6.126 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -12.844 3.274 -5.159 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -11.236 3.664 -4.583 1.00 0.00 H new ATOM 0 HG LEU B 42 -12.165 3.789 -7.472 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -11.870 6.279 -7.074 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -13.057 5.589 -5.941 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -11.399 5.932 -5.393 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -10.038 4.927 -7.962 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -9.501 4.640 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -9.778 3.264 -7.384 1.00 0.00 H new ATOM 2134 N THR B 43 -12.207 0.139 -4.121 1.00 0.00 N ATOM 2135 CA THR B 43 -12.146 -0.854 -3.048 1.00 0.00 C ATOM 2136 C THR B 43 -12.421 -0.243 -1.675 1.00 0.00 C ATOM 2137 O THR B 43 -13.344 -0.672 -0.990 1.00 0.00 O ATOM 2138 CB THR B 43 -10.842 -1.678 -3.098 1.00 0.00 C ATOM 2139 OG1 THR B 43 -10.673 -2.232 -4.389 1.00 0.00 O ATOM 2140 CG2 THR B 43 -10.891 -2.848 -2.110 1.00 0.00 C ATOM 0 H THR B 43 -13.079 0.097 -4.649 1.00 0.00 H new ATOM 0 HA THR B 43 -12.956 -1.562 -3.221 1.00 0.00 H new ATOM 0 HB THR B 43 -10.022 -1.006 -2.844 1.00 0.00 H new ATOM 0 HG1 THR B 43 -10.654 -1.512 -5.054 1.00 0.00 H new ATOM 0 HG21 THR B 43 -9.960 -3.411 -2.167 1.00 0.00 H new ATOM 0 HG22 THR B 43 -11.022 -2.465 -1.098 1.00 0.00 H new ATOM 0 HG23 THR B 43 -11.726 -3.502 -2.361 1.00 0.00 H new ATOM 2148 N ILE B 44 -11.603 0.741 -1.298 1.00 0.00 N ATOM 2149 CA ILE B 44 -11.741 1.636 -0.153 1.00 0.00 C ATOM 2150 C ILE B 44 -12.515 1.048 1.038 1.00 0.00 C ATOM 2151 O ILE B 44 -13.517 1.591 1.500 1.00 0.00 O ATOM 2152 CB ILE B 44 -12.232 3.021 -0.613 1.00 0.00 C ATOM 2153 CG1 ILE B 44 -13.379 3.022 -1.645 1.00 0.00 C ATOM 2154 CG2 ILE B 44 -11.073 3.824 -1.219 1.00 0.00 C ATOM 2155 CD1 ILE B 44 -14.716 2.505 -1.118 1.00 0.00 C ATOM 0 H ILE B 44 -10.758 0.947 -1.831 1.00 0.00 H new ATOM 0 HA ILE B 44 -10.745 1.768 0.269 1.00 0.00 H new ATOM 0 HB ILE B 44 -12.626 3.469 0.299 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -13.518 4.039 -2.012 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -13.081 2.413 -2.499 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -11.436 4.801 -1.540 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -10.291 3.955 -0.471 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -10.668 3.288 -2.077 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -15.460 2.543 -1.914 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -14.600 1.476 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -15.043 3.127 -0.285 1.00 0.00 H new ATOM 2167 N GLY B 45 -11.986 -0.060 1.556 1.00 0.00 N ATOM 2168 CA GLY B 45 -12.546 -0.820 2.664 1.00 0.00 C ATOM 2169 C GLY B 45 -11.585 -0.843 3.855 1.00 0.00 C ATOM 2170 O GLY B 45 -10.566 -0.147 3.864 1.00 0.00 O ATOM 0 H GLY B 45 -11.121 -0.466 1.198 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -13.496 -0.381 2.967 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -12.755 -1.840 2.341 1.00 0.00 H new ATOM 2373 N ASP B 58 -13.622 10.191 -3.030 1.00 0.00 N ATOM 2374 CA ASP B 58 -13.051 9.697 -4.277 1.00 0.00 C ATOM 2375 C ASP B 58 -13.592 10.393 -5.520 1.00 0.00 C ATOM 2376 O ASP B 58 -13.123 10.121 -6.624 1.00 0.00 O ATOM 2377 CB ASP B 58 -13.273 8.190 -4.379 1.00 0.00 C ATOM 2378 CG ASP B 58 -12.559 7.381 -3.303 1.00 0.00 C ATOM 2379 OD1 ASP B 58 -11.582 7.905 -2.725 1.00 0.00 O ATOM 2380 OD2 ASP B 58 -12.996 6.229 -3.097 1.00 0.00 O ATOM 0 HA ASP B 58 -11.986 9.926 -4.245 1.00 0.00 H new ATOM 0 HB2 ASP B 58 -14.342 7.987 -4.322 1.00 0.00 H new ATOM 0 HB3 ASP B 58 -12.936 7.849 -5.358 1.00 0.00 H new ATOM 2385 N ASP B 59 -14.503 11.355 -5.376 1.00 0.00 N ATOM 2386 CA ASP B 59 -14.868 12.221 -6.485 1.00 0.00 C ATOM 2387 C ASP B 59 -13.660 13.044 -6.965 1.00 0.00 C ATOM 2388 O ASP B 59 -13.727 13.655 -8.024 1.00 0.00 O ATOM 2389 CB ASP B 59 -16.058 13.102 -6.082 1.00 0.00 C ATOM 2390 CG ASP B 59 -16.637 13.866 -7.254 1.00 0.00 C ATOM 2391 OD1 ASP B 59 -17.344 13.228 -8.064 1.00 0.00 O ATOM 2392 OD2 ASP B 59 -16.328 15.071 -7.385 1.00 0.00 O ATOM 0 H ASP B 59 -14.997 11.550 -4.505 1.00 0.00 H new ATOM 0 HA ASP B 59 -15.178 11.611 -7.333 1.00 0.00 H new ATOM 0 HB2 ASP B 59 -16.835 12.478 -5.640 1.00 0.00 H new ATOM 0 HB3 ASP B 59 -15.740 13.807 -5.314 1.00 0.00 H new ATOM 2397 N LEU B 60 -12.523 12.995 -6.245 1.00 0.00 N ATOM 2398 CA LEU B 60 -11.190 13.485 -6.619 1.00 0.00 C ATOM 2399 C LEU B 60 -10.783 13.200 -8.074 1.00 0.00 C ATOM 2400 O LEU B 60 -9.798 13.766 -8.555 1.00 0.00 O ATOM 2401 CB LEU B 60 -10.140 12.947 -5.633 1.00 0.00 C ATOM 2402 CG LEU B 60 -10.072 13.769 -4.337 1.00 0.00 C ATOM 2403 CD1 LEU B 60 -9.371 12.949 -3.248 1.00 0.00 C ATOM 2404 CD2 LEU B 60 -9.301 15.081 -4.540 1.00 0.00 C ATOM 0 H LEU B 60 -12.516 12.578 -5.314 1.00 0.00 H new ATOM 0 HA LEU B 60 -11.240 14.572 -6.556 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -10.373 11.910 -5.390 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -9.161 12.950 -6.113 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.093 14.009 -4.041 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.322 13.532 -2.328 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -9.930 12.031 -3.067 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -8.361 12.700 -3.573 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.274 15.636 -3.602 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -8.283 14.859 -4.860 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -9.798 15.681 -5.302 1.00 0.00 H new ATOM 2416 N ASP B 61 -11.528 12.364 -8.806 1.00 0.00 N ATOM 2417 CA ASP B 61 -11.459 12.294 -10.262 1.00 0.00 C ATOM 2418 C ASP B 61 -11.561 13.696 -10.891 1.00 0.00 C ATOM 2419 O ASP B 61 -11.100 13.922 -12.015 1.00 0.00 O ATOM 2420 CB ASP B 61 -12.545 11.355 -10.784 1.00 0.00 C ATOM 2421 CG ASP B 61 -13.998 11.757 -10.560 1.00 0.00 C ATOM 2422 OD1 ASP B 61 -14.446 12.776 -11.129 1.00 0.00 O ATOM 2423 OD2 ASP B 61 -14.721 11.003 -9.878 1.00 0.00 O ATOM 0 H ASP B 61 -12.199 11.714 -8.397 1.00 0.00 H new ATOM 0 HA ASP B 61 -10.489 11.890 -10.553 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -12.393 11.230 -11.856 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -12.393 10.378 -10.325 1.00 0.00 H new ATOM 2428 N ARG B 62 -12.116 14.640 -10.119 1.00 0.00 N ATOM 2429 CA ARG B 62 -12.058 16.087 -10.392 1.00 0.00 C ATOM 2430 C ARG B 62 -10.679 16.509 -10.919 1.00 0.00 C ATOM 2431 O ARG B 62 -10.602 17.375 -11.787 1.00 0.00 O ATOM 2432 CB ARG B 62 -12.354 16.960 -9.153 1.00 0.00 C ATOM 2433 CG ARG B 62 -13.774 16.999 -8.564 1.00 0.00 C ATOM 2434 CD ARG B 62 -14.889 17.638 -9.424 1.00 0.00 C ATOM 2435 NE ARG B 62 -15.136 16.965 -10.711 1.00 0.00 N ATOM 2436 CZ ARG B 62 -15.256 15.644 -10.873 1.00 0.00 C ATOM 2437 NH1 ARG B 62 -15.477 14.818 -9.865 1.00 0.00 N ATOM 2438 NH2 ARG B 62 -15.082 15.118 -12.071 1.00 0.00 N ATOM 0 H ARG B 62 -12.630 14.416 -9.267 1.00 0.00 H new ATOM 0 HA ARG B 62 -12.833 16.252 -11.141 1.00 0.00 H new ATOM 0 HB2 ARG B 62 -11.682 16.635 -8.359 1.00 0.00 H new ATOM 0 HB3 ARG B 62 -12.079 17.984 -9.404 1.00 0.00 H new ATOM 0 HG2 ARG B 62 -14.071 15.975 -8.336 1.00 0.00 H new ATOM 0 HG3 ARG B 62 -13.730 17.537 -7.617 1.00 0.00 H new ATOM 0 HD2 ARG B 62 -15.815 17.643 -8.849 1.00 0.00 H new ATOM 0 HD3 ARG B 62 -14.628 18.678 -9.618 1.00 0.00 H new ATOM 0 HE ARG B 62 -15.222 17.552 -11.541 1.00 0.00 H new ATOM 0 HH11 ARG B 62 -15.563 15.183 -8.916 1.00 0.00 H new ATOM 0 HH12 ARG B 62 -15.562 13.816 -10.036 1.00 0.00 H new ATOM 0 HH21 ARG B 62 -14.858 15.719 -12.864 1.00 0.00 H new ATOM 0 HH22 ARG B 62 -15.172 14.111 -12.204 1.00 0.00 H new ATOM 2452 N ASN B 63 -9.594 15.920 -10.396 1.00 0.00 N ATOM 2453 CA ASN B 63 -8.220 16.266 -10.760 1.00 0.00 C ATOM 2454 C ASN B 63 -7.984 16.340 -12.274 1.00 0.00 C ATOM 2455 O ASN B 63 -7.146 17.123 -12.715 1.00 0.00 O ATOM 2456 CB ASN B 63 -7.206 15.325 -10.092 1.00 0.00 C ATOM 2457 CG ASN B 63 -7.043 13.997 -10.827 1.00 0.00 C ATOM 2458 OD1 ASN B 63 -6.185 13.859 -11.692 1.00 0.00 O ATOM 2459 ND2 ASN B 63 -7.849 12.999 -10.489 1.00 0.00 N ATOM 0 H ASN B 63 -9.652 15.179 -9.698 1.00 0.00 H new ATOM 0 HA ASN B 63 -8.062 17.275 -10.378 1.00 0.00 H new ATOM 0 HB2 ASN B 63 -6.238 15.824 -10.037 1.00 0.00 H new ATOM 0 HB3 ASN B 63 -7.522 15.129 -9.067 1.00 0.00 H new ATOM 0 HD21 ASN B 63 -7.762 12.094 -10.952 1.00 0.00 H new ATOM 0 HD22 ASN B 63 -8.556 13.137 -9.766 1.00 0.00 H new ATOM 2466 N LYS B 64 -8.719 15.554 -13.069 1.00 0.00 N ATOM 2467 CA LYS B 64 -8.728 15.697 -14.522 1.00 0.00 C ATOM 2468 C LYS B 64 -10.164 15.538 -15.024 1.00 0.00 C ATOM 2469 O LYS B 64 -10.433 14.849 -16.009 1.00 0.00 O ATOM 2470 CB LYS B 64 -7.711 14.721 -15.143 1.00 0.00 C ATOM 2471 CG LYS B 64 -6.582 15.475 -15.861 1.00 0.00 C ATOM 2472 CD LYS B 64 -6.982 16.183 -17.170 1.00 0.00 C ATOM 2473 CE LYS B 64 -7.808 15.348 -18.163 1.00 0.00 C ATOM 2474 NZ LYS B 64 -7.285 13.984 -18.372 1.00 0.00 N ATOM 0 H LYS B 64 -9.320 14.806 -12.722 1.00 0.00 H new ATOM 0 HA LYS B 64 -8.404 16.690 -14.835 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -7.289 14.087 -14.363 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -8.219 14.064 -15.849 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -6.174 16.219 -15.177 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -5.781 14.770 -16.081 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -7.551 17.078 -16.917 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -6.073 16.515 -17.673 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -8.835 15.282 -17.803 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -7.839 15.866 -19.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -7.839 13.510 -19.114 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -6.288 14.035 -18.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -7.359 13.444 -17.486 1.00 0.00 H new ATOM 2488 N ASP B 65 -11.078 16.190 -14.299 1.00 0.00 N ATOM 2489 CA ASP B 65 -12.527 16.087 -14.375 1.00 0.00 C ATOM 2490 C ASP B 65 -13.016 14.807 -15.059 1.00 0.00 C ATOM 2491 O ASP B 65 -13.774 14.845 -16.028 1.00 0.00 O ATOM 2492 CB ASP B 65 -13.137 17.379 -14.930 1.00 0.00 C ATOM 2493 CG ASP B 65 -14.614 17.471 -14.583 1.00 0.00 C ATOM 2494 OD1 ASP B 65 -14.918 17.351 -13.375 1.00 0.00 O ATOM 2495 OD2 ASP B 65 -15.423 17.592 -15.527 1.00 0.00 O ATOM 0 H ASP B 65 -10.792 16.859 -13.584 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.902 15.982 -13.357 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -12.609 18.241 -14.522 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -13.010 17.411 -16.012 1.00 0.00 H new ATOM 2500 N GLN B 66 -12.578 13.667 -14.517 1.00 0.00 N ATOM 2501 CA GLN B 66 -12.873 12.311 -14.969 1.00 0.00 C ATOM 2502 C GLN B 66 -12.681 12.005 -16.470 1.00 0.00 C ATOM 2503 O GLN B 66 -13.014 10.902 -16.899 1.00 0.00 O ATOM 2504 CB GLN B 66 -14.205 11.807 -14.381 1.00 0.00 C ATOM 2505 CG GLN B 66 -15.417 12.738 -14.507 1.00 0.00 C ATOM 2506 CD GLN B 66 -16.554 12.297 -13.595 1.00 0.00 C ATOM 2507 OE1 GLN B 66 -16.936 13.007 -12.671 1.00 0.00 O ATOM 2508 NE2 GLN B 66 -17.108 11.113 -13.804 1.00 0.00 N ATOM 0 H GLN B 66 -11.969 13.671 -13.699 1.00 0.00 H new ATOM 0 HA GLN B 66 -12.069 11.707 -14.549 1.00 0.00 H new ATOM 0 HB2 GLN B 66 -14.452 10.861 -14.864 1.00 0.00 H new ATOM 0 HB3 GLN B 66 -14.050 11.594 -13.323 1.00 0.00 H new ATOM 0 HG2 GLN B 66 -15.122 13.757 -14.257 1.00 0.00 H new ATOM 0 HG3 GLN B 66 -15.762 12.751 -15.541 1.00 0.00 H new ATOM 0 HE21 GLN B 66 -16.785 10.528 -14.575 1.00 0.00 H new ATOM 0 HE22 GLN B 66 -17.858 10.786 -13.195 1.00 0.00 H new ATOM 2517 N GLU B 67 -12.064 12.887 -17.262 1.00 0.00 N ATOM 2518 CA GLU B 67 -11.646 12.585 -18.634 1.00 0.00 C ATOM 2519 C GLU B 67 -10.294 11.881 -18.519 1.00 0.00 C ATOM 2520 O GLU B 67 -9.262 12.389 -18.962 1.00 0.00 O ATOM 2521 CB GLU B 67 -11.566 13.891 -19.437 1.00 0.00 C ATOM 2522 CG GLU B 67 -12.970 14.483 -19.600 1.00 0.00 C ATOM 2523 CD GLU B 67 -12.962 15.903 -20.136 1.00 0.00 C ATOM 2524 OE1 GLU B 67 -11.998 16.254 -20.846 1.00 0.00 O ATOM 2525 OE2 GLU B 67 -13.941 16.609 -19.797 1.00 0.00 O ATOM 0 H GLU B 67 -11.839 13.837 -16.967 1.00 0.00 H new ATOM 0 HA GLU B 67 -12.350 11.941 -19.161 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -10.917 14.603 -18.928 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -11.125 13.701 -20.416 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -13.548 13.851 -20.274 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -13.478 14.469 -18.635 1.00 0.00 H new ATOM 2532 N VAL B 68 -10.317 10.717 -17.869 1.00 0.00 N ATOM 2533 CA VAL B 68 -9.119 10.082 -17.354 1.00 0.00 C ATOM 2534 C VAL B 68 -8.202 9.428 -18.391 1.00 0.00 C ATOM 2535 O VAL B 68 -8.654 8.677 -19.257 1.00 0.00 O ATOM 2536 CB VAL B 68 -9.488 9.127 -16.202 1.00 0.00 C ATOM 2537 CG1 VAL B 68 -9.534 7.652 -16.620 1.00 0.00 C ATOM 2538 CG2 VAL B 68 -8.508 9.280 -15.041 1.00 0.00 C ATOM 0 H VAL B 68 -11.173 10.192 -17.688 1.00 0.00 H new ATOM 0 HA VAL B 68 -8.498 10.893 -16.974 1.00 0.00 H new ATOM 0 HB VAL B 68 -10.494 9.413 -15.895 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -9.800 7.038 -15.759 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -10.279 7.519 -17.404 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -8.556 7.349 -16.994 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -8.786 8.597 -14.238 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -7.500 9.047 -15.383 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -8.538 10.305 -14.672 1.00 0.00 H new ATOM 2548 N ASN B 69 -6.901 9.680 -18.236 1.00 0.00 N ATOM 2549 CA ASN B 69 -5.810 8.954 -18.888 1.00 0.00 C ATOM 2550 C ASN B 69 -5.262 7.957 -17.867 1.00 0.00 C ATOM 2551 O ASN B 69 -5.372 8.196 -16.664 1.00 0.00 O ATOM 2552 CB ASN B 69 -4.672 9.891 -19.319 1.00 0.00 C ATOM 2553 CG ASN B 69 -5.038 10.786 -20.498 1.00 0.00 C ATOM 2554 OD1 ASN B 69 -5.240 10.296 -21.604 1.00 0.00 O ATOM 2555 ND2 ASN B 69 -5.088 12.099 -20.300 1.00 0.00 N ATOM 0 H ASN B 69 -6.565 10.426 -17.627 1.00 0.00 H new ATOM 0 HA ASN B 69 -6.191 8.465 -19.785 1.00 0.00 H new ATOM 0 HB2 ASN B 69 -4.386 10.516 -18.473 1.00 0.00 H new ATOM 0 HB3 ASN B 69 -3.800 9.293 -19.583 1.00 0.00 H new ATOM 0 HD21 ASN B 69 -5.298 12.724 -21.078 1.00 0.00 H new ATOM 0 HD22 ASN B 69 -4.916 12.481 -19.370 1.00 0.00 H new ATOM 2562 N PHE B 70 -4.639 6.859 -18.321 1.00 0.00 N ATOM 2563 CA PHE B 70 -4.105 5.841 -17.414 1.00 0.00 C ATOM 2564 C PHE B 70 -3.190 6.474 -16.368 1.00 0.00 C ATOM 2565 O PHE B 70 -3.293 6.168 -15.187 1.00 0.00 O ATOM 2566 CB PHE B 70 -3.357 4.740 -18.172 1.00 0.00 C ATOM 2567 CG PHE B 70 -2.926 3.573 -17.298 1.00 0.00 C ATOM 2568 CD1 PHE B 70 -3.897 2.739 -16.714 1.00 0.00 C ATOM 2569 CD2 PHE B 70 -1.564 3.333 -17.036 1.00 0.00 C ATOM 2570 CE1 PHE B 70 -3.514 1.601 -15.986 1.00 0.00 C ATOM 2571 CE2 PHE B 70 -1.185 2.238 -16.236 1.00 0.00 C ATOM 2572 CZ PHE B 70 -2.155 1.352 -15.744 1.00 0.00 C ATOM 0 H PHE B 70 -4.494 6.657 -19.310 1.00 0.00 H new ATOM 0 HA PHE B 70 -4.955 5.381 -16.909 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -3.995 4.365 -18.972 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -2.475 5.173 -18.644 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -4.945 2.976 -16.826 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.811 3.988 -17.448 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -4.264 0.919 -15.613 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.143 2.080 -16.000 1.00 0.00 H new ATOM 0 HZ PHE B 70 -1.856 0.481 -15.180 1.00 0.00 H new ATOM 2582 N GLN B 71 -2.326 7.395 -16.809 1.00 0.00 N ATOM 2583 CA GLN B 71 -1.504 8.236 -15.945 1.00 0.00 C ATOM 2584 C GLN B 71 -2.307 8.722 -14.728 1.00 0.00 C ATOM 2585 O GLN B 71 -1.907 8.529 -13.584 1.00 0.00 O ATOM 2586 CB GLN B 71 -0.995 9.433 -16.778 1.00 0.00 C ATOM 2587 CG GLN B 71 0.199 10.207 -16.192 1.00 0.00 C ATOM 2588 CD GLN B 71 0.064 10.624 -14.731 1.00 0.00 C ATOM 2589 OE1 GLN B 71 0.893 10.244 -13.913 1.00 0.00 O ATOM 2590 NE2 GLN B 71 -0.978 11.374 -14.378 1.00 0.00 N ATOM 0 H GLN B 71 -2.179 7.577 -17.802 1.00 0.00 H new ATOM 0 HA GLN B 71 -0.659 7.661 -15.566 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -0.716 9.069 -17.767 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -1.821 10.130 -16.917 1.00 0.00 H new ATOM 0 HG2 GLN B 71 1.093 9.591 -16.294 1.00 0.00 H new ATOM 0 HG3 GLN B 71 0.358 11.102 -16.793 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -1.652 11.675 -15.082 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -1.103 11.648 -13.403 1.00 0.00 H new ATOM 2599 N GLU B 72 -3.430 9.387 -14.990 1.00 0.00 N ATOM 2600 CA GLU B 72 -4.213 10.133 -14.018 1.00 0.00 C ATOM 2601 C GLU B 72 -5.025 9.174 -13.146 1.00 0.00 C ATOM 2602 O GLU B 72 -5.048 9.289 -11.924 1.00 0.00 O ATOM 2603 CB GLU B 72 -5.132 11.073 -14.798 1.00 0.00 C ATOM 2604 CG GLU B 72 -4.386 11.977 -15.802 1.00 0.00 C ATOM 2605 CD GLU B 72 -5.301 12.418 -16.928 1.00 0.00 C ATOM 2606 OE1 GLU B 72 -6.490 12.035 -16.914 1.00 0.00 O ATOM 2607 OE2 GLU B 72 -4.857 13.152 -17.838 1.00 0.00 O ATOM 0 H GLU B 72 -3.833 9.420 -15.926 1.00 0.00 H new ATOM 0 HA GLU B 72 -3.565 10.706 -13.354 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -5.872 10.480 -15.336 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -5.678 11.700 -14.094 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -3.993 12.853 -15.285 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -3.531 11.440 -16.214 1.00 0.00 H new ATOM 2614 N TYR B 73 -5.667 8.205 -13.797 1.00 0.00 N ATOM 2615 CA TYR B 73 -6.334 7.062 -13.186 1.00 0.00 C ATOM 2616 C TYR B 73 -5.395 6.442 -12.145 1.00 0.00 C ATOM 2617 O TYR B 73 -5.767 6.232 -10.990 1.00 0.00 O ATOM 2618 CB TYR B 73 -6.671 6.120 -14.352 1.00 0.00 C ATOM 2619 CG TYR B 73 -7.108 4.700 -14.063 1.00 0.00 C ATOM 2620 CD1 TYR B 73 -6.123 3.716 -13.862 1.00 0.00 C ATOM 2621 CD2 TYR B 73 -8.415 4.304 -14.403 1.00 0.00 C ATOM 2622 CE1 TYR B 73 -6.436 2.355 -13.987 1.00 0.00 C ATOM 2623 CE2 TYR B 73 -8.723 2.942 -14.555 1.00 0.00 C ATOM 2624 CZ TYR B 73 -7.730 1.973 -14.359 1.00 0.00 C ATOM 2625 OH TYR B 73 -7.962 0.694 -14.740 1.00 0.00 O ATOM 0 H TYR B 73 -5.738 8.198 -14.814 1.00 0.00 H new ATOM 0 HA TYR B 73 -7.249 7.313 -12.649 1.00 0.00 H new ATOM 0 HB2 TYR B 73 -7.462 6.592 -14.935 1.00 0.00 H new ATOM 0 HB3 TYR B 73 -5.791 6.066 -14.993 1.00 0.00 H new ATOM 0 HD1 TYR B 73 -5.116 4.012 -13.609 1.00 0.00 H new ATOM 0 HD2 TYR B 73 -9.183 5.049 -14.547 1.00 0.00 H new ATOM 0 HE1 TYR B 73 -5.682 1.605 -13.797 1.00 0.00 H new ATOM 0 HE2 TYR B 73 -9.725 2.642 -14.823 1.00 0.00 H new ATOM 0 HH TYR B 73 -7.199 0.364 -15.259 1.00 0.00 H new ATOM 2635 N ILE B 74 -4.147 6.203 -12.548 1.00 0.00 N ATOM 2636 CA ILE B 74 -3.118 5.701 -11.663 1.00 0.00 C ATOM 2637 C ILE B 74 -2.731 6.740 -10.604 1.00 0.00 C ATOM 2638 O ILE B 74 -2.605 6.367 -9.443 1.00 0.00 O ATOM 2639 CB ILE B 74 -1.912 5.170 -12.455 1.00 0.00 C ATOM 2640 CG1 ILE B 74 -2.172 3.852 -13.208 1.00 0.00 C ATOM 2641 CG2 ILE B 74 -0.772 4.960 -11.470 1.00 0.00 C ATOM 2642 CD1 ILE B 74 -2.602 2.677 -12.318 1.00 0.00 C ATOM 0 H ILE B 74 -3.829 6.356 -13.505 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.526 4.850 -11.117 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.680 5.909 -13.222 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -2.945 4.024 -13.957 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -1.265 3.571 -13.744 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.102 4.582 -12.000 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -0.525 5.908 -10.992 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -1.075 4.239 -10.711 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.762 1.793 -12.935 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -1.822 2.471 -11.585 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -3.527 2.931 -11.801 1.00 0.00 H new ATOM 2654 N THR B 75 -2.523 8.013 -10.961 1.00 0.00 N ATOM 2655 CA THR B 75 -2.202 9.071 -9.994 1.00 0.00 C ATOM 2656 C THR B 75 -3.181 8.979 -8.822 1.00 0.00 C ATOM 2657 O THR B 75 -2.804 8.911 -7.656 1.00 0.00 O ATOM 2658 CB THR B 75 -2.289 10.469 -10.644 1.00 0.00 C ATOM 2659 OG1 THR B 75 -1.477 10.567 -11.793 1.00 0.00 O ATOM 2660 CG2 THR B 75 -1.846 11.580 -9.690 1.00 0.00 C ATOM 0 H THR B 75 -2.572 8.339 -11.926 1.00 0.00 H new ATOM 0 HA THR B 75 -1.179 8.931 -9.644 1.00 0.00 H new ATOM 0 HB THR B 75 -3.340 10.594 -10.906 1.00 0.00 H new ATOM 0 HG1 THR B 75 -1.767 9.906 -12.456 1.00 0.00 H new ATOM 0 HG21 THR B 75 -1.925 12.544 -10.193 1.00 0.00 H new ATOM 0 HG22 THR B 75 -2.485 11.578 -8.807 1.00 0.00 H new ATOM 0 HG23 THR B 75 -0.812 11.411 -9.390 1.00 0.00 H new ATOM 2668 N PHE B 76 -4.457 8.943 -9.180 1.00 0.00 N ATOM 2669 CA PHE B 76 -5.589 8.828 -8.293 1.00 0.00 C ATOM 2670 C PHE B 76 -5.524 7.541 -7.462 1.00 0.00 C ATOM 2671 O PHE B 76 -5.468 7.617 -6.234 1.00 0.00 O ATOM 2672 CB PHE B 76 -6.813 8.939 -9.202 1.00 0.00 C ATOM 2673 CG PHE B 76 -8.151 8.605 -8.606 1.00 0.00 C ATOM 2674 CD1 PHE B 76 -8.773 9.549 -7.775 1.00 0.00 C ATOM 2675 CD2 PHE B 76 -8.902 7.568 -9.188 1.00 0.00 C ATOM 2676 CE1 PHE B 76 -10.171 9.554 -7.657 1.00 0.00 C ATOM 2677 CE2 PHE B 76 -10.308 7.610 -9.116 1.00 0.00 C ATOM 2678 CZ PHE B 76 -10.943 8.641 -8.394 1.00 0.00 C ATOM 0 H PHE B 76 -4.738 8.997 -10.159 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.619 9.609 -7.534 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -6.859 9.960 -9.581 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -6.655 8.287 -10.061 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -8.179 10.267 -7.229 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.406 6.748 -9.685 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -10.654 10.261 -6.999 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -10.898 6.854 -9.613 1.00 0.00 H new ATOM 0 HZ PHE B 76 -12.019 8.728 -8.408 1.00 0.00 H new ATOM 2688 N LEU B 77 -5.488 6.368 -8.105 1.00 0.00 N ATOM 2689 CA LEU B 77 -5.364 5.090 -7.399 1.00 0.00 C ATOM 2690 C LEU B 77 -4.208 5.114 -6.392 1.00 0.00 C ATOM 2691 O LEU B 77 -4.372 4.680 -5.252 1.00 0.00 O ATOM 2692 CB LEU B 77 -5.164 3.944 -8.402 1.00 0.00 C ATOM 2693 CG LEU B 77 -6.482 3.482 -9.043 1.00 0.00 C ATOM 2694 CD1 LEU B 77 -6.206 2.798 -10.385 1.00 0.00 C ATOM 2695 CD2 LEU B 77 -7.201 2.488 -8.122 1.00 0.00 C ATOM 0 H LEU B 77 -5.543 6.279 -9.120 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.289 4.926 -6.846 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -4.477 4.267 -9.185 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -4.696 3.100 -7.895 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.111 4.359 -9.199 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -7.148 2.475 -10.829 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -5.710 3.500 -11.056 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -5.564 1.932 -10.227 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -8.133 2.169 -8.588 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -6.563 1.620 -7.955 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -7.418 2.968 -7.168 1.00 0.00 H new ATOM 2707 N GLY B 78 -3.044 5.605 -6.822 1.00 0.00 N ATOM 2708 CA GLY B 78 -1.832 5.739 -6.027 1.00 0.00 C ATOM 2709 C GLY B 78 -2.014 6.697 -4.850 1.00 0.00 C ATOM 2710 O GLY B 78 -1.618 6.375 -3.731 1.00 0.00 O ATOM 0 H GLY B 78 -2.920 5.934 -7.779 1.00 0.00 H new ATOM 0 HA2 GLY B 78 -1.535 4.759 -5.653 1.00 0.00 H new ATOM 0 HA3 GLY B 78 -1.021 6.097 -6.662 1.00 0.00 H new ATOM 2714 N ALA B 79 -2.611 7.872 -5.083 1.00 0.00 N ATOM 2715 CA ALA B 79 -2.902 8.817 -4.012 1.00 0.00 C ATOM 2716 C ALA B 79 -3.766 8.124 -2.964 1.00 0.00 C ATOM 2717 O ALA B 79 -3.420 8.064 -1.785 1.00 0.00 O ATOM 2718 CB ALA B 79 -3.601 10.060 -4.570 1.00 0.00 C ATOM 0 H ALA B 79 -2.901 8.187 -6.009 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.972 9.146 -3.547 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -3.811 10.755 -3.757 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -2.954 10.543 -5.303 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -4.536 9.768 -5.048 1.00 0.00 H new ATOM 2724 N LEU B 80 -4.884 7.567 -3.423 1.00 0.00 N ATOM 2725 CA LEU B 80 -5.835 6.894 -2.562 1.00 0.00 C ATOM 2726 C LEU B 80 -5.210 5.662 -1.893 1.00 0.00 C ATOM 2727 O LEU B 80 -5.570 5.344 -0.763 1.00 0.00 O ATOM 2728 CB LEU B 80 -7.098 6.575 -3.367 1.00 0.00 C ATOM 2729 CG LEU B 80 -7.842 7.827 -3.867 1.00 0.00 C ATOM 2730 CD1 LEU B 80 -9.003 7.367 -4.749 1.00 0.00 C ATOM 2731 CD2 LEU B 80 -8.390 8.680 -2.716 1.00 0.00 C ATOM 0 H LEU B 80 -5.151 7.573 -4.407 1.00 0.00 H new ATOM 0 HA LEU B 80 -6.122 7.550 -1.740 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -6.827 5.957 -4.223 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -7.773 5.984 -2.749 1.00 0.00 H new ATOM 0 HG LEU B 80 -7.138 8.447 -4.421 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -9.547 8.237 -5.117 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -8.615 6.798 -5.594 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -9.676 6.738 -4.166 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -8.906 9.550 -3.122 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -9.088 8.088 -2.125 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -7.566 9.009 -2.083 1.00 0.00 H new ATOM 2743 N ALA B 81 -4.248 4.984 -2.529 1.00 0.00 N ATOM 2744 CA ALA B 81 -3.548 3.856 -1.920 1.00 0.00 C ATOM 2745 C ALA B 81 -2.924 4.225 -0.575 1.00 0.00 C ATOM 2746 O ALA B 81 -3.028 3.453 0.375 1.00 0.00 O ATOM 2747 CB ALA B 81 -2.491 3.279 -2.865 1.00 0.00 C ATOM 0 H ALA B 81 -3.937 5.203 -3.475 1.00 0.00 H new ATOM 0 HA ALA B 81 -4.297 3.086 -1.734 1.00 0.00 H new ATOM 0 HB1 ALA B 81 -1.989 2.441 -2.381 1.00 0.00 H new ATOM 0 HB2 ALA B 81 -2.971 2.934 -3.781 1.00 0.00 H new ATOM 0 HB3 ALA B 81 -1.759 4.050 -3.107 1.00 0.00 H new ATOM 2753 N MET B 82 -2.313 5.408 -0.458 1.00 0.00 N ATOM 2754 CA MET B 82 -1.770 5.863 0.821 1.00 0.00 C ATOM 2755 C MET B 82 -2.861 6.015 1.895 1.00 0.00 C ATOM 2756 O MET B 82 -2.522 6.083 3.081 1.00 0.00 O ATOM 2757 CB MET B 82 -0.964 7.154 0.627 1.00 0.00 C ATOM 2758 CG MET B 82 0.414 6.892 -0.009 1.00 0.00 C ATOM 2759 SD MET B 82 1.351 8.385 -0.428 1.00 0.00 S ATOM 2760 CE MET B 82 0.308 9.089 -1.725 1.00 0.00 C ATOM 0 H MET B 82 -2.184 6.063 -1.229 1.00 0.00 H new ATOM 0 HA MET B 82 -1.092 5.094 1.191 1.00 0.00 H new ATOM 0 HB2 MET B 82 -1.528 7.841 -0.004 1.00 0.00 H new ATOM 0 HB3 MET B 82 -0.830 7.644 1.591 1.00 0.00 H new ATOM 0 HG2 MET B 82 1.007 6.288 0.678 1.00 0.00 H new ATOM 0 HG3 MET B 82 0.275 6.301 -0.914 1.00 0.00 H new ATOM 0 HE1 MET B 82 0.854 9.877 -2.243 1.00 0.00 H new ATOM 0 HE2 MET B 82 0.035 8.309 -2.436 1.00 0.00 H new ATOM 0 HE3 MET B 82 -0.595 9.506 -1.279 1.00 0.00 H new ATOM 2770 N ILE B 83 -4.141 6.064 1.497 1.00 0.00 N ATOM 2771 CA ILE B 83 -5.293 5.978 2.382 1.00 0.00 C ATOM 2772 C ILE B 83 -5.720 4.507 2.512 1.00 0.00 C ATOM 2773 O ILE B 83 -5.532 3.908 3.565 1.00 0.00 O ATOM 2774 CB ILE B 83 -6.442 6.897 1.908 1.00 0.00 C ATOM 2775 CG1 ILE B 83 -5.920 8.318 1.617 1.00 0.00 C ATOM 2776 CG2 ILE B 83 -7.547 6.927 2.975 1.00 0.00 C ATOM 2777 CD1 ILE B 83 -7.023 9.280 1.165 1.00 0.00 C ATOM 0 H ILE B 83 -4.402 6.168 0.517 1.00 0.00 H new ATOM 0 HA ILE B 83 -5.019 6.340 3.373 1.00 0.00 H new ATOM 0 HB ILE B 83 -6.856 6.501 0.981 1.00 0.00 H new ATOM 0 HG12 ILE B 83 -5.444 8.715 2.514 1.00 0.00 H new ATOM 0 HG13 ILE B 83 -5.152 8.266 0.845 1.00 0.00 H new ATOM 0 HG21 ILE B 83 -8.358 7.575 2.641 1.00 0.00 H new ATOM 0 HG22 ILE B 83 -7.930 5.918 3.131 1.00 0.00 H new ATOM 0 HG23 ILE B 83 -7.139 7.309 3.911 1.00 0.00 H new ATOM 0 HD11 ILE B 83 -6.593 10.264 0.976 1.00 0.00 H new ATOM 0 HD12 ILE B 83 -7.483 8.903 0.251 1.00 0.00 H new ATOM 0 HD13 ILE B 83 -7.779 9.359 1.946 1.00 0.00 H new ATOM 2789 N TYR B 84 -6.309 3.895 1.478 1.00 0.00 N ATOM 2790 CA TYR B 84 -6.919 2.574 1.640 1.00 0.00 C ATOM 2791 C TYR B 84 -5.892 1.503 2.010 1.00 0.00 C ATOM 2792 O TYR B 84 -6.170 0.634 2.836 1.00 0.00 O ATOM 2793 CB TYR B 84 -7.796 2.173 0.443 1.00 0.00 C ATOM 2794 CG TYR B 84 -7.148 2.120 -0.930 1.00 0.00 C ATOM 2795 CD1 TYR B 84 -6.429 0.980 -1.340 1.00 0.00 C ATOM 2796 CD2 TYR B 84 -7.432 3.125 -1.872 1.00 0.00 C ATOM 2797 CE1 TYR B 84 -5.834 0.942 -2.616 1.00 0.00 C ATOM 2798 CE2 TYR B 84 -6.880 3.063 -3.162 1.00 0.00 C ATOM 2799 CZ TYR B 84 -6.025 2.008 -3.511 1.00 0.00 C ATOM 2800 OH TYR B 84 -5.276 2.093 -4.646 1.00 0.00 O ATOM 0 H TYR B 84 -6.375 4.286 0.538 1.00 0.00 H new ATOM 0 HA TYR B 84 -7.598 2.651 2.489 1.00 0.00 H new ATOM 0 HB2 TYR B 84 -8.217 1.189 0.652 1.00 0.00 H new ATOM 0 HB3 TYR B 84 -8.631 2.872 0.392 1.00 0.00 H new ATOM 0 HD1 TYR B 84 -6.334 0.134 -0.675 1.00 0.00 H new ATOM 0 HD2 TYR B 84 -8.077 3.948 -1.602 1.00 0.00 H new ATOM 0 HE1 TYR B 84 -5.231 0.094 -2.906 1.00 0.00 H new ATOM 0 HE2 TYR B 84 -7.114 3.829 -3.886 1.00 0.00 H new ATOM 0 HH TYR B 84 -4.988 3.020 -4.779 1.00 0.00 H new ATOM 2810 N ASN B 85 -4.701 1.561 1.418 1.00 0.00 N ATOM 2811 CA ASN B 85 -3.566 0.706 1.739 1.00 0.00 C ATOM 2812 C ASN B 85 -2.630 1.357 2.775 1.00 0.00 C ATOM 2813 O ASN B 85 -1.429 1.080 2.753 1.00 0.00 O ATOM 2814 CB ASN B 85 -2.864 0.273 0.441 1.00 0.00 C ATOM 2815 CG ASN B 85 -2.234 -1.113 0.552 1.00 0.00 C ATOM 2816 OD1 ASN B 85 -2.631 -2.029 -0.159 1.00 0.00 O ATOM 2817 ND2 ASN B 85 -1.264 -1.296 1.441 1.00 0.00 N ATOM 0 H ASN B 85 -4.495 2.229 0.675 1.00 0.00 H new ATOM 0 HA ASN B 85 -3.921 -0.201 2.227 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -3.585 0.277 -0.377 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -2.092 1.000 0.189 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -0.832 -2.215 1.543 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -0.951 -0.518 2.021 1.00 0.00 H new ATOM 2824 N GLU B 86 -3.130 2.287 3.609 1.00 0.00 N ATOM 2825 CA GLU B 86 -2.326 3.137 4.488 1.00 0.00 C ATOM 2826 C GLU B 86 -1.066 2.509 5.090 1.00 0.00 C ATOM 2827 O GLU B 86 -0.030 3.188 5.109 1.00 0.00 O ATOM 2828 CB GLU B 86 -3.167 3.859 5.561 1.00 0.00 C ATOM 2829 CG GLU B 86 -4.239 3.020 6.272 1.00 0.00 C ATOM 2830 CD GLU B 86 -3.695 1.758 6.905 1.00 0.00 C ATOM 2831 OE1 GLU B 86 -3.212 1.843 8.047 1.00 0.00 O ATOM 2832 OE2 GLU B 86 -3.762 0.722 6.201 1.00 0.00 O ATOM 0 H GLU B 86 -4.131 2.468 3.688 1.00 0.00 H new ATOM 0 HA GLU B 86 -1.939 3.882 3.793 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -2.488 4.256 6.316 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -3.657 4.713 5.093 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -4.713 3.628 7.042 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -5.015 2.752 5.555 1.00 0.00 H new