USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 703 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 Single : A 265 LYS NZ :NH3+ -169:sc= -0.0172 (180deg=-0.166) USER MOD Single : A 270 SER OG : rot 130:sc= 0 USER MOD Single : A 272 LYS NZ :NH3+ -167:sc= -0.0523 (180deg=-0.291) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= -0.102 X(o=-0.1,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 167:sc= -0.0184 (180deg=-0.197) USER MOD Single : B 7 THR OG1 : rot -45:sc= 0.397 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 THR OG1 : rot 50:sc= -2.47! USER MOD Single : B 14 THR OG1 : rot -59:sc= 1.66 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 LYS NZ :NH3+ 171:sc= -3.14! (180deg=-3.49!) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ -175:sc= 0.745 (180deg=0.577) USER MOD Single : B 31 GLN : amide:sc= -1.65 K(o=-1.7,f=-0.35) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -0.0964 X(o=-0.096,f=-0.36) USER MOD Single : B 41 GLN : amide:sc= -4.71! C(o=-4.7!,f=-12!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -6.5! C(o=-6.5!,f=-6.4!) USER MOD Single : B 55 THR OG1 : rot 31:sc= 0.0132 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 90:sc= -0.0941 USER MOD Single : B 60 ASN : amide:sc= -2.12! K(o=-2.1!,f=-0.37) USER MOD Single : B 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 165:sc= -0.045 (180deg=-0.28) USER MOD Single : B 65 SER OG : rot 10:sc= -0.105 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= -1.06 X(o=-1.1,f=-1) USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 259 -15.549 0.762 0.041 1.00 0.00 N ATOM 66 CA GLU A 259 -14.103 0.601 -0.065 1.00 0.00 C ATOM 67 C GLU A 259 -13.477 1.762 -0.828 1.00 0.00 C ATOM 68 O GLU A 259 -12.384 2.215 -0.495 1.00 0.00 O ATOM 69 CB GLU A 259 -13.748 -0.725 -0.747 1.00 0.00 C ATOM 70 CG GLU A 259 -13.902 -1.942 0.154 1.00 0.00 C ATOM 71 CD GLU A 259 -15.349 -2.289 0.457 1.00 0.00 C ATOM 72 OE1 GLU A 259 -16.252 -1.689 -0.162 1.00 0.00 O ATOM 73 OE2 GLU A 259 -15.578 -3.177 1.305 1.00 0.00 O ATOM 0 HA GLU A 259 -13.699 0.593 0.947 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -14.382 -0.852 -1.625 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -12.719 -0.676 -1.102 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -13.422 -2.799 -0.320 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -13.376 -1.760 1.091 1.00 0.00 H new ATOM 80 N GLU A 260 -14.175 2.236 -1.855 1.00 0.00 N ATOM 81 CA GLU A 260 -13.683 3.343 -2.668 1.00 0.00 C ATOM 82 C GLU A 260 -13.454 4.588 -1.816 1.00 0.00 C ATOM 83 O GLU A 260 -12.435 5.266 -1.952 1.00 0.00 O ATOM 84 CB GLU A 260 -14.676 3.658 -3.789 1.00 0.00 C ATOM 85 CG GLU A 260 -14.241 4.807 -4.684 1.00 0.00 C ATOM 86 CD GLU A 260 -15.245 5.103 -5.780 1.00 0.00 C ATOM 87 OE1 GLU A 260 -16.408 5.421 -5.450 1.00 0.00 O ATOM 88 OE2 GLU A 260 -14.870 5.020 -6.968 1.00 0.00 O ATOM 0 H GLU A 260 -15.083 1.871 -2.144 1.00 0.00 H new ATOM 0 HA GLU A 260 -12.730 3.043 -3.105 1.00 0.00 H new ATOM 0 HB2 GLU A 260 -14.816 2.766 -4.400 1.00 0.00 H new ATOM 0 HB3 GLU A 260 -15.644 3.898 -3.349 1.00 0.00 H new ATOM 0 HG2 GLU A 260 -14.097 5.701 -4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 260 -13.277 4.568 -5.134 1.00 0.00 H new ATOM 95 N GLU A 261 -14.410 4.885 -0.941 1.00 0.00 N ATOM 96 CA GLU A 261 -14.317 6.051 -0.070 1.00 0.00 C ATOM 97 C GLU A 261 -13.127 5.937 0.880 1.00 0.00 C ATOM 98 O GLU A 261 -12.385 6.899 1.077 1.00 0.00 O ATOM 99 CB GLU A 261 -15.612 6.217 0.729 1.00 0.00 C ATOM 100 CG GLU A 261 -15.625 7.448 1.621 1.00 0.00 C ATOM 101 CD GLU A 261 -16.914 7.582 2.409 1.00 0.00 C ATOM 102 OE1 GLU A 261 -17.989 7.670 1.778 1.00 0.00 O ATOM 103 OE2 GLU A 261 -16.849 7.601 3.656 1.00 0.00 O ATOM 0 H GLU A 261 -15.259 4.333 -0.817 1.00 0.00 H new ATOM 0 HA GLU A 261 -14.167 6.930 -0.698 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -16.452 6.272 0.036 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -15.765 5.331 1.345 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -14.784 7.400 2.312 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -15.484 8.338 1.008 1.00 0.00 H new ATOM 110 N LEU A 262 -12.954 4.759 1.469 1.00 0.00 N ATOM 111 CA LEU A 262 -11.856 4.522 2.402 1.00 0.00 C ATOM 112 C LEU A 262 -10.506 4.592 1.691 1.00 0.00 C ATOM 113 O LEU A 262 -9.551 5.176 2.205 1.00 0.00 O ATOM 114 CB LEU A 262 -12.027 3.164 3.084 1.00 0.00 C ATOM 115 CG LEU A 262 -10.949 2.810 4.111 1.00 0.00 C ATOM 116 CD1 LEU A 262 -10.867 3.875 5.194 1.00 0.00 C ATOM 117 CD2 LEU A 262 -11.232 1.450 4.726 1.00 0.00 C ATOM 0 H LEU A 262 -13.560 3.952 1.318 1.00 0.00 H new ATOM 0 HA LEU A 262 -11.879 5.305 3.160 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -12.998 3.144 3.579 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -12.044 2.390 2.317 1.00 0.00 H new ATOM 0 HG LEU A 262 -9.988 2.768 3.599 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -10.095 3.604 5.914 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -10.620 4.836 4.742 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -11.827 3.950 5.704 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -10.457 1.212 5.454 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -12.202 1.470 5.222 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -11.240 0.691 3.943 1.00 0.00 H new ATOM 129 N ILE A 263 -10.437 3.999 0.504 1.00 0.00 N ATOM 130 CA ILE A 263 -9.209 3.999 -0.283 1.00 0.00 C ATOM 131 C ILE A 263 -8.744 5.428 -0.563 1.00 0.00 C ATOM 132 O ILE A 263 -7.606 5.791 -0.256 1.00 0.00 O ATOM 133 CB ILE A 263 -9.404 3.224 -1.610 1.00 0.00 C ATOM 134 CG1 ILE A 263 -8.908 1.785 -1.465 1.00 0.00 C ATOM 135 CG2 ILE A 263 -8.702 3.917 -2.771 1.00 0.00 C ATOM 136 CD1 ILE A 263 -9.198 0.915 -2.670 1.00 0.00 C ATOM 0 H ILE A 263 -11.218 3.512 0.065 1.00 0.00 H new ATOM 0 HA ILE A 263 -8.438 3.494 0.298 1.00 0.00 H new ATOM 0 HB ILE A 263 -10.471 3.208 -1.832 1.00 0.00 H new ATOM 0 HG12 ILE A 263 -7.833 1.797 -1.288 1.00 0.00 H new ATOM 0 HG13 ILE A 263 -9.371 1.338 -0.585 1.00 0.00 H new ATOM 0 HG21 ILE A 263 -8.860 3.345 -3.685 1.00 0.00 H new ATOM 0 HG22 ILE A 263 -9.109 4.921 -2.895 1.00 0.00 H new ATOM 0 HG23 ILE A 263 -7.634 3.982 -2.564 1.00 0.00 H new ATOM 0 HD11 ILE A 263 -8.817 -0.091 -2.493 1.00 0.00 H new ATOM 0 HD12 ILE A 263 -10.274 0.871 -2.836 1.00 0.00 H new ATOM 0 HD13 ILE A 263 -8.712 1.338 -3.549 1.00 0.00 H new ATOM 148 N ARG A 264 -9.630 6.243 -1.130 1.00 0.00 N ATOM 149 CA ARG A 264 -9.294 7.628 -1.425 1.00 0.00 C ATOM 150 C ARG A 264 -9.036 8.389 -0.134 1.00 0.00 C ATOM 151 O ARG A 264 -8.236 9.323 -0.104 1.00 0.00 O ATOM 152 CB ARG A 264 -10.400 8.306 -2.229 1.00 0.00 C ATOM 153 CG ARG A 264 -11.742 8.345 -1.516 1.00 0.00 C ATOM 154 CD ARG A 264 -12.809 8.996 -2.380 1.00 0.00 C ATOM 155 NE ARG A 264 -12.441 10.353 -2.773 1.00 0.00 N ATOM 156 CZ ARG A 264 -13.196 11.128 -3.546 1.00 0.00 C ATOM 157 NH1 ARG A 264 -14.359 10.682 -4.003 1.00 0.00 N ATOM 158 NH2 ARG A 264 -12.789 12.350 -3.862 1.00 0.00 N ATOM 0 H ARG A 264 -10.577 5.969 -1.391 1.00 0.00 H new ATOM 0 HA ARG A 264 -8.388 7.636 -2.030 1.00 0.00 H new ATOM 0 HB2 ARG A 264 -10.094 9.326 -2.462 1.00 0.00 H new ATOM 0 HB3 ARG A 264 -10.519 7.784 -3.178 1.00 0.00 H new ATOM 0 HG2 ARG A 264 -12.049 7.331 -1.258 1.00 0.00 H new ATOM 0 HG3 ARG A 264 -11.643 8.896 -0.580 1.00 0.00 H new ATOM 0 HD2 ARG A 264 -12.972 8.392 -3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 264 -13.753 9.020 -1.835 1.00 0.00 H new ATOM 0 HE ARG A 264 -11.554 10.728 -2.435 1.00 0.00 H new ATOM 0 HH11 ARG A 264 -14.676 9.743 -3.762 1.00 0.00 H new ATOM 0 HH12 ARG A 264 -14.937 11.278 -4.596 1.00 0.00 H new ATOM 0 HH21 ARG A 264 -11.896 12.696 -3.512 1.00 0.00 H new ATOM 0 HH22 ARG A 264 -13.369 12.943 -4.455 1.00 0.00 H new ATOM 172 N LYS A 265 -9.707 7.968 0.936 1.00 0.00 N ATOM 173 CA LYS A 265 -9.529 8.596 2.237 1.00 0.00 C ATOM 174 C LYS A 265 -8.053 8.579 2.596 1.00 0.00 C ATOM 175 O LYS A 265 -7.463 9.609 2.926 1.00 0.00 O ATOM 176 CB LYS A 265 -10.325 7.844 3.303 1.00 0.00 C ATOM 177 CG LYS A 265 -10.224 8.458 4.689 1.00 0.00 C ATOM 178 CD LYS A 265 -10.742 7.509 5.760 1.00 0.00 C ATOM 179 CE LYS A 265 -12.205 7.158 5.544 1.00 0.00 C ATOM 180 NZ LYS A 265 -13.077 8.364 5.589 1.00 0.00 N ATOM 0 H LYS A 265 -10.376 7.198 0.925 1.00 0.00 H new ATOM 0 HA LYS A 265 -9.890 9.624 2.193 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -11.373 7.812 3.005 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -9.974 6.813 3.346 1.00 0.00 H new ATOM 0 HG2 LYS A 265 -9.186 8.714 4.900 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -10.793 9.387 4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 265 -10.145 6.597 5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 265 -10.619 7.967 6.742 1.00 0.00 H new ATOM 0 HE2 LYS A 265 -12.321 6.662 4.580 1.00 0.00 H new ATOM 0 HE3 LYS A 265 -12.525 6.450 6.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 -14.074 8.070 5.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -12.850 8.925 6.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -12.916 8.940 4.738 1.00 0.00 H new ATOM 194 N ALA A 266 -7.459 7.395 2.494 1.00 0.00 N ATOM 195 CA ALA A 266 -6.044 7.223 2.771 1.00 0.00 C ATOM 196 C ALA A 266 -5.227 8.020 1.766 1.00 0.00 C ATOM 197 O ALA A 266 -4.192 8.594 2.105 1.00 0.00 O ATOM 198 CB ALA A 266 -5.669 5.751 2.723 1.00 0.00 C ATOM 0 H ALA A 266 -7.941 6.539 2.220 1.00 0.00 H new ATOM 0 HA ALA A 266 -5.828 7.593 3.773 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -4.605 5.640 2.933 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -6.245 5.204 3.469 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -5.887 5.352 1.732 1.00 0.00 H new ATOM 204 N ILE A 267 -5.710 8.055 0.524 1.00 0.00 N ATOM 205 CA ILE A 267 -5.038 8.790 -0.540 1.00 0.00 C ATOM 206 C ILE A 267 -4.848 10.254 -0.150 1.00 0.00 C ATOM 207 O ILE A 267 -3.759 10.812 -0.298 1.00 0.00 O ATOM 208 CB ILE A 267 -5.824 8.712 -1.866 1.00 0.00 C ATOM 209 CG1 ILE A 267 -5.866 7.267 -2.371 1.00 0.00 C ATOM 210 CG2 ILE A 267 -5.202 9.629 -2.912 1.00 0.00 C ATOM 211 CD1 ILE A 267 -6.658 7.089 -3.650 1.00 0.00 C ATOM 0 H ILE A 267 -6.565 7.581 0.233 1.00 0.00 H new ATOM 0 HA ILE A 267 -4.063 8.325 -0.686 1.00 0.00 H new ATOM 0 HB ILE A 267 -6.846 9.046 -1.686 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -4.846 6.920 -2.535 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -6.298 6.634 -1.596 1.00 0.00 H new ATOM 0 HG21 ILE A 267 -5.770 9.560 -3.840 1.00 0.00 H new ATOM 0 HG22 ILE A 267 -5.220 10.657 -2.551 1.00 0.00 H new ATOM 0 HG23 ILE A 267 -4.171 9.326 -3.094 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -6.642 6.040 -3.945 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -7.689 7.404 -3.487 1.00 0.00 H new ATOM 0 HD13 ILE A 267 -6.214 7.695 -4.440 1.00 0.00 H new ATOM 223 N GLU A 268 -5.913 10.865 0.357 1.00 0.00 N ATOM 224 CA GLU A 268 -5.870 12.259 0.778 1.00 0.00 C ATOM 225 C GLU A 268 -4.948 12.430 1.980 1.00 0.00 C ATOM 226 O GLU A 268 -4.183 13.390 2.056 1.00 0.00 O ATOM 227 CB GLU A 268 -7.275 12.753 1.121 1.00 0.00 C ATOM 228 CG GLU A 268 -8.260 12.633 -0.031 1.00 0.00 C ATOM 229 CD GLU A 268 -7.833 13.428 -1.249 1.00 0.00 C ATOM 230 OE1 GLU A 268 -7.701 14.665 -1.135 1.00 0.00 O ATOM 231 OE2 GLU A 268 -7.629 12.814 -2.317 1.00 0.00 O ATOM 0 H GLU A 268 -6.819 10.415 0.486 1.00 0.00 H new ATOM 0 HA GLU A 268 -5.478 12.853 -0.047 1.00 0.00 H new ATOM 0 HB2 GLU A 268 -7.653 12.186 1.972 1.00 0.00 H new ATOM 0 HB3 GLU A 268 -7.218 13.796 1.433 1.00 0.00 H new ATOM 0 HG2 GLU A 268 -8.366 11.584 -0.306 1.00 0.00 H new ATOM 0 HG3 GLU A 268 -9.241 12.977 0.297 1.00 0.00 H new ATOM 238 N LEU A 269 -5.029 11.490 2.919 1.00 0.00 N ATOM 239 CA LEU A 269 -4.202 11.532 4.121 1.00 0.00 C ATOM 240 C LEU A 269 -2.718 11.551 3.765 1.00 0.00 C ATOM 241 O LEU A 269 -1.939 12.305 4.348 1.00 0.00 O ATOM 242 CB LEU A 269 -4.510 10.328 5.016 1.00 0.00 C ATOM 243 CG LEU A 269 -5.950 10.249 5.526 1.00 0.00 C ATOM 244 CD1 LEU A 269 -6.173 8.957 6.297 1.00 0.00 C ATOM 245 CD2 LEU A 269 -6.275 11.452 6.400 1.00 0.00 C ATOM 0 H LEU A 269 -5.660 10.690 2.870 1.00 0.00 H new ATOM 0 HA LEU A 269 -4.436 12.449 4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -4.287 9.416 4.461 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -3.838 10.352 5.874 1.00 0.00 H new ATOM 0 HG LEU A 269 -6.619 10.258 4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -7.203 8.918 6.652 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -5.982 8.106 5.643 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -5.494 8.920 7.149 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -7.304 11.378 6.753 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -5.599 11.474 7.254 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -6.156 12.367 5.819 1.00 0.00 H new ATOM 257 N SER A 270 -2.333 10.716 2.804 1.00 0.00 N ATOM 258 CA SER A 270 -0.943 10.636 2.370 1.00 0.00 C ATOM 259 C SER A 270 -0.510 11.925 1.677 1.00 0.00 C ATOM 260 O SER A 270 0.568 12.454 1.950 1.00 0.00 O ATOM 261 CB SER A 270 -0.750 9.446 1.428 1.00 0.00 C ATOM 262 OG SER A 270 0.592 9.361 0.981 1.00 0.00 O ATOM 0 H SER A 270 -2.965 10.085 2.311 1.00 0.00 H new ATOM 0 HA SER A 270 -0.321 10.497 3.254 1.00 0.00 H new ATOM 0 HB2 SER A 270 -1.025 8.524 1.941 1.00 0.00 H new ATOM 0 HB3 SER A 270 -1.416 9.545 0.571 1.00 0.00 H new ATOM 0 HG SER A 270 0.923 8.448 1.113 1.00 0.00 H new ATOM 268 N LEU A 271 -1.356 12.425 0.780 1.00 0.00 N ATOM 269 CA LEU A 271 -1.058 13.652 0.047 1.00 0.00 C ATOM 270 C LEU A 271 -0.865 14.830 0.997 1.00 0.00 C ATOM 271 O LEU A 271 0.014 15.668 0.791 1.00 0.00 O ATOM 272 CB LEU A 271 -2.182 13.968 -0.943 1.00 0.00 C ATOM 273 CG LEU A 271 -2.375 12.944 -2.063 1.00 0.00 C ATOM 274 CD1 LEU A 271 -3.556 13.331 -2.940 1.00 0.00 C ATOM 275 CD2 LEU A 271 -1.108 12.824 -2.897 1.00 0.00 C ATOM 0 H LEU A 271 -2.252 12.000 0.543 1.00 0.00 H new ATOM 0 HA LEU A 271 -0.129 13.494 -0.500 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -3.117 14.057 -0.389 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -1.984 14.941 -1.393 1.00 0.00 H new ATOM 0 HG LEU A 271 -2.584 11.974 -1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -3.679 12.592 -3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -4.462 13.369 -2.335 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -3.375 14.310 -3.383 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -1.262 12.092 -3.689 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -0.870 13.792 -3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -0.283 12.503 -2.261 1.00 0.00 H new ATOM 287 N LYS A 272 -1.697 14.891 2.032 1.00 0.00 N ATOM 288 CA LYS A 272 -1.629 15.969 3.012 1.00 0.00 C ATOM 289 C LYS A 272 -0.237 16.064 3.632 1.00 0.00 C ATOM 290 O LYS A 272 0.347 17.145 3.705 1.00 0.00 O ATOM 291 CB LYS A 272 -2.674 15.750 4.110 1.00 0.00 C ATOM 292 CG LYS A 272 -2.695 16.844 5.168 1.00 0.00 C ATOM 293 CD LYS A 272 -3.090 18.188 4.578 1.00 0.00 C ATOM 294 CE LYS A 272 -3.097 19.279 5.637 1.00 0.00 C ATOM 295 NZ LYS A 272 -4.049 18.975 6.741 1.00 0.00 N ATOM 0 H LYS A 272 -2.429 14.204 2.214 1.00 0.00 H new ATOM 0 HA LYS A 272 -1.838 16.906 2.496 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -3.660 15.683 3.651 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -2.482 14.793 4.595 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -3.396 16.573 5.958 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -1.710 16.924 5.629 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -2.395 18.456 3.782 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.079 18.112 4.126 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -2.093 19.395 6.045 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -3.366 20.230 5.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -4.191 19.826 7.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -4.960 18.674 6.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -3.662 18.213 7.333 1.00 0.00 H new ATOM 396 N MET B 1 17.202 -2.100 2.574 1.00 0.00 N ATOM 397 CA MET B 1 15.973 -1.274 2.454 1.00 0.00 C ATOM 398 C MET B 1 14.762 -2.008 3.020 1.00 0.00 C ATOM 399 O MET B 1 14.578 -3.202 2.778 1.00 0.00 O ATOM 400 CB MET B 1 15.752 -0.942 0.977 1.00 0.00 C ATOM 401 CG MET B 1 14.539 -0.061 0.724 1.00 0.00 C ATOM 402 SD MET B 1 14.328 0.344 -1.020 1.00 0.00 S ATOM 403 CE MET B 1 12.873 1.387 -0.953 1.00 0.00 C ATOM 0 H1 MET B 1 18.011 -1.578 2.182 1.00 0.00 H new ATOM 0 H2 MET B 1 17.381 -2.313 3.576 1.00 0.00 H new ATOM 0 H3 MET B 1 17.076 -2.988 2.048 1.00 0.00 H new ATOM 0 HA MET B 1 16.098 -0.356 3.029 1.00 0.00 H new ATOM 0 HB2 MET B 1 16.640 -0.443 0.589 1.00 0.00 H new ATOM 0 HB3 MET B 1 15.639 -1.871 0.418 1.00 0.00 H new ATOM 0 HG2 MET B 1 13.645 -0.568 1.086 1.00 0.00 H new ATOM 0 HG3 MET B 1 14.638 0.860 1.298 1.00 0.00 H new ATOM 0 HE1 MET B 1 12.616 1.718 -1.959 1.00 0.00 H new ATOM 0 HE2 MET B 1 12.040 0.823 -0.533 1.00 0.00 H new ATOM 0 HE3 MET B 1 13.076 2.255 -0.326 1.00 0.00 H new ATOM 415 N GLN B 2 13.940 -1.288 3.777 1.00 0.00 N ATOM 416 CA GLN B 2 12.749 -1.875 4.382 1.00 0.00 C ATOM 417 C GLN B 2 11.612 -0.861 4.451 1.00 0.00 C ATOM 418 O GLN B 2 11.808 0.283 4.861 1.00 0.00 O ATOM 419 CB GLN B 2 13.069 -2.390 5.788 1.00 0.00 C ATOM 420 CG GLN B 2 14.116 -3.493 5.811 1.00 0.00 C ATOM 421 CD GLN B 2 14.434 -3.970 7.215 1.00 0.00 C ATOM 422 OE1 GLN B 2 14.882 -3.196 8.060 1.00 0.00 O ATOM 423 NE2 GLN B 2 14.204 -5.253 7.470 1.00 0.00 N ATOM 0 H GLN B 2 14.076 -0.299 3.986 1.00 0.00 H new ATOM 0 HA GLN B 2 12.430 -2.708 3.756 1.00 0.00 H new ATOM 0 HB2 GLN B 2 13.417 -1.558 6.400 1.00 0.00 H new ATOM 0 HB3 GLN B 2 12.153 -2.761 6.247 1.00 0.00 H new ATOM 0 HG2 GLN B 2 13.763 -4.336 5.217 1.00 0.00 H new ATOM 0 HG3 GLN B 2 15.029 -3.131 5.339 1.00 0.00 H new ATOM 0 HE21 GLN B 2 13.832 -5.859 6.739 1.00 0.00 H new ATOM 0 HE22 GLN B 2 14.400 -5.632 8.397 1.00 0.00 H new ATOM 432 N ILE B 3 10.422 -1.297 4.049 1.00 0.00 N ATOM 433 CA ILE B 3 9.242 -0.442 4.065 1.00 0.00 C ATOM 434 C ILE B 3 8.196 -0.975 5.041 1.00 0.00 C ATOM 435 O ILE B 3 8.166 -2.172 5.344 1.00 0.00 O ATOM 436 CB ILE B 3 8.612 -0.311 2.662 1.00 0.00 C ATOM 437 CG1 ILE B 3 8.273 -1.692 2.092 1.00 0.00 C ATOM 438 CG2 ILE B 3 9.552 0.440 1.729 1.00 0.00 C ATOM 439 CD1 ILE B 3 7.552 -1.640 0.760 1.00 0.00 C ATOM 0 H ILE B 3 10.250 -2.242 3.707 1.00 0.00 H new ATOM 0 HA ILE B 3 9.571 0.545 4.390 1.00 0.00 H new ATOM 0 HB ILE B 3 7.686 0.257 2.749 1.00 0.00 H new ATOM 0 HG12 ILE B 3 9.194 -2.263 1.975 1.00 0.00 H new ATOM 0 HG13 ILE B 3 7.654 -2.230 2.810 1.00 0.00 H new ATOM 0 HG21 ILE B 3 9.095 0.525 0.743 1.00 0.00 H new ATOM 0 HG22 ILE B 3 9.742 1.436 2.128 1.00 0.00 H new ATOM 0 HG23 ILE B 3 10.494 -0.103 1.647 1.00 0.00 H new ATOM 0 HD11 ILE B 3 7.345 -2.654 0.419 1.00 0.00 H new ATOM 0 HD12 ILE B 3 6.614 -1.097 0.875 1.00 0.00 H new ATOM 0 HD13 ILE B 3 8.178 -1.131 0.027 1.00 0.00 H new ATOM 451 N PHE B 4 7.349 -0.078 5.541 1.00 0.00 N ATOM 452 CA PHE B 4 6.307 -0.457 6.490 1.00 0.00 C ATOM 453 C PHE B 4 4.915 -0.363 5.877 1.00 0.00 C ATOM 454 O PHE B 4 4.602 0.584 5.154 1.00 0.00 O ATOM 455 CB PHE B 4 6.369 0.419 7.741 1.00 0.00 C ATOM 456 CG PHE B 4 7.407 -0.017 8.732 1.00 0.00 C ATOM 457 CD1 PHE B 4 8.758 0.151 8.472 1.00 0.00 C ATOM 458 CD2 PHE B 4 7.024 -0.594 9.930 1.00 0.00 C ATOM 459 CE1 PHE B 4 9.707 -0.252 9.392 1.00 0.00 C ATOM 460 CE2 PHE B 4 7.966 -0.999 10.852 1.00 0.00 C ATOM 461 CZ PHE B 4 9.310 -0.827 10.584 1.00 0.00 C ATOM 0 H PHE B 4 7.364 0.914 5.305 1.00 0.00 H new ATOM 0 HA PHE B 4 6.492 -1.496 6.762 1.00 0.00 H new ATOM 0 HB2 PHE B 4 6.573 1.448 7.444 1.00 0.00 H new ATOM 0 HB3 PHE B 4 5.393 0.415 8.225 1.00 0.00 H new ATOM 0 HD1 PHE B 4 9.072 0.601 7.542 1.00 0.00 H new ATOM 0 HD2 PHE B 4 5.974 -0.729 10.146 1.00 0.00 H new ATOM 0 HE1 PHE B 4 10.757 -0.118 9.180 1.00 0.00 H new ATOM 0 HE2 PHE B 4 7.653 -1.450 11.782 1.00 0.00 H new ATOM 0 HZ PHE B 4 10.050 -1.142 11.305 1.00 0.00 H new ATOM 471 N VAL B 5 4.076 -1.345 6.193 1.00 0.00 N ATOM 472 CA VAL B 5 2.706 -1.371 5.698 1.00 0.00 C ATOM 473 C VAL B 5 1.731 -1.034 6.821 1.00 0.00 C ATOM 474 O VAL B 5 1.560 -1.813 7.760 1.00 0.00 O ATOM 475 CB VAL B 5 2.345 -2.750 5.113 1.00 0.00 C ATOM 476 CG1 VAL B 5 0.926 -2.747 4.566 1.00 0.00 C ATOM 477 CG2 VAL B 5 3.339 -3.146 4.032 1.00 0.00 C ATOM 0 H VAL B 5 4.323 -2.134 6.791 1.00 0.00 H new ATOM 0 HA VAL B 5 2.630 -0.625 4.906 1.00 0.00 H new ATOM 0 HB VAL B 5 2.397 -3.488 5.914 1.00 0.00 H new ATOM 0 HG11 VAL B 5 0.691 -3.730 4.158 1.00 0.00 H new ATOM 0 HG12 VAL B 5 0.227 -2.511 5.369 1.00 0.00 H new ATOM 0 HG13 VAL B 5 0.841 -1.998 3.779 1.00 0.00 H new ATOM 0 HG21 VAL B 5 3.069 -4.122 3.630 1.00 0.00 H new ATOM 0 HG22 VAL B 5 3.320 -2.406 3.232 1.00 0.00 H new ATOM 0 HG23 VAL B 5 4.341 -3.194 4.459 1.00 0.00 H new ATOM 487 N LYS B 6 1.099 0.132 6.725 1.00 0.00 N ATOM 488 CA LYS B 6 0.146 0.569 7.740 1.00 0.00 C ATOM 489 C LYS B 6 -1.263 0.086 7.417 1.00 0.00 C ATOM 490 O LYS B 6 -1.781 0.335 6.328 1.00 0.00 O ATOM 491 CB LYS B 6 0.154 2.094 7.856 1.00 0.00 C ATOM 492 CG LYS B 6 -0.751 2.628 8.955 1.00 0.00 C ATOM 493 CD LYS B 6 -0.778 4.147 8.967 1.00 0.00 C ATOM 494 CE LYS B 6 -1.651 4.682 10.091 1.00 0.00 C ATOM 495 NZ LYS B 6 -1.125 4.302 11.433 1.00 0.00 N ATOM 0 H LYS B 6 1.229 0.790 5.957 1.00 0.00 H new ATOM 0 HA LYS B 6 0.451 0.133 8.692 1.00 0.00 H new ATOM 0 HB2 LYS B 6 1.174 2.430 8.042 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.154 2.524 6.903 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.762 2.246 8.812 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.406 2.262 9.922 1.00 0.00 H new ATOM 0 HD2 LYS B 6 0.237 4.529 9.080 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -1.151 4.513 8.010 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -1.711 5.768 10.019 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.665 4.299 9.977 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -1.609 4.859 12.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.295 3.289 11.598 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -0.103 4.492 11.472 1.00 0.00 H new ATOM 509 N THR B 7 -1.884 -0.590 8.376 1.00 0.00 N ATOM 510 CA THR B 7 -3.239 -1.091 8.200 1.00 0.00 C ATOM 511 C THR B 7 -4.254 0.010 8.478 1.00 0.00 C ATOM 512 O THR B 7 -4.077 0.807 9.399 1.00 0.00 O ATOM 513 CB THR B 7 -3.527 -2.290 9.121 1.00 0.00 C ATOM 514 OG1 THR B 7 -3.389 -1.901 10.493 1.00 0.00 O ATOM 515 CG2 THR B 7 -2.580 -3.443 8.820 1.00 0.00 C ATOM 0 H THR B 7 -1.470 -0.803 9.283 1.00 0.00 H new ATOM 0 HA THR B 7 -3.328 -1.422 7.165 1.00 0.00 H new ATOM 0 HB THR B 7 -4.549 -2.621 8.939 1.00 0.00 H new ATOM 0 HG1 THR B 7 -2.569 -1.375 10.603 1.00 0.00 H new ATOM 0 HG21 THR B 7 -2.802 -4.279 9.483 1.00 0.00 H new ATOM 0 HG22 THR B 7 -2.707 -3.758 7.784 1.00 0.00 H new ATOM 0 HG23 THR B 7 -1.551 -3.119 8.977 1.00 0.00 H new ATOM 563 N LYS B 11 -2.263 -0.311 12.427 1.00 0.00 N ATOM 564 CA LYS B 11 -1.117 -1.150 12.755 1.00 0.00 C ATOM 565 C LYS B 11 -0.176 -1.304 11.564 1.00 0.00 C ATOM 566 O LYS B 11 -0.548 -1.860 10.531 1.00 0.00 O ATOM 567 CB LYS B 11 -1.599 -2.526 13.215 1.00 0.00 C ATOM 568 CG LYS B 11 -0.484 -3.432 13.713 1.00 0.00 C ATOM 569 CD LYS B 11 0.193 -2.860 14.945 1.00 0.00 C ATOM 570 CE LYS B 11 1.320 -3.757 15.430 1.00 0.00 C ATOM 571 NZ LYS B 11 1.990 -3.203 16.637 1.00 0.00 N ATOM 0 HA LYS B 11 -0.564 -0.665 13.559 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.332 -2.396 14.011 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.111 -3.017 12.387 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.891 -4.416 13.945 1.00 0.00 H new ATOM 0 HG3 LYS B 11 0.254 -3.570 12.923 1.00 0.00 H new ATOM 0 HD2 LYS B 11 0.587 -1.870 14.718 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.542 -2.736 15.740 1.00 0.00 H new ATOM 0 HE2 LYS B 11 0.924 -4.747 15.657 1.00 0.00 H new ATOM 0 HE3 LYS B 11 2.053 -3.882 14.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 2.752 -3.844 16.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 2.390 -2.269 16.414 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 1.296 -3.108 17.406 1.00 0.00 H new ATOM 585 N THR B 12 1.052 -0.818 11.725 1.00 0.00 N ATOM 586 CA THR B 12 2.061 -0.906 10.675 1.00 0.00 C ATOM 587 C THR B 12 3.047 -2.035 10.965 1.00 0.00 C ATOM 588 O THR B 12 3.437 -2.247 12.113 1.00 0.00 O ATOM 589 CB THR B 12 2.833 0.418 10.521 1.00 0.00 C ATOM 590 OG1 THR B 12 3.835 0.285 9.506 1.00 0.00 O ATOM 591 CG2 THR B 12 3.484 0.824 11.835 1.00 0.00 C ATOM 0 H THR B 12 1.373 -0.357 12.577 1.00 0.00 H new ATOM 0 HA THR B 12 1.536 -1.114 9.742 1.00 0.00 H new ATOM 0 HB THR B 12 2.124 1.194 10.232 1.00 0.00 H new ATOM 0 HG1 THR B 12 3.433 -0.095 8.697 1.00 0.00 H new ATOM 0 HG21 THR B 12 4.023 1.762 11.700 1.00 0.00 H new ATOM 0 HG22 THR B 12 2.715 0.954 12.597 1.00 0.00 H new ATOM 0 HG23 THR B 12 4.181 0.048 12.151 1.00 0.00 H new ATOM 599 N ILE B 13 3.442 -2.764 9.924 1.00 0.00 N ATOM 600 CA ILE B 13 4.375 -3.875 10.089 1.00 0.00 C ATOM 601 C ILE B 13 5.631 -3.706 9.237 1.00 0.00 C ATOM 602 O ILE B 13 5.566 -3.248 8.095 1.00 0.00 O ATOM 603 CB ILE B 13 3.719 -5.223 9.731 1.00 0.00 C ATOM 604 CG1 ILE B 13 2.506 -5.490 10.629 1.00 0.00 C ATOM 605 CG2 ILE B 13 4.739 -6.349 9.847 1.00 0.00 C ATOM 606 CD1 ILE B 13 2.840 -5.576 12.104 1.00 0.00 C ATOM 0 H ILE B 13 3.133 -2.607 8.965 1.00 0.00 H new ATOM 0 HA ILE B 13 4.657 -3.871 11.142 1.00 0.00 H new ATOM 0 HB ILE B 13 3.369 -5.178 8.700 1.00 0.00 H new ATOM 0 HG12 ILE B 13 1.773 -4.697 10.478 1.00 0.00 H new ATOM 0 HG13 ILE B 13 2.035 -6.423 10.318 1.00 0.00 H new ATOM 0 HG21 ILE B 13 4.265 -7.297 9.592 1.00 0.00 H new ATOM 0 HG22 ILE B 13 5.567 -6.162 9.163 1.00 0.00 H new ATOM 0 HG23 ILE B 13 5.116 -6.395 10.869 1.00 0.00 H new ATOM 0 HD11 ILE B 13 1.930 -5.767 12.673 1.00 0.00 H new ATOM 0 HD12 ILE B 13 3.548 -6.388 12.270 1.00 0.00 H new ATOM 0 HD13 ILE B 13 3.283 -4.636 12.432 1.00 0.00 H new ATOM 618 N THR B 14 6.769 -4.102 9.806 1.00 0.00 N ATOM 619 CA THR B 14 8.052 -4.027 9.116 1.00 0.00 C ATOM 620 C THR B 14 8.100 -5.029 7.968 1.00 0.00 C ATOM 621 O THR B 14 7.682 -6.177 8.129 1.00 0.00 O ATOM 622 CB THR B 14 9.220 -4.344 10.072 1.00 0.00 C ATOM 623 OG1 THR B 14 9.054 -3.648 11.311 1.00 0.00 O ATOM 624 CG2 THR B 14 10.552 -3.958 9.446 1.00 0.00 C ATOM 0 H THR B 14 6.826 -4.481 10.751 1.00 0.00 H new ATOM 0 HA THR B 14 8.153 -3.010 8.738 1.00 0.00 H new ATOM 0 HB THR B 14 9.218 -5.418 10.260 1.00 0.00 H new ATOM 0 HG1 THR B 14 9.015 -2.683 11.142 1.00 0.00 H new ATOM 0 HG21 THR B 14 11.361 -4.191 10.139 1.00 0.00 H new ATOM 0 HG22 THR B 14 10.695 -4.516 8.521 1.00 0.00 H new ATOM 0 HG23 THR B 14 10.556 -2.890 9.229 1.00 0.00 H new ATOM 632 N LEU B 15 8.616 -4.610 6.817 1.00 0.00 N ATOM 633 CA LEU B 15 8.711 -5.510 5.674 1.00 0.00 C ATOM 634 C LEU B 15 9.942 -5.177 4.835 1.00 0.00 C ATOM 635 O LEU B 15 10.058 -4.080 4.290 1.00 0.00 O ATOM 636 CB LEU B 15 7.435 -5.420 4.827 1.00 0.00 C ATOM 637 CG LEU B 15 7.143 -6.626 3.922 1.00 0.00 C ATOM 638 CD1 LEU B 15 8.222 -6.799 2.864 1.00 0.00 C ATOM 639 CD2 LEU B 15 7.006 -7.893 4.754 1.00 0.00 C ATOM 0 H LEU B 15 8.970 -3.668 6.652 1.00 0.00 H new ATOM 0 HA LEU B 15 8.814 -6.532 6.037 1.00 0.00 H new ATOM 0 HB2 LEU B 15 6.587 -5.280 5.497 1.00 0.00 H new ATOM 0 HB3 LEU B 15 7.499 -4.529 4.202 1.00 0.00 H new ATOM 0 HG LEU B 15 6.200 -6.438 3.409 1.00 0.00 H new ATOM 0 HD11 LEU B 15 7.985 -7.661 2.240 1.00 0.00 H new ATOM 0 HD12 LEU B 15 8.270 -5.904 2.243 1.00 0.00 H new ATOM 0 HD13 LEU B 15 9.185 -6.956 3.349 1.00 0.00 H new ATOM 0 HD21 LEU B 15 6.799 -8.739 4.098 1.00 0.00 H new ATOM 0 HD22 LEU B 15 7.934 -8.074 5.297 1.00 0.00 H new ATOM 0 HD23 LEU B 15 6.187 -7.776 5.464 1.00 0.00 H new ATOM 651 N GLU B 16 10.857 -6.139 4.736 1.00 0.00 N ATOM 652 CA GLU B 16 12.083 -5.959 3.965 1.00 0.00 C ATOM 653 C GLU B 16 11.759 -5.908 2.479 1.00 0.00 C ATOM 654 O GLU B 16 11.074 -6.786 1.955 1.00 0.00 O ATOM 655 CB GLU B 16 13.061 -7.102 4.273 1.00 0.00 C ATOM 656 CG GLU B 16 14.459 -6.922 3.697 1.00 0.00 C ATOM 657 CD GLU B 16 14.592 -7.407 2.263 1.00 0.00 C ATOM 658 OE1 GLU B 16 14.000 -6.784 1.360 1.00 0.00 O ATOM 659 OE2 GLU B 16 15.292 -8.419 2.045 1.00 0.00 O ATOM 0 H GLU B 16 10.771 -7.053 5.181 1.00 0.00 H new ATOM 0 HA GLU B 16 12.553 -5.016 4.245 1.00 0.00 H new ATOM 0 HB2 GLU B 16 13.141 -7.211 5.355 1.00 0.00 H new ATOM 0 HB3 GLU B 16 12.643 -8.032 3.889 1.00 0.00 H new ATOM 0 HG2 GLU B 16 14.728 -5.867 3.742 1.00 0.00 H new ATOM 0 HG3 GLU B 16 15.172 -7.460 4.321 1.00 0.00 H new ATOM 666 N VAL B 17 12.239 -4.868 1.803 1.00 0.00 N ATOM 667 CA VAL B 17 11.982 -4.700 0.390 1.00 0.00 C ATOM 668 C VAL B 17 13.169 -4.057 -0.323 1.00 0.00 C ATOM 669 O VAL B 17 13.624 -2.976 0.053 1.00 0.00 O ATOM 670 CB VAL B 17 10.728 -3.831 0.183 1.00 0.00 C ATOM 671 CG1 VAL B 17 10.741 -3.198 -1.190 1.00 0.00 C ATOM 672 CG2 VAL B 17 9.465 -4.654 0.387 1.00 0.00 C ATOM 0 H VAL B 17 12.809 -4.131 2.219 1.00 0.00 H new ATOM 0 HA VAL B 17 11.822 -5.690 -0.038 1.00 0.00 H new ATOM 0 HB VAL B 17 10.736 -3.033 0.926 1.00 0.00 H new ATOM 0 HG11 VAL B 17 9.847 -2.588 -1.318 1.00 0.00 H new ATOM 0 HG12 VAL B 17 11.626 -2.571 -1.293 1.00 0.00 H new ATOM 0 HG13 VAL B 17 10.759 -3.979 -1.950 1.00 0.00 H new ATOM 0 HG21 VAL B 17 8.590 -4.021 0.236 1.00 0.00 H new ATOM 0 HG22 VAL B 17 9.446 -5.476 -0.329 1.00 0.00 H new ATOM 0 HG23 VAL B 17 9.452 -5.056 1.400 1.00 0.00 H new ATOM 682 N GLU B 18 13.650 -4.724 -1.368 1.00 0.00 N ATOM 683 CA GLU B 18 14.767 -4.220 -2.158 1.00 0.00 C ATOM 684 C GLU B 18 14.298 -3.086 -3.062 1.00 0.00 C ATOM 685 O GLU B 18 13.138 -3.049 -3.463 1.00 0.00 O ATOM 686 CB GLU B 18 15.378 -5.342 -3.000 1.00 0.00 C ATOM 687 CG GLU B 18 15.906 -6.506 -2.175 1.00 0.00 C ATOM 688 CD GLU B 18 16.503 -7.608 -3.030 1.00 0.00 C ATOM 689 OE1 GLU B 18 16.506 -7.464 -4.271 1.00 0.00 O ATOM 690 OE2 GLU B 18 16.968 -8.616 -2.458 1.00 0.00 O ATOM 0 H GLU B 18 13.281 -5.619 -1.688 1.00 0.00 H new ATOM 0 HA GLU B 18 15.530 -3.841 -1.478 1.00 0.00 H new ATOM 0 HB2 GLU B 18 14.626 -5.713 -3.696 1.00 0.00 H new ATOM 0 HB3 GLU B 18 16.192 -4.933 -3.599 1.00 0.00 H new ATOM 0 HG2 GLU B 18 16.663 -6.140 -1.481 1.00 0.00 H new ATOM 0 HG3 GLU B 18 15.095 -6.917 -1.574 1.00 0.00 H new ATOM 697 N SER B 19 15.194 -2.158 -3.375 1.00 0.00 N ATOM 698 CA SER B 19 14.846 -1.026 -4.229 1.00 0.00 C ATOM 699 C SER B 19 14.295 -1.500 -5.573 1.00 0.00 C ATOM 700 O SER B 19 13.236 -1.050 -6.010 1.00 0.00 O ATOM 701 CB SER B 19 16.068 -0.134 -4.453 1.00 0.00 C ATOM 702 OG SER B 19 15.746 0.973 -5.277 1.00 0.00 O ATOM 0 H SER B 19 16.162 -2.165 -3.053 1.00 0.00 H new ATOM 0 HA SER B 19 14.071 -0.450 -3.723 1.00 0.00 H new ATOM 0 HB2 SER B 19 16.445 0.220 -3.493 1.00 0.00 H new ATOM 0 HB3 SER B 19 16.867 -0.715 -4.914 1.00 0.00 H new ATOM 0 HG SER B 19 16.543 1.529 -5.404 1.00 0.00 H new ATOM 708 N SER B 20 15.018 -2.407 -6.224 1.00 0.00 N ATOM 709 CA SER B 20 14.595 -2.934 -7.518 1.00 0.00 C ATOM 710 C SER B 20 13.767 -4.208 -7.358 1.00 0.00 C ATOM 711 O SER B 20 13.900 -5.148 -8.142 1.00 0.00 O ATOM 712 CB SER B 20 15.814 -3.212 -8.401 1.00 0.00 C ATOM 713 OG SER B 20 16.553 -2.026 -8.638 1.00 0.00 O ATOM 0 H SER B 20 15.897 -2.791 -5.878 1.00 0.00 H new ATOM 0 HA SER B 20 13.968 -2.180 -7.995 1.00 0.00 H new ATOM 0 HB2 SER B 20 16.453 -3.953 -7.921 1.00 0.00 H new ATOM 0 HB3 SER B 20 15.490 -3.638 -9.350 1.00 0.00 H new ATOM 0 HG SER B 20 17.327 -2.230 -9.203 1.00 0.00 H new ATOM 719 N ASP B 21 12.911 -4.235 -6.341 1.00 0.00 N ATOM 720 CA ASP B 21 12.063 -5.396 -6.085 1.00 0.00 C ATOM 721 C ASP B 21 10.871 -5.419 -7.040 1.00 0.00 C ATOM 722 O ASP B 21 10.963 -4.948 -8.172 1.00 0.00 O ATOM 723 CB ASP B 21 11.570 -5.378 -4.637 1.00 0.00 C ATOM 724 CG ASP B 21 10.603 -4.241 -4.376 1.00 0.00 C ATOM 725 OD1 ASP B 21 10.966 -3.079 -4.652 1.00 0.00 O ATOM 726 OD2 ASP B 21 9.483 -4.512 -3.895 1.00 0.00 O ATOM 0 H ASP B 21 12.786 -3.467 -5.681 1.00 0.00 H new ATOM 0 HA ASP B 21 12.656 -6.295 -6.251 1.00 0.00 H new ATOM 0 HB2 ASP B 21 11.083 -6.326 -4.409 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.424 -5.288 -3.965 1.00 0.00 H new ATOM 731 N THR B 22 9.754 -5.961 -6.563 1.00 0.00 N ATOM 732 CA THR B 22 8.528 -6.048 -7.351 1.00 0.00 C ATOM 733 C THR B 22 7.312 -6.098 -6.434 1.00 0.00 C ATOM 734 O THR B 22 7.327 -6.788 -5.414 1.00 0.00 O ATOM 735 CB THR B 22 8.513 -7.299 -8.256 1.00 0.00 C ATOM 736 OG1 THR B 22 8.724 -8.476 -7.469 1.00 0.00 O ATOM 737 CG2 THR B 22 9.575 -7.213 -9.343 1.00 0.00 C ATOM 0 H THR B 22 9.673 -6.351 -5.624 1.00 0.00 H new ATOM 0 HA THR B 22 8.492 -5.159 -7.981 1.00 0.00 H new ATOM 0 HB THR B 22 7.537 -7.350 -8.738 1.00 0.00 H new ATOM 0 HG1 THR B 22 8.711 -9.265 -8.050 1.00 0.00 H new ATOM 0 HG21 THR B 22 9.536 -8.110 -9.961 1.00 0.00 H new ATOM 0 HG22 THR B 22 9.390 -6.336 -9.964 1.00 0.00 H new ATOM 0 HG23 THR B 22 10.560 -7.131 -8.884 1.00 0.00 H new ATOM 745 N ILE B 23 6.260 -5.366 -6.796 1.00 0.00 N ATOM 746 CA ILE B 23 5.042 -5.341 -5.993 1.00 0.00 C ATOM 747 C ILE B 23 4.550 -6.755 -5.713 1.00 0.00 C ATOM 748 O ILE B 23 4.082 -7.053 -4.614 1.00 0.00 O ATOM 749 CB ILE B 23 3.916 -4.539 -6.679 1.00 0.00 C ATOM 750 CG1 ILE B 23 4.316 -3.068 -6.831 1.00 0.00 C ATOM 751 CG2 ILE B 23 2.621 -4.662 -5.887 1.00 0.00 C ATOM 752 CD1 ILE B 23 4.578 -2.367 -5.514 1.00 0.00 C ATOM 0 H ILE B 23 6.227 -4.786 -7.635 1.00 0.00 H new ATOM 0 HA ILE B 23 5.294 -4.848 -5.054 1.00 0.00 H new ATOM 0 HB ILE B 23 3.754 -4.953 -7.674 1.00 0.00 H new ATOM 0 HG12 ILE B 23 5.212 -3.007 -7.449 1.00 0.00 H new ATOM 0 HG13 ILE B 23 3.525 -2.539 -7.363 1.00 0.00 H new ATOM 0 HG21 ILE B 23 1.836 -4.091 -6.383 1.00 0.00 H new ATOM 0 HG22 ILE B 23 2.327 -5.710 -5.831 1.00 0.00 H new ATOM 0 HG23 ILE B 23 2.772 -4.273 -4.880 1.00 0.00 H new ATOM 0 HD11 ILE B 23 4.856 -1.330 -5.703 1.00 0.00 H new ATOM 0 HD12 ILE B 23 3.677 -2.396 -4.901 1.00 0.00 H new ATOM 0 HD13 ILE B 23 5.390 -2.870 -4.989 1.00 0.00 H new ATOM 764 N ASP B 24 4.664 -7.625 -6.713 1.00 0.00 N ATOM 765 CA ASP B 24 4.234 -9.012 -6.568 1.00 0.00 C ATOM 766 C ASP B 24 4.914 -9.664 -5.367 1.00 0.00 C ATOM 767 O ASP B 24 4.260 -10.294 -4.533 1.00 0.00 O ATOM 768 CB ASP B 24 4.554 -9.805 -7.837 1.00 0.00 C ATOM 769 CG ASP B 24 3.927 -9.197 -9.076 1.00 0.00 C ATOM 770 OD1 ASP B 24 4.253 -8.035 -9.397 1.00 0.00 O ATOM 771 OD2 ASP B 24 3.111 -9.883 -9.727 1.00 0.00 O ATOM 0 H ASP B 24 5.049 -7.395 -7.629 1.00 0.00 H new ATOM 0 HA ASP B 24 3.156 -9.018 -6.407 1.00 0.00 H new ATOM 0 HB2 ASP B 24 5.635 -9.854 -7.968 1.00 0.00 H new ATOM 0 HB3 ASP B 24 4.200 -10.829 -7.720 1.00 0.00 H new ATOM 776 N ASN B 25 6.232 -9.501 -5.282 1.00 0.00 N ATOM 777 CA ASN B 25 7.003 -10.065 -4.181 1.00 0.00 C ATOM 778 C ASN B 25 6.545 -9.479 -2.851 1.00 0.00 C ATOM 779 O ASN B 25 6.418 -10.194 -1.856 1.00 0.00 O ATOM 780 CB ASN B 25 8.496 -9.801 -4.383 1.00 0.00 C ATOM 781 CG ASN B 25 9.343 -10.382 -3.267 1.00 0.00 C ATOM 782 OD1 ASN B 25 9.339 -11.590 -3.033 1.00 0.00 O ATOM 783 ND2 ASN B 25 10.074 -9.520 -2.570 1.00 0.00 N ATOM 0 H ASN B 25 6.787 -8.983 -5.963 1.00 0.00 H new ATOM 0 HA ASN B 25 6.836 -11.142 -4.164 1.00 0.00 H new ATOM 0 HB2 ASN B 25 8.812 -10.228 -5.335 1.00 0.00 H new ATOM 0 HB3 ASN B 25 8.667 -8.726 -4.443 1.00 0.00 H new ATOM 0 HD21 ASN B 25 10.663 -9.852 -1.806 1.00 0.00 H new ATOM 0 HD22 ASN B 25 10.047 -8.526 -2.799 1.00 0.00 H new ATOM 790 N VAL B 26 6.295 -8.172 -2.845 1.00 0.00 N ATOM 791 CA VAL B 26 5.844 -7.484 -1.642 1.00 0.00 C ATOM 792 C VAL B 26 4.557 -8.106 -1.112 1.00 0.00 C ATOM 793 O VAL B 26 4.424 -8.357 0.084 1.00 0.00 O ATOM 794 CB VAL B 26 5.609 -5.984 -1.907 1.00 0.00 C ATOM 795 CG1 VAL B 26 5.128 -5.281 -0.646 1.00 0.00 C ATOM 796 CG2 VAL B 26 6.877 -5.331 -2.437 1.00 0.00 C ATOM 0 H VAL B 26 6.398 -7.569 -3.661 1.00 0.00 H new ATOM 0 HA VAL B 26 6.632 -7.591 -0.897 1.00 0.00 H new ATOM 0 HB VAL B 26 4.831 -5.889 -2.665 1.00 0.00 H new ATOM 0 HG11 VAL B 26 4.969 -4.224 -0.857 1.00 0.00 H new ATOM 0 HG12 VAL B 26 4.192 -5.730 -0.314 1.00 0.00 H new ATOM 0 HG13 VAL B 26 5.878 -5.386 0.138 1.00 0.00 H new ATOM 0 HG21 VAL B 26 6.692 -4.272 -2.618 1.00 0.00 H new ATOM 0 HG22 VAL B 26 7.676 -5.440 -1.704 1.00 0.00 H new ATOM 0 HG23 VAL B 26 7.172 -5.813 -3.369 1.00 0.00 H new ATOM 806 N LYS B 27 3.613 -8.357 -2.015 1.00 0.00 N ATOM 807 CA LYS B 27 2.337 -8.954 -1.642 1.00 0.00 C ATOM 808 C LYS B 27 2.532 -10.350 -1.061 1.00 0.00 C ATOM 809 O LYS B 27 1.900 -10.710 -0.069 1.00 0.00 O ATOM 810 CB LYS B 27 1.404 -9.019 -2.853 1.00 0.00 C ATOM 811 CG LYS B 27 0.877 -7.663 -3.296 1.00 0.00 C ATOM 812 CD LYS B 27 -0.015 -7.039 -2.234 1.00 0.00 C ATOM 813 CE LYS B 27 -0.599 -5.715 -2.702 1.00 0.00 C ATOM 814 NZ LYS B 27 -1.484 -5.104 -1.672 1.00 0.00 N ATOM 0 H LYS B 27 3.709 -8.156 -3.010 1.00 0.00 H new ATOM 0 HA LYS B 27 1.885 -8.324 -0.876 1.00 0.00 H new ATOM 0 HB2 LYS B 27 1.936 -9.481 -3.685 1.00 0.00 H new ATOM 0 HB3 LYS B 27 0.560 -9.666 -2.615 1.00 0.00 H new ATOM 0 HG2 LYS B 27 1.714 -6.997 -3.507 1.00 0.00 H new ATOM 0 HG3 LYS B 27 0.316 -7.775 -4.224 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -0.823 -7.727 -1.987 1.00 0.00 H new ATOM 0 HD3 LYS B 27 0.560 -6.882 -1.321 1.00 0.00 H new ATOM 0 HE2 LYS B 27 0.211 -5.025 -2.941 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -1.165 -5.872 -3.620 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -1.740 -4.139 -1.962 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -2.347 -5.676 -1.573 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -0.984 -5.070 -0.761 1.00 0.00 H new ATOM 828 N SER B 28 3.407 -11.133 -1.685 1.00 0.00 N ATOM 829 CA SER B 28 3.677 -12.492 -1.224 1.00 0.00 C ATOM 830 C SER B 28 4.174 -12.492 0.220 1.00 0.00 C ATOM 831 O SER B 28 3.681 -13.251 1.058 1.00 0.00 O ATOM 832 CB SER B 28 4.710 -13.165 -2.131 1.00 0.00 C ATOM 833 OG SER B 28 4.978 -14.489 -1.704 1.00 0.00 O ATOM 0 H SER B 28 3.940 -10.852 -2.508 1.00 0.00 H new ATOM 0 HA SER B 28 2.744 -13.054 -1.267 1.00 0.00 H new ATOM 0 HB2 SER B 28 4.344 -13.178 -3.158 1.00 0.00 H new ATOM 0 HB3 SER B 28 5.633 -12.585 -2.129 1.00 0.00 H new ATOM 0 HG SER B 28 5.640 -14.898 -2.301 1.00 0.00 H new ATOM 839 N LYS B 29 5.153 -11.639 0.505 1.00 0.00 N ATOM 840 CA LYS B 29 5.717 -11.544 1.847 1.00 0.00 C ATOM 841 C LYS B 29 4.659 -11.103 2.853 1.00 0.00 C ATOM 842 O LYS B 29 4.538 -11.682 3.934 1.00 0.00 O ATOM 843 CB LYS B 29 6.900 -10.574 1.861 1.00 0.00 C ATOM 844 CG LYS B 29 7.985 -10.934 0.858 1.00 0.00 C ATOM 845 CD LYS B 29 9.215 -10.055 1.017 1.00 0.00 C ATOM 846 CE LYS B 29 9.899 -10.287 2.356 1.00 0.00 C ATOM 847 NZ LYS B 29 11.125 -9.457 2.505 1.00 0.00 N ATOM 0 H LYS B 29 5.572 -11.004 -0.175 1.00 0.00 H new ATOM 0 HA LYS B 29 6.071 -12.533 2.137 1.00 0.00 H new ATOM 0 HB2 LYS B 29 6.538 -9.568 1.649 1.00 0.00 H new ATOM 0 HB3 LYS B 29 7.332 -10.553 2.861 1.00 0.00 H new ATOM 0 HG2 LYS B 29 8.266 -11.979 0.986 1.00 0.00 H new ATOM 0 HG3 LYS B 29 7.593 -10.831 -0.154 1.00 0.00 H new ATOM 0 HD2 LYS B 29 9.917 -10.260 0.209 1.00 0.00 H new ATOM 0 HD3 LYS B 29 8.928 -9.007 0.931 1.00 0.00 H new ATOM 0 HE2 LYS B 29 9.204 -10.056 3.163 1.00 0.00 H new ATOM 0 HE3 LYS B 29 10.160 -11.341 2.452 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 11.607 -9.706 3.392 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 11.763 -9.633 1.703 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 10.863 -8.451 2.524 1.00 0.00 H new ATOM 861 N ILE B 30 3.887 -10.082 2.487 1.00 0.00 N ATOM 862 CA ILE B 30 2.831 -9.575 3.356 1.00 0.00 C ATOM 863 C ILE B 30 1.832 -10.680 3.679 1.00 0.00 C ATOM 864 O ILE B 30 1.392 -10.821 4.821 1.00 0.00 O ATOM 865 CB ILE B 30 2.086 -8.387 2.711 1.00 0.00 C ATOM 866 CG1 ILE B 30 3.046 -7.214 2.495 1.00 0.00 C ATOM 867 CG2 ILE B 30 0.907 -7.965 3.579 1.00 0.00 C ATOM 868 CD1 ILE B 30 2.415 -6.032 1.791 1.00 0.00 C ATOM 0 H ILE B 30 3.974 -9.592 1.597 1.00 0.00 H new ATOM 0 HA ILE B 30 3.305 -9.228 4.274 1.00 0.00 H new ATOM 0 HB ILE B 30 1.701 -8.700 1.741 1.00 0.00 H new ATOM 0 HG12 ILE B 30 3.429 -6.887 3.462 1.00 0.00 H new ATOM 0 HG13 ILE B 30 3.901 -7.558 1.913 1.00 0.00 H new ATOM 0 HG21 ILE B 30 0.392 -7.126 3.110 1.00 0.00 H new ATOM 0 HG22 ILE B 30 0.216 -8.801 3.686 1.00 0.00 H new ATOM 0 HG23 ILE B 30 1.268 -7.665 4.563 1.00 0.00 H new ATOM 0 HD11 ILE B 30 3.155 -5.241 1.674 1.00 0.00 H new ATOM 0 HD12 ILE B 30 2.057 -6.342 0.809 1.00 0.00 H new ATOM 0 HD13 ILE B 30 1.578 -5.661 2.382 1.00 0.00 H new ATOM 880 N GLN B 31 1.488 -11.467 2.664 1.00 0.00 N ATOM 881 CA GLN B 31 0.552 -12.570 2.833 1.00 0.00 C ATOM 882 C GLN B 31 1.102 -13.583 3.830 1.00 0.00 C ATOM 883 O GLN B 31 0.368 -14.117 4.655 1.00 0.00 O ATOM 884 CB GLN B 31 0.277 -13.251 1.490 1.00 0.00 C ATOM 885 CG GLN B 31 -0.715 -14.399 1.582 1.00 0.00 C ATOM 886 CD GLN B 31 -0.973 -15.058 0.241 1.00 0.00 C ATOM 887 OE1 GLN B 31 -0.051 -15.551 -0.409 1.00 0.00 O ATOM 888 NE2 GLN B 31 -2.233 -15.072 -0.179 1.00 0.00 N ATOM 0 H GLN B 31 1.845 -11.360 1.715 1.00 0.00 H new ATOM 0 HA GLN B 31 -0.385 -12.169 3.219 1.00 0.00 H new ATOM 0 HB2 GLN B 31 -0.102 -12.509 0.787 1.00 0.00 H new ATOM 0 HB3 GLN B 31 1.216 -13.625 1.083 1.00 0.00 H new ATOM 0 HG2 GLN B 31 -0.338 -15.145 2.282 1.00 0.00 H new ATOM 0 HG3 GLN B 31 -1.657 -14.029 1.987 1.00 0.00 H new ATOM 0 HE21 GLN B 31 -2.966 -14.651 0.392 1.00 0.00 H new ATOM 0 HE22 GLN B 31 -2.468 -15.503 -1.073 1.00 0.00 H new ATOM 897 N ASP B 32 2.400 -13.842 3.748 1.00 0.00 N ATOM 898 CA ASP B 32 3.044 -14.790 4.649 1.00 0.00 C ATOM 899 C ASP B 32 2.969 -14.306 6.097 1.00 0.00 C ATOM 900 O ASP B 32 2.754 -15.099 7.014 1.00 0.00 O ATOM 901 CB ASP B 32 4.503 -15.003 4.239 1.00 0.00 C ATOM 902 CG ASP B 32 5.208 -16.033 5.102 1.00 0.00 C ATOM 903 OD1 ASP B 32 5.339 -15.800 6.323 1.00 0.00 O ATOM 904 OD2 ASP B 32 5.629 -17.075 4.557 1.00 0.00 O ATOM 0 H ASP B 32 3.027 -13.411 3.069 1.00 0.00 H new ATOM 0 HA ASP B 32 2.513 -15.740 4.579 1.00 0.00 H new ATOM 0 HB2 ASP B 32 4.541 -15.321 3.197 1.00 0.00 H new ATOM 0 HB3 ASP B 32 5.037 -14.055 4.303 1.00 0.00 H new ATOM 909 N LYS B 33 3.163 -13.004 6.296 1.00 0.00 N ATOM 910 CA LYS B 33 3.134 -12.417 7.636 1.00 0.00 C ATOM 911 C LYS B 33 1.727 -12.408 8.238 1.00 0.00 C ATOM 912 O LYS B 33 1.457 -13.107 9.214 1.00 0.00 O ATOM 913 CB LYS B 33 3.675 -10.985 7.600 1.00 0.00 C ATOM 914 CG LYS B 33 5.143 -10.885 7.209 1.00 0.00 C ATOM 915 CD LYS B 33 6.052 -11.531 8.246 1.00 0.00 C ATOM 916 CE LYS B 33 5.937 -10.850 9.602 1.00 0.00 C ATOM 917 NZ LYS B 33 6.814 -11.491 10.621 1.00 0.00 N ATOM 0 H LYS B 33 3.342 -12.335 5.547 1.00 0.00 H new ATOM 0 HA LYS B 33 3.766 -13.042 8.268 1.00 0.00 H new ATOM 0 HB2 LYS B 33 3.082 -10.402 6.896 1.00 0.00 H new ATOM 0 HB3 LYS B 33 3.540 -10.532 8.582 1.00 0.00 H new ATOM 0 HG2 LYS B 33 5.295 -11.366 6.243 1.00 0.00 H new ATOM 0 HG3 LYS B 33 5.416 -9.837 7.089 1.00 0.00 H new ATOM 0 HD2 LYS B 33 5.796 -12.586 8.346 1.00 0.00 H new ATOM 0 HD3 LYS B 33 7.085 -11.485 7.903 1.00 0.00 H new ATOM 0 HE2 LYS B 33 6.204 -9.798 9.504 1.00 0.00 H new ATOM 0 HE3 LYS B 33 4.901 -10.886 9.940 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 6.707 -10.998 11.531 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 6.543 -12.489 10.734 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 7.805 -11.434 10.311 1.00 0.00 H new ATOM 931 N GLU B 34 0.846 -11.589 7.669 1.00 0.00 N ATOM 932 CA GLU B 34 -0.523 -11.462 8.171 1.00 0.00 C ATOM 933 C GLU B 34 -1.402 -12.646 7.777 1.00 0.00 C ATOM 934 O GLU B 34 -2.232 -13.098 8.566 1.00 0.00 O ATOM 935 CB GLU B 34 -1.154 -10.164 7.662 1.00 0.00 C ATOM 936 CG GLU B 34 -0.384 -8.913 8.059 1.00 0.00 C ATOM 937 CD GLU B 34 -0.355 -8.686 9.561 1.00 0.00 C ATOM 938 OE1 GLU B 34 -0.974 -9.483 10.298 1.00 0.00 O ATOM 939 OE2 GLU B 34 0.282 -7.706 9.999 1.00 0.00 O ATOM 0 H GLU B 34 1.054 -11.003 6.860 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.461 -11.445 9.259 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -1.225 -10.207 6.575 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -2.172 -10.090 8.045 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.638 -8.989 7.689 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -0.834 -8.047 7.575 1.00 0.00 H new ATOM 946 N GLY B 35 -1.240 -13.128 6.551 1.00 0.00 N ATOM 947 CA GLY B 35 -2.054 -14.234 6.079 1.00 0.00 C ATOM 948 C GLY B 35 -3.303 -13.742 5.379 1.00 0.00 C ATOM 949 O GLY B 35 -4.401 -14.249 5.612 1.00 0.00 O ATOM 0 H GLY B 35 -0.562 -12.775 5.876 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -1.471 -14.851 5.395 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -2.333 -14.868 6.921 1.00 0.00 H new ATOM 953 N ILE B 36 -3.127 -12.737 4.525 1.00 0.00 N ATOM 954 CA ILE B 36 -4.234 -12.145 3.784 1.00 0.00 C ATOM 955 C ILE B 36 -3.948 -12.154 2.282 1.00 0.00 C ATOM 956 O ILE B 36 -2.830 -11.861 1.860 1.00 0.00 O ATOM 957 CB ILE B 36 -4.479 -10.689 4.238 1.00 0.00 C ATOM 958 CG1 ILE B 36 -4.584 -10.610 5.765 1.00 0.00 C ATOM 959 CG2 ILE B 36 -5.733 -10.125 3.588 1.00 0.00 C ATOM 960 CD1 ILE B 36 -5.686 -11.467 6.350 1.00 0.00 C ATOM 0 H ILE B 36 -2.220 -12.314 4.329 1.00 0.00 H new ATOM 0 HA ILE B 36 -5.122 -12.743 3.987 1.00 0.00 H new ATOM 0 HB ILE B 36 -3.628 -10.086 3.919 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -3.632 -10.913 6.201 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -4.752 -9.573 6.055 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -5.886 -9.099 3.922 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -5.619 -10.141 2.504 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -6.594 -10.731 3.871 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -5.696 -11.357 7.434 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -6.647 -11.151 5.944 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -5.510 -12.512 6.093 1.00 0.00 H new ATOM 972 N PRO B 37 -4.952 -12.492 1.448 1.00 0.00 N ATOM 973 CA PRO B 37 -4.782 -12.528 -0.010 1.00 0.00 C ATOM 974 C PRO B 37 -4.216 -11.216 -0.553 1.00 0.00 C ATOM 975 O PRO B 37 -4.628 -10.135 -0.133 1.00 0.00 O ATOM 976 CB PRO B 37 -6.203 -12.758 -0.530 1.00 0.00 C ATOM 977 CG PRO B 37 -6.915 -13.428 0.593 1.00 0.00 C ATOM 978 CD PRO B 37 -6.323 -12.862 1.853 1.00 0.00 C ATOM 0 HA PRO B 37 -4.075 -13.296 -0.323 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -6.683 -11.817 -0.798 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -6.201 -13.381 -1.425 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -7.987 -13.237 0.545 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -6.782 -14.509 0.550 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -6.884 -11.998 2.208 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -6.320 -13.594 2.660 1.00 0.00 H new ATOM 986 N PRO B 38 -3.252 -11.293 -1.491 1.00 0.00 N ATOM 987 CA PRO B 38 -2.622 -10.103 -2.081 1.00 0.00 C ATOM 988 C PRO B 38 -3.609 -9.226 -2.844 1.00 0.00 C ATOM 989 O PRO B 38 -3.619 -8.005 -2.683 1.00 0.00 O ATOM 990 CB PRO B 38 -1.577 -10.681 -3.041 1.00 0.00 C ATOM 991 CG PRO B 38 -2.020 -12.079 -3.304 1.00 0.00 C ATOM 992 CD PRO B 38 -2.693 -12.539 -2.044 1.00 0.00 C ATOM 0 HA PRO B 38 -2.204 -9.454 -1.311 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -1.528 -10.103 -3.964 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -0.581 -10.660 -2.598 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -2.706 -12.119 -4.150 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -1.172 -12.718 -3.550 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -3.471 -13.275 -2.248 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -1.987 -13.004 -1.356 1.00 0.00 H new ATOM 1000 N ASP B 39 -4.430 -9.853 -3.679 1.00 0.00 N ATOM 1001 CA ASP B 39 -5.414 -9.126 -4.475 1.00 0.00 C ATOM 1002 C ASP B 39 -6.344 -8.303 -3.586 1.00 0.00 C ATOM 1003 O ASP B 39 -6.649 -7.150 -3.892 1.00 0.00 O ATOM 1004 CB ASP B 39 -6.231 -10.101 -5.325 1.00 0.00 C ATOM 1005 CG ASP B 39 -5.372 -10.881 -6.303 1.00 0.00 C ATOM 1006 OD1 ASP B 39 -4.143 -10.657 -6.326 1.00 0.00 O ATOM 1007 OD2 ASP B 39 -5.930 -11.715 -7.047 1.00 0.00 O ATOM 0 H ASP B 39 -4.434 -10.863 -3.823 1.00 0.00 H new ATOM 0 HA ASP B 39 -4.876 -8.442 -5.131 1.00 0.00 H new ATOM 0 HB2 ASP B 39 -6.754 -10.798 -4.670 1.00 0.00 H new ATOM 0 HB3 ASP B 39 -6.992 -9.548 -5.876 1.00 0.00 H new ATOM 1012 N GLN B 40 -6.793 -8.904 -2.488 1.00 0.00 N ATOM 1013 CA GLN B 40 -7.693 -8.230 -1.556 1.00 0.00 C ATOM 1014 C GLN B 40 -7.050 -6.973 -0.977 1.00 0.00 C ATOM 1015 O GLN B 40 -7.658 -5.902 -0.968 1.00 0.00 O ATOM 1016 CB GLN B 40 -8.087 -9.178 -0.422 1.00 0.00 C ATOM 1017 CG GLN B 40 -8.821 -10.422 -0.894 1.00 0.00 C ATOM 1018 CD GLN B 40 -10.118 -10.099 -1.610 1.00 0.00 C ATOM 1019 OE1 GLN B 40 -11.020 -9.485 -1.040 1.00 0.00 O ATOM 1020 NE2 GLN B 40 -10.217 -10.513 -2.868 1.00 0.00 N ATOM 0 H GLN B 40 -6.548 -9.858 -2.221 1.00 0.00 H new ATOM 0 HA GLN B 40 -8.585 -7.935 -2.108 1.00 0.00 H new ATOM 0 HB2 GLN B 40 -7.189 -9.479 0.117 1.00 0.00 H new ATOM 0 HB3 GLN B 40 -8.718 -8.641 0.286 1.00 0.00 H new ATOM 0 HG2 GLN B 40 -8.173 -10.990 -1.562 1.00 0.00 H new ATOM 0 HG3 GLN B 40 -9.033 -11.061 -0.037 1.00 0.00 H new ATOM 0 HE21 GLN B 40 -9.444 -11.019 -3.301 1.00 0.00 H new ATOM 0 HE22 GLN B 40 -11.066 -10.325 -3.401 1.00 0.00 H new ATOM 1029 N GLN B 41 -5.823 -7.111 -0.488 1.00 0.00 N ATOM 1030 CA GLN B 41 -5.102 -5.986 0.100 1.00 0.00 C ATOM 1031 C GLN B 41 -4.768 -4.936 -0.955 1.00 0.00 C ATOM 1032 O GLN B 41 -4.276 -5.264 -2.035 1.00 0.00 O ATOM 1033 CB GLN B 41 -3.815 -6.473 0.765 1.00 0.00 C ATOM 1034 CG GLN B 41 -4.041 -7.527 1.836 1.00 0.00 C ATOM 1035 CD GLN B 41 -2.748 -7.987 2.478 1.00 0.00 C ATOM 1036 OE1 GLN B 41 -2.032 -7.198 3.093 1.00 0.00 O ATOM 1037 NE2 GLN B 41 -2.441 -9.270 2.335 1.00 0.00 N ATOM 0 H GLN B 41 -5.306 -7.990 -0.487 1.00 0.00 H new ATOM 0 HA GLN B 41 -5.748 -5.530 0.850 1.00 0.00 H new ATOM 0 HB2 GLN B 41 -3.153 -6.881 0.001 1.00 0.00 H new ATOM 0 HB3 GLN B 41 -3.301 -5.621 1.209 1.00 0.00 H new ATOM 0 HG2 GLN B 41 -4.701 -7.124 2.604 1.00 0.00 H new ATOM 0 HG3 GLN B 41 -4.550 -8.385 1.396 1.00 0.00 H new ATOM 0 HE21 GLN B 41 -3.064 -9.889 1.817 1.00 0.00 H new ATOM 0 HE22 GLN B 41 -1.582 -9.637 2.744 1.00 0.00 H new ATOM 1046 N ARG B 42 -5.028 -3.672 -0.633 1.00 0.00 N ATOM 1047 CA ARG B 42 -4.743 -2.578 -1.556 1.00 0.00 C ATOM 1048 C ARG B 42 -3.718 -1.618 -0.958 1.00 0.00 C ATOM 1049 O ARG B 42 -3.949 -1.028 0.097 1.00 0.00 O ATOM 1050 CB ARG B 42 -6.030 -1.826 -1.903 1.00 0.00 C ATOM 1051 CG ARG B 42 -7.066 -2.687 -2.608 1.00 0.00 C ATOM 1052 CD ARG B 42 -6.540 -3.221 -3.932 1.00 0.00 C ATOM 1053 NE ARG B 42 -7.516 -4.070 -4.609 1.00 0.00 N ATOM 1054 CZ ARG B 42 -7.306 -4.637 -5.793 1.00 0.00 C ATOM 1055 NH1 ARG B 42 -6.161 -4.442 -6.433 1.00 0.00 N ATOM 1056 NH2 ARG B 42 -8.243 -5.400 -6.339 1.00 0.00 N ATOM 0 H ARG B 42 -5.434 -3.381 0.256 1.00 0.00 H new ATOM 0 HA ARG B 42 -4.325 -3.002 -2.469 1.00 0.00 H new ATOM 0 HB2 ARG B 42 -6.465 -1.425 -0.987 1.00 0.00 H new ATOM 0 HB3 ARG B 42 -5.784 -0.975 -2.538 1.00 0.00 H new ATOM 0 HG2 ARG B 42 -7.347 -3.521 -1.964 1.00 0.00 H new ATOM 0 HG3 ARG B 42 -7.969 -2.102 -2.783 1.00 0.00 H new ATOM 0 HD2 ARG B 42 -6.276 -2.385 -4.580 1.00 0.00 H new ATOM 0 HD3 ARG B 42 -5.626 -3.789 -3.756 1.00 0.00 H new ATOM 0 HE ARG B 42 -8.410 -4.238 -4.147 1.00 0.00 H new ATOM 0 HH11 ARG B 42 -5.438 -3.855 -6.017 1.00 0.00 H new ATOM 0 HH12 ARG B 42 -6.004 -4.879 -7.341 1.00 0.00 H new ATOM 0 HH21 ARG B 42 -9.125 -5.552 -5.851 1.00 0.00 H new ATOM 0 HH22 ARG B 42 -8.081 -5.835 -7.247 1.00 0.00 H new ATOM 1070 N LEU B 43 -2.586 -1.470 -1.640 1.00 0.00 N ATOM 1071 CA LEU B 43 -1.523 -0.583 -1.178 1.00 0.00 C ATOM 1072 C LEU B 43 -1.697 0.824 -1.741 1.00 0.00 C ATOM 1073 O LEU B 43 -1.972 0.999 -2.928 1.00 0.00 O ATOM 1074 CB LEU B 43 -0.153 -1.139 -1.578 1.00 0.00 C ATOM 1075 CG LEU B 43 0.177 -2.527 -1.023 1.00 0.00 C ATOM 1076 CD1 LEU B 43 1.532 -2.994 -1.531 1.00 0.00 C ATOM 1077 CD2 LEU B 43 0.154 -2.516 0.499 1.00 0.00 C ATOM 0 H LEU B 43 -2.381 -1.953 -2.515 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.583 -0.527 -0.091 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -0.099 -1.179 -2.666 1.00 0.00 H new ATOM 0 HB3 LEU B 43 0.615 -0.441 -1.246 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.583 -3.226 -1.372 1.00 0.00 H new ATOM 0 HD11 LEU B 43 1.751 -3.982 -1.127 1.00 0.00 H new ATOM 0 HD12 LEU B 43 1.515 -3.043 -2.620 1.00 0.00 H new ATOM 0 HD13 LEU B 43 2.302 -2.292 -1.211 1.00 0.00 H new ATOM 0 HD21 LEU B 43 0.391 -3.512 0.874 1.00 0.00 H new ATOM 0 HD22 LEU B 43 0.892 -1.804 0.869 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -0.837 -2.224 0.846 1.00 0.00 H new ATOM 1089 N ILE B 44 -1.524 1.823 -0.882 1.00 0.00 N ATOM 1090 CA ILE B 44 -1.653 3.217 -1.292 1.00 0.00 C ATOM 1091 C ILE B 44 -0.451 4.028 -0.820 1.00 0.00 C ATOM 1092 O ILE B 44 0.024 3.852 0.302 1.00 0.00 O ATOM 1093 CB ILE B 44 -2.945 3.853 -0.737 1.00 0.00 C ATOM 1094 CG1 ILE B 44 -4.170 3.083 -1.239 1.00 0.00 C ATOM 1095 CG2 ILE B 44 -3.030 5.320 -1.140 1.00 0.00 C ATOM 1096 CD1 ILE B 44 -5.480 3.580 -0.666 1.00 0.00 C ATOM 0 H ILE B 44 -1.294 1.693 0.103 1.00 0.00 H new ATOM 0 HA ILE B 44 -1.698 3.230 -2.381 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.924 3.798 0.351 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -4.210 3.151 -2.326 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -4.052 2.028 -0.990 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -3.947 5.754 -0.741 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -2.170 5.857 -0.741 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -3.034 5.399 -2.227 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -6.301 2.986 -1.068 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -5.461 3.486 0.420 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -5.622 4.626 -0.937 1.00 0.00 H new ATOM 1108 N PHE B 45 0.042 4.911 -1.683 1.00 0.00 N ATOM 1109 CA PHE B 45 1.195 5.738 -1.347 1.00 0.00 C ATOM 1110 C PHE B 45 1.292 6.948 -2.272 1.00 0.00 C ATOM 1111 O PHE B 45 1.027 6.847 -3.472 1.00 0.00 O ATOM 1112 CB PHE B 45 2.481 4.909 -1.432 1.00 0.00 C ATOM 1113 CG PHE B 45 3.717 5.658 -1.013 1.00 0.00 C ATOM 1114 CD1 PHE B 45 3.758 6.338 0.194 1.00 0.00 C ATOM 1115 CD2 PHE B 45 4.838 5.678 -1.827 1.00 0.00 C ATOM 1116 CE1 PHE B 45 4.893 7.025 0.581 1.00 0.00 C ATOM 1117 CE2 PHE B 45 5.976 6.363 -1.446 1.00 0.00 C ATOM 1118 CZ PHE B 45 6.004 7.037 -0.241 1.00 0.00 C ATOM 0 H PHE B 45 -0.337 5.072 -2.616 1.00 0.00 H new ATOM 0 HA PHE B 45 1.067 6.099 -0.326 1.00 0.00 H new ATOM 0 HB2 PHE B 45 2.374 4.024 -0.804 1.00 0.00 H new ATOM 0 HB3 PHE B 45 2.609 4.559 -2.456 1.00 0.00 H new ATOM 0 HD1 PHE B 45 2.892 6.331 0.840 1.00 0.00 H new ATOM 0 HD2 PHE B 45 4.822 5.152 -2.770 1.00 0.00 H new ATOM 0 HE1 PHE B 45 4.912 7.551 1.524 1.00 0.00 H new ATOM 0 HE2 PHE B 45 6.843 6.371 -2.090 1.00 0.00 H new ATOM 0 HZ PHE B 45 6.893 7.573 0.059 1.00 0.00 H new ATOM 1128 N ALA B 46 1.669 8.091 -1.700 1.00 0.00 N ATOM 1129 CA ALA B 46 1.805 9.330 -2.460 1.00 0.00 C ATOM 1130 C ALA B 46 0.573 9.585 -3.318 1.00 0.00 C ATOM 1131 O ALA B 46 0.679 10.038 -4.459 1.00 0.00 O ATOM 1132 CB ALA B 46 3.057 9.285 -3.323 1.00 0.00 C ATOM 0 H ALA B 46 1.886 8.183 -0.708 1.00 0.00 H new ATOM 0 HA ALA B 46 1.897 10.154 -1.753 1.00 0.00 H new ATOM 0 HB1 ALA B 46 3.146 10.215 -3.884 1.00 0.00 H new ATOM 0 HB2 ALA B 46 3.933 9.160 -2.687 1.00 0.00 H new ATOM 0 HB3 ALA B 46 2.990 8.447 -4.017 1.00 0.00 H new ATOM 1138 N GLY B 47 -0.596 9.290 -2.760 1.00 0.00 N ATOM 1139 CA GLY B 47 -1.835 9.490 -3.484 1.00 0.00 C ATOM 1140 C GLY B 47 -1.885 8.701 -4.776 1.00 0.00 C ATOM 1141 O GLY B 47 -2.334 9.211 -5.803 1.00 0.00 O ATOM 0 H GLY B 47 -0.706 8.915 -1.818 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -2.673 9.198 -2.851 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -1.956 10.551 -3.705 1.00 0.00 H new ATOM 1145 N LYS B 48 -1.422 7.454 -4.730 1.00 0.00 N ATOM 1146 CA LYS B 48 -1.419 6.602 -5.912 1.00 0.00 C ATOM 1147 C LYS B 48 -1.423 5.125 -5.527 1.00 0.00 C ATOM 1148 O LYS B 48 -0.664 4.695 -4.657 1.00 0.00 O ATOM 1149 CB LYS B 48 -0.198 6.912 -6.782 1.00 0.00 C ATOM 1150 CG LYS B 48 -0.102 6.039 -8.022 1.00 0.00 C ATOM 1151 CD LYS B 48 1.126 6.374 -8.857 1.00 0.00 C ATOM 1152 CE LYS B 48 1.063 7.790 -9.409 1.00 0.00 C ATOM 1153 NZ LYS B 48 2.258 8.116 -10.235 1.00 0.00 N ATOM 0 H LYS B 48 -1.046 7.014 -3.890 1.00 0.00 H new ATOM 0 HA LYS B 48 -2.327 6.809 -6.479 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -0.234 7.958 -7.085 1.00 0.00 H new ATOM 0 HB3 LYS B 48 0.705 6.784 -6.186 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -0.065 4.991 -7.726 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -0.999 6.168 -8.627 1.00 0.00 H new ATOM 0 HD2 LYS B 48 2.022 6.261 -8.247 1.00 0.00 H new ATOM 0 HD3 LYS B 48 1.210 5.666 -9.681 1.00 0.00 H new ATOM 0 HE2 LYS B 48 0.162 7.905 -10.012 1.00 0.00 H new ATOM 0 HE3 LYS B 48 0.987 8.498 -8.584 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 2.178 9.089 -10.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 3.116 8.031 -9.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 2.316 7.456 -11.037 1.00 0.00 H new ATOM 1167 N GLN B 49 -2.286 4.357 -6.188 1.00 0.00 N ATOM 1168 CA GLN B 49 -2.400 2.926 -5.929 1.00 0.00 C ATOM 1169 C GLN B 49 -1.205 2.168 -6.499 1.00 0.00 C ATOM 1170 O GLN B 49 -0.844 2.345 -7.663 1.00 0.00 O ATOM 1171 CB GLN B 49 -3.695 2.382 -6.536 1.00 0.00 C ATOM 1172 CG GLN B 49 -4.951 2.959 -5.903 1.00 0.00 C ATOM 1173 CD GLN B 49 -5.168 2.489 -4.474 1.00 0.00 C ATOM 1174 OE1 GLN B 49 -6.070 2.966 -3.788 1.00 0.00 O ATOM 1175 NE2 GLN B 49 -4.355 1.540 -4.021 1.00 0.00 N ATOM 0 H GLN B 49 -2.918 4.704 -6.909 1.00 0.00 H new ATOM 0 HA GLN B 49 -2.417 2.779 -4.849 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -3.704 2.597 -7.604 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -3.709 1.297 -6.429 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -4.890 4.047 -5.916 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -5.815 2.681 -6.506 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -3.618 1.170 -4.622 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -4.468 1.182 -3.073 1.00 0.00 H new ATOM 1184 N LEU B 50 -0.603 1.316 -5.677 1.00 0.00 N ATOM 1185 CA LEU B 50 0.543 0.524 -6.107 1.00 0.00 C ATOM 1186 C LEU B 50 0.112 -0.545 -7.104 1.00 0.00 C ATOM 1187 O LEU B 50 -0.858 -1.266 -6.872 1.00 0.00 O ATOM 1188 CB LEU B 50 1.233 -0.133 -4.904 1.00 0.00 C ATOM 1189 CG LEU B 50 2.067 0.802 -4.019 1.00 0.00 C ATOM 1190 CD1 LEU B 50 3.226 1.392 -4.807 1.00 0.00 C ATOM 1191 CD2 LEU B 50 1.205 1.909 -3.430 1.00 0.00 C ATOM 0 H LEU B 50 -0.889 1.156 -4.711 1.00 0.00 H new ATOM 0 HA LEU B 50 1.252 1.195 -6.593 1.00 0.00 H new ATOM 0 HB2 LEU B 50 0.470 -0.604 -4.284 1.00 0.00 H new ATOM 0 HB3 LEU B 50 1.881 -0.929 -5.271 1.00 0.00 H new ATOM 0 HG LEU B 50 2.472 0.214 -3.196 1.00 0.00 H new ATOM 0 HD11 LEU B 50 3.806 2.052 -4.162 1.00 0.00 H new ATOM 0 HD12 LEU B 50 3.865 0.588 -5.171 1.00 0.00 H new ATOM 0 HD13 LEU B 50 2.839 1.959 -5.653 1.00 0.00 H new ATOM 0 HD21 LEU B 50 1.821 2.557 -2.807 1.00 0.00 H new ATOM 0 HD22 LEU B 50 0.763 2.494 -4.236 1.00 0.00 H new ATOM 0 HD23 LEU B 50 0.413 1.470 -2.824 1.00 0.00 H new ATOM 1203 N GLU B 51 0.839 -0.643 -8.212 1.00 0.00 N ATOM 1204 CA GLU B 51 0.533 -1.630 -9.241 1.00 0.00 C ATOM 1205 C GLU B 51 0.812 -3.038 -8.732 1.00 0.00 C ATOM 1206 O GLU B 51 0.621 -3.329 -7.552 1.00 0.00 O ATOM 1207 CB GLU B 51 1.345 -1.336 -10.504 1.00 0.00 C ATOM 1208 CG GLU B 51 1.147 0.076 -11.031 1.00 0.00 C ATOM 1209 CD GLU B 51 1.810 0.300 -12.375 1.00 0.00 C ATOM 1210 OE1 GLU B 51 2.340 -0.676 -12.945 1.00 0.00 O ATOM 1211 OE2 GLU B 51 1.790 1.450 -12.863 1.00 0.00 O ATOM 0 H GLU B 51 1.644 -0.052 -8.420 1.00 0.00 H new ATOM 0 HA GLU B 51 -0.527 -1.566 -9.487 1.00 0.00 H new ATOM 0 HB2 GLU B 51 2.403 -1.492 -10.292 1.00 0.00 H new ATOM 0 HB3 GLU B 51 1.067 -2.049 -11.281 1.00 0.00 H new ATOM 0 HG2 GLU B 51 0.080 0.280 -11.119 1.00 0.00 H new ATOM 0 HG3 GLU B 51 1.549 0.788 -10.310 1.00 0.00 H new ATOM 1218 N ASP B 52 1.257 -3.907 -9.623 1.00 0.00 N ATOM 1219 CA ASP B 52 1.557 -5.287 -9.259 1.00 0.00 C ATOM 1220 C ASP B 52 2.421 -5.958 -10.325 1.00 0.00 C ATOM 1221 O ASP B 52 2.116 -7.058 -10.788 1.00 0.00 O ATOM 1222 CB ASP B 52 0.260 -6.075 -9.053 1.00 0.00 C ATOM 1223 CG ASP B 52 0.509 -7.483 -8.548 1.00 0.00 C ATOM 1224 OD1 ASP B 52 1.099 -7.627 -7.456 1.00 0.00 O ATOM 1225 OD2 ASP B 52 0.115 -8.442 -9.244 1.00 0.00 O ATOM 0 H ASP B 52 1.420 -3.684 -10.605 1.00 0.00 H new ATOM 0 HA ASP B 52 2.117 -5.278 -8.324 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -0.374 -5.545 -8.343 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -0.286 -6.122 -9.995 1.00 0.00 H new ATOM 1230 N GLY B 53 3.503 -5.287 -10.709 1.00 0.00 N ATOM 1231 CA GLY B 53 4.397 -5.833 -11.714 1.00 0.00 C ATOM 1232 C GLY B 53 5.435 -4.831 -12.178 1.00 0.00 C ATOM 1233 O GLY B 53 5.700 -4.717 -13.376 1.00 0.00 O ATOM 0 H GLY B 53 3.776 -4.375 -10.342 1.00 0.00 H new ATOM 0 HA2 GLY B 53 4.901 -6.711 -11.309 1.00 0.00 H new ATOM 0 HA3 GLY B 53 3.813 -6.168 -12.571 1.00 0.00 H new ATOM 1237 N ARG B 54 6.026 -4.104 -11.231 1.00 0.00 N ATOM 1238 CA ARG B 54 7.041 -3.104 -11.551 1.00 0.00 C ATOM 1239 C ARG B 54 7.973 -2.861 -10.369 1.00 0.00 C ATOM 1240 O ARG B 54 7.543 -2.848 -9.216 1.00 0.00 O ATOM 1241 CB ARG B 54 6.389 -1.780 -11.954 1.00 0.00 C ATOM 1242 CG ARG B 54 5.717 -1.805 -13.317 1.00 0.00 C ATOM 1243 CD ARG B 54 5.174 -0.435 -13.692 1.00 0.00 C ATOM 1244 NE ARG B 54 4.480 -0.451 -14.976 1.00 0.00 N ATOM 1245 CZ ARG B 54 3.883 0.613 -15.505 1.00 0.00 C ATOM 1246 NH1 ARG B 54 3.897 1.773 -14.861 1.00 0.00 N ATOM 1247 NH2 ARG B 54 3.271 0.519 -16.677 1.00 0.00 N ATOM 0 H ARG B 54 5.819 -4.189 -10.236 1.00 0.00 H new ATOM 0 HA ARG B 54 7.624 -3.493 -12.386 1.00 0.00 H new ATOM 0 HB2 ARG B 54 5.649 -1.509 -11.201 1.00 0.00 H new ATOM 0 HB3 ARG B 54 7.148 -0.998 -11.950 1.00 0.00 H new ATOM 0 HG2 ARG B 54 6.432 -2.134 -14.071 1.00 0.00 H new ATOM 0 HG3 ARG B 54 4.904 -2.531 -13.311 1.00 0.00 H new ATOM 0 HD2 ARG B 54 4.490 -0.092 -12.915 1.00 0.00 H new ATOM 0 HD3 ARG B 54 5.995 0.281 -13.733 1.00 0.00 H new ATOM 0 HE ARG B 54 4.451 -1.328 -15.497 1.00 0.00 H new ATOM 0 HH11 ARG B 54 4.366 1.850 -13.959 1.00 0.00 H new ATOM 0 HH12 ARG B 54 3.439 2.588 -15.268 1.00 0.00 H new ATOM 0 HH21 ARG B 54 3.257 -0.371 -17.175 1.00 0.00 H new ATOM 0 HH22 ARG B 54 2.814 1.337 -17.081 1.00 0.00 H new ATOM 1261 N THR B 55 9.253 -2.662 -10.670 1.00 0.00 N ATOM 1262 CA THR B 55 10.253 -2.409 -9.640 1.00 0.00 C ATOM 1263 C THR B 55 10.009 -1.067 -8.958 1.00 0.00 C ATOM 1264 O THR B 55 9.753 -0.062 -9.621 1.00 0.00 O ATOM 1265 CB THR B 55 11.678 -2.421 -10.227 1.00 0.00 C ATOM 1266 OG1 THR B 55 11.811 -1.394 -11.217 1.00 0.00 O ATOM 1267 CG2 THR B 55 11.997 -3.772 -10.849 1.00 0.00 C ATOM 0 H THR B 55 9.622 -2.671 -11.621 1.00 0.00 H new ATOM 0 HA THR B 55 10.163 -3.210 -8.906 1.00 0.00 H new ATOM 0 HB THR B 55 12.381 -2.236 -9.415 1.00 0.00 H new ATOM 0 HG1 THR B 55 11.231 -0.639 -10.985 1.00 0.00 H new ATOM 0 HG21 THR B 55 13.008 -3.755 -11.256 1.00 0.00 H new ATOM 0 HG22 THR B 55 11.925 -4.549 -10.088 1.00 0.00 H new ATOM 0 HG23 THR B 55 11.287 -3.981 -11.649 1.00 0.00 H new ATOM 1275 N LEU B 56 10.091 -1.057 -7.631 1.00 0.00 N ATOM 1276 CA LEU B 56 9.879 0.164 -6.859 1.00 0.00 C ATOM 1277 C LEU B 56 10.937 1.212 -7.187 1.00 0.00 C ATOM 1278 O LEU B 56 10.732 2.404 -6.958 1.00 0.00 O ATOM 1279 CB LEU B 56 9.887 -0.137 -5.358 1.00 0.00 C ATOM 1280 CG LEU B 56 8.794 -1.099 -4.882 1.00 0.00 C ATOM 1281 CD1 LEU B 56 8.865 -1.282 -3.374 1.00 0.00 C ATOM 1282 CD2 LEU B 56 7.419 -0.597 -5.295 1.00 0.00 C ATOM 0 H LEU B 56 10.303 -1.880 -7.067 1.00 0.00 H new ATOM 0 HA LEU B 56 8.903 0.564 -7.133 1.00 0.00 H new ATOM 0 HB2 LEU B 56 10.858 -0.555 -5.092 1.00 0.00 H new ATOM 0 HB3 LEU B 56 9.785 0.802 -4.814 1.00 0.00 H new ATOM 0 HG LEU B 56 8.960 -2.067 -5.355 1.00 0.00 H new ATOM 0 HD11 LEU B 56 8.081 -1.968 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU B 56 9.838 -1.690 -3.102 1.00 0.00 H new ATOM 0 HD13 LEU B 56 8.726 -0.318 -2.884 1.00 0.00 H new ATOM 0 HD21 LEU B 56 6.657 -1.295 -4.947 1.00 0.00 H new ATOM 0 HD22 LEU B 56 7.242 0.384 -4.853 1.00 0.00 H new ATOM 0 HD23 LEU B 56 7.371 -0.519 -6.381 1.00 0.00 H new ATOM 1294 N SER B 57 12.070 0.759 -7.718 1.00 0.00 N ATOM 1295 CA SER B 57 13.164 1.657 -8.074 1.00 0.00 C ATOM 1296 C SER B 57 12.667 2.806 -8.944 1.00 0.00 C ATOM 1297 O SER B 57 13.072 3.952 -8.760 1.00 0.00 O ATOM 1298 CB SER B 57 14.267 0.890 -8.806 1.00 0.00 C ATOM 1299 OG SER B 57 15.322 1.756 -9.188 1.00 0.00 O ATOM 0 H SER B 57 12.254 -0.226 -7.911 1.00 0.00 H new ATOM 0 HA SER B 57 13.570 2.073 -7.152 1.00 0.00 H new ATOM 0 HB2 SER B 57 14.655 0.101 -8.162 1.00 0.00 H new ATOM 0 HB3 SER B 57 13.852 0.405 -9.690 1.00 0.00 H new ATOM 0 HG SER B 57 16.015 1.242 -9.653 1.00 0.00 H new ATOM 1305 N ASP B 58 11.783 2.495 -9.886 1.00 0.00 N ATOM 1306 CA ASP B 58 11.227 3.509 -10.775 1.00 0.00 C ATOM 1307 C ASP B 58 10.313 4.456 -10.002 1.00 0.00 C ATOM 1308 O ASP B 58 10.303 5.664 -10.242 1.00 0.00 O ATOM 1309 CB ASP B 58 10.451 2.851 -11.918 1.00 0.00 C ATOM 1310 CG ASP B 58 9.859 3.868 -12.874 1.00 0.00 C ATOM 1311 OD1 ASP B 58 10.633 4.661 -13.451 1.00 0.00 O ATOM 1312 OD2 ASP B 58 8.622 3.871 -13.046 1.00 0.00 O ATOM 0 H ASP B 58 11.436 1.550 -10.054 1.00 0.00 H new ATOM 0 HA ASP B 58 12.052 4.084 -11.195 1.00 0.00 H new ATOM 0 HB2 ASP B 58 11.115 2.183 -12.467 1.00 0.00 H new ATOM 0 HB3 ASP B 58 9.651 2.236 -11.504 1.00 0.00 H new ATOM 1317 N TYR B 59 9.547 3.892 -9.073 1.00 0.00 N ATOM 1318 CA TYR B 59 8.621 4.667 -8.254 1.00 0.00 C ATOM 1319 C TYR B 59 9.365 5.702 -7.413 1.00 0.00 C ATOM 1320 O TYR B 59 8.810 6.745 -7.066 1.00 0.00 O ATOM 1321 CB TYR B 59 7.811 3.742 -7.338 1.00 0.00 C ATOM 1322 CG TYR B 59 6.875 2.798 -8.069 1.00 0.00 C ATOM 1323 CD1 TYR B 59 7.327 1.995 -9.109 1.00 0.00 C ATOM 1324 CD2 TYR B 59 5.535 2.709 -7.709 1.00 0.00 C ATOM 1325 CE1 TYR B 59 6.473 1.132 -9.770 1.00 0.00 C ATOM 1326 CE2 TYR B 59 4.675 1.848 -8.366 1.00 0.00 C ATOM 1327 CZ TYR B 59 5.149 1.063 -9.394 1.00 0.00 C ATOM 1328 OH TYR B 59 4.295 0.205 -10.049 1.00 0.00 O ATOM 0 H TYR B 59 9.550 2.893 -8.868 1.00 0.00 H new ATOM 0 HA TYR B 59 7.941 5.190 -8.926 1.00 0.00 H new ATOM 0 HB2 TYR B 59 8.502 3.154 -6.734 1.00 0.00 H new ATOM 0 HB3 TYR B 59 7.227 4.353 -6.650 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.364 2.046 -9.406 1.00 0.00 H new ATOM 0 HD2 TYR B 59 5.160 3.322 -6.903 1.00 0.00 H new ATOM 0 HE1 TYR B 59 6.841 0.515 -10.577 1.00 0.00 H new ATOM 0 HE2 TYR B 59 3.637 1.791 -8.074 1.00 0.00 H new ATOM 0 HH TYR B 59 4.299 -0.666 -9.601 1.00 0.00 H new ATOM 1338 N ASN B 60 10.618 5.394 -7.079 1.00 0.00 N ATOM 1339 CA ASN B 60 11.447 6.284 -6.266 1.00 0.00 C ATOM 1340 C ASN B 60 10.912 6.368 -4.840 1.00 0.00 C ATOM 1341 O ASN B 60 10.905 7.437 -4.229 1.00 0.00 O ATOM 1342 CB ASN B 60 11.510 7.688 -6.882 1.00 0.00 C ATOM 1343 CG ASN B 60 12.110 7.705 -8.279 1.00 0.00 C ATOM 1344 OD1 ASN B 60 12.210 8.760 -8.906 1.00 0.00 O ATOM 1345 ND2 ASN B 60 12.515 6.542 -8.776 1.00 0.00 N ATOM 0 H ASN B 60 11.083 4.531 -7.360 1.00 0.00 H new ATOM 0 HA ASN B 60 12.454 5.868 -6.240 1.00 0.00 H new ATOM 0 HB2 ASN B 60 10.504 8.106 -6.921 1.00 0.00 H new ATOM 0 HB3 ASN B 60 12.099 8.336 -6.233 1.00 0.00 H new ATOM 0 HD21 ASN B 60 12.926 6.501 -9.709 1.00 0.00 H new ATOM 0 HD22 ASN B 60 12.415 5.689 -8.225 1.00 0.00 H new ATOM 1352 N ILE B 61 10.461 5.232 -4.317 1.00 0.00 N ATOM 1353 CA ILE B 61 9.921 5.172 -2.965 1.00 0.00 C ATOM 1354 C ILE B 61 11.015 5.359 -1.918 1.00 0.00 C ATOM 1355 O ILE B 61 12.059 4.708 -1.973 1.00 0.00 O ATOM 1356 CB ILE B 61 9.207 3.831 -2.711 1.00 0.00 C ATOM 1357 CG1 ILE B 61 8.087 3.628 -3.735 1.00 0.00 C ATOM 1358 CG2 ILE B 61 8.657 3.783 -1.292 1.00 0.00 C ATOM 1359 CD1 ILE B 61 7.315 2.339 -3.550 1.00 0.00 C ATOM 0 H ILE B 61 10.459 4.340 -4.811 1.00 0.00 H new ATOM 0 HA ILE B 61 9.202 5.986 -2.877 1.00 0.00 H new ATOM 0 HB ILE B 61 9.928 3.021 -2.824 1.00 0.00 H new ATOM 0 HG12 ILE B 61 7.394 4.467 -3.673 1.00 0.00 H new ATOM 0 HG13 ILE B 61 8.516 3.643 -4.737 1.00 0.00 H new ATOM 0 HG21 ILE B 61 8.155 2.829 -1.128 1.00 0.00 H new ATOM 0 HG22 ILE B 61 9.476 3.889 -0.581 1.00 0.00 H new ATOM 0 HG23 ILE B 61 7.945 4.596 -1.150 1.00 0.00 H new ATOM 0 HD11 ILE B 61 6.539 2.267 -4.312 1.00 0.00 H new ATOM 0 HD12 ILE B 61 7.994 1.492 -3.642 1.00 0.00 H new ATOM 0 HD13 ILE B 61 6.855 2.329 -2.562 1.00 0.00 H new ATOM 1371 N GLN B 62 10.763 6.246 -0.960 1.00 0.00 N ATOM 1372 CA GLN B 62 11.718 6.514 0.110 1.00 0.00 C ATOM 1373 C GLN B 62 11.769 5.348 1.094 1.00 0.00 C ATOM 1374 O GLN B 62 10.751 4.715 1.372 1.00 0.00 O ATOM 1375 CB GLN B 62 11.350 7.806 0.844 1.00 0.00 C ATOM 1376 CG GLN B 62 9.959 7.787 1.457 1.00 0.00 C ATOM 1377 CD GLN B 62 9.621 9.080 2.174 1.00 0.00 C ATOM 1378 OE1 GLN B 62 10.310 9.480 3.112 1.00 0.00 O ATOM 1379 NE2 GLN B 62 8.556 9.740 1.734 1.00 0.00 N ATOM 0 H GLN B 62 9.904 6.792 -0.903 1.00 0.00 H new ATOM 0 HA GLN B 62 12.705 6.633 -0.338 1.00 0.00 H new ATOM 0 HB2 GLN B 62 12.082 7.987 1.631 1.00 0.00 H new ATOM 0 HB3 GLN B 62 11.419 8.641 0.147 1.00 0.00 H new ATOM 0 HG2 GLN B 62 9.223 7.607 0.673 1.00 0.00 H new ATOM 0 HG3 GLN B 62 9.887 6.957 2.159 1.00 0.00 H new ATOM 0 HE21 GLN B 62 8.014 9.371 0.953 1.00 0.00 H new ATOM 0 HE22 GLN B 62 8.280 10.616 2.177 1.00 0.00 H new ATOM 1388 N LYS B 63 12.961 5.067 1.614 1.00 0.00 N ATOM 1389 CA LYS B 63 13.142 3.974 2.565 1.00 0.00 C ATOM 1390 C LYS B 63 12.238 4.153 3.783 1.00 0.00 C ATOM 1391 O LYS B 63 11.989 5.277 4.221 1.00 0.00 O ATOM 1392 CB LYS B 63 14.606 3.886 3.004 1.00 0.00 C ATOM 1393 CG LYS B 63 15.104 5.124 3.732 1.00 0.00 C ATOM 1394 CD LYS B 63 16.564 4.984 4.131 1.00 0.00 C ATOM 1395 CE LYS B 63 17.045 6.192 4.918 1.00 0.00 C ATOM 1396 NZ LYS B 63 16.295 6.356 6.194 1.00 0.00 N ATOM 0 H LYS B 63 13.815 5.580 1.393 1.00 0.00 H new ATOM 0 HA LYS B 63 12.866 3.045 2.067 1.00 0.00 H new ATOM 0 HB2 LYS B 63 14.729 3.020 3.654 1.00 0.00 H new ATOM 0 HB3 LYS B 63 15.229 3.717 2.126 1.00 0.00 H new ATOM 0 HG2 LYS B 63 14.983 5.998 3.092 1.00 0.00 H new ATOM 0 HG3 LYS B 63 14.497 5.294 4.621 1.00 0.00 H new ATOM 0 HD2 LYS B 63 16.694 4.083 4.730 1.00 0.00 H new ATOM 0 HD3 LYS B 63 17.176 4.863 3.237 1.00 0.00 H new ATOM 0 HE2 LYS B 63 18.108 6.086 5.133 1.00 0.00 H new ATOM 0 HE3 LYS B 63 16.930 7.090 4.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 16.805 7.018 6.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 15.346 6.731 5.993 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 16.210 5.434 6.668 1.00 0.00 H new ATOM 1410 N GLU B 64 11.743 3.037 4.318 1.00 0.00 N ATOM 1411 CA GLU B 64 10.858 3.064 5.481 1.00 0.00 C ATOM 1412 C GLU B 64 9.577 3.829 5.164 1.00 0.00 C ATOM 1413 O GLU B 64 9.069 4.586 5.992 1.00 0.00 O ATOM 1414 CB GLU B 64 11.565 3.697 6.683 1.00 0.00 C ATOM 1415 CG GLU B 64 12.836 2.970 7.095 1.00 0.00 C ATOM 1416 CD GLU B 64 13.526 3.622 8.278 1.00 0.00 C ATOM 1417 OE1 GLU B 64 13.012 4.645 8.777 1.00 0.00 O ATOM 1418 OE2 GLU B 64 14.582 3.109 8.705 1.00 0.00 O ATOM 0 H GLU B 64 11.941 2.101 3.963 1.00 0.00 H new ATOM 0 HA GLU B 64 10.597 2.036 5.732 1.00 0.00 H new ATOM 0 HB2 GLU B 64 11.809 4.732 6.446 1.00 0.00 H new ATOM 0 HB3 GLU B 64 10.878 3.717 7.529 1.00 0.00 H new ATOM 0 HG2 GLU B 64 12.594 1.937 7.345 1.00 0.00 H new ATOM 0 HG3 GLU B 64 13.523 2.941 6.250 1.00 0.00 H new ATOM 1425 N SER B 65 9.061 3.623 3.956 1.00 0.00 N ATOM 1426 CA SER B 65 7.840 4.287 3.517 1.00 0.00 C ATOM 1427 C SER B 65 6.604 3.584 4.063 1.00 0.00 C ATOM 1428 O SER B 65 6.518 2.355 4.048 1.00 0.00 O ATOM 1429 CB SER B 65 7.776 4.323 1.991 1.00 0.00 C ATOM 1430 OG SER B 65 7.750 3.012 1.453 1.00 0.00 O ATOM 0 H SER B 65 9.472 2.999 3.262 1.00 0.00 H new ATOM 0 HA SER B 65 7.858 5.306 3.904 1.00 0.00 H new ATOM 0 HB2 SER B 65 6.887 4.868 1.673 1.00 0.00 H new ATOM 0 HB3 SER B 65 8.638 4.864 1.600 1.00 0.00 H new ATOM 0 HG SER B 65 7.620 2.364 2.177 1.00 0.00 H new ATOM 1436 N THR B 66 5.644 4.372 4.535 1.00 0.00 N ATOM 1437 CA THR B 66 4.404 3.829 5.072 1.00 0.00 C ATOM 1438 C THR B 66 3.335 3.757 3.985 1.00 0.00 C ATOM 1439 O THR B 66 3.012 4.763 3.354 1.00 0.00 O ATOM 1440 CB THR B 66 3.882 4.682 6.244 1.00 0.00 C ATOM 1441 OG1 THR B 66 4.855 4.720 7.295 1.00 0.00 O ATOM 1442 CG2 THR B 66 2.574 4.124 6.781 1.00 0.00 C ATOM 0 H THR B 66 5.702 5.390 4.556 1.00 0.00 H new ATOM 0 HA THR B 66 4.618 2.825 5.438 1.00 0.00 H new ATOM 0 HB THR B 66 3.704 5.692 5.876 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.516 5.266 8.035 1.00 0.00 H new ATOM 0 HG21 THR B 66 2.226 4.744 7.608 1.00 0.00 H new ATOM 0 HG22 THR B 66 1.826 4.123 5.988 1.00 0.00 H new ATOM 0 HG23 THR B 66 2.731 3.104 7.133 1.00 0.00 H new ATOM 1450 N LEU B 67 2.791 2.562 3.768 1.00 0.00 N ATOM 1451 CA LEU B 67 1.760 2.366 2.751 1.00 0.00 C ATOM 1452 C LEU B 67 0.413 2.040 3.387 1.00 0.00 C ATOM 1453 O LEU B 67 0.314 1.153 4.235 1.00 0.00 O ATOM 1454 CB LEU B 67 2.160 1.245 1.785 1.00 0.00 C ATOM 1455 CG LEU B 67 3.317 1.569 0.832 1.00 0.00 C ATOM 1456 CD1 LEU B 67 4.617 1.769 1.596 1.00 0.00 C ATOM 1457 CD2 LEU B 67 3.474 0.465 -0.202 1.00 0.00 C ATOM 0 H LEU B 67 3.045 1.717 4.280 1.00 0.00 H new ATOM 0 HA LEU B 67 1.664 3.299 2.196 1.00 0.00 H new ATOM 0 HB2 LEU B 67 2.431 0.366 2.370 1.00 0.00 H new ATOM 0 HB3 LEU B 67 1.288 0.975 1.189 1.00 0.00 H new ATOM 0 HG LEU B 67 3.082 2.501 0.319 1.00 0.00 H new ATOM 0 HD11 LEU B 67 5.420 1.997 0.895 1.00 0.00 H new ATOM 0 HD12 LEU B 67 4.503 2.595 2.298 1.00 0.00 H new ATOM 0 HD13 LEU B 67 4.861 0.858 2.143 1.00 0.00 H new ATOM 0 HD21 LEU B 67 4.299 0.708 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU B 67 3.682 -0.479 0.302 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.554 0.373 -0.779 1.00 0.00 H new ATOM 1469 N HIS B 68 -0.624 2.757 2.965 1.00 0.00 N ATOM 1470 CA HIS B 68 -1.969 2.539 3.486 1.00 0.00 C ATOM 1471 C HIS B 68 -2.594 1.293 2.864 1.00 0.00 C ATOM 1472 O HIS B 68 -2.605 1.136 1.643 1.00 0.00 O ATOM 1473 CB HIS B 68 -2.847 3.761 3.212 1.00 0.00 C ATOM 1474 CG HIS B 68 -2.317 5.023 3.820 1.00 0.00 C ATOM 1475 ND1 HIS B 68 -2.141 5.190 5.177 1.00 0.00 N ATOM 1476 CD2 HIS B 68 -1.916 6.183 3.246 1.00 0.00 C ATOM 1477 CE1 HIS B 68 -1.657 6.398 5.412 1.00 0.00 C ATOM 1478 NE2 HIS B 68 -1.511 7.020 4.256 1.00 0.00 N ATOM 0 H HIS B 68 -0.558 3.494 2.263 1.00 0.00 H new ATOM 0 HA HIS B 68 -1.899 2.388 4.563 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -2.941 3.897 2.135 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -3.849 3.573 3.598 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -1.915 6.408 2.190 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -1.421 6.806 6.384 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -1.155 7.968 4.134 1.00 0.00 H new ATOM 1487 N LEU B 69 -3.106 0.408 3.714 1.00 0.00 N ATOM 1488 CA LEU B 69 -3.727 -0.829 3.251 1.00 0.00 C ATOM 1489 C LEU B 69 -5.250 -0.729 3.317 1.00 0.00 C ATOM 1490 O LEU B 69 -5.808 -0.252 4.306 1.00 0.00 O ATOM 1491 CB LEU B 69 -3.225 -2.009 4.098 1.00 0.00 C ATOM 1492 CG LEU B 69 -3.601 -3.408 3.593 1.00 0.00 C ATOM 1493 CD1 LEU B 69 -2.732 -4.459 4.266 1.00 0.00 C ATOM 1494 CD2 LEU B 69 -5.070 -3.708 3.853 1.00 0.00 C ATOM 0 H LEU B 69 -3.103 0.524 4.727 1.00 0.00 H new ATOM 0 HA LEU B 69 -3.448 -0.995 2.211 1.00 0.00 H new ATOM 0 HB2 LEU B 69 -2.139 -1.948 4.163 1.00 0.00 H new ATOM 0 HB3 LEU B 69 -3.612 -1.894 5.111 1.00 0.00 H new ATOM 0 HG LEU B 69 -3.431 -3.435 2.517 1.00 0.00 H new ATOM 0 HD11 LEU B 69 -3.008 -5.448 3.900 1.00 0.00 H new ATOM 0 HD12 LEU B 69 -1.684 -4.266 4.036 1.00 0.00 H new ATOM 0 HD13 LEU B 69 -2.880 -4.417 5.345 1.00 0.00 H new ATOM 0 HD21 LEU B 69 -5.308 -4.706 3.485 1.00 0.00 H new ATOM 0 HD22 LEU B 69 -5.267 -3.660 4.924 1.00 0.00 H new ATOM 0 HD23 LEU B 69 -5.688 -2.974 3.337 1.00 0.00 H new ATOM 1506 N VAL B 70 -5.916 -1.194 2.262 1.00 0.00 N ATOM 1507 CA VAL B 70 -7.374 -1.171 2.201 1.00 0.00 C ATOM 1508 C VAL B 70 -7.906 -2.526 1.749 1.00 0.00 C ATOM 1509 O VAL B 70 -7.455 -3.074 0.742 1.00 0.00 O ATOM 1510 CB VAL B 70 -7.891 -0.084 1.235 1.00 0.00 C ATOM 1511 CG1 VAL B 70 -9.413 -0.005 1.273 1.00 0.00 C ATOM 1512 CG2 VAL B 70 -7.277 1.268 1.562 1.00 0.00 C ATOM 0 H VAL B 70 -5.467 -1.592 1.437 1.00 0.00 H new ATOM 0 HA VAL B 70 -7.733 -0.943 3.205 1.00 0.00 H new ATOM 0 HB VAL B 70 -7.588 -0.360 0.225 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -9.755 0.768 0.584 1.00 0.00 H new ATOM 0 HG12 VAL B 70 -9.835 -0.966 0.978 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -9.740 0.240 2.284 1.00 0.00 H new ATOM 0 HG21 VAL B 70 -7.657 2.018 0.868 1.00 0.00 H new ATOM 0 HG22 VAL B 70 -7.541 1.551 2.581 1.00 0.00 H new ATOM 0 HG23 VAL B 70 -6.192 1.206 1.472 1.00 0.00 H new ATOM 1522 N LEU B 71 -8.860 -3.065 2.501 1.00 0.00 N ATOM 1523 CA LEU B 71 -9.448 -4.360 2.176 1.00 0.00 C ATOM 1524 C LEU B 71 -10.393 -4.249 0.985 1.00 0.00 C ATOM 1525 O LEU B 71 -11.279 -3.395 0.960 1.00 0.00 O ATOM 1526 CB LEU B 71 -10.200 -4.935 3.382 1.00 0.00 C ATOM 1527 CG LEU B 71 -9.332 -5.352 4.576 1.00 0.00 C ATOM 1528 CD1 LEU B 71 -8.282 -6.368 4.151 1.00 0.00 C ATOM 1529 CD2 LEU B 71 -8.675 -4.140 5.222 1.00 0.00 C ATOM 0 H LEU B 71 -9.242 -2.626 3.339 1.00 0.00 H new ATOM 0 HA LEU B 71 -8.633 -5.034 1.913 1.00 0.00 H new ATOM 0 HB2 LEU B 71 -10.921 -4.193 3.724 1.00 0.00 H new ATOM 0 HB3 LEU B 71 -10.769 -5.803 3.050 1.00 0.00 H new ATOM 0 HG LEU B 71 -9.981 -5.820 5.316 1.00 0.00 H new ATOM 0 HD11 LEU B 71 -7.678 -6.649 5.014 1.00 0.00 H new ATOM 0 HD12 LEU B 71 -8.774 -7.253 3.748 1.00 0.00 H new ATOM 0 HD13 LEU B 71 -7.641 -5.930 3.386 1.00 0.00 H new ATOM 0 HD21 LEU B 71 -8.065 -4.463 6.066 1.00 0.00 H new ATOM 0 HD22 LEU B 71 -8.044 -3.635 4.491 1.00 0.00 H new ATOM 0 HD23 LEU B 71 -9.445 -3.453 5.573 1.00 0.00 H new ATOM 1541 N ARG B 72 -10.201 -5.125 0.005 1.00 0.00 N ATOM 1542 CA ARG B 72 -11.039 -5.138 -1.189 1.00 0.00 C ATOM 1543 C ARG B 72 -12.468 -5.542 -0.837 1.00 0.00 C ATOM 1544 O ARG B 72 -12.685 -6.408 0.011 1.00 0.00 O ATOM 1545 CB ARG B 72 -10.468 -6.104 -2.229 1.00 0.00 C ATOM 1546 CG ARG B 72 -11.213 -6.086 -3.555 1.00 0.00 C ATOM 1547 CD ARG B 72 -11.029 -4.761 -4.278 1.00 0.00 C ATOM 1548 NE ARG B 72 -11.725 -4.732 -5.563 1.00 0.00 N ATOM 1549 CZ ARG B 72 -13.049 -4.782 -5.692 1.00 0.00 C ATOM 1550 NH1 ARG B 72 -13.824 -4.845 -4.617 1.00 0.00 N ATOM 1551 NH2 ARG B 72 -13.599 -4.762 -6.899 1.00 0.00 N ATOM 0 H ARG B 72 -9.471 -5.837 0.014 1.00 0.00 H new ATOM 0 HA ARG B 72 -11.052 -4.132 -1.608 1.00 0.00 H new ATOM 0 HB2 ARG B 72 -9.422 -5.855 -2.407 1.00 0.00 H new ATOM 0 HB3 ARG B 72 -10.491 -7.115 -1.823 1.00 0.00 H new ATOM 0 HG2 ARG B 72 -10.855 -6.899 -4.186 1.00 0.00 H new ATOM 0 HG3 ARG B 72 -12.274 -6.262 -3.380 1.00 0.00 H new ATOM 0 HD2 ARG B 72 -11.398 -3.951 -3.649 1.00 0.00 H new ATOM 0 HD3 ARG B 72 -9.966 -4.581 -4.438 1.00 0.00 H new ATOM 0 HE ARG B 72 -11.163 -4.670 -6.412 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -13.406 -4.855 -3.687 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -14.838 -4.883 -4.721 1.00 0.00 H new ATOM 0 HH21 ARG B 72 -13.007 -4.708 -7.728 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -14.613 -4.800 -6.998 1.00 0.00 H new