USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 582 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 194 LYS NZ :NH3+ -118:sc= 0 (180deg=-0.205) USER MOD Set 1.2: B 197 GLN : amide:sc= -0.63 K(o=-0.63,f=-0.13) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.869 K(o=-0.87,f=-0.27) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -162:sc=-0.00212 (180deg=-0.366) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ -162:sc= 1.03 (180deg=0.702) USER MOD Single : A 84 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.017) USER MOD Single : A 85 GLN : amide:sc= -0.259 X(o=-0.26,f=-0.049) USER MOD Single : A 89 GLN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : B 168 SER OG : rot 180:sc= 0 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 175 ASN : amide:sc= -0.107 K(o=-0.11,f=-1.3!) USER MOD Single : B 176 MET CE :methyl -167:sc= -9.87! (180deg=-10.8!) USER MOD Single : B 184 THR OG1 : rot 88:sc= -0.408 USER MOD Single : B 185 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 188 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.23) USER MOD Single : B 189 GLN : amide:sc= -0.325 X(o=-0.32,f=0) USER MOD Single : B 191 SER OG : rot 180:sc= 0 USER MOD Single : B 192 LYS NZ :NH3+ 146:sc= 0 (180deg=-0.0194) USER MOD Single : B 195 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.0221) USER MOD Single : B 196 LYS NZ :NH3+ 160:sc= -2.24! (180deg=-3.27!) USER MOD Single : B 198 GLN : amide:sc= -0.339 X(o=-0.34,f=-0.055) USER MOD Single : B 199 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 0.687 -18.171 2.772 1.00 0.00 N ATOM 162 CA LEU A 62 0.269 -17.241 1.679 1.00 0.00 C ATOM 163 C LEU A 62 -1.059 -16.570 2.038 1.00 0.00 C ATOM 164 O LEU A 62 -1.335 -15.461 1.621 1.00 0.00 O ATOM 165 CB LEU A 62 0.106 -18.124 0.438 1.00 0.00 C ATOM 166 CG LEU A 62 0.648 -17.392 -0.790 1.00 0.00 C ATOM 167 CD1 LEU A 62 1.264 -18.406 -1.758 1.00 0.00 C ATOM 168 CD2 LEU A 62 -0.495 -16.651 -1.487 1.00 0.00 C ATOM 0 HA LEU A 62 0.996 -16.445 1.516 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.638 -19.065 0.577 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.945 -18.371 0.291 1.00 0.00 H new ATOM 0 HG LEU A 62 1.410 -16.677 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.651 -17.885 -2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 62 2.078 -18.935 -1.262 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.503 -19.122 -2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.110 -16.129 -2.363 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.257 -17.366 -1.797 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.934 -15.929 -0.798 1.00 0.00 H new ATOM 180 N GLU A 63 -1.880 -17.236 2.810 1.00 0.00 N ATOM 181 CA GLU A 63 -3.195 -16.642 3.202 1.00 0.00 C ATOM 182 C GLU A 63 -2.983 -15.524 4.224 1.00 0.00 C ATOM 183 O GLU A 63 -3.710 -14.548 4.248 1.00 0.00 O ATOM 184 CB GLU A 63 -3.990 -17.794 3.821 1.00 0.00 C ATOM 185 CG GLU A 63 -4.463 -18.740 2.716 1.00 0.00 C ATOM 186 CD GLU A 63 -5.704 -19.498 3.188 1.00 0.00 C ATOM 187 OE1 GLU A 63 -5.572 -20.303 4.096 1.00 0.00 O ATOM 188 OE2 GLU A 63 -6.766 -19.261 2.636 1.00 0.00 O ATOM 0 H GLU A 63 -1.697 -18.166 3.186 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.718 -16.203 2.352 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.370 -18.335 4.536 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.846 -17.404 4.372 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.691 -18.175 1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.670 -19.443 2.461 1.00 0.00 H new ATOM 195 N GLU A 64 -1.990 -15.660 5.062 1.00 0.00 N ATOM 196 CA GLU A 64 -1.718 -14.605 6.086 1.00 0.00 C ATOM 197 C GLU A 64 -1.050 -13.399 5.426 1.00 0.00 C ATOM 198 O GLU A 64 -1.217 -12.273 5.857 1.00 0.00 O ATOM 199 CB GLU A 64 -0.773 -15.259 7.097 1.00 0.00 C ATOM 200 CG GLU A 64 -0.855 -14.513 8.429 1.00 0.00 C ATOM 201 CD GLU A 64 -0.677 -15.503 9.582 1.00 0.00 C ATOM 202 OE1 GLU A 64 0.304 -16.228 9.566 1.00 0.00 O ATOM 203 OE2 GLU A 64 -1.523 -15.520 10.460 1.00 0.00 O ATOM 0 H GLU A 64 -1.354 -16.457 5.083 1.00 0.00 H new ATOM 0 HA GLU A 64 -2.630 -14.246 6.563 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.042 -16.306 7.237 1.00 0.00 H new ATOM 0 HB3 GLU A 64 0.250 -15.240 6.720 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -0.084 -13.743 8.475 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.817 -14.007 8.516 1.00 0.00 H new ATOM 210 N THR A 65 -0.301 -13.629 4.379 1.00 0.00 N ATOM 211 CA THR A 65 0.378 -12.500 3.675 1.00 0.00 C ATOM 212 C THR A 65 -0.637 -11.728 2.831 1.00 0.00 C ATOM 213 O THR A 65 -0.501 -10.538 2.616 1.00 0.00 O ATOM 214 CB THR A 65 1.432 -13.158 2.781 1.00 0.00 C ATOM 215 OG1 THR A 65 2.306 -13.943 3.581 1.00 0.00 O ATOM 216 CG2 THR A 65 2.236 -12.080 2.052 1.00 0.00 C ATOM 0 H THR A 65 -0.130 -14.552 3.980 1.00 0.00 H new ATOM 0 HA THR A 65 0.827 -11.789 4.369 1.00 0.00 H new ATOM 0 HB THR A 65 0.938 -13.795 2.048 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.980 -14.366 3.010 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.985 -12.552 1.417 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.566 -11.479 1.437 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.731 -11.439 2.782 1.00 0.00 H new ATOM 224 N LYS A 66 -1.658 -12.398 2.358 1.00 0.00 N ATOM 225 CA LYS A 66 -2.694 -11.709 1.531 1.00 0.00 C ATOM 226 C LYS A 66 -3.580 -10.831 2.419 1.00 0.00 C ATOM 227 O LYS A 66 -4.141 -9.850 1.969 1.00 0.00 O ATOM 228 CB LYS A 66 -3.516 -12.833 0.895 1.00 0.00 C ATOM 229 CG LYS A 66 -3.011 -13.098 -0.525 1.00 0.00 C ATOM 230 CD LYS A 66 -3.329 -11.892 -1.412 1.00 0.00 C ATOM 231 CE LYS A 66 -3.193 -12.290 -2.884 1.00 0.00 C ATOM 232 NZ LYS A 66 -4.578 -12.614 -3.324 1.00 0.00 N ATOM 0 H LYS A 66 -1.818 -13.394 2.509 1.00 0.00 H new ATOM 0 HA LYS A 66 -2.251 -11.057 0.778 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.437 -13.739 1.495 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.570 -12.558 0.871 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.936 -13.281 -0.512 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -3.482 -13.994 -0.929 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -4.340 -11.537 -1.212 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -2.651 -11.070 -1.183 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.771 -11.478 -3.475 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -2.531 -13.148 -3.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.567 -12.896 -4.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -4.951 -13.395 -2.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -5.184 -11.777 -3.207 1.00 0.00 H new ATOM 246 N GLU A 67 -3.708 -11.179 3.676 1.00 0.00 N ATOM 247 CA GLU A 67 -4.559 -10.365 4.597 1.00 0.00 C ATOM 248 C GLU A 67 -3.841 -9.066 4.967 1.00 0.00 C ATOM 249 O GLU A 67 -4.464 -8.039 5.158 1.00 0.00 O ATOM 250 CB GLU A 67 -4.762 -11.239 5.836 1.00 0.00 C ATOM 251 CG GLU A 67 -5.904 -12.225 5.584 1.00 0.00 C ATOM 252 CD GLU A 67 -7.244 -11.494 5.697 1.00 0.00 C ATOM 253 OE1 GLU A 67 -7.616 -10.830 4.743 1.00 0.00 O ATOM 254 OE2 GLU A 67 -7.875 -11.611 6.734 1.00 0.00 O ATOM 0 H GLU A 67 -3.261 -11.990 4.103 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.508 -10.086 4.140 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -3.844 -11.780 6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.990 -10.615 6.700 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.803 -12.670 4.594 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.861 -13.040 6.306 1.00 0.00 H new ATOM 261 N GLN A 68 -2.537 -9.106 5.063 1.00 0.00 N ATOM 262 CA GLN A 68 -1.773 -7.871 5.415 1.00 0.00 C ATOM 263 C GLN A 68 -1.690 -6.952 4.197 1.00 0.00 C ATOM 264 O GLN A 68 -1.769 -5.743 4.312 1.00 0.00 O ATOM 265 CB GLN A 68 -0.382 -8.359 5.821 1.00 0.00 C ATOM 266 CG GLN A 68 0.470 -7.167 6.264 1.00 0.00 C ATOM 267 CD GLN A 68 -0.112 -6.571 7.547 1.00 0.00 C ATOM 268 OE1 GLN A 68 0.276 -6.947 8.636 1.00 0.00 O ATOM 269 NE2 GLN A 68 -1.032 -5.650 7.464 1.00 0.00 N ATOM 0 H GLN A 68 -1.968 -9.939 4.913 1.00 0.00 H new ATOM 0 HA GLN A 68 -2.246 -7.303 6.216 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.462 -9.083 6.632 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.095 -8.869 4.984 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.499 -7.485 6.432 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.494 -6.412 5.478 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -1.357 -5.335 6.550 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -1.426 -5.245 8.313 1.00 0.00 H new ATOM 278 N ILE A 69 -1.543 -7.523 3.031 1.00 0.00 N ATOM 279 CA ILE A 69 -1.467 -6.695 1.790 1.00 0.00 C ATOM 280 C ILE A 69 -2.853 -6.128 1.464 1.00 0.00 C ATOM 281 O ILE A 69 -2.976 -5.087 0.847 1.00 0.00 O ATOM 282 CB ILE A 69 -0.991 -7.653 0.693 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.386 -8.208 1.066 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.886 -6.904 -0.638 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.727 -9.390 0.158 1.00 0.00 C ATOM 0 H ILE A 69 -1.472 -8.530 2.883 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.791 -5.846 1.893 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.706 -8.470 0.595 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.142 -7.429 0.965 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.391 -8.525 2.109 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.547 -7.589 -1.415 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.863 -6.503 -0.908 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -0.173 -6.086 -0.540 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.708 -9.783 0.426 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.023 -10.171 0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.740 -9.059 -0.881 1.00 0.00 H new ATOM 297 N LEU A 70 -3.895 -6.804 1.883 1.00 0.00 N ATOM 298 CA LEU A 70 -5.277 -6.302 1.607 1.00 0.00 C ATOM 299 C LEU A 70 -5.573 -5.090 2.493 1.00 0.00 C ATOM 300 O LEU A 70 -6.228 -4.154 2.077 1.00 0.00 O ATOM 301 CB LEU A 70 -6.210 -7.467 1.957 1.00 0.00 C ATOM 302 CG LEU A 70 -6.720 -8.124 0.672 1.00 0.00 C ATOM 303 CD1 LEU A 70 -7.434 -9.432 1.014 1.00 0.00 C ATOM 304 CD2 LEU A 70 -7.699 -7.178 -0.026 1.00 0.00 C ATOM 0 H LEU A 70 -3.848 -7.680 2.403 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.404 -5.985 0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.680 -8.200 2.566 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.050 -7.107 2.551 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.878 -8.333 0.012 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.797 -9.899 0.098 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.739 -10.106 1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.276 -9.225 1.674 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.064 -7.643 -0.942 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.540 -6.971 0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.192 -6.245 -0.270 1.00 0.00 H new ATOM 316 N LYS A 71 -5.086 -5.101 3.711 1.00 0.00 N ATOM 317 CA LYS A 71 -5.330 -3.945 4.626 1.00 0.00 C ATOM 318 C LYS A 71 -4.518 -2.736 4.158 1.00 0.00 C ATOM 319 O LYS A 71 -4.922 -1.602 4.329 1.00 0.00 O ATOM 320 CB LYS A 71 -4.853 -4.412 6.003 1.00 0.00 C ATOM 321 CG LYS A 71 -5.176 -3.339 7.045 1.00 0.00 C ATOM 322 CD LYS A 71 -5.515 -4.008 8.379 1.00 0.00 C ATOM 323 CE LYS A 71 -6.563 -3.173 9.118 1.00 0.00 C ATOM 324 NZ LYS A 71 -7.355 -4.159 9.904 1.00 0.00 N ATOM 0 H LYS A 71 -4.532 -5.859 4.109 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.378 -3.645 4.645 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -5.339 -5.351 6.269 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -3.780 -4.603 5.983 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -4.325 -2.669 7.168 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.015 -2.730 6.708 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.893 -5.016 8.207 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -4.616 -4.105 8.988 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.093 -2.435 9.769 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.196 -2.625 8.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.095 -3.662 10.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.796 -4.844 9.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.728 -4.660 10.565 1.00 0.00 H new ATOM 338 N LEU A 72 -3.379 -2.979 3.562 1.00 0.00 N ATOM 339 CA LEU A 72 -2.531 -1.852 3.069 1.00 0.00 C ATOM 340 C LEU A 72 -3.211 -1.173 1.879 1.00 0.00 C ATOM 341 O LEU A 72 -3.056 0.014 1.659 1.00 0.00 O ATOM 342 CB LEU A 72 -1.211 -2.498 2.635 1.00 0.00 C ATOM 343 CG LEU A 72 -0.149 -2.275 3.715 1.00 0.00 C ATOM 344 CD1 LEU A 72 1.097 -3.099 3.384 1.00 0.00 C ATOM 345 CD2 LEU A 72 0.222 -0.790 3.764 1.00 0.00 C ATOM 0 H LEU A 72 -2.999 -3.911 3.395 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.374 -1.089 3.831 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.355 -3.565 2.468 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.878 -2.069 1.690 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.544 -2.585 4.682 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.853 -2.940 4.153 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.835 -4.156 3.346 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.492 -2.788 2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.978 -0.629 4.532 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.617 -0.482 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.665 -0.201 3.998 1.00 0.00 H new ATOM 357 N GLU A 73 -3.966 -1.920 1.113 1.00 0.00 N ATOM 358 CA GLU A 73 -4.665 -1.325 -0.066 1.00 0.00 C ATOM 359 C GLU A 73 -5.770 -0.380 0.408 1.00 0.00 C ATOM 360 O GLU A 73 -6.077 0.604 -0.241 1.00 0.00 O ATOM 361 CB GLU A 73 -5.262 -2.511 -0.827 1.00 0.00 C ATOM 362 CG GLU A 73 -5.154 -2.260 -2.332 1.00 0.00 C ATOM 363 CD GLU A 73 -5.554 -3.527 -3.091 1.00 0.00 C ATOM 364 OE1 GLU A 73 -6.628 -4.038 -2.826 1.00 0.00 O ATOM 365 OE2 GLU A 73 -4.777 -3.963 -3.924 1.00 0.00 O ATOM 0 H GLU A 73 -4.128 -2.917 1.254 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.991 -0.744 -0.695 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -4.736 -3.428 -0.562 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.306 -2.649 -0.545 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.800 -1.431 -2.620 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.135 -1.974 -2.592 1.00 0.00 H new ATOM 372 N GLU A 74 -6.361 -0.667 1.538 1.00 0.00 N ATOM 373 CA GLU A 74 -7.443 0.216 2.068 1.00 0.00 C ATOM 374 C GLU A 74 -6.825 1.464 2.697 1.00 0.00 C ATOM 375 O GLU A 74 -7.394 2.539 2.655 1.00 0.00 O ATOM 376 CB GLU A 74 -8.164 -0.620 3.128 1.00 0.00 C ATOM 377 CG GLU A 74 -9.458 -1.189 2.542 1.00 0.00 C ATOM 378 CD GLU A 74 -9.125 -2.321 1.571 1.00 0.00 C ATOM 379 OE1 GLU A 74 -8.365 -2.079 0.647 1.00 0.00 O ATOM 380 OE2 GLU A 74 -9.636 -3.412 1.765 1.00 0.00 O ATOM 0 H GLU A 74 -6.141 -1.476 2.118 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.127 0.550 1.288 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.519 -1.431 3.466 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.387 -0.005 4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.100 -1.559 3.342 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.012 -0.404 2.026 1.00 0.00 H new ATOM 387 N LYS A 75 -5.659 1.326 3.272 1.00 0.00 N ATOM 388 CA LYS A 75 -4.983 2.499 3.902 1.00 0.00 C ATOM 389 C LYS A 75 -4.385 3.392 2.813 1.00 0.00 C ATOM 390 O LYS A 75 -4.335 4.600 2.948 1.00 0.00 O ATOM 391 CB LYS A 75 -3.880 1.904 4.782 1.00 0.00 C ATOM 392 CG LYS A 75 -3.827 2.653 6.115 1.00 0.00 C ATOM 393 CD LYS A 75 -5.033 2.259 6.971 1.00 0.00 C ATOM 394 CE LYS A 75 -5.217 3.280 8.096 1.00 0.00 C ATOM 395 NZ LYS A 75 -4.030 3.097 8.978 1.00 0.00 N ATOM 0 H LYS A 75 -5.144 0.448 3.333 1.00 0.00 H new ATOM 0 HA LYS A 75 -5.669 3.114 4.484 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -4.071 0.845 4.956 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.918 1.975 4.275 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.902 2.416 6.641 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.828 3.729 5.940 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.931 2.216 6.355 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -4.885 1.264 7.390 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.265 4.296 7.704 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -6.145 3.105 8.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.219 3.523 9.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.837 2.082 9.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.203 3.559 8.548 1.00 0.00 H new ATOM 409 N LEU A 76 -3.939 2.802 1.733 1.00 0.00 N ATOM 410 CA LEU A 76 -3.351 3.609 0.623 1.00 0.00 C ATOM 411 C LEU A 76 -4.466 4.316 -0.148 1.00 0.00 C ATOM 412 O LEU A 76 -4.276 5.390 -0.688 1.00 0.00 O ATOM 413 CB LEU A 76 -2.631 2.600 -0.274 1.00 0.00 C ATOM 414 CG LEU A 76 -1.906 3.341 -1.398 1.00 0.00 C ATOM 415 CD1 LEU A 76 -0.592 3.917 -0.864 1.00 0.00 C ATOM 416 CD2 LEU A 76 -1.607 2.368 -2.540 1.00 0.00 C ATOM 0 H LEU A 76 -3.957 1.795 1.573 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.670 4.379 0.985 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -1.918 2.020 0.312 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.348 1.894 -0.693 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.537 4.151 -1.765 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.074 4.445 -1.665 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -0.803 4.610 -0.049 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.038 3.107 -0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.090 2.896 -3.342 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.976 1.559 -2.173 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.541 1.956 -2.921 1.00 0.00 H new ATOM 428 N LEU A 77 -5.631 3.720 -0.194 1.00 0.00 N ATOM 429 CA LEU A 77 -6.773 4.353 -0.920 1.00 0.00 C ATOM 430 C LEU A 77 -7.336 5.505 -0.090 1.00 0.00 C ATOM 431 O LEU A 77 -7.744 6.522 -0.619 1.00 0.00 O ATOM 432 CB LEU A 77 -7.813 3.244 -1.082 1.00 0.00 C ATOM 433 CG LEU A 77 -8.642 3.501 -2.341 1.00 0.00 C ATOM 434 CD1 LEU A 77 -9.359 2.215 -2.754 1.00 0.00 C ATOM 435 CD2 LEU A 77 -9.678 4.591 -2.055 1.00 0.00 C ATOM 0 H LEU A 77 -5.840 2.821 0.241 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.476 4.765 -1.884 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.319 2.275 -1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.462 3.209 -0.207 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.984 3.825 -3.148 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.949 2.400 -3.651 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.623 1.437 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -10.016 1.890 -1.948 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -10.270 4.775 -2.952 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -10.334 4.266 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.169 5.509 -1.762 1.00 0.00 H new ATOM 447 N ALA A 78 -7.353 5.352 1.209 1.00 0.00 N ATOM 448 CA ALA A 78 -7.880 6.440 2.088 1.00 0.00 C ATOM 449 C ALA A 78 -6.908 7.620 2.088 1.00 0.00 C ATOM 450 O ALA A 78 -7.304 8.763 2.225 1.00 0.00 O ATOM 451 CB ALA A 78 -7.976 5.824 3.485 1.00 0.00 C ATOM 0 H ALA A 78 -7.025 4.520 1.700 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.846 6.814 1.749 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -8.357 6.568 4.185 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.652 4.969 3.460 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.988 5.496 3.807 1.00 0.00 H new ATOM 457 N LEU A 79 -5.639 7.347 1.927 1.00 0.00 N ATOM 458 CA LEU A 79 -4.627 8.448 1.907 1.00 0.00 C ATOM 459 C LEU A 79 -4.794 9.279 0.634 1.00 0.00 C ATOM 460 O LEU A 79 -4.651 10.488 0.649 1.00 0.00 O ATOM 461 CB LEU A 79 -3.266 7.745 1.922 1.00 0.00 C ATOM 462 CG LEU A 79 -2.262 8.577 2.726 1.00 0.00 C ATOM 463 CD1 LEU A 79 -2.706 8.660 4.195 1.00 0.00 C ATOM 464 CD2 LEU A 79 -0.880 7.920 2.643 1.00 0.00 C ATOM 0 H LEU A 79 -5.258 6.408 1.808 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.734 9.128 2.752 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.364 6.752 2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.905 7.608 0.902 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.215 9.584 2.312 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.987 9.253 4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.688 9.129 4.252 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.759 7.656 4.616 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.162 8.509 3.214 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.931 6.912 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.562 7.871 1.601 1.00 0.00 H new ATOM 476 N GLN A 80 -5.108 8.639 -0.464 1.00 0.00 N ATOM 477 CA GLN A 80 -5.301 9.388 -1.741 1.00 0.00 C ATOM 478 C GLN A 80 -6.603 10.188 -1.676 1.00 0.00 C ATOM 479 O GLN A 80 -6.728 11.241 -2.274 1.00 0.00 O ATOM 480 CB GLN A 80 -5.381 8.318 -2.832 1.00 0.00 C ATOM 481 CG GLN A 80 -4.970 8.924 -4.176 1.00 0.00 C ATOM 482 CD GLN A 80 -4.567 7.806 -5.138 1.00 0.00 C ATOM 483 OE1 GLN A 80 -5.310 7.467 -6.039 1.00 0.00 O ATOM 484 NE2 GLN A 80 -3.415 7.215 -4.987 1.00 0.00 N ATOM 0 H GLN A 80 -5.239 7.630 -0.530 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.494 10.095 -1.934 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -4.728 7.481 -2.584 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.395 7.923 -2.895 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -5.796 9.499 -4.595 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -4.139 9.615 -4.036 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.791 7.499 -4.231 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -3.137 6.469 -5.624 1.00 0.00 H new ATOM 493 N GLU A 81 -7.570 9.697 -0.943 1.00 0.00 N ATOM 494 CA GLU A 81 -8.869 10.423 -0.820 1.00 0.00 C ATOM 495 C GLU A 81 -8.673 11.705 -0.008 1.00 0.00 C ATOM 496 O GLU A 81 -9.361 12.687 -0.205 1.00 0.00 O ATOM 497 CB GLU A 81 -9.802 9.459 -0.083 1.00 0.00 C ATOM 498 CG GLU A 81 -11.240 9.671 -0.561 1.00 0.00 C ATOM 499 CD GLU A 81 -11.719 11.062 -0.140 1.00 0.00 C ATOM 500 OE1 GLU A 81 -12.009 11.238 1.032 1.00 0.00 O ATOM 501 OE2 GLU A 81 -11.789 11.927 -0.998 1.00 0.00 O ATOM 0 H GLU A 81 -7.515 8.821 -0.423 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.274 10.713 -1.789 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.495 8.429 -0.266 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -9.737 9.625 0.992 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.293 9.569 -1.645 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -11.892 8.907 -0.137 1.00 0.00 H new ATOM 508 N GLU A 82 -7.732 11.697 0.903 1.00 0.00 N ATOM 509 CA GLU A 82 -7.478 12.914 1.735 1.00 0.00 C ATOM 510 C GLU A 82 -6.914 14.035 0.859 1.00 0.00 C ATOM 511 O GLU A 82 -7.309 15.180 0.976 1.00 0.00 O ATOM 512 CB GLU A 82 -6.452 12.481 2.788 1.00 0.00 C ATOM 513 CG GLU A 82 -7.146 12.287 4.138 1.00 0.00 C ATOM 514 CD GLU A 82 -7.273 13.636 4.847 1.00 0.00 C ATOM 515 OE1 GLU A 82 -6.320 14.398 4.801 1.00 0.00 O ATOM 516 OE2 GLU A 82 -8.318 13.885 5.423 1.00 0.00 O ATOM 0 H GLU A 82 -7.128 10.900 1.107 1.00 0.00 H new ATOM 0 HA GLU A 82 -8.388 13.295 2.198 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.970 11.553 2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.668 13.233 2.876 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.133 11.847 3.991 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.576 11.592 4.755 1.00 0.00 H new ATOM 523 N LYS A 83 -5.998 13.712 -0.021 1.00 0.00 N ATOM 524 CA LYS A 83 -5.413 14.760 -0.914 1.00 0.00 C ATOM 525 C LYS A 83 -6.511 15.362 -1.794 1.00 0.00 C ATOM 526 O LYS A 83 -6.446 16.514 -2.180 1.00 0.00 O ATOM 527 CB LYS A 83 -4.374 14.034 -1.771 1.00 0.00 C ATOM 528 CG LYS A 83 -3.198 14.972 -2.051 1.00 0.00 C ATOM 529 CD LYS A 83 -2.119 14.219 -2.832 1.00 0.00 C ATOM 530 CE LYS A 83 -2.601 13.976 -4.265 1.00 0.00 C ATOM 531 NZ LYS A 83 -1.998 15.077 -5.066 1.00 0.00 N ATOM 0 H LYS A 83 -5.631 12.770 -0.159 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.964 15.578 -0.351 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -4.024 13.139 -1.257 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.824 13.708 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.537 15.837 -2.621 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -2.788 15.348 -1.114 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.193 14.795 -2.841 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.899 13.269 -2.345 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -2.279 13.001 -4.630 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -3.689 13.995 -4.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.506 15.168 -5.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.069 15.970 -4.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -0.997 14.863 -5.252 1.00 0.00 H new ATOM 545 N HIS A 84 -7.519 14.587 -2.106 1.00 0.00 N ATOM 546 CA HIS A 84 -8.633 15.107 -2.957 1.00 0.00 C ATOM 547 C HIS A 84 -9.336 16.262 -2.244 1.00 0.00 C ATOM 548 O HIS A 84 -9.823 17.184 -2.870 1.00 0.00 O ATOM 549 CB HIS A 84 -9.590 13.926 -3.140 1.00 0.00 C ATOM 550 CG HIS A 84 -10.554 14.229 -4.253 1.00 0.00 C ATOM 551 ND1 HIS A 84 -11.808 13.643 -4.325 1.00 0.00 N ATOM 552 CD2 HIS A 84 -10.463 15.053 -5.347 1.00 0.00 C ATOM 553 CE1 HIS A 84 -12.415 14.118 -5.427 1.00 0.00 C ATOM 554 NE2 HIS A 84 -11.639 14.983 -6.087 1.00 0.00 N ATOM 0 H HIS A 84 -7.619 13.617 -1.808 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.278 15.487 -3.915 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -9.028 13.021 -3.368 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -10.134 13.738 -2.214 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -9.608 15.664 -5.596 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -13.409 13.835 -5.741 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -11.861 15.484 -6.947 1.00 0.00 H new ATOM 562 N GLN A 85 -9.385 16.218 -0.937 1.00 0.00 N ATOM 563 CA GLN A 85 -10.050 17.316 -0.171 1.00 0.00 C ATOM 564 C GLN A 85 -9.226 18.599 -0.288 1.00 0.00 C ATOM 565 O GLN A 85 -9.766 19.686 -0.391 1.00 0.00 O ATOM 566 CB GLN A 85 -10.091 16.832 1.280 1.00 0.00 C ATOM 567 CG GLN A 85 -11.139 17.632 2.055 1.00 0.00 C ATOM 568 CD GLN A 85 -12.534 17.091 1.734 1.00 0.00 C ATOM 569 OE1 GLN A 85 -12.960 16.103 2.297 1.00 0.00 O ATOM 570 NE2 GLN A 85 -13.269 17.703 0.847 1.00 0.00 N ATOM 0 H GLN A 85 -8.993 15.469 -0.367 1.00 0.00 H new ATOM 0 HA GLN A 85 -11.049 17.537 -0.546 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -10.331 15.769 1.313 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.111 16.952 1.742 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -10.947 17.561 3.126 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -11.076 18.687 1.789 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -12.912 18.533 0.374 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -14.201 17.352 0.627 1.00 0.00 H new ATOM 579 N LEU A 86 -7.923 18.477 -0.279 1.00 0.00 N ATOM 580 CA LEU A 86 -7.054 19.687 -0.397 1.00 0.00 C ATOM 581 C LEU A 86 -7.269 20.346 -1.762 1.00 0.00 C ATOM 582 O LEU A 86 -7.141 21.548 -1.908 1.00 0.00 O ATOM 583 CB LEU A 86 -5.616 19.169 -0.265 1.00 0.00 C ATOM 584 CG LEU A 86 -4.823 20.082 0.671 1.00 0.00 C ATOM 585 CD1 LEU A 86 -3.745 19.266 1.387 1.00 0.00 C ATOM 586 CD2 LEU A 86 -4.160 21.195 -0.144 1.00 0.00 C ATOM 0 H LEU A 86 -7.423 17.592 -0.195 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.279 20.436 0.362 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -5.620 18.150 0.123 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.140 19.135 -1.245 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.497 20.521 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.179 19.916 2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.215 18.472 1.967 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.071 18.828 0.651 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -3.594 21.846 0.522 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -3.486 20.755 -0.880 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -4.926 21.777 -0.656 1.00 0.00 H new ATOM 598 N PHE A 87 -7.600 19.564 -2.760 1.00 0.00 N ATOM 599 CA PHE A 87 -7.831 20.135 -4.121 1.00 0.00 C ATOM 600 C PHE A 87 -9.011 21.108 -4.082 1.00 0.00 C ATOM 601 O PHE A 87 -9.016 22.120 -4.756 1.00 0.00 O ATOM 602 CB PHE A 87 -8.155 18.936 -5.017 1.00 0.00 C ATOM 603 CG PHE A 87 -6.931 18.547 -5.812 1.00 0.00 C ATOM 604 CD1 PHE A 87 -6.658 19.176 -7.032 1.00 0.00 C ATOM 605 CD2 PHE A 87 -6.068 17.556 -5.327 1.00 0.00 C ATOM 606 CE1 PHE A 87 -5.524 18.815 -7.769 1.00 0.00 C ATOM 607 CE2 PHE A 87 -4.933 17.195 -6.063 1.00 0.00 C ATOM 608 CZ PHE A 87 -4.661 17.825 -7.284 1.00 0.00 C ATOM 0 H PHE A 87 -7.720 18.554 -2.690 1.00 0.00 H new ATOM 0 HA PHE A 87 -6.966 20.688 -4.488 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -8.487 18.095 -4.409 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -8.974 19.185 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -7.323 19.941 -7.405 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.278 17.070 -4.385 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.315 19.300 -8.711 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.267 16.431 -5.689 1.00 0.00 H new ATOM 0 HZ PHE A 87 -3.785 17.547 -7.852 1.00 0.00 H new ATOM 618 N LEU A 88 -10.007 20.806 -3.291 1.00 0.00 N ATOM 619 CA LEU A 88 -11.194 21.711 -3.193 1.00 0.00 C ATOM 620 C LEU A 88 -10.765 23.082 -2.665 1.00 0.00 C ATOM 621 O LEU A 88 -11.368 24.093 -2.972 1.00 0.00 O ATOM 622 CB LEU A 88 -12.144 21.030 -2.205 1.00 0.00 C ATOM 623 CG LEU A 88 -12.996 19.997 -2.945 1.00 0.00 C ATOM 624 CD1 LEU A 88 -12.201 18.699 -3.106 1.00 0.00 C ATOM 625 CD2 LEU A 88 -14.268 19.718 -2.143 1.00 0.00 C ATOM 0 H LEU A 88 -10.051 19.971 -2.707 1.00 0.00 H new ATOM 0 HA LEU A 88 -11.668 21.872 -4.161 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.575 20.546 -1.411 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.785 21.773 -1.730 1.00 0.00 H new ATOM 0 HG LEU A 88 -13.262 20.384 -3.929 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -12.808 17.963 -3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -11.294 18.897 -3.677 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -11.934 18.312 -2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -14.876 18.982 -2.669 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.001 19.331 -1.160 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.835 20.642 -2.028 1.00 0.00 H new ATOM 637 N GLN A 89 -9.722 23.120 -1.875 1.00 0.00 N ATOM 638 CA GLN A 89 -9.238 24.418 -1.321 1.00 0.00 C ATOM 639 C GLN A 89 -8.250 25.078 -2.290 1.00 0.00 C ATOM 640 O GLN A 89 -8.065 26.280 -2.273 1.00 0.00 O ATOM 641 CB GLN A 89 -8.540 24.054 -0.011 1.00 0.00 C ATOM 642 CG GLN A 89 -9.551 23.431 0.953 1.00 0.00 C ATOM 643 CD GLN A 89 -8.902 23.247 2.325 1.00 0.00 C ATOM 644 OE1 GLN A 89 -9.509 23.523 3.341 1.00 0.00 O ATOM 645 NE2 GLN A 89 -7.683 22.787 2.400 1.00 0.00 N ATOM 0 H GLN A 89 -9.183 22.303 -1.589 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.051 25.128 -1.168 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -7.726 23.354 -0.203 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -8.097 24.944 0.436 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -10.430 24.070 1.038 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -9.892 22.470 0.568 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -7.172 22.555 1.548 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -7.241 22.660 3.310 1.00 0.00 H new ATOM 654 N LEU A 90 -7.612 24.301 -3.134 1.00 0.00 N ATOM 655 CA LEU A 90 -6.629 24.879 -4.108 1.00 0.00 C ATOM 656 C LEU A 90 -7.283 25.992 -4.938 1.00 0.00 C ATOM 657 O LEU A 90 -8.149 25.677 -5.738 1.00 0.00 O ATOM 658 CB LEU A 90 -6.223 23.710 -5.011 1.00 0.00 C ATOM 659 CG LEU A 90 -5.171 24.181 -6.020 1.00 0.00 C ATOM 660 CD1 LEU A 90 -3.835 24.406 -5.306 1.00 0.00 C ATOM 661 CD2 LEU A 90 -4.998 23.117 -7.109 1.00 0.00 C ATOM 662 OXT LEU A 90 -6.906 27.139 -4.757 1.00 0.00 O ATOM 0 H LEU A 90 -7.730 23.289 -3.191 1.00 0.00 H new ATOM 0 HA LEU A 90 -5.771 25.324 -3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -5.824 22.894 -4.409 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -7.096 23.322 -5.535 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.498 25.117 -6.473 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -3.089 24.741 -6.027 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.959 25.164 -4.533 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.505 23.473 -4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.250 23.451 -7.828 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.673 22.181 -6.655 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.948 22.962 -7.620 1.00 0.00 H new ATOM 675 N GLY B 166 -8.000 30.342 -2.209 1.00 0.00 N ATOM 676 CA GLY B 166 -6.824 29.759 -1.501 1.00 0.00 C ATOM 677 C GLY B 166 -6.091 30.861 -0.735 1.00 0.00 C ATOM 678 O GLY B 166 -6.701 31.775 -0.212 1.00 0.00 O ATOM 0 HA2 GLY B 166 -7.150 28.979 -0.813 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -6.150 29.290 -2.218 1.00 0.00 H new ATOM 684 N LEU B 167 -4.786 30.780 -0.666 1.00 0.00 N ATOM 685 CA LEU B 167 -4.000 31.825 0.066 1.00 0.00 C ATOM 686 C LEU B 167 -3.233 32.672 -0.948 1.00 0.00 C ATOM 687 O LEU B 167 -3.441 33.865 -1.068 1.00 0.00 O ATOM 688 CB LEU B 167 -2.996 31.089 0.982 1.00 0.00 C ATOM 689 CG LEU B 167 -3.578 29.773 1.526 1.00 0.00 C ATOM 690 CD1 LEU B 167 -3.119 28.611 0.637 1.00 0.00 C ATOM 691 CD2 LEU B 167 -3.081 29.549 2.956 1.00 0.00 C ATOM 0 H LEU B 167 -4.229 30.035 -1.085 1.00 0.00 H new ATOM 0 HA LEU B 167 -4.655 32.471 0.650 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -2.082 30.880 0.426 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -2.721 31.737 1.815 1.00 0.00 H new ATOM 0 HG LEU B 167 -4.667 29.826 1.525 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -3.529 27.676 1.019 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -3.471 28.772 -0.382 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -2.030 28.558 0.641 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -3.493 28.617 3.342 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -1.992 29.493 2.958 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -3.403 30.377 3.587 1.00 0.00 H new ATOM 703 N SER B 168 -2.349 32.049 -1.680 1.00 0.00 N ATOM 704 CA SER B 168 -1.551 32.781 -2.701 1.00 0.00 C ATOM 705 C SER B 168 -1.089 31.805 -3.781 1.00 0.00 C ATOM 706 O SER B 168 0.002 31.912 -4.306 1.00 0.00 O ATOM 707 CB SER B 168 -0.354 33.350 -1.941 1.00 0.00 C ATOM 708 OG SER B 168 0.449 32.280 -1.462 1.00 0.00 O ATOM 0 H SER B 168 -2.145 31.052 -1.612 1.00 0.00 H new ATOM 0 HA SER B 168 -2.121 33.568 -3.195 1.00 0.00 H new ATOM 0 HB2 SER B 168 0.233 33.996 -2.594 1.00 0.00 H new ATOM 0 HB3 SER B 168 -0.696 33.965 -1.108 1.00 0.00 H new ATOM 0 HG SER B 168 1.219 32.641 -0.975 1.00 0.00 H new ATOM 714 N LYS B 169 -1.914 30.833 -4.102 1.00 0.00 N ATOM 715 CA LYS B 169 -1.537 29.814 -5.135 1.00 0.00 C ATOM 716 C LYS B 169 -0.168 29.208 -4.804 1.00 0.00 C ATOM 717 O LYS B 169 0.546 28.744 -5.673 1.00 0.00 O ATOM 718 CB LYS B 169 -1.490 30.572 -6.466 1.00 0.00 C ATOM 719 CG LYS B 169 -1.510 29.574 -7.630 1.00 0.00 C ATOM 720 CD LYS B 169 -2.824 28.784 -7.614 1.00 0.00 C ATOM 721 CE LYS B 169 -3.131 28.270 -9.023 1.00 0.00 C ATOM 722 NZ LYS B 169 -4.136 29.224 -9.569 1.00 0.00 N ATOM 0 H LYS B 169 -2.838 30.702 -3.689 1.00 0.00 H new ATOM 0 HA LYS B 169 -2.249 28.989 -5.173 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -2.341 31.249 -6.540 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -0.590 31.185 -6.515 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -1.405 30.104 -8.577 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -0.664 28.892 -7.551 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -2.749 27.948 -6.919 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -3.637 29.419 -7.262 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -2.232 28.247 -9.640 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -3.525 27.254 -8.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -4.397 28.938 -10.534 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -4.983 29.219 -8.965 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -3.731 30.182 -9.589 1.00 0.00 H new ATOM 736 N GLU B 170 0.195 29.213 -3.545 1.00 0.00 N ATOM 737 CA GLU B 170 1.508 28.644 -3.136 1.00 0.00 C ATOM 738 C GLU B 170 1.404 28.053 -1.734 1.00 0.00 C ATOM 739 O GLU B 170 1.875 26.958 -1.482 1.00 0.00 O ATOM 740 CB GLU B 170 2.480 29.823 -3.157 1.00 0.00 C ATOM 741 CG GLU B 170 3.907 29.306 -3.352 1.00 0.00 C ATOM 742 CD GLU B 170 4.890 30.476 -3.281 1.00 0.00 C ATOM 743 OE1 GLU B 170 4.598 31.505 -3.867 1.00 0.00 O ATOM 744 OE2 GLU B 170 5.917 30.323 -2.641 1.00 0.00 O ATOM 0 H GLU B 170 -0.368 29.590 -2.782 1.00 0.00 H new ATOM 0 HA GLU B 170 1.837 27.842 -3.796 1.00 0.00 H new ATOM 0 HB2 GLU B 170 2.218 30.510 -3.962 1.00 0.00 H new ATOM 0 HB3 GLU B 170 2.409 30.383 -2.224 1.00 0.00 H new ATOM 0 HG2 GLU B 170 4.146 28.570 -2.585 1.00 0.00 H new ATOM 0 HG3 GLU B 170 3.994 28.803 -4.315 1.00 0.00 H new ATOM 751 N GLU B 171 0.783 28.759 -0.821 1.00 0.00 N ATOM 752 CA GLU B 171 0.646 28.217 0.565 1.00 0.00 C ATOM 753 C GLU B 171 -0.209 26.949 0.529 1.00 0.00 C ATOM 754 O GLU B 171 -0.021 26.040 1.316 1.00 0.00 O ATOM 755 CB GLU B 171 -0.036 29.323 1.382 1.00 0.00 C ATOM 756 CG GLU B 171 0.900 29.796 2.498 1.00 0.00 C ATOM 757 CD GLU B 171 0.927 28.754 3.618 1.00 0.00 C ATOM 758 OE1 GLU B 171 1.170 27.597 3.318 1.00 0.00 O ATOM 759 OE2 GLU B 171 0.705 29.131 4.757 1.00 0.00 O ATOM 0 H GLU B 171 0.369 29.679 -0.974 1.00 0.00 H new ATOM 0 HA GLU B 171 1.606 27.949 1.006 1.00 0.00 H new ATOM 0 HB2 GLU B 171 -0.295 30.160 0.733 1.00 0.00 H new ATOM 0 HB3 GLU B 171 -0.967 28.951 1.809 1.00 0.00 H new ATOM 0 HG2 GLU B 171 1.905 29.948 2.104 1.00 0.00 H new ATOM 0 HG3 GLU B 171 0.562 30.756 2.888 1.00 0.00 H new ATOM 766 N LEU B 172 -1.125 26.875 -0.400 1.00 0.00 N ATOM 767 CA LEU B 172 -1.978 25.659 -0.522 1.00 0.00 C ATOM 768 C LEU B 172 -1.220 24.607 -1.335 1.00 0.00 C ATOM 769 O LEU B 172 -1.397 23.417 -1.150 1.00 0.00 O ATOM 770 CB LEU B 172 -3.243 26.118 -1.261 1.00 0.00 C ATOM 771 CG LEU B 172 -4.463 25.946 -0.352 1.00 0.00 C ATOM 772 CD1 LEU B 172 -5.672 26.642 -0.978 1.00 0.00 C ATOM 773 CD2 LEU B 172 -4.765 24.455 -0.183 1.00 0.00 C ATOM 0 H LEU B 172 -1.319 27.608 -1.082 1.00 0.00 H new ATOM 0 HA LEU B 172 -2.230 25.216 0.442 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -3.143 27.162 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -3.373 25.537 -2.174 1.00 0.00 H new ATOM 0 HG LEU B 172 -4.254 26.389 0.622 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -6.539 26.518 -0.329 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -5.458 27.704 -1.099 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -5.882 26.201 -1.952 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -5.633 24.331 0.464 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -4.972 24.013 -1.158 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -3.905 23.958 0.265 1.00 0.00 H new ATOM 785 N ILE B 173 -0.360 25.046 -2.222 1.00 0.00 N ATOM 786 CA ILE B 173 0.435 24.087 -3.041 1.00 0.00 C ATOM 787 C ILE B 173 1.423 23.352 -2.133 1.00 0.00 C ATOM 788 O ILE B 173 1.763 22.208 -2.368 1.00 0.00 O ATOM 789 CB ILE B 173 1.187 24.942 -4.071 1.00 0.00 C ATOM 790 CG1 ILE B 173 0.191 25.760 -4.914 1.00 0.00 C ATOM 791 CG2 ILE B 173 2.010 24.033 -4.990 1.00 0.00 C ATOM 792 CD1 ILE B 173 -0.777 24.830 -5.656 1.00 0.00 C ATOM 0 H ILE B 173 -0.176 26.031 -2.412 1.00 0.00 H new ATOM 0 HA ILE B 173 -0.190 23.340 -3.531 1.00 0.00 H new ATOM 0 HB ILE B 173 1.851 25.627 -3.544 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -0.369 26.438 -4.270 1.00 0.00 H new ATOM 0 HG13 ILE B 173 0.733 26.377 -5.631 1.00 0.00 H new ATOM 0 HG21 ILE B 173 2.543 24.641 -5.721 1.00 0.00 H new ATOM 0 HG22 ILE B 173 2.728 23.468 -4.395 1.00 0.00 H new ATOM 0 HG23 ILE B 173 1.345 23.342 -5.509 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -1.473 25.426 -6.246 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -0.214 24.170 -6.316 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -1.333 24.232 -4.934 1.00 0.00 H new ATOM 804 N GLN B 174 1.879 24.006 -1.091 1.00 0.00 N ATOM 805 CA GLN B 174 2.841 23.348 -0.155 1.00 0.00 C ATOM 806 C GLN B 174 2.127 22.257 0.643 1.00 0.00 C ATOM 807 O GLN B 174 2.720 21.268 1.029 1.00 0.00 O ATOM 808 CB GLN B 174 3.330 24.462 0.773 1.00 0.00 C ATOM 809 CG GLN B 174 4.776 24.186 1.187 1.00 0.00 C ATOM 810 CD GLN B 174 5.283 25.329 2.068 1.00 0.00 C ATOM 811 OE1 GLN B 174 4.731 25.593 3.118 1.00 0.00 O ATOM 812 NE2 GLN B 174 6.319 26.023 1.682 1.00 0.00 N ATOM 0 H GLN B 174 1.626 24.964 -0.850 1.00 0.00 H new ATOM 0 HA GLN B 174 3.669 22.872 -0.681 1.00 0.00 H new ATOM 0 HB2 GLN B 174 3.263 25.426 0.268 1.00 0.00 H new ATOM 0 HB3 GLN B 174 2.693 24.520 1.656 1.00 0.00 H new ATOM 0 HG2 GLN B 174 4.836 23.242 1.728 1.00 0.00 H new ATOM 0 HG3 GLN B 174 5.406 24.088 0.303 1.00 0.00 H new ATOM 0 HE21 GLN B 174 6.782 25.801 0.801 1.00 0.00 H new ATOM 0 HE22 GLN B 174 6.666 26.787 2.262 1.00 0.00 H new ATOM 821 N ASN B 175 0.852 22.431 0.885 1.00 0.00 N ATOM 822 CA ASN B 175 0.083 21.405 1.653 1.00 0.00 C ATOM 823 C ASN B 175 -0.242 20.217 0.747 1.00 0.00 C ATOM 824 O ASN B 175 -0.295 19.084 1.188 1.00 0.00 O ATOM 825 CB ASN B 175 -1.199 22.112 2.095 1.00 0.00 C ATOM 826 CG ASN B 175 -0.934 22.893 3.384 1.00 0.00 C ATOM 827 OD1 ASN B 175 -0.187 22.448 4.234 1.00 0.00 O ATOM 828 ND2 ASN B 175 -1.518 24.044 3.567 1.00 0.00 N ATOM 0 H ASN B 175 0.310 23.241 0.583 1.00 0.00 H new ATOM 0 HA ASN B 175 0.642 21.018 2.505 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -1.542 22.788 1.312 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -1.992 21.382 2.256 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -1.348 24.572 4.423 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -2.145 24.417 2.854 1.00 0.00 H new ATOM 835 N MET B 176 -0.452 20.472 -0.519 1.00 0.00 N ATOM 836 CA MET B 176 -0.766 19.363 -1.469 1.00 0.00 C ATOM 837 C MET B 176 0.510 18.580 -1.790 1.00 0.00 C ATOM 838 O MET B 176 0.471 17.393 -2.054 1.00 0.00 O ATOM 839 CB MET B 176 -1.310 20.049 -2.729 1.00 0.00 C ATOM 840 CG MET B 176 -2.837 19.883 -2.798 1.00 0.00 C ATOM 841 SD MET B 176 -3.338 19.452 -4.485 1.00 0.00 S ATOM 842 CE MET B 176 -4.470 20.839 -4.747 1.00 0.00 C ATOM 0 H MET B 176 -0.419 21.402 -0.936 1.00 0.00 H new ATOM 0 HA MET B 176 -1.485 18.655 -1.057 1.00 0.00 H new ATOM 0 HB2 MET B 176 -1.051 21.108 -2.718 1.00 0.00 H new ATOM 0 HB3 MET B 176 -0.848 19.617 -3.617 1.00 0.00 H new ATOM 0 HG2 MET B 176 -3.158 19.106 -2.105 1.00 0.00 H new ATOM 0 HG3 MET B 176 -3.326 20.807 -2.490 1.00 0.00 H new ATOM 0 HE1 MET B 176 -5.072 20.654 -5.637 1.00 0.00 H new ATOM 0 HE2 MET B 176 -5.124 20.943 -3.882 1.00 0.00 H new ATOM 0 HE3 MET B 176 -3.897 21.756 -4.881 1.00 0.00 H new ATOM 852 N ASP B 177 1.640 19.241 -1.764 1.00 0.00 N ATOM 853 CA ASP B 177 2.928 18.545 -2.061 1.00 0.00 C ATOM 854 C ASP B 177 3.358 17.711 -0.854 1.00 0.00 C ATOM 855 O ASP B 177 3.994 16.682 -0.994 1.00 0.00 O ATOM 856 CB ASP B 177 3.937 19.662 -2.332 1.00 0.00 C ATOM 857 CG ASP B 177 3.896 20.040 -3.813 1.00 0.00 C ATOM 858 OD1 ASP B 177 4.106 19.162 -4.634 1.00 0.00 O ATOM 859 OD2 ASP B 177 3.654 21.200 -4.102 1.00 0.00 O ATOM 0 H ASP B 177 1.726 20.234 -1.549 1.00 0.00 H new ATOM 0 HA ASP B 177 2.846 17.865 -2.909 1.00 0.00 H new ATOM 0 HB2 ASP B 177 3.706 20.532 -1.717 1.00 0.00 H new ATOM 0 HB3 ASP B 177 4.940 19.335 -2.057 1.00 0.00 H new ATOM 864 N ARG B 178 3.009 18.146 0.329 1.00 0.00 N ATOM 865 CA ARG B 178 3.387 17.383 1.556 1.00 0.00 C ATOM 866 C ARG B 178 2.465 16.175 1.719 1.00 0.00 C ATOM 867 O ARG B 178 2.874 15.128 2.185 1.00 0.00 O ATOM 868 CB ARG B 178 3.201 18.364 2.715 1.00 0.00 C ATOM 869 CG ARG B 178 3.859 17.798 3.976 1.00 0.00 C ATOM 870 CD ARG B 178 4.496 18.936 4.777 1.00 0.00 C ATOM 871 NE ARG B 178 3.346 19.731 5.293 1.00 0.00 N ATOM 872 CZ ARG B 178 3.333 20.128 6.536 1.00 0.00 C ATOM 873 NH1 ARG B 178 3.966 21.214 6.881 1.00 0.00 N ATOM 874 NH2 ARG B 178 2.685 19.437 7.434 1.00 0.00 N ATOM 0 H ARG B 178 2.477 18.999 0.499 1.00 0.00 H new ATOM 0 HA ARG B 178 4.408 17.005 1.511 1.00 0.00 H new ATOM 0 HB2 ARG B 178 3.643 19.328 2.463 1.00 0.00 H new ATOM 0 HB3 ARG B 178 2.139 18.536 2.892 1.00 0.00 H new ATOM 0 HG2 ARG B 178 3.117 17.282 4.585 1.00 0.00 H new ATOM 0 HG3 ARG B 178 4.616 17.062 3.705 1.00 0.00 H new ATOM 0 HD2 ARG B 178 5.108 18.551 5.593 1.00 0.00 H new ATOM 0 HD3 ARG B 178 5.147 19.545 4.150 1.00 0.00 H new ATOM 0 HE ARG B 178 2.569 19.965 4.675 1.00 0.00 H new ATOM 0 HH11 ARG B 178 4.472 21.754 6.179 1.00 0.00 H new ATOM 0 HH12 ARG B 178 3.955 21.524 7.853 1.00 0.00 H new ATOM 0 HH21 ARG B 178 2.189 18.587 7.164 1.00 0.00 H new ATOM 0 HH22 ARG B 178 2.674 19.747 8.406 1.00 0.00 H new ATOM 888 N VAL B 179 1.225 16.313 1.326 1.00 0.00 N ATOM 889 CA VAL B 179 0.266 15.175 1.442 1.00 0.00 C ATOM 890 C VAL B 179 0.535 14.165 0.324 1.00 0.00 C ATOM 891 O VAL B 179 0.331 12.977 0.486 1.00 0.00 O ATOM 892 CB VAL B 179 -1.127 15.801 1.290 1.00 0.00 C ATOM 893 CG1 VAL B 179 -2.196 14.710 1.383 1.00 0.00 C ATOM 894 CG2 VAL B 179 -1.353 16.825 2.405 1.00 0.00 C ATOM 0 H VAL B 179 0.835 17.168 0.929 1.00 0.00 H new ATOM 0 HA VAL B 179 0.359 14.643 2.389 1.00 0.00 H new ATOM 0 HB VAL B 179 -1.194 16.294 0.320 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -3.184 15.158 1.275 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -2.040 13.979 0.589 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -2.127 14.214 2.351 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -2.343 17.269 2.296 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -1.282 16.330 3.374 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.596 17.606 2.340 1.00 0.00 H new ATOM 904 N ASP B 180 1.002 14.634 -0.805 1.00 0.00 N ATOM 905 CA ASP B 180 1.300 13.710 -1.939 1.00 0.00 C ATOM 906 C ASP B 180 2.597 12.947 -1.661 1.00 0.00 C ATOM 907 O ASP B 180 2.777 11.829 -2.106 1.00 0.00 O ATOM 908 CB ASP B 180 1.461 14.615 -3.163 1.00 0.00 C ATOM 909 CG ASP B 180 1.356 13.773 -4.437 1.00 0.00 C ATOM 910 OD1 ASP B 180 0.244 13.557 -4.890 1.00 0.00 O ATOM 911 OD2 ASP B 180 2.389 13.361 -4.938 1.00 0.00 O ATOM 0 H ASP B 180 1.190 15.619 -0.990 1.00 0.00 H new ATOM 0 HA ASP B 180 0.515 12.968 -2.087 1.00 0.00 H new ATOM 0 HB2 ASP B 180 0.693 15.388 -3.161 1.00 0.00 H new ATOM 0 HB3 ASP B 180 2.425 15.123 -3.129 1.00 0.00 H new ATOM 916 N ARG B 181 3.498 13.545 -0.922 1.00 0.00 N ATOM 917 CA ARG B 181 4.786 12.860 -0.601 1.00 0.00 C ATOM 918 C ARG B 181 4.547 11.751 0.426 1.00 0.00 C ATOM 919 O ARG B 181 5.245 10.755 0.451 1.00 0.00 O ATOM 920 CB ARG B 181 5.689 13.949 -0.017 1.00 0.00 C ATOM 921 CG ARG B 181 6.605 14.498 -1.112 1.00 0.00 C ATOM 922 CD ARG B 181 6.862 15.986 -0.865 1.00 0.00 C ATOM 923 NE ARG B 181 8.273 16.208 -1.287 1.00 0.00 N ATOM 924 CZ ARG B 181 9.058 16.964 -0.570 1.00 0.00 C ATOM 925 NH1 ARG B 181 8.997 18.262 -0.686 1.00 0.00 N ATOM 926 NH2 ARG B 181 9.904 16.422 0.263 1.00 0.00 N ATOM 0 H ARG B 181 3.396 14.480 -0.527 1.00 0.00 H new ATOM 0 HA ARG B 181 5.235 12.394 -1.478 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.083 14.753 0.401 1.00 0.00 H new ATOM 0 HB3 ARG B 181 6.285 13.542 0.800 1.00 0.00 H new ATOM 0 HG2 ARG B 181 7.548 13.952 -1.119 1.00 0.00 H new ATOM 0 HG3 ARG B 181 6.146 14.355 -2.090 1.00 0.00 H new ATOM 0 HD2 ARG B 181 6.175 16.606 -1.441 1.00 0.00 H new ATOM 0 HD3 ARG B 181 6.719 16.242 0.185 1.00 0.00 H new ATOM 0 HE ARG B 181 8.626 15.769 -2.137 1.00 0.00 H new ATOM 0 HH11 ARG B 181 8.336 18.685 -1.337 1.00 0.00 H new ATOM 0 HH12 ARG B 181 9.611 18.854 -0.126 1.00 0.00 H new ATOM 0 HH21 ARG B 181 9.951 15.407 0.353 1.00 0.00 H new ATOM 0 HH22 ARG B 181 10.518 17.013 0.823 1.00 0.00 H new ATOM 940 N GLU B 182 3.560 11.919 1.271 1.00 0.00 N ATOM 941 CA GLU B 182 3.263 10.875 2.299 1.00 0.00 C ATOM 942 C GLU B 182 2.574 9.678 1.644 1.00 0.00 C ATOM 943 O GLU B 182 2.761 8.545 2.047 1.00 0.00 O ATOM 944 CB GLU B 182 2.327 11.551 3.302 1.00 0.00 C ATOM 945 CG GLU B 182 2.591 10.997 4.703 1.00 0.00 C ATOM 946 CD GLU B 182 1.354 11.209 5.577 1.00 0.00 C ATOM 947 OE1 GLU B 182 0.832 12.312 5.574 1.00 0.00 O ATOM 948 OE2 GLU B 182 0.949 10.265 6.235 1.00 0.00 O ATOM 0 H GLU B 182 2.947 12.734 1.293 1.00 0.00 H new ATOM 0 HA GLU B 182 4.167 10.501 2.780 1.00 0.00 H new ATOM 0 HB2 GLU B 182 2.483 12.630 3.291 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.289 11.377 3.021 1.00 0.00 H new ATOM 0 HG2 GLU B 182 2.832 9.935 4.646 1.00 0.00 H new ATOM 0 HG3 GLU B 182 3.453 11.496 5.147 1.00 0.00 H new ATOM 955 N ILE B 183 1.783 9.925 0.631 1.00 0.00 N ATOM 956 CA ILE B 183 1.079 8.807 -0.066 1.00 0.00 C ATOM 957 C ILE B 183 2.083 8.000 -0.894 1.00 0.00 C ATOM 958 O ILE B 183 1.923 6.809 -1.091 1.00 0.00 O ATOM 959 CB ILE B 183 0.039 9.483 -0.966 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.944 10.269 -0.096 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.729 8.425 -1.763 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.785 11.192 -0.977 1.00 0.00 C ATOM 0 H ILE B 183 1.594 10.855 0.256 1.00 0.00 H new ATOM 0 HA ILE B 183 0.608 8.111 0.629 1.00 0.00 H new ATOM 0 HB ILE B 183 0.546 10.156 -1.658 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.591 9.583 0.450 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.401 10.854 0.646 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.466 8.914 -2.400 1.00 0.00 H new ATOM 0 HG22 ILE B 183 -0.033 7.859 -2.382 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -1.236 7.748 -1.075 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.484 11.751 -0.355 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -1.131 11.888 -1.503 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.340 10.597 -1.702 1.00 0.00 H new ATOM 974 N THR B 184 3.118 8.642 -1.371 1.00 0.00 N ATOM 975 CA THR B 184 4.145 7.918 -2.180 1.00 0.00 C ATOM 976 C THR B 184 4.950 6.982 -1.277 1.00 0.00 C ATOM 977 O THR B 184 5.342 5.903 -1.678 1.00 0.00 O ATOM 978 CB THR B 184 5.046 9.010 -2.763 1.00 0.00 C ATOM 979 OG1 THR B 184 4.280 10.185 -2.985 1.00 0.00 O ATOM 980 CG2 THR B 184 5.642 8.529 -4.087 1.00 0.00 C ATOM 0 H THR B 184 3.297 9.637 -1.235 1.00 0.00 H new ATOM 0 HA THR B 184 3.699 7.306 -2.964 1.00 0.00 H new ATOM 0 HB THR B 184 5.852 9.229 -2.063 1.00 0.00 H new ATOM 0 HG1 THR B 184 4.272 10.729 -2.170 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.283 9.307 -4.501 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.230 7.627 -3.915 1.00 0.00 H new ATOM 0 HG23 THR B 184 4.838 8.309 -4.789 1.00 0.00 H new ATOM 988 N MET B 185 5.190 7.388 -0.054 1.00 0.00 N ATOM 989 CA MET B 185 5.963 6.523 0.888 1.00 0.00 C ATOM 990 C MET B 185 5.148 5.275 1.233 1.00 0.00 C ATOM 991 O MET B 185 5.670 4.178 1.288 1.00 0.00 O ATOM 992 CB MET B 185 6.189 7.380 2.134 1.00 0.00 C ATOM 993 CG MET B 185 7.588 7.113 2.694 1.00 0.00 C ATOM 994 SD MET B 185 7.780 7.973 4.274 1.00 0.00 S ATOM 995 CE MET B 185 9.514 7.538 4.559 1.00 0.00 C ATOM 0 H MET B 185 4.884 8.281 0.332 1.00 0.00 H new ATOM 0 HA MET B 185 6.906 6.185 0.459 1.00 0.00 H new ATOM 0 HB2 MET B 185 6.081 8.436 1.886 1.00 0.00 H new ATOM 0 HB3 MET B 185 5.435 7.151 2.887 1.00 0.00 H new ATOM 0 HG2 MET B 185 7.738 6.042 2.830 1.00 0.00 H new ATOM 0 HG3 MET B 185 8.345 7.454 1.988 1.00 0.00 H new ATOM 0 HE1 MET B 185 9.848 7.974 5.500 1.00 0.00 H new ATOM 0 HE2 MET B 185 9.614 6.454 4.605 1.00 0.00 H new ATOM 0 HE3 MET B 185 10.125 7.924 3.743 1.00 0.00 H new ATOM 1005 N VAL B 186 3.869 5.440 1.460 1.00 0.00 N ATOM 1006 CA VAL B 186 3.006 4.265 1.795 1.00 0.00 C ATOM 1007 C VAL B 186 2.827 3.388 0.554 1.00 0.00 C ATOM 1008 O VAL B 186 2.674 2.185 0.650 1.00 0.00 O ATOM 1009 CB VAL B 186 1.664 4.858 2.240 1.00 0.00 C ATOM 1010 CG1 VAL B 186 0.704 3.730 2.622 1.00 0.00 C ATOM 1011 CG2 VAL B 186 1.882 5.767 3.453 1.00 0.00 C ATOM 0 H VAL B 186 3.385 6.337 1.428 1.00 0.00 H new ATOM 0 HA VAL B 186 3.440 3.638 2.574 1.00 0.00 H new ATOM 0 HB VAL B 186 1.239 5.437 1.420 1.00 0.00 H new ATOM 0 HG11 VAL B 186 -0.249 4.155 2.938 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.544 3.081 1.761 1.00 0.00 H new ATOM 0 HG13 VAL B 186 1.131 3.150 3.440 1.00 0.00 H new ATOM 0 HG21 VAL B 186 0.927 6.188 3.768 1.00 0.00 H new ATOM 0 HG22 VAL B 186 2.310 5.187 4.270 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.564 6.574 3.185 1.00 0.00 H new ATOM 1021 N GLU B 187 2.851 3.985 -0.610 1.00 0.00 N ATOM 1022 CA GLU B 187 2.690 3.196 -1.867 1.00 0.00 C ATOM 1023 C GLU B 187 3.969 2.409 -2.157 1.00 0.00 C ATOM 1024 O GLU B 187 3.935 1.345 -2.745 1.00 0.00 O ATOM 1025 CB GLU B 187 2.435 4.232 -2.964 1.00 0.00 C ATOM 1026 CG GLU B 187 1.564 3.613 -4.060 1.00 0.00 C ATOM 1027 CD GLU B 187 1.836 4.318 -5.389 1.00 0.00 C ATOM 1028 OE1 GLU B 187 1.792 5.537 -5.411 1.00 0.00 O ATOM 1029 OE2 GLU B 187 2.086 3.627 -6.363 1.00 0.00 O ATOM 0 H GLU B 187 2.976 4.988 -0.744 1.00 0.00 H new ATOM 0 HA GLU B 187 1.877 2.473 -1.800 1.00 0.00 H new ATOM 0 HB2 GLU B 187 1.941 5.108 -2.544 1.00 0.00 H new ATOM 0 HB3 GLU B 187 3.381 4.571 -3.385 1.00 0.00 H new ATOM 0 HG2 GLU B 187 1.778 2.548 -4.151 1.00 0.00 H new ATOM 0 HG3 GLU B 187 0.510 3.705 -3.797 1.00 0.00 H new ATOM 1036 N GLN B 188 5.099 2.927 -1.743 1.00 0.00 N ATOM 1037 CA GLN B 188 6.389 2.214 -1.985 1.00 0.00 C ATOM 1038 C GLN B 188 6.486 0.988 -1.074 1.00 0.00 C ATOM 1039 O GLN B 188 7.107 -0.001 -1.416 1.00 0.00 O ATOM 1040 CB GLN B 188 7.483 3.227 -1.639 1.00 0.00 C ATOM 1041 CG GLN B 188 7.635 4.230 -2.786 1.00 0.00 C ATOM 1042 CD GLN B 188 8.143 3.508 -4.035 1.00 0.00 C ATOM 1043 OE1 GLN B 188 9.279 3.081 -4.087 1.00 0.00 O ATOM 1044 NE2 GLN B 188 7.341 3.353 -5.053 1.00 0.00 N ATOM 0 H GLN B 188 5.183 3.814 -1.247 1.00 0.00 H new ATOM 0 HA GLN B 188 6.478 1.861 -3.012 1.00 0.00 H new ATOM 0 HB2 GLN B 188 7.230 3.750 -0.716 1.00 0.00 H new ATOM 0 HB3 GLN B 188 8.428 2.712 -1.465 1.00 0.00 H new ATOM 0 HG2 GLN B 188 6.678 4.708 -2.994 1.00 0.00 H new ATOM 0 HG3 GLN B 188 8.330 5.020 -2.502 1.00 0.00 H new ATOM 0 HE21 GLN B 188 6.387 3.711 -5.010 1.00 0.00 H new ATOM 0 HE22 GLN B 188 7.668 2.873 -5.892 1.00 0.00 H new ATOM 1053 N GLN B 189 5.873 1.049 0.079 1.00 0.00 N ATOM 1054 CA GLN B 189 5.918 -0.111 1.021 1.00 0.00 C ATOM 1055 C GLN B 189 5.021 -1.238 0.501 1.00 0.00 C ATOM 1056 O GLN B 189 5.358 -2.403 0.599 1.00 0.00 O ATOM 1057 CB GLN B 189 5.388 0.429 2.353 1.00 0.00 C ATOM 1058 CG GLN B 189 6.237 -0.116 3.506 1.00 0.00 C ATOM 1059 CD GLN B 189 7.283 0.924 3.915 1.00 0.00 C ATOM 1060 OE1 GLN B 189 7.546 1.110 5.087 1.00 0.00 O ATOM 1061 NE2 GLN B 189 7.894 1.616 2.993 1.00 0.00 N ATOM 0 H GLN B 189 5.341 1.854 0.411 1.00 0.00 H new ATOM 0 HA GLN B 189 6.923 -0.521 1.126 1.00 0.00 H new ATOM 0 HB2 GLN B 189 5.416 1.519 2.352 1.00 0.00 H new ATOM 0 HB3 GLN B 189 4.346 0.137 2.486 1.00 0.00 H new ATOM 0 HG2 GLN B 189 5.600 -0.358 4.356 1.00 0.00 H new ATOM 0 HG3 GLN B 189 6.729 -1.040 3.203 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.674 1.461 2.009 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.592 2.312 3.256 1.00 0.00 H new ATOM 1070 N ILE B 190 3.888 -0.894 -0.053 1.00 0.00 N ATOM 1071 CA ILE B 190 2.964 -1.940 -0.589 1.00 0.00 C ATOM 1072 C ILE B 190 3.567 -2.560 -1.852 1.00 0.00 C ATOM 1073 O ILE B 190 3.349 -3.719 -2.150 1.00 0.00 O ATOM 1074 CB ILE B 190 1.655 -1.206 -0.911 1.00 0.00 C ATOM 1075 CG1 ILE B 190 1.112 -0.549 0.365 1.00 0.00 C ATOM 1076 CG2 ILE B 190 0.623 -2.205 -1.446 1.00 0.00 C ATOM 1077 CD1 ILE B 190 -0.130 0.281 0.030 1.00 0.00 C ATOM 0 H ILE B 190 3.561 0.067 -0.158 1.00 0.00 H new ATOM 0 HA ILE B 190 2.797 -2.751 0.120 1.00 0.00 H new ATOM 0 HB ILE B 190 1.845 -0.442 -1.665 1.00 0.00 H new ATOM 0 HG12 ILE B 190 0.863 -1.313 1.101 1.00 0.00 H new ATOM 0 HG13 ILE B 190 1.876 0.087 0.812 1.00 0.00 H new ATOM 0 HG21 ILE B 190 -0.306 -1.682 -1.674 1.00 0.00 H new ATOM 0 HG22 ILE B 190 1.007 -2.675 -2.352 1.00 0.00 H new ATOM 0 HG23 ILE B 190 0.433 -2.970 -0.693 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.513 0.746 0.938 1.00 0.00 H new ATOM 0 HD12 ILE B 190 0.133 1.055 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE B 190 -0.896 -0.366 -0.397 1.00 0.00 H new ATOM 1089 N SER B 191 4.331 -1.793 -2.589 1.00 0.00 N ATOM 1090 CA SER B 191 4.963 -2.330 -3.831 1.00 0.00 C ATOM 1091 C SER B 191 6.068 -3.319 -3.458 1.00 0.00 C ATOM 1092 O SER B 191 6.264 -4.322 -4.119 1.00 0.00 O ATOM 1093 CB SER B 191 5.549 -1.113 -4.547 1.00 0.00 C ATOM 1094 OG SER B 191 4.579 -0.585 -5.443 1.00 0.00 O ATOM 0 H SER B 191 4.544 -0.817 -2.383 1.00 0.00 H new ATOM 0 HA SER B 191 4.251 -2.860 -4.464 1.00 0.00 H new ATOM 0 HB2 SER B 191 5.841 -0.355 -3.821 1.00 0.00 H new ATOM 0 HB3 SER B 191 6.449 -1.396 -5.092 1.00 0.00 H new ATOM 0 HG SER B 191 4.950 0.197 -5.903 1.00 0.00 H new ATOM 1100 N LYS B 192 6.784 -3.045 -2.397 1.00 0.00 N ATOM 1101 CA LYS B 192 7.873 -3.972 -1.966 1.00 0.00 C ATOM 1102 C LYS B 192 7.262 -5.213 -1.316 1.00 0.00 C ATOM 1103 O LYS B 192 7.795 -6.301 -1.412 1.00 0.00 O ATOM 1104 CB LYS B 192 8.699 -3.179 -0.950 1.00 0.00 C ATOM 1105 CG LYS B 192 9.299 -1.946 -1.629 1.00 0.00 C ATOM 1106 CD LYS B 192 10.589 -2.337 -2.351 1.00 0.00 C ATOM 1107 CE LYS B 192 10.816 -1.398 -3.538 1.00 0.00 C ATOM 1108 NZ LYS B 192 10.001 -1.976 -4.644 1.00 0.00 N ATOM 0 H LYS B 192 6.661 -2.219 -1.811 1.00 0.00 H new ATOM 0 HA LYS B 192 8.487 -4.312 -2.800 1.00 0.00 H new ATOM 0 HB2 LYS B 192 8.071 -2.876 -0.112 1.00 0.00 H new ATOM 0 HB3 LYS B 192 9.493 -3.805 -0.543 1.00 0.00 H new ATOM 0 HG2 LYS B 192 8.586 -1.526 -2.338 1.00 0.00 H new ATOM 0 HG3 LYS B 192 9.505 -1.174 -0.888 1.00 0.00 H new ATOM 0 HD2 LYS B 192 11.433 -2.282 -1.664 1.00 0.00 H new ATOM 0 HD3 LYS B 192 10.526 -3.369 -2.697 1.00 0.00 H new ATOM 0 HE2 LYS B 192 10.500 -0.381 -3.304 1.00 0.00 H new ATOM 0 HE3 LYS B 192 11.871 -1.350 -3.808 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 9.625 -1.208 -5.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 10.597 -2.601 -5.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 9.212 -2.523 -4.244 1.00 0.00 H new ATOM 1122 N LEU B 193 6.136 -5.053 -0.665 1.00 0.00 N ATOM 1123 CA LEU B 193 5.470 -6.221 -0.015 1.00 0.00 C ATOM 1124 C LEU B 193 4.719 -7.058 -1.058 1.00 0.00 C ATOM 1125 O LEU B 193 4.337 -8.183 -0.796 1.00 0.00 O ATOM 1126 CB LEU B 193 4.492 -5.617 0.996 1.00 0.00 C ATOM 1127 CG LEU B 193 4.448 -6.490 2.256 1.00 0.00 C ATOM 1128 CD1 LEU B 193 5.306 -5.852 3.353 1.00 0.00 C ATOM 1129 CD2 LEU B 193 3.003 -6.611 2.749 1.00 0.00 C ATOM 0 H LEU B 193 5.650 -4.163 -0.556 1.00 0.00 H new ATOM 0 HA LEU B 193 6.189 -6.886 0.464 1.00 0.00 H new ATOM 0 HB2 LEU B 193 4.800 -4.604 1.254 1.00 0.00 H new ATOM 0 HB3 LEU B 193 3.497 -5.545 0.556 1.00 0.00 H new ATOM 0 HG LEU B 193 4.836 -7.481 2.020 1.00 0.00 H new ATOM 0 HD11 LEU B 193 5.274 -6.474 4.248 1.00 0.00 H new ATOM 0 HD12 LEU B 193 6.336 -5.768 3.007 1.00 0.00 H new ATOM 0 HD13 LEU B 193 4.920 -4.860 3.586 1.00 0.00 H new ATOM 0 HD21 LEU B 193 2.975 -7.232 3.644 1.00 0.00 H new ATOM 0 HD22 LEU B 193 2.614 -5.620 2.982 1.00 0.00 H new ATOM 0 HD23 LEU B 193 2.390 -7.067 1.972 1.00 0.00 H new ATOM 1141 N LYS B 194 4.510 -6.526 -2.240 1.00 0.00 N ATOM 1142 CA LYS B 194 3.799 -7.302 -3.296 1.00 0.00 C ATOM 1143 C LYS B 194 4.811 -8.140 -4.079 1.00 0.00 C ATOM 1144 O LYS B 194 4.489 -9.190 -4.601 1.00 0.00 O ATOM 1145 CB LYS B 194 3.150 -6.252 -4.198 1.00 0.00 C ATOM 1146 CG LYS B 194 1.949 -6.869 -4.917 1.00 0.00 C ATOM 1147 CD LYS B 194 0.693 -6.689 -4.062 1.00 0.00 C ATOM 1148 CE LYS B 194 -0.547 -6.995 -4.904 1.00 0.00 C ATOM 1149 NZ LYS B 194 -0.548 -8.476 -5.061 1.00 0.00 N ATOM 0 H LYS B 194 4.802 -5.588 -2.515 1.00 0.00 H new ATOM 0 HA LYS B 194 3.057 -7.987 -2.887 1.00 0.00 H new ATOM 0 HB2 LYS B 194 2.831 -5.395 -3.605 1.00 0.00 H new ATOM 0 HB3 LYS B 194 3.874 -5.885 -4.926 1.00 0.00 H new ATOM 0 HG2 LYS B 194 1.811 -6.395 -5.889 1.00 0.00 H new ATOM 0 HG3 LYS B 194 2.127 -7.928 -5.101 1.00 0.00 H new ATOM 0 HD2 LYS B 194 0.731 -7.352 -3.197 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.643 -5.669 -3.680 1.00 0.00 H new ATOM 0 HE2 LYS B 194 -1.455 -6.650 -4.410 1.00 0.00 H new ATOM 0 HE3 LYS B 194 -0.501 -6.495 -5.872 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -0.463 -8.718 -6.069 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 0.255 -8.881 -4.538 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -1.437 -8.864 -4.686 1.00 0.00 H new ATOM 1163 N LYS B 195 6.038 -7.683 -4.155 1.00 0.00 N ATOM 1164 CA LYS B 195 7.083 -8.451 -4.893 1.00 0.00 C ATOM 1165 C LYS B 195 7.558 -9.629 -4.040 1.00 0.00 C ATOM 1166 O LYS B 195 7.861 -10.689 -4.554 1.00 0.00 O ATOM 1167 CB LYS B 195 8.220 -7.456 -5.131 1.00 0.00 C ATOM 1168 CG LYS B 195 8.777 -7.637 -6.545 1.00 0.00 C ATOM 1169 CD LYS B 195 9.681 -8.870 -6.585 1.00 0.00 C ATOM 1170 CE LYS B 195 9.860 -9.327 -8.035 1.00 0.00 C ATOM 1171 NZ LYS B 195 10.839 -8.369 -8.620 1.00 0.00 N ATOM 0 H LYS B 195 6.359 -6.810 -3.736 1.00 0.00 H new ATOM 0 HA LYS B 195 6.713 -8.865 -5.831 1.00 0.00 H new ATOM 0 HB2 LYS B 195 7.857 -6.436 -5.001 1.00 0.00 H new ATOM 0 HB3 LYS B 195 9.010 -7.610 -4.396 1.00 0.00 H new ATOM 0 HG2 LYS B 195 7.960 -7.749 -7.257 1.00 0.00 H new ATOM 0 HG3 LYS B 195 9.339 -6.751 -6.842 1.00 0.00 H new ATOM 0 HD2 LYS B 195 10.650 -8.638 -6.144 1.00 0.00 H new ATOM 0 HD3 LYS B 195 9.245 -9.673 -5.991 1.00 0.00 H new ATOM 0 HE2 LYS B 195 10.231 -10.351 -8.084 1.00 0.00 H new ATOM 0 HE3 LYS B 195 8.914 -9.305 -8.576 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 10.461 -7.987 -9.511 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 11.004 -7.590 -7.951 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 11.736 -8.860 -8.807 1.00 0.00 H new ATOM 1185 N LYS B 196 7.616 -9.455 -2.741 1.00 0.00 N ATOM 1186 CA LYS B 196 8.061 -10.576 -1.862 1.00 0.00 C ATOM 1187 C LYS B 196 6.990 -11.675 -1.850 1.00 0.00 C ATOM 1188 O LYS B 196 7.286 -12.840 -1.663 1.00 0.00 O ATOM 1189 CB LYS B 196 8.262 -9.959 -0.466 1.00 0.00 C ATOM 1190 CG LYS B 196 6.923 -9.501 0.122 1.00 0.00 C ATOM 1191 CD LYS B 196 6.375 -10.580 1.060 1.00 0.00 C ATOM 1192 CE LYS B 196 4.906 -10.287 1.379 1.00 0.00 C ATOM 1193 NZ LYS B 196 4.772 -10.536 2.842 1.00 0.00 N ATOM 0 H LYS B 196 7.376 -8.590 -2.257 1.00 0.00 H new ATOM 0 HA LYS B 196 8.984 -11.041 -2.209 1.00 0.00 H new ATOM 0 HB2 LYS B 196 8.725 -10.690 0.197 1.00 0.00 H new ATOM 0 HB3 LYS B 196 8.945 -9.112 -0.532 1.00 0.00 H new ATOM 0 HG2 LYS B 196 7.055 -8.566 0.666 1.00 0.00 H new ATOM 0 HG3 LYS B 196 6.210 -9.306 -0.680 1.00 0.00 H new ATOM 0 HD2 LYS B 196 6.468 -11.561 0.595 1.00 0.00 H new ATOM 0 HD3 LYS B 196 6.959 -10.607 1.980 1.00 0.00 H new ATOM 0 HE2 LYS B 196 4.645 -9.259 1.128 1.00 0.00 H new ATOM 0 HE3 LYS B 196 4.241 -10.933 0.806 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 3.925 -10.050 3.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 4.683 -11.558 3.014 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 5.614 -10.174 3.334 1.00 0.00 H new ATOM 1207 N GLN B 197 5.748 -11.308 -2.065 1.00 0.00 N ATOM 1208 CA GLN B 197 4.656 -12.326 -2.086 1.00 0.00 C ATOM 1209 C GLN B 197 4.805 -13.208 -3.328 1.00 0.00 C ATOM 1210 O GLN B 197 4.441 -14.368 -3.324 1.00 0.00 O ATOM 1211 CB GLN B 197 3.353 -11.526 -2.147 1.00 0.00 C ATOM 1212 CG GLN B 197 2.162 -12.483 -2.089 1.00 0.00 C ATOM 1213 CD GLN B 197 0.919 -11.787 -2.646 1.00 0.00 C ATOM 1214 OE1 GLN B 197 0.912 -11.345 -3.779 1.00 0.00 O ATOM 1215 NE2 GLN B 197 -0.140 -11.669 -1.894 1.00 0.00 N ATOM 0 H GLN B 197 5.446 -10.347 -2.226 1.00 0.00 H new ATOM 0 HA GLN B 197 4.680 -12.980 -1.214 1.00 0.00 H new ATOM 0 HB2 GLN B 197 3.307 -10.822 -1.316 1.00 0.00 H new ATOM 0 HB3 GLN B 197 3.317 -10.939 -3.065 1.00 0.00 H new ATOM 0 HG2 GLN B 197 2.377 -13.383 -2.666 1.00 0.00 H new ATOM 0 HG3 GLN B 197 1.985 -12.798 -1.061 1.00 0.00 H new ATOM 0 HE21 GLN B 197 -0.135 -12.040 -0.944 1.00 0.00 H new ATOM 0 HE22 GLN B 197 -0.974 -11.206 -2.256 1.00 0.00 H new ATOM 1224 N GLN B 198 5.349 -12.660 -4.388 1.00 0.00 N ATOM 1225 CA GLN B 198 5.539 -13.459 -5.637 1.00 0.00 C ATOM 1226 C GLN B 198 6.463 -14.642 -5.356 1.00 0.00 C ATOM 1227 O GLN B 198 6.210 -15.755 -5.777 1.00 0.00 O ATOM 1228 CB GLN B 198 6.189 -12.502 -6.638 1.00 0.00 C ATOM 1229 CG GLN B 198 5.825 -12.927 -8.062 1.00 0.00 C ATOM 1230 CD GLN B 198 4.478 -12.315 -8.447 1.00 0.00 C ATOM 1231 OE1 GLN B 198 3.583 -13.013 -8.883 1.00 0.00 O ATOM 1232 NE2 GLN B 198 4.294 -11.032 -8.305 1.00 0.00 N ATOM 0 H GLN B 198 5.669 -11.693 -4.441 1.00 0.00 H new ATOM 0 HA GLN B 198 4.599 -13.860 -6.017 1.00 0.00 H new ATOM 0 HB2 GLN B 198 5.851 -11.482 -6.454 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.272 -12.507 -6.511 1.00 0.00 H new ATOM 0 HG2 GLN B 198 6.597 -12.601 -8.759 1.00 0.00 H new ATOM 0 HG3 GLN B 198 5.775 -14.014 -8.127 1.00 0.00 H new ATOM 0 HE21 GLN B 198 5.045 -10.447 -7.939 1.00 0.00 H new ATOM 0 HE22 GLN B 198 3.399 -10.614 -8.560 1.00 0.00 H new ATOM 1241 N GLN B 199 7.527 -14.405 -4.634 1.00 0.00 N ATOM 1242 CA GLN B 199 8.475 -15.512 -4.302 1.00 0.00 C ATOM 1243 C GLN B 199 7.749 -16.582 -3.484 1.00 0.00 C ATOM 1244 O GLN B 199 8.018 -17.762 -3.609 1.00 0.00 O ATOM 1245 CB GLN B 199 9.587 -14.863 -3.476 1.00 0.00 C ATOM 1246 CG GLN B 199 10.753 -14.486 -4.393 1.00 0.00 C ATOM 1247 CD GLN B 199 10.606 -13.030 -4.836 1.00 0.00 C ATOM 1248 OE1 GLN B 199 10.976 -12.124 -4.117 1.00 0.00 O ATOM 1249 NE2 GLN B 199 10.075 -12.764 -5.999 1.00 0.00 N ATOM 0 H GLN B 199 7.782 -13.491 -4.259 1.00 0.00 H new ATOM 0 HA GLN B 199 8.874 -15.998 -5.192 1.00 0.00 H new ATOM 0 HB2 GLN B 199 9.207 -13.975 -2.970 1.00 0.00 H new ATOM 0 HB3 GLN B 199 9.927 -15.550 -2.702 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.699 -14.624 -3.870 1.00 0.00 H new ATOM 0 HG3 GLN B 199 10.771 -15.142 -5.264 1.00 0.00 H new ATOM 0 HE21 GLN B 199 9.764 -13.524 -6.604 1.00 0.00 H new ATOM 0 HE22 GLN B 199 9.971 -11.796 -6.303 1.00 0.00 H new ATOM 1258 N LEU B 200 6.820 -16.171 -2.659 1.00 0.00 N ATOM 1259 CA LEU B 200 6.052 -17.152 -1.837 1.00 0.00 C ATOM 1260 C LEU B 200 4.984 -17.817 -2.708 1.00 0.00 C ATOM 1261 O LEU B 200 4.642 -18.969 -2.517 1.00 0.00 O ATOM 1262 CB LEU B 200 5.407 -16.324 -0.723 1.00 0.00 C ATOM 1263 CG LEU B 200 4.617 -17.244 0.209 1.00 0.00 C ATOM 1264 CD1 LEU B 200 5.586 -18.026 1.099 1.00 0.00 C ATOM 1265 CD2 LEU B 200 3.688 -16.402 1.087 1.00 0.00 C ATOM 0 H LEU B 200 6.560 -15.195 -2.519 1.00 0.00 H new ATOM 0 HA LEU B 200 6.680 -17.945 -1.430 1.00 0.00 H new ATOM 0 HB2 LEU B 200 6.174 -15.792 -0.161 1.00 0.00 H new ATOM 0 HB3 LEU B 200 4.747 -15.570 -1.152 1.00 0.00 H new ATOM 0 HG LEU B 200 4.026 -17.941 -0.385 1.00 0.00 H new ATOM 0 HD11 LEU B 200 5.022 -18.681 1.763 1.00 0.00 H new ATOM 0 HD12 LEU B 200 6.250 -18.625 0.476 1.00 0.00 H new ATOM 0 HD13 LEU B 200 6.177 -17.329 1.693 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.124 -17.056 1.752 1.00 0.00 H new ATOM 0 HD22 LEU B 200 4.280 -15.705 1.680 1.00 0.00 H new ATOM 0 HD23 LEU B 200 2.997 -15.844 0.455 1.00 0.00 H new ATOM 1277 N GLU B 201 4.464 -17.095 -3.668 1.00 0.00 N ATOM 1278 CA GLU B 201 3.425 -17.674 -4.570 1.00 0.00 C ATOM 1279 C GLU B 201 4.094 -18.566 -5.616 1.00 0.00 C ATOM 1280 O GLU B 201 3.536 -19.556 -6.049 1.00 0.00 O ATOM 1281 CB GLU B 201 2.756 -16.469 -5.239 1.00 0.00 C ATOM 1282 CG GLU B 201 1.434 -16.157 -4.535 1.00 0.00 C ATOM 1283 CD GLU B 201 0.352 -17.122 -5.026 1.00 0.00 C ATOM 1284 OE1 GLU B 201 0.392 -17.483 -6.192 1.00 0.00 O ATOM 1285 OE2 GLU B 201 -0.500 -17.481 -4.231 1.00 0.00 O ATOM 0 H GLU B 201 4.716 -16.127 -3.866 1.00 0.00 H new ATOM 0 HA GLU B 201 2.701 -18.288 -4.034 1.00 0.00 H new ATOM 0 HB2 GLU B 201 3.416 -15.603 -5.194 1.00 0.00 H new ATOM 0 HB3 GLU B 201 2.577 -16.679 -6.293 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.555 -16.248 -3.456 1.00 0.00 H new ATOM 0 HG3 GLU B 201 1.137 -15.128 -4.737 1.00 0.00 H new