USER MOD reduce.3.24.130724 H: found=0, std=0, add=940, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 940 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 79 CYS SG : rot -31:sc= 0.118 USER MOD Set 1.2: A 98 THR OG1 : rot 180:sc= 0.111 USER MOD Set 2.1: A 57 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 50 THR OG1 : rot 82:sc= 0.416 USER MOD Set 3.2: A 54 SER OG : rot 148:sc= 0.0533 USER MOD Single : A 19 TYR OH : rot -169:sc= -0.861 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -4.22! C(o=-4.2!,f=-4!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 69:sc= -0.316 USER MOD Single : A 44 THR OG1 : rot 130:sc= -0.0957 USER MOD Single : A 45 THR OG1 : rot -49:sc= 0.695 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 CYS SG : rot 62:sc= -0.669 USER MOD Single : A 70 THR OG1 : rot -152:sc= -0.742 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -0.0117 X(o=-0.012,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -92:sc= 0.166 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 83:sc= 1.28 USER MOD Single : A 112 THR OG1 : rot -71:sc= -2.03! USER MOD Single : A 115 SER OG : rot 180:sc= 0.00372 USER MOD Single : A 118 GLN : amide:sc= -0.819 X(o=-0.82,f=-0.57) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.0819 K(o=-0.082,f=-0.75) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N PRO A 17 -2.986 6.246 3.176 1.00 0.00 N ATOM 226 CA PRO A 17 -4.398 5.907 3.243 1.00 0.00 C ATOM 227 C PRO A 17 -5.248 6.952 2.517 1.00 0.00 C ATOM 228 O PRO A 17 -5.233 8.128 2.877 1.00 0.00 O ATOM 229 CB PRO A 17 -4.710 5.815 4.728 1.00 0.00 C ATOM 230 CG PRO A 17 -3.588 6.557 5.437 1.00 0.00 C ATOM 231 CD PRO A 17 -2.465 6.770 4.435 1.00 0.00 C ATOM 0 HA PRO A 17 -4.629 4.967 2.742 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -5.678 6.264 4.952 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -4.758 4.776 5.053 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -3.945 7.513 5.820 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -3.232 5.984 6.293 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -2.207 7.825 4.348 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -1.559 6.245 4.738 1.00 0.00 H new ATOM 239 N LEU A 18 -5.969 6.484 1.509 1.00 0.00 N ATOM 240 CA LEU A 18 -6.824 7.364 0.730 1.00 0.00 C ATOM 241 C LEU A 18 -7.821 8.056 1.661 1.00 0.00 C ATOM 242 O LEU A 18 -8.303 7.452 2.618 1.00 0.00 O ATOM 243 CB LEU A 18 -7.485 6.592 -0.415 1.00 0.00 C ATOM 244 CG LEU A 18 -8.322 7.424 -1.389 1.00 0.00 C ATOM 245 CD1 LEU A 18 -7.428 8.183 -2.370 1.00 0.00 C ATOM 246 CD2 LEU A 18 -9.353 6.552 -2.108 1.00 0.00 C ATOM 0 H LEU A 18 -5.979 5.508 1.214 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.233 8.148 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.705 6.082 -0.981 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -8.124 5.820 0.015 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.874 8.169 -0.816 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.048 8.766 -3.051 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.768 8.852 -1.818 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.830 7.473 -2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.935 7.167 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -8.841 5.769 -2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.019 6.097 -1.375 1.00 0.00 H new ATOM 258 N TYR A 19 -8.100 9.312 1.348 1.00 0.00 N ATOM 259 CA TYR A 19 -9.031 10.093 2.145 1.00 0.00 C ATOM 260 C TYR A 19 -10.169 10.639 1.280 1.00 0.00 C ATOM 261 O TYR A 19 -11.329 10.622 1.691 1.00 0.00 O ATOM 262 CB TYR A 19 -8.225 11.266 2.707 1.00 0.00 C ATOM 263 CG TYR A 19 -7.117 10.851 3.677 1.00 0.00 C ATOM 264 CD1 TYR A 19 -7.295 9.758 4.500 1.00 0.00 C ATOM 265 CD2 TYR A 19 -5.941 11.571 3.729 1.00 0.00 C ATOM 266 CE1 TYR A 19 -6.252 9.368 5.414 1.00 0.00 C ATOM 267 CE2 TYR A 19 -4.898 11.180 4.642 1.00 0.00 C ATOM 268 CZ TYR A 19 -5.105 10.098 5.439 1.00 0.00 C ATOM 269 OH TYR A 19 -4.120 9.730 6.302 1.00 0.00 O ATOM 0 H TYR A 19 -7.698 9.809 0.553 1.00 0.00 H new ATOM 0 HA TYR A 19 -9.475 9.478 2.928 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -7.781 11.818 1.879 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -8.904 11.949 3.218 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.216 9.195 4.459 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -5.803 12.427 3.085 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.378 8.515 6.065 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -3.972 11.734 4.692 1.00 0.00 H new ATOM 0 HH TYR A 19 -3.439 10.433 6.340 1.00 0.00 H new ATOM 279 N PHE A 20 -9.798 11.111 0.099 1.00 0.00 N ATOM 280 CA PHE A 20 -10.773 11.662 -0.827 1.00 0.00 C ATOM 281 C PHE A 20 -10.230 11.666 -2.257 1.00 0.00 C ATOM 282 O PHE A 20 -9.018 11.718 -2.464 1.00 0.00 O ATOM 283 CB PHE A 20 -11.039 13.104 -0.391 1.00 0.00 C ATOM 284 CG PHE A 20 -12.346 13.687 -0.932 1.00 0.00 C ATOM 285 CD1 PHE A 20 -13.481 12.938 -0.920 1.00 0.00 C ATOM 286 CD2 PHE A 20 -12.373 14.954 -1.425 1.00 0.00 C ATOM 287 CE1 PHE A 20 -14.694 13.478 -1.423 1.00 0.00 C ATOM 288 CE2 PHE A 20 -13.586 15.495 -1.928 1.00 0.00 C ATOM 289 CZ PHE A 20 -14.721 14.745 -1.916 1.00 0.00 C ATOM 0 H PHE A 20 -8.835 11.123 -0.238 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.681 11.059 -0.814 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -11.058 13.146 0.698 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.210 13.731 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -13.460 11.932 -0.528 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -11.472 15.549 -1.434 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -15.595 12.883 -1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.607 16.501 -2.320 1.00 0.00 H new ATOM 0 HZ PHE A 20 -15.644 15.156 -2.298 1.00 0.00 H new ATOM 299 N GLU A 21 -11.152 11.610 -3.206 1.00 0.00 N ATOM 300 CA GLU A 21 -10.781 11.606 -4.611 1.00 0.00 C ATOM 301 C GLU A 21 -11.947 12.098 -5.470 1.00 0.00 C ATOM 302 O GLU A 21 -13.106 11.816 -5.169 1.00 0.00 O ATOM 303 CB GLU A 21 -10.322 10.215 -5.054 1.00 0.00 C ATOM 304 CG GLU A 21 -11.409 9.170 -4.791 1.00 0.00 C ATOM 305 CD GLU A 21 -11.102 8.367 -3.525 1.00 0.00 C ATOM 306 OE1 GLU A 21 -10.318 8.885 -2.701 1.00 0.00 O ATOM 307 OE2 GLU A 21 -11.659 7.254 -3.410 1.00 0.00 O ATOM 0 H GLU A 21 -12.156 11.567 -3.030 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.942 12.289 -4.746 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.076 10.230 -6.116 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.412 9.941 -4.520 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -12.375 9.663 -4.688 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.485 8.496 -5.644 1.00 0.00 H new ATOM 314 N GLY A 22 -11.601 12.825 -6.522 1.00 0.00 N ATOM 315 CA GLY A 22 -12.605 13.358 -7.427 1.00 0.00 C ATOM 316 C GLY A 22 -11.998 14.402 -8.366 1.00 0.00 C ATOM 317 O GLY A 22 -11.132 15.176 -7.963 1.00 0.00 O ATOM 0 H GLY A 22 -10.639 13.058 -6.768 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -13.040 12.547 -8.011 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -13.415 13.807 -6.853 1.00 0.00 H new ATOM 321 N PHE A 23 -12.476 14.389 -9.602 1.00 0.00 N ATOM 322 CA PHE A 23 -11.991 15.324 -10.602 1.00 0.00 C ATOM 323 C PHE A 23 -11.817 16.722 -10.006 1.00 0.00 C ATOM 324 O PHE A 23 -12.794 17.440 -9.799 1.00 0.00 O ATOM 325 CB PHE A 23 -13.046 15.383 -11.709 1.00 0.00 C ATOM 326 CG PHE A 23 -12.861 14.328 -12.801 1.00 0.00 C ATOM 327 CD1 PHE A 23 -11.643 14.155 -13.380 1.00 0.00 C ATOM 328 CD2 PHE A 23 -13.915 13.564 -13.195 1.00 0.00 C ATOM 329 CE1 PHE A 23 -11.471 13.176 -14.394 1.00 0.00 C ATOM 330 CE2 PHE A 23 -13.744 12.585 -14.209 1.00 0.00 C ATOM 331 CZ PHE A 23 -12.525 12.412 -14.787 1.00 0.00 C ATOM 0 H PHE A 23 -13.194 13.745 -9.933 1.00 0.00 H new ATOM 0 HA PHE A 23 -11.023 14.995 -10.980 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -14.033 15.260 -11.263 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -13.023 16.372 -12.166 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -10.806 14.762 -13.069 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -14.883 13.702 -12.736 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.503 13.038 -14.853 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -14.581 11.978 -14.521 1.00 0.00 H new ATOM 0 HZ PHE A 23 -12.394 11.668 -15.558 1.00 0.00 H new ATOM 341 N LEU A 24 -10.564 17.068 -9.747 1.00 0.00 N ATOM 342 CA LEU A 24 -10.248 18.368 -9.179 1.00 0.00 C ATOM 343 C LEU A 24 -9.548 19.225 -10.235 1.00 0.00 C ATOM 344 O LEU A 24 -8.857 18.700 -11.107 1.00 0.00 O ATOM 345 CB LEU A 24 -9.445 18.207 -7.886 1.00 0.00 C ATOM 346 CG LEU A 24 -9.345 19.450 -7.000 1.00 0.00 C ATOM 347 CD1 LEU A 24 -10.719 19.850 -6.459 1.00 0.00 C ATOM 348 CD2 LEU A 24 -8.326 19.242 -5.878 1.00 0.00 C ATOM 0 H LEU A 24 -9.756 16.470 -9.920 1.00 0.00 H new ATOM 0 HA LEU A 24 -11.161 18.892 -8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.893 17.403 -7.301 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -8.436 17.888 -8.146 1.00 0.00 H new ATOM 0 HG LEU A 24 -8.987 20.278 -7.612 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.619 20.736 -5.832 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.389 20.067 -7.291 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.129 19.032 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.274 20.140 -5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -8.631 18.397 -5.261 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.346 19.041 -6.310 1.00 0.00 H new ATOM 360 N LEU A 25 -9.751 20.529 -10.122 1.00 0.00 N ATOM 361 CA LEU A 25 -9.148 21.464 -11.056 1.00 0.00 C ATOM 362 C LEU A 25 -7.939 22.131 -10.396 1.00 0.00 C ATOM 363 O LEU A 25 -8.046 22.664 -9.293 1.00 0.00 O ATOM 364 CB LEU A 25 -10.192 22.457 -11.570 1.00 0.00 C ATOM 365 CG LEU A 25 -11.210 21.903 -12.569 1.00 0.00 C ATOM 366 CD1 LEU A 25 -12.532 22.669 -12.488 1.00 0.00 C ATOM 367 CD2 LEU A 25 -10.638 21.895 -13.988 1.00 0.00 C ATOM 0 H LEU A 25 -10.325 20.960 -9.397 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.781 20.937 -11.937 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -10.734 22.859 -10.714 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -9.671 23.292 -12.038 1.00 0.00 H new ATOM 0 HG LEU A 25 -11.421 20.868 -12.301 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -13.237 22.255 -13.208 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -12.944 22.578 -11.483 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -12.358 23.721 -12.715 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -11.382 21.497 -14.678 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -10.379 22.912 -14.282 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -9.745 21.270 -14.017 1.00 0.00 H new ATOM 379 N ILE A 26 -6.817 22.077 -11.098 1.00 0.00 N ATOM 380 CA ILE A 26 -5.590 22.669 -10.594 1.00 0.00 C ATOM 381 C ILE A 26 -5.162 23.811 -11.518 1.00 0.00 C ATOM 382 O ILE A 26 -5.042 23.624 -12.728 1.00 0.00 O ATOM 383 CB ILE A 26 -4.516 21.596 -10.405 1.00 0.00 C ATOM 384 CG1 ILE A 26 -5.087 20.368 -9.693 1.00 0.00 C ATOM 385 CG2 ILE A 26 -3.295 22.163 -9.679 1.00 0.00 C ATOM 386 CD1 ILE A 26 -5.423 20.687 -8.234 1.00 0.00 C ATOM 0 H ILE A 26 -6.732 21.632 -12.012 1.00 0.00 H new ATOM 0 HA ILE A 26 -5.754 23.102 -9.607 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.182 21.271 -11.390 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.984 20.027 -10.210 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -4.366 19.552 -9.734 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.547 21.379 -9.558 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.872 22.981 -10.262 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -3.594 22.534 -8.699 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.827 19.797 -7.751 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.519 21.004 -7.713 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -6.162 21.487 -8.197 1.00 0.00 H new ATOM 398 N LYS A 27 -4.943 24.969 -10.913 1.00 0.00 N ATOM 399 CA LYS A 27 -4.531 26.141 -11.666 1.00 0.00 C ATOM 400 C LYS A 27 -3.252 26.714 -11.051 1.00 0.00 C ATOM 401 O LYS A 27 -3.273 27.229 -9.934 1.00 0.00 O ATOM 402 CB LYS A 27 -5.677 27.151 -11.755 1.00 0.00 C ATOM 403 CG LYS A 27 -5.513 28.060 -12.975 1.00 0.00 C ATOM 404 CD LYS A 27 -5.849 29.511 -12.626 1.00 0.00 C ATOM 405 CE LYS A 27 -6.978 30.041 -13.512 1.00 0.00 C ATOM 406 NZ LYS A 27 -6.449 30.995 -14.512 1.00 0.00 N ATOM 0 H LYS A 27 -5.043 25.121 -9.909 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.296 25.869 -12.695 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.628 26.623 -11.816 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.705 27.755 -10.848 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.489 27.999 -13.344 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.163 27.716 -13.780 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.142 29.578 -11.578 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.963 30.133 -12.749 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.471 29.211 -14.018 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -7.732 30.532 -12.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.229 31.345 -15.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -5.999 31.796 -14.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -5.747 30.516 -15.111 1.00 0.00 H new ATOM 522 N TYR A 34 -8.173 26.290 -15.908 1.00 0.00 N ATOM 523 CA TYR A 34 -8.327 25.160 -15.008 1.00 0.00 C ATOM 524 C TYR A 34 -8.431 23.847 -15.787 1.00 0.00 C ATOM 525 O TYR A 34 -9.269 23.715 -16.678 1.00 0.00 O ATOM 526 CB TYR A 34 -9.638 25.397 -14.254 1.00 0.00 C ATOM 527 CG TYR A 34 -9.546 26.472 -13.170 1.00 0.00 C ATOM 528 CD1 TYR A 34 -8.925 26.192 -11.970 1.00 0.00 C ATOM 529 CD2 TYR A 34 -10.085 27.723 -13.392 1.00 0.00 C ATOM 530 CE1 TYR A 34 -8.839 27.204 -10.949 1.00 0.00 C ATOM 531 CE2 TYR A 34 -9.999 28.736 -12.371 1.00 0.00 C ATOM 532 CZ TYR A 34 -9.380 28.426 -11.200 1.00 0.00 C ATOM 533 OH TYR A 34 -9.298 29.382 -10.236 1.00 0.00 O ATOM 0 HA TYR A 34 -7.469 25.082 -14.341 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -10.410 25.681 -14.969 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.957 24.460 -13.796 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -8.503 25.213 -11.796 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.571 27.943 -14.331 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.356 26.997 -10.006 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.416 29.719 -12.532 1.00 0.00 H new ATOM 0 HH TYR A 34 -9.726 30.205 -10.554 1.00 0.00 H new ATOM 543 N GLU A 35 -7.568 22.910 -15.423 1.00 0.00 N ATOM 544 CA GLU A 35 -7.553 21.613 -16.077 1.00 0.00 C ATOM 545 C GLU A 35 -8.198 20.557 -15.178 1.00 0.00 C ATOM 546 O GLU A 35 -8.061 20.609 -13.956 1.00 0.00 O ATOM 547 CB GLU A 35 -6.127 21.209 -16.461 1.00 0.00 C ATOM 548 CG GLU A 35 -5.665 21.954 -17.715 1.00 0.00 C ATOM 549 CD GLU A 35 -6.309 21.364 -18.971 1.00 0.00 C ATOM 550 OE1 GLU A 35 -6.241 20.124 -19.115 1.00 0.00 O ATOM 551 OE2 GLU A 35 -6.854 22.166 -19.760 1.00 0.00 O ATOM 0 H GLU A 35 -6.874 23.023 -14.684 1.00 0.00 H new ATOM 0 HA GLU A 35 -8.136 21.685 -16.995 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.449 21.425 -15.635 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.084 20.134 -16.636 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -5.923 23.010 -17.631 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.580 21.897 -17.797 1.00 0.00 H new ATOM 558 N HIS A 36 -8.889 19.624 -15.816 1.00 0.00 N ATOM 559 CA HIS A 36 -9.556 18.557 -15.089 1.00 0.00 C ATOM 560 C HIS A 36 -8.614 17.358 -14.958 1.00 0.00 C ATOM 561 O HIS A 36 -8.300 16.700 -15.948 1.00 0.00 O ATOM 562 CB HIS A 36 -10.886 18.197 -15.753 1.00 0.00 C ATOM 563 CG HIS A 36 -11.803 19.376 -15.971 1.00 0.00 C ATOM 564 ND1 HIS A 36 -11.725 20.191 -17.087 1.00 0.00 N ATOM 565 CD2 HIS A 36 -12.819 19.869 -15.205 1.00 0.00 C ATOM 566 CE1 HIS A 36 -12.655 21.128 -16.987 1.00 0.00 C ATOM 567 NE2 HIS A 36 -13.332 20.928 -15.820 1.00 0.00 N ATOM 0 H HIS A 36 -9.002 19.585 -16.829 1.00 0.00 H new ATOM 0 HA HIS A 36 -9.799 18.895 -14.082 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -10.684 17.724 -16.714 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -11.400 17.459 -15.137 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -13.150 19.466 -14.259 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -12.844 21.913 -17.704 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -14.105 21.498 -15.476 1.00 0.00 H new ATOM 575 N TYR A 37 -8.190 17.111 -13.727 1.00 0.00 N ATOM 576 CA TYR A 37 -7.291 16.003 -13.454 1.00 0.00 C ATOM 577 C TYR A 37 -7.792 15.169 -12.273 1.00 0.00 C ATOM 578 O TYR A 37 -8.229 15.717 -11.262 1.00 0.00 O ATOM 579 CB TYR A 37 -5.947 16.633 -13.084 1.00 0.00 C ATOM 580 CG TYR A 37 -5.107 17.061 -14.289 1.00 0.00 C ATOM 581 CD1 TYR A 37 -4.432 16.113 -15.031 1.00 0.00 C ATOM 582 CD2 TYR A 37 -5.025 18.394 -14.634 1.00 0.00 C ATOM 583 CE1 TYR A 37 -3.642 16.516 -16.166 1.00 0.00 C ATOM 584 CE2 TYR A 37 -4.235 18.797 -15.768 1.00 0.00 C ATOM 585 CZ TYR A 37 -3.582 17.838 -16.478 1.00 0.00 C ATOM 586 OH TYR A 37 -2.836 18.219 -17.550 1.00 0.00 O ATOM 0 H TYR A 37 -8.453 17.659 -12.908 1.00 0.00 H new ATOM 0 HA TYR A 37 -7.220 15.344 -14.319 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -6.127 17.503 -12.452 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -5.375 15.920 -12.490 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -4.496 15.069 -14.761 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -5.554 19.135 -14.053 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.109 15.785 -16.756 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -4.162 19.837 -16.049 1.00 0.00 H new ATOM 0 HH TYR A 37 -2.886 19.192 -17.654 1.00 0.00 H new ATOM 596 N TRP A 38 -7.712 13.857 -12.441 1.00 0.00 N ATOM 597 CA TRP A 38 -8.152 12.941 -11.402 1.00 0.00 C ATOM 598 C TRP A 38 -7.227 13.116 -10.195 1.00 0.00 C ATOM 599 O TRP A 38 -6.154 12.518 -10.140 1.00 0.00 O ATOM 600 CB TRP A 38 -8.194 11.503 -11.920 1.00 0.00 C ATOM 601 CG TRP A 38 -8.572 10.469 -10.858 1.00 0.00 C ATOM 602 CD1 TRP A 38 -7.762 9.626 -10.202 1.00 0.00 C ATOM 603 CD2 TRP A 38 -9.897 10.201 -10.351 1.00 0.00 C ATOM 604 NE1 TRP A 38 -8.465 8.838 -9.313 1.00 0.00 N ATOM 605 CE2 TRP A 38 -9.805 9.199 -9.407 1.00 0.00 C ATOM 606 CE3 TRP A 38 -11.132 10.787 -10.680 1.00 0.00 C ATOM 607 CZ2 TRP A 38 -10.911 8.694 -8.714 1.00 0.00 C ATOM 608 CZ3 TRP A 38 -12.228 10.272 -9.979 1.00 0.00 C ATOM 609 CH2 TRP A 38 -12.153 9.263 -9.025 1.00 0.00 C ATOM 0 H TRP A 38 -7.349 13.406 -13.281 1.00 0.00 H new ATOM 0 HA TRP A 38 -9.173 13.168 -11.094 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -8.909 11.444 -12.740 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -7.217 11.247 -12.330 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.694 9.570 -10.350 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -8.074 8.123 -8.700 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -11.227 11.572 -11.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -10.813 7.908 -7.979 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -13.201 10.688 -10.194 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -13.047 8.920 -8.526 1.00 0.00 H new ATOM 620 N THR A 39 -7.678 13.937 -9.259 1.00 0.00 N ATOM 621 CA THR A 39 -6.904 14.198 -8.057 1.00 0.00 C ATOM 622 C THR A 39 -7.242 13.173 -6.972 1.00 0.00 C ATOM 623 O THR A 39 -8.397 12.776 -6.827 1.00 0.00 O ATOM 624 CB THR A 39 -7.166 15.643 -7.629 1.00 0.00 C ATOM 625 OG1 THR A 39 -6.475 16.424 -8.601 1.00 0.00 O ATOM 626 CG2 THR A 39 -6.479 15.998 -6.309 1.00 0.00 C ATOM 0 H THR A 39 -8.569 14.430 -9.308 1.00 0.00 H new ATOM 0 HA THR A 39 -5.836 14.088 -8.244 1.00 0.00 H new ATOM 0 HB THR A 39 -8.240 15.803 -7.533 1.00 0.00 H new ATOM 0 HG1 THR A 39 -6.929 16.346 -9.466 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.698 17.034 -6.052 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.847 15.343 -5.519 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.402 15.870 -6.414 1.00 0.00 H new ATOM 634 N GLU A 40 -6.213 12.773 -6.239 1.00 0.00 N ATOM 635 CA GLU A 40 -6.387 11.802 -5.173 1.00 0.00 C ATOM 636 C GLU A 40 -5.690 12.283 -3.898 1.00 0.00 C ATOM 637 O GLU A 40 -4.509 12.628 -3.924 1.00 0.00 O ATOM 638 CB GLU A 40 -5.868 10.426 -5.595 1.00 0.00 C ATOM 639 CG GLU A 40 -6.883 9.707 -6.486 1.00 0.00 C ATOM 640 CD GLU A 40 -6.507 8.236 -6.670 1.00 0.00 C ATOM 641 OE1 GLU A 40 -5.344 7.991 -7.059 1.00 0.00 O ATOM 642 OE2 GLU A 40 -7.390 7.388 -6.416 1.00 0.00 O ATOM 0 H GLU A 40 -5.256 13.104 -6.363 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.453 11.705 -4.967 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.924 10.537 -6.129 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.664 9.823 -4.710 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.876 9.779 -6.043 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.931 10.198 -7.458 1.00 0.00 H new ATOM 649 N LEU A 41 -6.450 12.291 -2.813 1.00 0.00 N ATOM 650 CA LEU A 41 -5.921 12.724 -1.531 1.00 0.00 C ATOM 651 C LEU A 41 -5.357 11.515 -0.782 1.00 0.00 C ATOM 652 O LEU A 41 -6.055 10.520 -0.588 1.00 0.00 O ATOM 653 CB LEU A 41 -6.984 13.494 -0.745 1.00 0.00 C ATOM 654 CG LEU A 41 -6.483 14.694 0.062 1.00 0.00 C ATOM 655 CD1 LEU A 41 -7.626 15.345 0.842 1.00 0.00 C ATOM 656 CD2 LEU A 41 -5.321 14.294 0.974 1.00 0.00 C ATOM 0 H LEU A 41 -7.429 12.004 -2.795 1.00 0.00 H new ATOM 0 HA LEU A 41 -5.097 13.422 -1.675 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -7.743 13.843 -1.445 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.475 12.801 -0.062 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.103 15.441 -0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.243 16.195 1.407 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.393 15.687 0.147 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.058 14.618 1.529 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.983 15.165 1.536 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.652 13.520 1.667 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.499 13.912 0.369 1.00 0.00 H new ATOM 668 N ARG A 42 -4.101 11.640 -0.382 1.00 0.00 N ATOM 669 CA ARG A 42 -3.436 10.569 0.342 1.00 0.00 C ATOM 670 C ARG A 42 -2.454 11.148 1.362 1.00 0.00 C ATOM 671 O ARG A 42 -1.607 11.971 1.017 1.00 0.00 O ATOM 672 CB ARG A 42 -2.680 9.644 -0.615 1.00 0.00 C ATOM 673 CG ARG A 42 -3.647 8.915 -1.550 1.00 0.00 C ATOM 674 CD ARG A 42 -3.013 7.638 -2.106 1.00 0.00 C ATOM 675 NE ARG A 42 -3.461 7.416 -3.499 1.00 0.00 N ATOM 676 CZ ARG A 42 -2.970 6.463 -4.303 1.00 0.00 C ATOM 677 NH1 ARG A 42 -2.013 5.638 -3.857 1.00 0.00 N ATOM 678 NH2 ARG A 42 -3.436 6.335 -5.553 1.00 0.00 N ATOM 0 H ARG A 42 -3.526 12.466 -0.545 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.203 9.991 0.858 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -1.969 10.225 -1.202 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -2.103 8.917 -0.044 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.562 8.667 -1.012 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -3.930 9.573 -2.372 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -1.926 7.717 -2.073 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -3.289 6.785 -1.486 1.00 0.00 H new ATOM 0 HE ARG A 42 -4.189 8.027 -3.870 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -1.658 5.735 -2.906 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -1.639 4.913 -4.469 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -4.164 6.963 -5.893 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -3.062 5.610 -6.165 1.00 0.00 H new ATOM 692 N GLY A 43 -2.600 10.696 2.599 1.00 0.00 N ATOM 693 CA GLY A 43 -1.737 11.159 3.672 1.00 0.00 C ATOM 694 C GLY A 43 -1.667 12.687 3.699 1.00 0.00 C ATOM 695 O GLY A 43 -2.497 13.339 4.331 1.00 0.00 O ATOM 0 H GLY A 43 -3.303 10.014 2.882 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.110 10.792 4.628 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.736 10.748 3.541 1.00 0.00 H new ATOM 699 N THR A 44 -0.670 13.215 3.005 1.00 0.00 N ATOM 700 CA THR A 44 -0.481 14.654 2.941 1.00 0.00 C ATOM 701 C THR A 44 0.196 15.046 1.626 1.00 0.00 C ATOM 702 O THR A 44 0.964 16.005 1.580 1.00 0.00 O ATOM 703 CB THR A 44 0.307 15.083 4.181 1.00 0.00 C ATOM 704 OG1 THR A 44 1.325 14.093 4.305 1.00 0.00 O ATOM 705 CG2 THR A 44 -0.507 14.943 5.469 1.00 0.00 C ATOM 0 H THR A 44 0.016 12.671 2.482 1.00 0.00 H new ATOM 0 HA THR A 44 -1.437 15.178 2.947 1.00 0.00 H new ATOM 0 HB THR A 44 0.630 16.118 4.066 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.196 14.530 4.408 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.098 15.260 6.318 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.399 15.567 5.406 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.801 13.902 5.602 1.00 0.00 H new ATOM 713 N THR A 45 -0.114 14.282 0.588 1.00 0.00 N ATOM 714 CA THR A 45 0.455 14.538 -0.724 1.00 0.00 C ATOM 715 C THR A 45 -0.623 14.420 -1.804 1.00 0.00 C ATOM 716 O THR A 45 -1.167 13.340 -2.028 1.00 0.00 O ATOM 717 CB THR A 45 1.626 13.575 -0.928 1.00 0.00 C ATOM 718 OG1 THR A 45 2.663 14.111 -0.110 1.00 0.00 O ATOM 719 CG2 THR A 45 2.198 13.639 -2.345 1.00 0.00 C ATOM 0 H THR A 45 -0.751 13.487 0.629 1.00 0.00 H new ATOM 0 HA THR A 45 0.836 15.556 -0.798 1.00 0.00 H new ATOM 0 HB THR A 45 1.299 12.557 -0.715 1.00 0.00 H new ATOM 0 HG1 THR A 45 2.759 15.070 -0.290 1.00 0.00 H new ATOM 0 HG21 THR A 45 3.026 12.936 -2.435 1.00 0.00 H new ATOM 0 HG22 THR A 45 1.421 13.378 -3.063 1.00 0.00 H new ATOM 0 HG23 THR A 45 2.555 14.649 -2.548 1.00 0.00 H new ATOM 727 N LEU A 46 -0.898 15.547 -2.445 1.00 0.00 N ATOM 728 CA LEU A 46 -1.901 15.584 -3.496 1.00 0.00 C ATOM 729 C LEU A 46 -1.336 14.926 -4.757 1.00 0.00 C ATOM 730 O LEU A 46 -0.235 15.258 -5.195 1.00 0.00 O ATOM 731 CB LEU A 46 -2.393 17.015 -3.717 1.00 0.00 C ATOM 732 CG LEU A 46 -3.439 17.526 -2.724 1.00 0.00 C ATOM 733 CD1 LEU A 46 -3.647 19.034 -2.874 1.00 0.00 C ATOM 734 CD2 LEU A 46 -4.750 16.749 -2.861 1.00 0.00 C ATOM 0 H LEU A 46 -0.444 16.441 -2.257 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.781 15.011 -3.203 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.532 17.683 -3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.811 17.083 -4.721 1.00 0.00 H new ATOM 0 HG LEU A 46 -3.066 17.352 -1.715 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.395 19.371 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.706 19.551 -2.687 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.988 19.255 -3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.476 17.132 -2.144 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -5.140 16.869 -3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.569 15.692 -2.665 1.00 0.00 H new ATOM 746 N PHE A 47 -2.116 14.006 -5.306 1.00 0.00 N ATOM 747 CA PHE A 47 -1.707 13.299 -6.507 1.00 0.00 C ATOM 748 C PHE A 47 -2.674 13.574 -7.661 1.00 0.00 C ATOM 749 O PHE A 47 -3.868 13.300 -7.553 1.00 0.00 O ATOM 750 CB PHE A 47 -1.736 11.805 -6.179 1.00 0.00 C ATOM 751 CG PHE A 47 -0.580 11.340 -5.291 1.00 0.00 C ATOM 752 CD1 PHE A 47 -0.703 11.383 -3.937 1.00 0.00 C ATOM 753 CD2 PHE A 47 0.571 10.884 -5.855 1.00 0.00 C ATOM 754 CE1 PHE A 47 0.370 10.952 -3.113 1.00 0.00 C ATOM 755 CE2 PHE A 47 1.643 10.453 -5.031 1.00 0.00 C ATOM 756 CZ PHE A 47 1.521 10.496 -3.677 1.00 0.00 C ATOM 0 H PHE A 47 -3.029 13.734 -4.941 1.00 0.00 H new ATOM 0 HA PHE A 47 -0.714 13.629 -6.813 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -2.678 11.571 -5.684 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.716 11.239 -7.110 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -1.617 11.745 -3.489 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.669 10.850 -6.930 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.272 10.986 -2.038 1.00 0.00 H new ATOM 0 HE2 PHE A 47 2.556 10.091 -5.479 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.337 10.168 -3.050 1.00 0.00 H new ATOM 766 N PHE A 48 -2.121 14.112 -8.738 1.00 0.00 N ATOM 767 CA PHE A 48 -2.920 14.427 -9.911 1.00 0.00 C ATOM 768 C PHE A 48 -2.737 13.368 -11.000 1.00 0.00 C ATOM 769 O PHE A 48 -1.620 12.921 -11.254 1.00 0.00 O ATOM 770 CB PHE A 48 -2.426 15.775 -10.439 1.00 0.00 C ATOM 771 CG PHE A 48 -2.327 16.865 -9.369 1.00 0.00 C ATOM 772 CD1 PHE A 48 -3.369 17.082 -8.521 1.00 0.00 C ATOM 773 CD2 PHE A 48 -1.198 17.616 -9.265 1.00 0.00 C ATOM 774 CE1 PHE A 48 -3.277 18.093 -7.528 1.00 0.00 C ATOM 775 CE2 PHE A 48 -1.107 18.627 -8.272 1.00 0.00 C ATOM 776 CZ PHE A 48 -2.149 18.844 -7.425 1.00 0.00 C ATOM 0 H PHE A 48 -1.130 14.338 -8.823 1.00 0.00 H new ATOM 0 HA PHE A 48 -3.977 14.456 -9.645 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -1.445 15.638 -10.895 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.099 16.114 -11.227 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -4.266 16.486 -8.603 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.371 17.444 -9.938 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -4.104 18.265 -6.855 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.211 19.224 -8.189 1.00 0.00 H new ATOM 0 HZ PHE A 48 -2.080 19.613 -6.670 1.00 0.00 H new ATOM 786 N TYR A 49 -3.851 12.998 -11.613 1.00 0.00 N ATOM 787 CA TYR A 49 -3.828 12.000 -12.669 1.00 0.00 C ATOM 788 C TYR A 49 -4.665 12.450 -13.868 1.00 0.00 C ATOM 789 O TYR A 49 -5.807 12.877 -13.707 1.00 0.00 O ATOM 790 CB TYR A 49 -4.453 10.738 -12.071 1.00 0.00 C ATOM 791 CG TYR A 49 -3.550 10.007 -11.076 1.00 0.00 C ATOM 792 CD1 TYR A 49 -2.581 9.137 -11.534 1.00 0.00 C ATOM 793 CD2 TYR A 49 -3.703 10.218 -9.721 1.00 0.00 C ATOM 794 CE1 TYR A 49 -1.731 8.449 -10.598 1.00 0.00 C ATOM 795 CE2 TYR A 49 -2.852 9.530 -8.784 1.00 0.00 C ATOM 796 CZ TYR A 49 -1.908 8.679 -9.269 1.00 0.00 C ATOM 797 OH TYR A 49 -1.105 8.029 -8.385 1.00 0.00 O ATOM 0 H TYR A 49 -4.776 13.371 -11.399 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.809 11.836 -13.019 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -5.383 11.008 -11.571 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -4.712 10.055 -12.880 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -2.461 8.973 -12.595 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -4.461 10.899 -9.363 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -0.970 7.765 -10.943 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.961 9.686 -7.721 1.00 0.00 H new ATOM 0 HH TYR A 49 -1.344 8.291 -7.472 1.00 0.00 H new ATOM 807 N THR A 50 -4.063 12.340 -15.044 1.00 0.00 N ATOM 808 CA THR A 50 -4.739 12.731 -16.269 1.00 0.00 C ATOM 809 C THR A 50 -5.997 11.885 -16.477 1.00 0.00 C ATOM 810 O THR A 50 -6.968 12.348 -17.074 1.00 0.00 O ATOM 811 CB THR A 50 -3.735 12.619 -17.418 1.00 0.00 C ATOM 812 OG1 THR A 50 -3.511 11.218 -17.549 1.00 0.00 O ATOM 813 CG2 THR A 50 -2.361 13.184 -17.053 1.00 0.00 C ATOM 0 H THR A 50 -3.115 11.986 -15.174 1.00 0.00 H new ATOM 0 HA THR A 50 -5.084 13.764 -16.219 1.00 0.00 H new ATOM 0 HB THR A 50 -4.123 13.145 -18.291 1.00 0.00 H new ATOM 0 HG1 THR A 50 -4.231 10.820 -18.082 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.687 13.080 -17.903 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.458 14.238 -16.794 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.957 12.637 -16.201 1.00 0.00 H new ATOM 821 N ASP A 51 -5.939 10.661 -15.973 1.00 0.00 N ATOM 822 CA ASP A 51 -7.062 9.747 -16.097 1.00 0.00 C ATOM 823 C ASP A 51 -6.883 8.591 -15.111 1.00 0.00 C ATOM 824 O ASP A 51 -5.770 8.318 -14.665 1.00 0.00 O ATOM 825 CB ASP A 51 -7.141 9.159 -17.507 1.00 0.00 C ATOM 826 CG ASP A 51 -7.186 10.190 -18.636 1.00 0.00 C ATOM 827 OD1 ASP A 51 -6.115 10.770 -18.918 1.00 0.00 O ATOM 828 OD2 ASP A 51 -8.290 10.375 -19.192 1.00 0.00 O ATOM 0 H ASP A 51 -5.132 10.281 -15.478 1.00 0.00 H new ATOM 0 HA ASP A 51 -7.975 10.304 -15.888 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -6.279 8.510 -17.662 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -8.029 8.531 -17.573 1.00 0.00 H new ATOM 833 N LYS A 52 -7.996 7.943 -14.800 1.00 0.00 N ATOM 834 CA LYS A 52 -7.977 6.822 -13.875 1.00 0.00 C ATOM 835 C LYS A 52 -7.124 5.696 -14.464 1.00 0.00 C ATOM 836 O LYS A 52 -6.406 5.012 -13.737 1.00 0.00 O ATOM 837 CB LYS A 52 -9.402 6.394 -13.522 1.00 0.00 C ATOM 838 CG LYS A 52 -10.144 5.883 -14.759 1.00 0.00 C ATOM 839 CD LYS A 52 -11.617 5.617 -14.444 1.00 0.00 C ATOM 840 CE LYS A 52 -12.206 4.585 -15.409 1.00 0.00 C ATOM 841 NZ LYS A 52 -13.675 4.506 -15.248 1.00 0.00 N ATOM 0 H LYS A 52 -8.917 8.173 -15.172 1.00 0.00 H new ATOM 0 HA LYS A 52 -7.515 7.114 -12.932 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.373 5.613 -12.762 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -9.943 7.237 -13.092 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -10.067 6.616 -15.562 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -9.674 4.967 -15.117 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -11.715 5.259 -13.419 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.181 6.547 -14.512 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.961 4.857 -16.436 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -11.760 3.608 -15.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -14.059 3.802 -15.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -13.903 4.226 -14.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.097 5.435 -15.448 1.00 0.00 H new ATOM 855 N LYS A 53 -7.231 5.539 -15.775 1.00 0.00 N ATOM 856 CA LYS A 53 -6.479 4.508 -16.469 1.00 0.00 C ATOM 857 C LYS A 53 -4.990 4.674 -16.161 1.00 0.00 C ATOM 858 O LYS A 53 -4.301 3.699 -15.865 1.00 0.00 O ATOM 859 CB LYS A 53 -6.803 4.524 -17.965 1.00 0.00 C ATOM 860 CG LYS A 53 -8.111 3.783 -18.251 1.00 0.00 C ATOM 861 CD LYS A 53 -7.906 2.268 -18.197 1.00 0.00 C ATOM 862 CE LYS A 53 -7.137 1.775 -19.425 1.00 0.00 C ATOM 863 NZ LYS A 53 -5.949 0.995 -19.014 1.00 0.00 N ATOM 0 H LYS A 53 -7.827 6.109 -16.375 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.770 3.520 -16.113 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -6.881 5.554 -18.313 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -5.989 4.060 -18.522 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -8.867 4.077 -17.523 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -8.487 4.068 -19.234 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -7.360 2.003 -17.291 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -8.873 1.768 -18.144 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -7.787 1.158 -20.045 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -6.828 2.625 -20.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -5.439 0.668 -19.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -5.321 1.594 -18.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.251 0.173 -18.452 1.00 0.00 H new ATOM 877 N SER A 54 -4.537 5.916 -16.240 1.00 0.00 N ATOM 878 CA SER A 54 -3.141 6.222 -15.973 1.00 0.00 C ATOM 879 C SER A 54 -2.724 5.627 -14.627 1.00 0.00 C ATOM 880 O SER A 54 -3.475 5.691 -13.655 1.00 0.00 O ATOM 881 CB SER A 54 -2.897 7.733 -15.983 1.00 0.00 C ATOM 882 OG SER A 54 -2.398 8.184 -17.239 1.00 0.00 O ATOM 0 H SER A 54 -5.111 6.723 -16.485 1.00 0.00 H new ATOM 0 HA SER A 54 -2.536 5.778 -16.763 1.00 0.00 H new ATOM 0 HB2 SER A 54 -3.828 8.252 -15.755 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.187 7.991 -15.197 1.00 0.00 H new ATOM 0 HG SER A 54 -2.713 9.097 -17.408 1.00 0.00 H new ATOM 888 N ILE A 55 -1.526 5.060 -14.613 1.00 0.00 N ATOM 889 CA ILE A 55 -0.999 4.453 -13.402 1.00 0.00 C ATOM 890 C ILE A 55 -0.187 5.493 -12.628 1.00 0.00 C ATOM 891 O ILE A 55 -0.352 5.639 -11.418 1.00 0.00 O ATOM 892 CB ILE A 55 -0.213 3.184 -13.738 1.00 0.00 C ATOM 893 CG1 ILE A 55 -1.108 2.149 -14.422 1.00 0.00 C ATOM 894 CG2 ILE A 55 0.470 2.617 -12.491 1.00 0.00 C ATOM 895 CD1 ILE A 55 -2.224 1.683 -13.484 1.00 0.00 C ATOM 0 H ILE A 55 -0.905 5.008 -15.421 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.812 4.133 -12.750 1.00 0.00 H new ATOM 0 HB ILE A 55 0.573 3.446 -14.446 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.543 2.579 -15.325 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -0.509 1.293 -14.733 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.022 1.715 -12.757 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.159 3.358 -12.085 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -0.284 2.373 -11.742 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -2.845 0.948 -13.995 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.786 1.232 -12.594 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -2.836 2.537 -13.194 1.00 0.00 H new ATOM 907 N ILE A 56 0.673 6.189 -13.357 1.00 0.00 N ATOM 908 CA ILE A 56 1.511 7.211 -12.753 1.00 0.00 C ATOM 909 C ILE A 56 0.742 8.532 -12.704 1.00 0.00 C ATOM 910 O ILE A 56 -0.100 8.796 -13.561 1.00 0.00 O ATOM 911 CB ILE A 56 2.851 7.306 -13.486 1.00 0.00 C ATOM 912 CG1 ILE A 56 3.567 5.954 -13.499 1.00 0.00 C ATOM 913 CG2 ILE A 56 3.725 8.412 -12.889 1.00 0.00 C ATOM 914 CD1 ILE A 56 3.870 5.508 -14.930 1.00 0.00 C ATOM 0 H ILE A 56 0.808 6.065 -14.360 1.00 0.00 H new ATOM 0 HA ILE A 56 1.754 6.946 -11.724 1.00 0.00 H new ATOM 0 HB ILE A 56 2.654 7.575 -14.524 1.00 0.00 H new ATOM 0 HG12 ILE A 56 4.495 6.025 -12.932 1.00 0.00 H new ATOM 0 HG13 ILE A 56 2.948 5.206 -13.005 1.00 0.00 H new ATOM 0 HG21 ILE A 56 4.671 8.459 -13.428 1.00 0.00 H new ATOM 0 HG22 ILE A 56 3.211 9.369 -12.976 1.00 0.00 H new ATOM 0 HG23 ILE A 56 3.916 8.197 -11.838 1.00 0.00 H new ATOM 0 HD11 ILE A 56 4.379 4.544 -14.911 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.938 5.415 -15.487 1.00 0.00 H new ATOM 0 HD13 ILE A 56 4.509 6.246 -15.414 1.00 0.00 H new ATOM 926 N TYR A 57 1.058 9.327 -11.693 1.00 0.00 N ATOM 927 CA TYR A 57 0.407 10.615 -11.521 1.00 0.00 C ATOM 928 C TYR A 57 1.136 11.707 -12.305 1.00 0.00 C ATOM 929 O TYR A 57 2.345 11.882 -12.156 1.00 0.00 O ATOM 930 CB TYR A 57 0.491 10.933 -10.027 1.00 0.00 C ATOM 931 CG TYR A 57 1.920 11.084 -9.502 1.00 0.00 C ATOM 932 CD1 TYR A 57 2.538 12.318 -9.527 1.00 0.00 C ATOM 933 CD2 TYR A 57 2.592 9.987 -9.004 1.00 0.00 C ATOM 934 CE1 TYR A 57 3.883 12.460 -9.034 1.00 0.00 C ATOM 935 CE2 TYR A 57 3.937 10.129 -8.510 1.00 0.00 C ATOM 936 CZ TYR A 57 4.516 11.359 -8.549 1.00 0.00 C ATOM 937 OH TYR A 57 5.787 11.493 -8.083 1.00 0.00 O ATOM 0 H TYR A 57 1.757 9.104 -10.984 1.00 0.00 H new ATOM 0 HA TYR A 57 -0.620 10.578 -11.883 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.056 11.855 -9.831 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.008 10.141 -9.469 1.00 0.00 H new ATOM 0 HD1 TYR A 57 2.012 13.177 -9.917 1.00 0.00 H new ATOM 0 HD2 TYR A 57 2.109 9.021 -8.985 1.00 0.00 H new ATOM 0 HE1 TYR A 57 4.378 13.420 -9.049 1.00 0.00 H new ATOM 0 HE2 TYR A 57 4.474 9.278 -8.117 1.00 0.00 H new ATOM 0 HH TYR A 57 6.113 10.624 -7.767 1.00 0.00 H new ATOM 947 N VAL A 58 0.371 12.414 -13.124 1.00 0.00 N ATOM 948 CA VAL A 58 0.929 13.485 -13.932 1.00 0.00 C ATOM 949 C VAL A 58 1.849 14.346 -13.064 1.00 0.00 C ATOM 950 O VAL A 58 2.982 14.633 -13.448 1.00 0.00 O ATOM 951 CB VAL A 58 -0.196 14.287 -14.588 1.00 0.00 C ATOM 952 CG1 VAL A 58 -0.934 15.142 -13.556 1.00 0.00 C ATOM 953 CG2 VAL A 58 0.340 15.149 -15.732 1.00 0.00 C ATOM 0 H VAL A 58 -0.631 12.266 -13.245 1.00 0.00 H new ATOM 0 HA VAL A 58 1.534 13.077 -14.742 1.00 0.00 H new ATOM 0 HB VAL A 58 -0.910 13.579 -15.009 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.729 15.702 -14.049 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -1.365 14.497 -12.791 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.234 15.837 -13.092 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.480 15.709 -16.181 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.085 15.844 -15.345 1.00 0.00 H new ATOM 0 HG23 VAL A 58 0.798 14.509 -16.486 1.00 0.00 H new ATOM 963 N ASP A 59 1.328 14.735 -11.910 1.00 0.00 N ATOM 964 CA ASP A 59 2.088 15.558 -10.985 1.00 0.00 C ATOM 965 C ASP A 59 1.438 15.495 -9.601 1.00 0.00 C ATOM 966 O ASP A 59 0.231 15.291 -9.487 1.00 0.00 O ATOM 967 CB ASP A 59 2.104 17.021 -11.434 1.00 0.00 C ATOM 968 CG ASP A 59 3.400 17.476 -12.108 1.00 0.00 C ATOM 969 OD1 ASP A 59 4.428 16.803 -11.875 1.00 0.00 O ATOM 970 OD2 ASP A 59 3.333 18.485 -12.842 1.00 0.00 O ATOM 0 H ASP A 59 0.388 14.495 -11.594 1.00 0.00 H new ATOM 0 HA ASP A 59 3.109 15.179 -10.957 1.00 0.00 H new ATOM 0 HB2 ASP A 59 1.277 17.182 -12.125 1.00 0.00 H new ATOM 0 HB3 ASP A 59 1.922 17.654 -10.566 1.00 0.00 H new ATOM 975 N LYS A 60 2.268 15.675 -8.584 1.00 0.00 N ATOM 976 CA LYS A 60 1.790 15.642 -7.212 1.00 0.00 C ATOM 977 C LYS A 60 2.143 16.960 -6.521 1.00 0.00 C ATOM 978 O LYS A 60 3.048 17.670 -6.956 1.00 0.00 O ATOM 979 CB LYS A 60 2.325 14.405 -6.488 1.00 0.00 C ATOM 980 CG LYS A 60 3.844 14.481 -6.323 1.00 0.00 C ATOM 981 CD LYS A 60 4.352 13.370 -5.403 1.00 0.00 C ATOM 982 CE LYS A 60 5.739 13.706 -4.851 1.00 0.00 C ATOM 983 NZ LYS A 60 6.522 12.469 -4.628 1.00 0.00 N ATOM 0 H LYS A 60 3.269 15.844 -8.683 1.00 0.00 H new ATOM 0 HA LYS A 60 0.704 15.551 -7.189 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.853 14.320 -5.509 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.061 13.508 -7.049 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.324 14.398 -7.298 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.121 15.452 -5.913 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.653 13.228 -4.579 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.393 12.429 -5.952 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.267 14.357 -5.548 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.641 14.255 -3.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.460 12.715 -4.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 6.025 11.862 -3.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.631 11.960 -5.528 1.00 0.00 H new ATOM 997 N LEU A 61 1.408 17.248 -5.457 1.00 0.00 N ATOM 998 CA LEU A 61 1.633 18.469 -4.701 1.00 0.00 C ATOM 999 C LEU A 61 1.718 18.133 -3.211 1.00 0.00 C ATOM 1000 O LEU A 61 1.382 17.023 -2.801 1.00 0.00 O ATOM 1001 CB LEU A 61 0.563 19.511 -5.036 1.00 0.00 C ATOM 1002 CG LEU A 61 1.008 20.661 -5.942 1.00 0.00 C ATOM 1003 CD1 LEU A 61 -0.070 21.744 -6.023 1.00 0.00 C ATOM 1004 CD2 LEU A 61 2.356 21.226 -5.490 1.00 0.00 C ATOM 0 H LEU A 61 0.657 16.658 -5.100 1.00 0.00 H new ATOM 0 HA LEU A 61 2.585 18.921 -4.981 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.275 19.002 -5.513 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.190 19.933 -4.103 1.00 0.00 H new ATOM 0 HG LEU A 61 1.146 20.268 -6.949 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.272 22.550 -6.673 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.987 21.315 -6.428 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.264 22.140 -5.026 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.649 22.042 -6.151 1.00 0.00 H new ATOM 0 HD22 LEU A 61 2.270 21.599 -4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 61 3.111 20.440 -5.527 1.00 0.00 H new ATOM 1016 N ASP A 62 2.169 19.113 -2.441 1.00 0.00 N ATOM 1017 CA ASP A 62 2.303 18.935 -1.005 1.00 0.00 C ATOM 1018 C ASP A 62 1.725 20.156 -0.288 1.00 0.00 C ATOM 1019 O ASP A 62 2.018 21.293 -0.656 1.00 0.00 O ATOM 1020 CB ASP A 62 3.772 18.801 -0.601 1.00 0.00 C ATOM 1021 CG ASP A 62 4.042 17.822 0.544 1.00 0.00 C ATOM 1022 OD1 ASP A 62 3.616 16.656 0.405 1.00 0.00 O ATOM 1023 OD2 ASP A 62 4.668 18.263 1.532 1.00 0.00 O ATOM 0 H ASP A 62 2.446 20.033 -2.785 1.00 0.00 H new ATOM 0 HA ASP A 62 1.768 18.027 -0.727 1.00 0.00 H new ATOM 0 HB2 ASP A 62 4.345 18.484 -1.472 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.145 19.784 -0.314 1.00 0.00 H new ATOM 1028 N ILE A 63 0.914 19.881 0.723 1.00 0.00 N ATOM 1029 CA ILE A 63 0.292 20.943 1.495 1.00 0.00 C ATOM 1030 C ILE A 63 0.437 20.636 2.987 1.00 0.00 C ATOM 1031 O ILE A 63 -0.420 21.008 3.787 1.00 0.00 O ATOM 1032 CB ILE A 63 -1.156 21.153 1.048 1.00 0.00 C ATOM 1033 CG1 ILE A 63 -1.911 19.823 0.992 1.00 0.00 C ATOM 1034 CG2 ILE A 63 -1.216 21.903 -0.284 1.00 0.00 C ATOM 1035 CD1 ILE A 63 -3.365 20.035 0.567 1.00 0.00 C ATOM 0 H ILE A 63 0.673 18.937 1.026 1.00 0.00 H new ATOM 0 HA ILE A 63 0.798 21.891 1.314 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.655 21.776 1.790 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.418 19.150 0.290 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.881 19.342 1.970 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.257 22.039 -0.579 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.740 22.877 -0.175 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.694 21.328 -1.049 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.879 19.074 0.535 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.862 20.689 1.284 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.392 20.494 -0.421 1.00 0.00 H new ATOM 1047 N VAL A 64 1.528 19.960 3.315 1.00 0.00 N ATOM 1048 CA VAL A 64 1.796 19.598 4.697 1.00 0.00 C ATOM 1049 C VAL A 64 2.270 20.836 5.461 1.00 0.00 C ATOM 1050 O VAL A 64 1.863 21.061 6.600 1.00 0.00 O ATOM 1051 CB VAL A 64 2.798 18.443 4.751 1.00 0.00 C ATOM 1052 CG1 VAL A 64 4.188 18.902 4.307 1.00 0.00 C ATOM 1053 CG2 VAL A 64 2.845 17.823 6.148 1.00 0.00 C ATOM 0 H VAL A 64 2.237 19.653 2.648 1.00 0.00 H new ATOM 0 HA VAL A 64 0.886 19.244 5.182 1.00 0.00 H new ATOM 0 HB VAL A 64 2.461 17.674 4.055 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.881 18.062 4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 64 4.139 19.274 3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.536 19.697 4.966 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.565 17.005 6.159 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.146 18.580 6.872 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.858 17.442 6.410 1.00 0.00 H new ATOM 1063 N ASP A 65 3.124 21.607 4.803 1.00 0.00 N ATOM 1064 CA ASP A 65 3.658 22.817 5.406 1.00 0.00 C ATOM 1065 C ASP A 65 2.745 23.996 5.066 1.00 0.00 C ATOM 1066 O ASP A 65 3.148 25.152 5.184 1.00 0.00 O ATOM 1067 CB ASP A 65 5.055 23.130 4.868 1.00 0.00 C ATOM 1068 CG ASP A 65 6.204 22.799 5.822 1.00 0.00 C ATOM 1069 OD1 ASP A 65 6.567 23.701 6.608 1.00 0.00 O ATOM 1070 OD2 ASP A 65 6.694 21.651 5.744 1.00 0.00 O ATOM 0 H ASP A 65 3.459 21.417 3.859 1.00 0.00 H new ATOM 0 HA ASP A 65 3.713 22.661 6.483 1.00 0.00 H new ATOM 0 HB2 ASP A 65 5.203 22.578 3.940 1.00 0.00 H new ATOM 0 HB3 ASP A 65 5.103 24.190 4.619 1.00 0.00 H new ATOM 1075 N LEU A 66 1.531 23.664 4.651 1.00 0.00 N ATOM 1076 CA LEU A 66 0.558 24.682 4.293 1.00 0.00 C ATOM 1077 C LEU A 66 0.569 25.787 5.351 1.00 0.00 C ATOM 1078 O LEU A 66 0.570 25.505 6.548 1.00 0.00 O ATOM 1079 CB LEU A 66 -0.820 24.052 4.076 1.00 0.00 C ATOM 1080 CG LEU A 66 -1.909 24.988 3.546 1.00 0.00 C ATOM 1081 CD1 LEU A 66 -1.865 25.070 2.019 1.00 0.00 C ATOM 1082 CD2 LEU A 66 -3.288 24.570 4.059 1.00 0.00 C ATOM 0 H LEU A 66 1.199 22.704 4.555 1.00 0.00 H new ATOM 0 HA LEU A 66 0.824 25.147 3.344 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.712 23.221 3.379 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.159 23.632 5.023 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.714 25.990 3.928 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.649 25.741 1.668 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.893 25.450 1.703 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.021 24.077 1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.044 25.251 3.668 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.508 23.555 3.727 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -3.297 24.605 5.148 1.00 0.00 H new ATOM 1094 N THR A 67 0.578 27.022 4.871 1.00 0.00 N ATOM 1095 CA THR A 67 0.590 28.171 5.760 1.00 0.00 C ATOM 1096 C THR A 67 -0.835 28.528 6.188 1.00 0.00 C ATOM 1097 O THR A 67 -1.057 28.960 7.318 1.00 0.00 O ATOM 1098 CB THR A 67 1.315 29.313 5.046 1.00 0.00 C ATOM 1099 OG1 THR A 67 2.683 29.135 5.406 1.00 0.00 O ATOM 1100 CG2 THR A 67 0.955 30.685 5.621 1.00 0.00 C ATOM 0 H THR A 67 0.577 27.252 3.877 1.00 0.00 H new ATOM 0 HA THR A 67 1.128 27.953 6.683 1.00 0.00 H new ATOM 0 HB THR A 67 1.072 29.289 3.984 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.226 29.833 4.984 1.00 0.00 H new ATOM 0 HG21 THR A 67 1.497 31.460 5.079 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.117 30.852 5.519 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.229 30.721 6.675 1.00 0.00 H new ATOM 1108 N CYS A 68 -1.762 28.335 5.262 1.00 0.00 N ATOM 1109 CA CYS A 68 -3.159 28.632 5.529 1.00 0.00 C ATOM 1110 C CYS A 68 -3.952 28.414 4.239 1.00 0.00 C ATOM 1111 O CYS A 68 -3.390 28.014 3.221 1.00 0.00 O ATOM 1112 CB CYS A 68 -3.342 30.048 6.078 1.00 0.00 C ATOM 1113 SG CYS A 68 -3.595 29.989 7.890 1.00 0.00 S ATOM 0 H CYS A 68 -1.573 27.977 4.326 1.00 0.00 H new ATOM 0 HA CYS A 68 -3.534 27.962 6.303 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -2.466 30.653 5.844 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -4.197 30.525 5.599 1.00 0.00 H new ATOM 0 HG CYS A 68 -2.541 29.485 8.459 1.00 0.00 H new ATOM 1119 N LEU A 69 -5.246 28.687 4.323 1.00 0.00 N ATOM 1120 CA LEU A 69 -6.122 28.526 3.175 1.00 0.00 C ATOM 1121 C LEU A 69 -6.965 29.790 3.001 1.00 0.00 C ATOM 1122 O LEU A 69 -7.632 30.229 3.936 1.00 0.00 O ATOM 1123 CB LEU A 69 -6.951 27.247 3.309 1.00 0.00 C ATOM 1124 CG LEU A 69 -7.754 26.836 2.074 1.00 0.00 C ATOM 1125 CD1 LEU A 69 -7.390 25.417 1.630 1.00 0.00 C ATOM 1126 CD2 LEU A 69 -9.256 26.992 2.319 1.00 0.00 C ATOM 0 H LEU A 69 -5.709 29.019 5.169 1.00 0.00 H new ATOM 0 HA LEU A 69 -5.537 28.405 2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.280 26.429 3.571 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.642 27.371 4.143 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.490 27.507 1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.975 25.150 0.750 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.328 25.373 1.387 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.607 24.717 2.436 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.803 26.693 1.425 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -9.556 26.361 3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.481 28.033 2.551 1.00 0.00 H new ATOM 1138 N THR A 70 -6.907 30.340 1.797 1.00 0.00 N ATOM 1139 CA THR A 70 -7.658 31.545 1.488 1.00 0.00 C ATOM 1140 C THR A 70 -8.943 31.195 0.735 1.00 0.00 C ATOM 1141 O THR A 70 -9.101 30.073 0.259 1.00 0.00 O ATOM 1142 CB THR A 70 -6.737 32.490 0.712 1.00 0.00 C ATOM 1143 OG1 THR A 70 -6.171 31.666 -0.303 1.00 0.00 O ATOM 1144 CG2 THR A 70 -5.532 32.943 1.539 1.00 0.00 C ATOM 0 H THR A 70 -6.352 29.973 1.024 1.00 0.00 H new ATOM 0 HA THR A 70 -7.980 32.054 2.396 1.00 0.00 H new ATOM 0 HB THR A 70 -7.303 33.363 0.387 1.00 0.00 H new ATOM 0 HG1 THR A 70 -5.289 32.013 -0.553 1.00 0.00 H new ATOM 0 HG21 THR A 70 -4.911 33.611 0.942 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.878 33.468 2.429 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.947 32.073 1.836 1.00 0.00 H new ATOM 1152 N GLU A 71 -9.828 32.178 0.651 1.00 0.00 N ATOM 1153 CA GLU A 71 -11.094 31.988 -0.036 1.00 0.00 C ATOM 1154 C GLU A 71 -11.312 33.100 -1.064 1.00 0.00 C ATOM 1155 O GLU A 71 -11.219 34.282 -0.734 1.00 0.00 O ATOM 1156 CB GLU A 71 -12.254 31.926 0.960 1.00 0.00 C ATOM 1157 CG GLU A 71 -12.476 30.495 1.454 1.00 0.00 C ATOM 1158 CD GLU A 71 -13.918 30.295 1.925 1.00 0.00 C ATOM 1159 OE1 GLU A 71 -14.221 30.768 3.042 1.00 0.00 O ATOM 1160 OE2 GLU A 71 -14.685 29.675 1.157 1.00 0.00 O ATOM 0 H GLU A 71 -9.693 33.108 1.047 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.060 31.035 -0.563 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.046 32.579 1.808 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -13.164 32.297 0.488 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -12.250 29.791 0.653 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -11.789 30.278 2.272 1.00 0.00 H new ATOM 1274 N CYS A 79 -19.526 28.267 -5.383 1.00 0.00 N ATOM 1275 CA CYS A 79 -18.618 27.133 -5.334 1.00 0.00 C ATOM 1276 C CYS A 79 -17.498 27.456 -4.344 1.00 0.00 C ATOM 1277 O CYS A 79 -17.261 28.621 -4.028 1.00 0.00 O ATOM 1278 CB CYS A 79 -18.072 26.785 -6.720 1.00 0.00 C ATOM 1279 SG CYS A 79 -19.445 26.303 -7.830 1.00 0.00 S ATOM 0 HA CYS A 79 -19.156 26.248 -4.995 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -17.540 27.641 -7.136 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -17.353 25.970 -6.642 1.00 0.00 H new ATOM 0 HG CYS A 79 -20.387 25.739 -7.135 1.00 0.00 H new ATOM 1285 N ALA A 80 -16.838 26.405 -3.881 1.00 0.00 N ATOM 1286 CA ALA A 80 -15.748 26.562 -2.934 1.00 0.00 C ATOM 1287 C ALA A 80 -14.453 26.852 -3.696 1.00 0.00 C ATOM 1288 O ALA A 80 -13.968 26.007 -4.446 1.00 0.00 O ATOM 1289 CB ALA A 80 -15.643 25.309 -2.062 1.00 0.00 C ATOM 0 H ALA A 80 -17.038 25.440 -4.145 1.00 0.00 H new ATOM 0 HA ALA A 80 -15.936 27.406 -2.270 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -14.825 25.428 -1.352 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -16.577 25.164 -1.519 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -15.452 24.441 -2.693 1.00 0.00 H new ATOM 1295 N LYS A 81 -13.931 28.050 -3.477 1.00 0.00 N ATOM 1296 CA LYS A 81 -12.702 28.462 -4.134 1.00 0.00 C ATOM 1297 C LYS A 81 -11.702 28.943 -3.080 1.00 0.00 C ATOM 1298 O LYS A 81 -11.962 29.913 -2.369 1.00 0.00 O ATOM 1299 CB LYS A 81 -12.997 29.498 -5.220 1.00 0.00 C ATOM 1300 CG LYS A 81 -13.154 28.830 -6.587 1.00 0.00 C ATOM 1301 CD LYS A 81 -13.227 29.874 -7.703 1.00 0.00 C ATOM 1302 CE LYS A 81 -14.361 29.555 -8.680 1.00 0.00 C ATOM 1303 NZ LYS A 81 -15.177 30.763 -8.938 1.00 0.00 N ATOM 0 H LYS A 81 -14.337 28.748 -2.854 1.00 0.00 H new ATOM 0 HA LYS A 81 -12.243 27.618 -4.648 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.908 30.042 -4.971 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -12.189 30.229 -5.259 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.314 28.159 -6.766 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -14.057 28.220 -6.596 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.382 30.863 -7.271 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.278 29.905 -8.239 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.948 29.181 -9.617 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.990 28.764 -8.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.942 30.530 -9.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -15.586 31.103 -8.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -14.577 31.506 -9.348 1.00 0.00 H new ATOM 1317 N PHE A 82 -10.579 28.243 -3.013 1.00 0.00 N ATOM 1318 CA PHE A 82 -9.539 28.587 -2.058 1.00 0.00 C ATOM 1319 C PHE A 82 -8.150 28.334 -2.646 1.00 0.00 C ATOM 1320 O PHE A 82 -7.983 27.468 -3.504 1.00 0.00 O ATOM 1321 CB PHE A 82 -9.736 27.684 -0.838 1.00 0.00 C ATOM 1322 CG PHE A 82 -9.965 26.211 -1.185 1.00 0.00 C ATOM 1323 CD1 PHE A 82 -8.911 25.419 -1.518 1.00 0.00 C ATOM 1324 CD2 PHE A 82 -11.223 25.694 -1.159 1.00 0.00 C ATOM 1325 CE1 PHE A 82 -9.124 24.052 -1.839 1.00 0.00 C ATOM 1326 CE2 PHE A 82 -11.436 24.328 -1.481 1.00 0.00 C ATOM 1327 CZ PHE A 82 -10.382 23.536 -1.814 1.00 0.00 C ATOM 0 H PHE A 82 -10.367 27.439 -3.604 1.00 0.00 H new ATOM 0 HA PHE A 82 -9.607 29.643 -1.798 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -8.860 27.763 -0.195 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -10.587 28.048 -0.263 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.912 25.829 -1.538 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -12.060 26.323 -0.893 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.287 23.422 -2.103 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -12.435 23.918 -1.462 1.00 0.00 H new ATOM 0 HZ PHE A 82 -10.544 22.497 -2.059 1.00 0.00 H new ATOM 1337 N THR A 83 -7.188 29.105 -2.161 1.00 0.00 N ATOM 1338 CA THR A 83 -5.818 28.975 -2.628 1.00 0.00 C ATOM 1339 C THR A 83 -4.927 28.415 -1.518 1.00 0.00 C ATOM 1340 O THR A 83 -5.035 28.826 -0.364 1.00 0.00 O ATOM 1341 CB THR A 83 -5.362 30.342 -3.142 1.00 0.00 C ATOM 1342 OG1 THR A 83 -5.861 30.396 -4.475 1.00 0.00 O ATOM 1343 CG2 THR A 83 -3.843 30.428 -3.309 1.00 0.00 C ATOM 0 H THR A 83 -7.330 29.822 -1.449 1.00 0.00 H new ATOM 0 HA THR A 83 -5.746 28.262 -3.450 1.00 0.00 H new ATOM 0 HB THR A 83 -5.696 31.118 -2.454 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.612 31.251 -4.883 1.00 0.00 H new ATOM 0 HG21 THR A 83 -3.573 31.418 -3.676 1.00 0.00 H new ATOM 0 HG22 THR A 83 -3.361 30.253 -2.347 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.512 29.674 -4.023 1.00 0.00 H new ATOM 1351 N LEU A 84 -4.066 27.486 -1.906 1.00 0.00 N ATOM 1352 CA LEU A 84 -3.156 26.865 -0.958 1.00 0.00 C ATOM 1353 C LEU A 84 -1.944 27.775 -0.750 1.00 0.00 C ATOM 1354 O LEU A 84 -1.159 27.990 -1.672 1.00 0.00 O ATOM 1355 CB LEU A 84 -2.792 25.450 -1.412 1.00 0.00 C ATOM 1356 CG LEU A 84 -3.918 24.416 -1.352 1.00 0.00 C ATOM 1357 CD1 LEU A 84 -4.286 24.089 0.096 1.00 0.00 C ATOM 1358 CD2 LEU A 84 -5.131 24.878 -2.162 1.00 0.00 C ATOM 0 H LEU A 84 -3.979 27.148 -2.864 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.638 26.749 0.013 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.427 25.502 -2.438 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.965 25.094 -0.797 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.559 23.494 -1.809 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.089 23.352 0.110 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.414 23.686 0.611 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.618 24.996 0.601 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.917 24.125 -2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.501 25.821 -1.758 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.841 25.018 -3.203 1.00 0.00 H new ATOM 1370 N VAL A 85 -1.830 28.286 0.468 1.00 0.00 N ATOM 1371 CA VAL A 85 -0.727 29.168 0.809 1.00 0.00 C ATOM 1372 C VAL A 85 0.410 28.344 1.417 1.00 0.00 C ATOM 1373 O VAL A 85 0.290 27.845 2.535 1.00 0.00 O ATOM 1374 CB VAL A 85 -1.217 30.285 1.733 1.00 0.00 C ATOM 1375 CG1 VAL A 85 -0.101 31.293 2.013 1.00 0.00 C ATOM 1376 CG2 VAL A 85 -2.449 30.979 1.148 1.00 0.00 C ATOM 0 H VAL A 85 -2.483 28.106 1.230 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.335 29.653 -0.085 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.506 29.833 2.682 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.475 32.076 2.672 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.736 30.785 2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.232 31.737 1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.777 31.769 1.824 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.197 31.412 0.180 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.251 30.252 1.023 1.00 0.00 H new ATOM 1386 N LEU A 86 1.487 28.228 0.655 1.00 0.00 N ATOM 1387 CA LEU A 86 2.645 27.474 1.105 1.00 0.00 C ATOM 1388 C LEU A 86 3.822 28.429 1.312 1.00 0.00 C ATOM 1389 O LEU A 86 3.851 29.517 0.739 1.00 0.00 O ATOM 1390 CB LEU A 86 2.946 26.327 0.138 1.00 0.00 C ATOM 1391 CG LEU A 86 1.746 25.483 -0.295 1.00 0.00 C ATOM 1392 CD1 LEU A 86 1.983 24.859 -1.672 1.00 0.00 C ATOM 1393 CD2 LEU A 86 1.408 24.428 0.761 1.00 0.00 C ATOM 0 H LEU A 86 1.583 28.644 -0.272 1.00 0.00 H new ATOM 0 HA LEU A 86 2.443 27.004 2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.413 26.744 -0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.679 25.668 0.604 1.00 0.00 H new ATOM 0 HG LEU A 86 0.881 26.140 -0.383 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.115 24.264 -1.956 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.138 25.648 -2.407 1.00 0.00 H new ATOM 0 HD13 LEU A 86 2.865 24.219 -1.635 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.551 23.842 0.428 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.265 23.769 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.167 24.920 1.703 1.00 0.00 H new ATOM 1405 N PRO A 87 4.789 27.976 2.155 1.00 0.00 N ATOM 1406 CA PRO A 87 5.965 28.778 2.444 1.00 0.00 C ATOM 1407 C PRO A 87 6.939 28.768 1.265 1.00 0.00 C ATOM 1408 O PRO A 87 8.012 29.367 1.336 1.00 0.00 O ATOM 1409 CB PRO A 87 6.554 28.171 3.707 1.00 0.00 C ATOM 1410 CG PRO A 87 5.959 26.776 3.815 1.00 0.00 C ATOM 1411 CD PRO A 87 4.787 26.693 2.851 1.00 0.00 C ATOM 0 HA PRO A 87 5.729 29.831 2.597 1.00 0.00 H new ATOM 0 HB2 PRO A 87 7.642 28.128 3.649 1.00 0.00 H new ATOM 0 HB3 PRO A 87 6.304 28.771 4.582 1.00 0.00 H new ATOM 0 HG2 PRO A 87 6.707 26.022 3.572 1.00 0.00 H new ATOM 0 HG3 PRO A 87 5.629 26.580 4.835 1.00 0.00 H new ATOM 0 HD2 PRO A 87 4.906 25.864 2.154 1.00 0.00 H new ATOM 0 HD3 PRO A 87 3.849 26.532 3.381 1.00 0.00 H new ATOM 1419 N LYS A 88 6.532 28.081 0.208 1.00 0.00 N ATOM 1420 CA LYS A 88 7.356 27.985 -0.985 1.00 0.00 C ATOM 1421 C LYS A 88 6.654 28.698 -2.143 1.00 0.00 C ATOM 1422 O LYS A 88 7.179 29.667 -2.690 1.00 0.00 O ATOM 1423 CB LYS A 88 7.701 26.524 -1.282 1.00 0.00 C ATOM 1424 CG LYS A 88 7.868 25.727 0.013 1.00 0.00 C ATOM 1425 CD LYS A 88 6.574 24.994 0.376 1.00 0.00 C ATOM 1426 CE LYS A 88 6.411 23.724 -0.461 1.00 0.00 C ATOM 1427 NZ LYS A 88 6.712 22.525 0.353 1.00 0.00 N ATOM 0 H LYS A 88 5.642 27.585 0.153 1.00 0.00 H new ATOM 0 HA LYS A 88 8.310 28.489 -0.830 1.00 0.00 H new ATOM 0 HB2 LYS A 88 6.914 26.077 -1.890 1.00 0.00 H new ATOM 0 HB3 LYS A 88 8.621 26.475 -1.865 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.678 25.007 -0.101 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.150 26.399 0.824 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.582 24.737 1.435 1.00 0.00 H new ATOM 0 HD3 LYS A 88 5.721 25.653 0.214 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.393 23.663 -0.846 1.00 0.00 H new ATOM 0 HE3 LYS A 88 7.076 23.762 -1.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.597 21.672 -0.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.691 22.578 0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.060 22.482 1.162 1.00 0.00 H new ATOM 1441 N GLU A 89 5.478 28.191 -2.483 1.00 0.00 N ATOM 1442 CA GLU A 89 4.699 28.767 -3.565 1.00 0.00 C ATOM 1443 C GLU A 89 3.204 28.553 -3.317 1.00 0.00 C ATOM 1444 O GLU A 89 2.814 27.601 -2.642 1.00 0.00 O ATOM 1445 CB GLU A 89 5.120 28.182 -4.915 1.00 0.00 C ATOM 1446 CG GLU A 89 3.952 28.190 -5.904 1.00 0.00 C ATOM 1447 CD GLU A 89 4.379 27.628 -7.261 1.00 0.00 C ATOM 1448 OE1 GLU A 89 4.970 28.408 -8.038 1.00 0.00 O ATOM 1449 OE2 GLU A 89 4.105 26.430 -7.491 1.00 0.00 O ATOM 0 H GLU A 89 5.046 27.387 -2.028 1.00 0.00 H new ATOM 0 HA GLU A 89 4.892 29.839 -3.594 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.950 28.759 -5.322 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.478 27.162 -4.778 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.128 27.598 -5.504 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.583 29.208 -6.028 1.00 0.00 H new ATOM 1456 N GLU A 90 2.409 29.453 -3.874 1.00 0.00 N ATOM 1457 CA GLU A 90 0.966 29.375 -3.721 1.00 0.00 C ATOM 1458 C GLU A 90 0.341 28.681 -4.934 1.00 0.00 C ATOM 1459 O GLU A 90 0.809 28.848 -6.059 1.00 0.00 O ATOM 1460 CB GLU A 90 0.361 30.764 -3.512 1.00 0.00 C ATOM 1461 CG GLU A 90 1.039 31.488 -2.347 1.00 0.00 C ATOM 1462 CD GLU A 90 1.518 32.878 -2.770 1.00 0.00 C ATOM 1463 OE1 GLU A 90 2.417 32.930 -3.636 1.00 0.00 O ATOM 1464 OE2 GLU A 90 0.974 33.858 -2.216 1.00 0.00 O ATOM 0 H GLU A 90 2.736 30.241 -4.433 1.00 0.00 H new ATOM 0 HA GLU A 90 0.745 28.782 -2.833 1.00 0.00 H new ATOM 0 HB2 GLU A 90 0.469 31.353 -4.423 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -0.707 30.673 -3.316 1.00 0.00 H new ATOM 0 HG2 GLU A 90 0.341 31.578 -1.514 1.00 0.00 H new ATOM 0 HG3 GLU A 90 1.885 30.900 -1.992 1.00 0.00 H new ATOM 1471 N VAL A 91 -0.707 27.918 -4.663 1.00 0.00 N ATOM 1472 CA VAL A 91 -1.401 27.198 -5.717 1.00 0.00 C ATOM 1473 C VAL A 91 -2.896 27.516 -5.647 1.00 0.00 C ATOM 1474 O VAL A 91 -3.439 27.727 -4.564 1.00 0.00 O ATOM 1475 CB VAL A 91 -1.103 25.701 -5.613 1.00 0.00 C ATOM 1476 CG1 VAL A 91 -1.962 24.901 -6.594 1.00 0.00 C ATOM 1477 CG2 VAL A 91 0.385 25.422 -5.834 1.00 0.00 C ATOM 0 H VAL A 91 -1.093 27.782 -3.729 1.00 0.00 H new ATOM 0 HA VAL A 91 -1.046 27.519 -6.696 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.359 25.378 -4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.730 23.840 -6.499 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.016 25.063 -6.371 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.752 25.229 -7.612 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.570 24.351 -5.755 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.677 25.768 -6.825 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.970 25.948 -5.079 1.00 0.00 H new ATOM 1487 N GLN A 92 -3.519 27.541 -6.816 1.00 0.00 N ATOM 1488 CA GLN A 92 -4.941 27.829 -6.901 1.00 0.00 C ATOM 1489 C GLN A 92 -5.736 26.534 -7.071 1.00 0.00 C ATOM 1490 O GLN A 92 -5.480 25.760 -7.993 1.00 0.00 O ATOM 1491 CB GLN A 92 -5.235 28.807 -8.041 1.00 0.00 C ATOM 1492 CG GLN A 92 -4.569 30.161 -7.787 1.00 0.00 C ATOM 1493 CD GLN A 92 -4.502 30.988 -9.073 1.00 0.00 C ATOM 1494 OE1 GLN A 92 -5.496 31.485 -9.575 1.00 0.00 O ATOM 1495 NE2 GLN A 92 -3.276 31.107 -9.576 1.00 0.00 N ATOM 0 H GLN A 92 -3.065 27.366 -7.713 1.00 0.00 H new ATOM 0 HA GLN A 92 -5.252 28.303 -5.970 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -4.876 28.392 -8.983 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -6.312 28.941 -8.142 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -5.127 30.708 -7.027 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -3.563 30.008 -7.396 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -2.486 30.665 -9.105 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -3.126 31.640 -10.433 1.00 0.00 H new ATOM 1504 N LEU A 93 -6.685 26.336 -6.167 1.00 0.00 N ATOM 1505 CA LEU A 93 -7.519 25.148 -6.206 1.00 0.00 C ATOM 1506 C LEU A 93 -8.955 25.549 -6.549 1.00 0.00 C ATOM 1507 O LEU A 93 -9.482 26.515 -5.999 1.00 0.00 O ATOM 1508 CB LEU A 93 -7.396 24.364 -4.897 1.00 0.00 C ATOM 1509 CG LEU A 93 -6.780 22.968 -5.008 1.00 0.00 C ATOM 1510 CD1 LEU A 93 -5.255 23.030 -4.894 1.00 0.00 C ATOM 1511 CD2 LEU A 93 -7.393 22.015 -3.979 1.00 0.00 C ATOM 0 H LEU A 93 -6.894 26.979 -5.403 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.181 24.471 -6.990 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.796 24.950 -4.200 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.390 24.268 -4.459 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.013 22.570 -5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.843 22.024 -4.976 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.855 23.653 -5.695 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -4.979 23.457 -3.930 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.938 21.030 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -7.212 22.398 -2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -8.467 21.938 -4.149 1.00 0.00 H new ATOM 1523 N LYS A 94 -9.548 24.786 -7.456 1.00 0.00 N ATOM 1524 CA LYS A 94 -10.913 25.050 -7.879 1.00 0.00 C ATOM 1525 C LYS A 94 -11.674 23.727 -7.985 1.00 0.00 C ATOM 1526 O LYS A 94 -11.091 22.696 -8.316 1.00 0.00 O ATOM 1527 CB LYS A 94 -10.925 25.871 -9.170 1.00 0.00 C ATOM 1528 CG LYS A 94 -12.313 26.458 -9.434 1.00 0.00 C ATOM 1529 CD LYS A 94 -12.385 27.091 -10.825 1.00 0.00 C ATOM 1530 CE LYS A 94 -13.410 26.371 -11.703 1.00 0.00 C ATOM 1531 NZ LYS A 94 -14.181 27.346 -12.506 1.00 0.00 N ATOM 0 H LYS A 94 -9.108 23.985 -7.909 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.431 25.658 -7.137 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.193 26.676 -9.100 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -10.627 25.241 -10.008 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -13.066 25.674 -9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.545 27.207 -8.677 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -12.653 28.144 -10.736 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.404 27.051 -11.298 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.902 25.668 -12.363 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.088 25.789 -11.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -14.872 26.840 -13.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -14.681 28.000 -11.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -13.532 27.883 -13.116 1.00 0.00 H new ATOM 1545 N THR A 95 -12.966 23.800 -7.698 1.00 0.00 N ATOM 1546 CA THR A 95 -13.813 22.621 -7.757 1.00 0.00 C ATOM 1547 C THR A 95 -14.941 22.825 -8.770 1.00 0.00 C ATOM 1548 O THR A 95 -15.242 23.955 -9.149 1.00 0.00 O ATOM 1549 CB THR A 95 -14.313 22.327 -6.341 1.00 0.00 C ATOM 1550 OG1 THR A 95 -14.781 23.588 -5.869 1.00 0.00 O ATOM 1551 CG2 THR A 95 -13.177 21.968 -5.381 1.00 0.00 C ATOM 0 H THR A 95 -13.446 24.657 -7.424 1.00 0.00 H new ATOM 0 HA THR A 95 -13.257 21.752 -8.108 1.00 0.00 H new ATOM 0 HB THR A 95 -15.033 21.509 -6.373 1.00 0.00 H new ATOM 0 HG1 THR A 95 -14.055 24.053 -5.403 1.00 0.00 H new ATOM 0 HG21 THR A 95 -13.587 21.769 -4.391 1.00 0.00 H new ATOM 0 HG22 THR A 95 -12.660 21.080 -5.745 1.00 0.00 H new ATOM 0 HG23 THR A 95 -12.474 22.799 -5.322 1.00 0.00 H new ATOM 1559 N GLU A 96 -15.534 21.713 -9.179 1.00 0.00 N ATOM 1560 CA GLU A 96 -16.622 21.755 -10.141 1.00 0.00 C ATOM 1561 C GLU A 96 -17.955 21.984 -9.424 1.00 0.00 C ATOM 1562 O GLU A 96 -18.753 22.821 -9.843 1.00 0.00 O ATOM 1563 CB GLU A 96 -16.663 20.476 -10.979 1.00 0.00 C ATOM 1564 CG GLU A 96 -15.840 20.633 -12.259 1.00 0.00 C ATOM 1565 CD GLU A 96 -16.637 20.179 -13.483 1.00 0.00 C ATOM 1566 OE1 GLU A 96 -16.683 18.950 -13.707 1.00 0.00 O ATOM 1567 OE2 GLU A 96 -17.183 21.071 -14.168 1.00 0.00 O ATOM 0 H GLU A 96 -15.281 20.777 -8.862 1.00 0.00 H new ATOM 0 HA GLU A 96 -16.449 22.589 -10.821 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -16.277 19.641 -10.394 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -17.695 20.236 -11.233 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -15.544 21.675 -12.380 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -14.923 20.048 -12.180 1.00 0.00 H new ATOM 1574 N ASN A 97 -18.154 21.225 -8.357 1.00 0.00 N ATOM 1575 CA ASN A 97 -19.376 21.334 -7.578 1.00 0.00 C ATOM 1576 C ASN A 97 -19.094 22.130 -6.302 1.00 0.00 C ATOM 1577 O ASN A 97 -17.940 22.417 -5.988 1.00 0.00 O ATOM 1578 CB ASN A 97 -19.894 19.954 -7.170 1.00 0.00 C ATOM 1579 CG ASN A 97 -20.379 19.167 -8.389 1.00 0.00 C ATOM 1580 OD1 ASN A 97 -19.725 18.258 -8.874 1.00 0.00 O ATOM 1581 ND2 ASN A 97 -21.558 19.566 -8.857 1.00 0.00 N ATOM 0 H ASN A 97 -17.490 20.532 -8.013 1.00 0.00 H new ATOM 0 HA ASN A 97 -20.125 21.832 -8.194 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -19.103 19.399 -6.666 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -20.710 20.065 -6.456 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -21.967 19.104 -9.669 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -22.053 20.334 -8.404 1.00 0.00 H new ATOM 1588 N THR A 98 -20.167 22.464 -5.602 1.00 0.00 N ATOM 1589 CA THR A 98 -20.049 23.221 -4.367 1.00 0.00 C ATOM 1590 C THR A 98 -19.761 22.284 -3.192 1.00 0.00 C ATOM 1591 O THR A 98 -18.785 22.472 -2.468 1.00 0.00 O ATOM 1592 CB THR A 98 -21.329 24.040 -4.190 1.00 0.00 C ATOM 1593 OG1 THR A 98 -21.325 24.934 -5.301 1.00 0.00 O ATOM 1594 CG2 THR A 98 -21.271 24.962 -2.970 1.00 0.00 C ATOM 0 H THR A 98 -21.123 22.225 -5.866 1.00 0.00 H new ATOM 0 HA THR A 98 -19.206 23.911 -4.406 1.00 0.00 H new ATOM 0 HB THR A 98 -22.181 23.366 -4.095 1.00 0.00 H new ATOM 0 HG1 THR A 98 -22.122 25.503 -5.266 1.00 0.00 H new ATOM 0 HG21 THR A 98 -22.204 25.520 -2.891 1.00 0.00 H new ATOM 0 HG22 THR A 98 -21.128 24.365 -2.069 1.00 0.00 H new ATOM 0 HG23 THR A 98 -20.440 25.659 -3.080 1.00 0.00 H new ATOM 1602 N GLU A 99 -20.628 21.294 -3.040 1.00 0.00 N ATOM 1603 CA GLU A 99 -20.479 20.327 -1.966 1.00 0.00 C ATOM 1604 C GLU A 99 -19.039 19.811 -1.912 1.00 0.00 C ATOM 1605 O GLU A 99 -18.334 20.030 -0.928 1.00 0.00 O ATOM 1606 CB GLU A 99 -21.469 19.171 -2.127 1.00 0.00 C ATOM 1607 CG GLU A 99 -21.270 18.122 -1.031 1.00 0.00 C ATOM 1608 CD GLU A 99 -22.353 17.043 -1.102 1.00 0.00 C ATOM 1609 OE1 GLU A 99 -22.441 16.397 -2.168 1.00 0.00 O ATOM 1610 OE2 GLU A 99 -23.067 16.889 -0.088 1.00 0.00 O ATOM 0 H GLU A 99 -21.436 21.141 -3.643 1.00 0.00 H new ATOM 0 HA GLU A 99 -20.702 20.825 -1.022 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -22.489 19.553 -2.089 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -21.338 18.709 -3.106 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -20.287 17.663 -1.136 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -21.294 18.603 -0.053 1.00 0.00 H new ATOM 1617 N SER A 100 -18.646 19.136 -2.982 1.00 0.00 N ATOM 1618 CA SER A 100 -17.303 18.588 -3.069 1.00 0.00 C ATOM 1619 C SER A 100 -16.285 19.614 -2.568 1.00 0.00 C ATOM 1620 O SER A 100 -15.293 19.253 -1.938 1.00 0.00 O ATOM 1621 CB SER A 100 -16.971 18.167 -4.502 1.00 0.00 C ATOM 1622 OG SER A 100 -17.556 16.912 -4.839 1.00 0.00 O ATOM 0 H SER A 100 -19.234 18.956 -3.796 1.00 0.00 H new ATOM 0 HA SER A 100 -17.255 17.700 -2.438 1.00 0.00 H new ATOM 0 HB2 SER A 100 -17.325 18.930 -5.195 1.00 0.00 H new ATOM 0 HB3 SER A 100 -15.889 18.106 -4.621 1.00 0.00 H new ATOM 0 HG SER A 100 -17.322 16.679 -5.762 1.00 0.00 H new ATOM 1628 N GLY A 101 -16.566 20.874 -2.868 1.00 0.00 N ATOM 1629 CA GLY A 101 -15.688 21.955 -2.456 1.00 0.00 C ATOM 1630 C GLY A 101 -15.443 21.918 -0.946 1.00 0.00 C ATOM 1631 O GLY A 101 -14.297 21.923 -0.499 1.00 0.00 O ATOM 0 H GLY A 101 -17.390 21.170 -3.392 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -14.738 21.878 -2.984 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -16.129 22.912 -2.733 1.00 0.00 H new ATOM 1635 N GLU A 102 -16.539 21.881 -0.202 1.00 0.00 N ATOM 1636 CA GLU A 102 -16.458 21.843 1.248 1.00 0.00 C ATOM 1637 C GLU A 102 -15.747 20.569 1.707 1.00 0.00 C ATOM 1638 O GLU A 102 -15.155 20.538 2.785 1.00 0.00 O ATOM 1639 CB GLU A 102 -17.848 21.952 1.878 1.00 0.00 C ATOM 1640 CG GLU A 102 -18.068 23.339 2.485 1.00 0.00 C ATOM 1641 CD GLU A 102 -17.729 23.345 3.977 1.00 0.00 C ATOM 1642 OE1 GLU A 102 -18.336 22.526 4.700 1.00 0.00 O ATOM 1643 OE2 GLU A 102 -16.871 24.169 4.361 1.00 0.00 O ATOM 0 H GLU A 102 -17.488 21.877 -0.576 1.00 0.00 H new ATOM 0 HA GLU A 102 -15.875 22.701 1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -18.610 21.757 1.123 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -17.962 21.191 2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -17.449 24.070 1.965 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -19.105 23.642 2.343 1.00 0.00 H new ATOM 1650 N GLU A 103 -15.827 19.549 0.865 1.00 0.00 N ATOM 1651 CA GLU A 103 -15.198 18.275 1.171 1.00 0.00 C ATOM 1652 C GLU A 103 -13.674 18.417 1.152 1.00 0.00 C ATOM 1653 O GLU A 103 -13.026 18.321 2.192 1.00 0.00 O ATOM 1654 CB GLU A 103 -15.659 17.189 0.197 1.00 0.00 C ATOM 1655 CG GLU A 103 -16.622 16.214 0.879 1.00 0.00 C ATOM 1656 CD GLU A 103 -16.855 14.976 0.012 1.00 0.00 C ATOM 1657 OE1 GLU A 103 -17.466 15.145 -1.066 1.00 0.00 O ATOM 1658 OE2 GLU A 103 -16.417 13.889 0.445 1.00 0.00 O ATOM 0 H GLU A 103 -16.318 19.579 -0.029 1.00 0.00 H new ATOM 0 HA GLU A 103 -15.503 17.973 2.173 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.149 17.649 -0.661 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -14.794 16.645 -0.183 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -16.217 15.914 1.846 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.573 16.711 1.072 1.00 0.00 H new ATOM 1665 N TRP A 104 -13.148 18.645 -0.042 1.00 0.00 N ATOM 1666 CA TRP A 104 -11.713 18.801 -0.210 1.00 0.00 C ATOM 1667 C TRP A 104 -11.204 19.716 0.905 1.00 0.00 C ATOM 1668 O TRP A 104 -10.409 19.295 1.744 1.00 0.00 O ATOM 1669 CB TRP A 104 -11.378 19.322 -1.610 1.00 0.00 C ATOM 1670 CG TRP A 104 -11.407 18.246 -2.697 1.00 0.00 C ATOM 1671 CD1 TRP A 104 -12.362 18.021 -3.610 1.00 0.00 C ATOM 1672 CD2 TRP A 104 -10.392 17.251 -2.949 1.00 0.00 C ATOM 1673 NE1 TRP A 104 -12.038 16.958 -4.429 1.00 0.00 N ATOM 1674 CE2 TRP A 104 -10.802 16.475 -4.014 1.00 0.00 C ATOM 1675 CE3 TRP A 104 -9.169 17.014 -2.298 1.00 0.00 C ATOM 1676 CZ2 TRP A 104 -10.048 15.411 -4.523 1.00 0.00 C ATOM 1677 CZ3 TRP A 104 -8.426 15.947 -2.819 1.00 0.00 C ATOM 1678 CH2 TRP A 104 -8.825 15.157 -3.891 1.00 0.00 C ATOM 0 H TRP A 104 -13.690 18.726 -0.903 1.00 0.00 H new ATOM 0 HA TRP A 104 -11.208 17.838 -0.129 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -12.085 20.109 -1.873 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -10.388 19.777 -1.590 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -13.271 18.599 -3.694 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -12.602 16.594 -5.197 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -8.829 17.608 -1.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -10.391 14.818 -5.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -7.477 15.722 -2.355 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -8.194 14.351 -4.235 1.00 0.00 H new ATOM 1689 N ARG A 105 -11.682 20.951 0.879 1.00 0.00 N ATOM 1690 CA ARG A 105 -11.285 21.929 1.878 1.00 0.00 C ATOM 1691 C ARG A 105 -11.143 21.262 3.247 1.00 0.00 C ATOM 1692 O ARG A 105 -10.059 21.254 3.828 1.00 0.00 O ATOM 1693 CB ARG A 105 -12.307 23.064 1.975 1.00 0.00 C ATOM 1694 CG ARG A 105 -11.611 24.424 2.044 1.00 0.00 C ATOM 1695 CD ARG A 105 -12.632 25.564 2.028 1.00 0.00 C ATOM 1696 NE ARG A 105 -12.950 25.979 3.412 1.00 0.00 N ATOM 1697 CZ ARG A 105 -14.010 26.726 3.748 1.00 0.00 C ATOM 1698 NH1 ARG A 105 -14.862 27.144 2.802 1.00 0.00 N ATOM 1699 NH2 ARG A 105 -14.219 27.054 5.030 1.00 0.00 N ATOM 0 H ARG A 105 -12.341 21.297 0.182 1.00 0.00 H new ATOM 0 HA ARG A 105 -10.325 22.345 1.571 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -12.971 23.035 1.111 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -12.928 22.924 2.860 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -11.009 24.483 2.951 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -10.928 24.530 1.201 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -12.235 26.411 1.468 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -13.540 25.242 1.518 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.323 25.677 4.157 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -14.703 26.893 1.826 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -15.669 27.713 3.058 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -13.571 26.735 5.750 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -15.026 27.623 5.286 1.00 0.00 H new ATOM 1713 N GLY A 106 -12.254 20.718 3.723 1.00 0.00 N ATOM 1714 CA GLY A 106 -12.267 20.050 5.013 1.00 0.00 C ATOM 1715 C GLY A 106 -11.107 19.058 5.129 1.00 0.00 C ATOM 1716 O GLY A 106 -10.175 19.274 5.902 1.00 0.00 O ATOM 0 H GLY A 106 -13.151 20.726 3.238 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.198 20.790 5.810 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -13.213 19.526 5.145 1.00 0.00 H new ATOM 1720 N PHE A 107 -11.202 17.992 4.348 1.00 0.00 N ATOM 1721 CA PHE A 107 -10.173 16.966 4.353 1.00 0.00 C ATOM 1722 C PHE A 107 -8.777 17.591 4.399 1.00 0.00 C ATOM 1723 O PHE A 107 -7.934 17.177 5.193 1.00 0.00 O ATOM 1724 CB PHE A 107 -10.323 16.176 3.051 1.00 0.00 C ATOM 1725 CG PHE A 107 -11.293 14.998 3.147 1.00 0.00 C ATOM 1726 CD1 PHE A 107 -10.844 13.776 3.542 1.00 0.00 C ATOM 1727 CD2 PHE A 107 -12.606 15.171 2.837 1.00 0.00 C ATOM 1728 CE1 PHE A 107 -11.745 12.682 3.630 1.00 0.00 C ATOM 1729 CE2 PHE A 107 -13.508 14.077 2.926 1.00 0.00 C ATOM 1730 CZ PHE A 107 -13.058 12.856 3.320 1.00 0.00 C ATOM 0 H PHE A 107 -11.976 17.817 3.707 1.00 0.00 H new ATOM 0 HA PHE A 107 -10.286 16.329 5.230 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -10.664 16.851 2.266 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -9.344 15.804 2.749 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -9.802 13.638 3.789 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -12.963 16.141 2.523 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -11.388 11.712 3.943 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -14.551 14.215 2.681 1.00 0.00 H new ATOM 0 HZ PHE A 107 -13.743 12.024 3.387 1.00 0.00 H new ATOM 1740 N ILE A 108 -8.576 18.577 3.537 1.00 0.00 N ATOM 1741 CA ILE A 108 -7.297 19.263 3.470 1.00 0.00 C ATOM 1742 C ILE A 108 -7.045 19.995 4.789 1.00 0.00 C ATOM 1743 O ILE A 108 -5.990 19.835 5.401 1.00 0.00 O ATOM 1744 CB ILE A 108 -7.241 20.173 2.241 1.00 0.00 C ATOM 1745 CG1 ILE A 108 -7.078 19.354 0.959 1.00 0.00 C ATOM 1746 CG2 ILE A 108 -6.145 21.229 2.390 1.00 0.00 C ATOM 1747 CD1 ILE A 108 -8.360 19.379 0.125 1.00 0.00 C ATOM 0 H ILE A 108 -9.277 18.917 2.879 1.00 0.00 H new ATOM 0 HA ILE A 108 -6.486 18.545 3.344 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.190 20.703 2.165 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.250 19.752 0.372 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -6.824 18.324 1.211 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -6.127 21.862 1.503 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.347 21.841 3.269 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -5.179 20.737 2.504 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -8.217 18.789 -0.780 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -9.180 18.958 0.706 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.598 20.408 -0.146 1.00 0.00 H new ATOM 1759 N LEU A 109 -8.033 20.783 5.189 1.00 0.00 N ATOM 1760 CA LEU A 109 -7.932 21.540 6.425 1.00 0.00 C ATOM 1761 C LEU A 109 -7.619 20.586 7.579 1.00 0.00 C ATOM 1762 O LEU A 109 -7.175 21.016 8.643 1.00 0.00 O ATOM 1763 CB LEU A 109 -9.193 22.379 6.645 1.00 0.00 C ATOM 1764 CG LEU A 109 -9.240 23.722 5.914 1.00 0.00 C ATOM 1765 CD1 LEU A 109 -10.598 24.401 6.104 1.00 0.00 C ATOM 1766 CD2 LEU A 109 -8.083 24.624 6.348 1.00 0.00 C ATOM 0 H LEU A 109 -8.907 20.913 4.679 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.109 22.253 6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.056 21.789 6.336 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.300 22.565 7.714 1.00 0.00 H new ATOM 0 HG LEU A 109 -9.119 23.535 4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.606 25.354 5.575 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -11.384 23.759 5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -10.773 24.575 7.166 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -8.140 25.572 5.813 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -8.148 24.808 7.420 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -7.136 24.136 6.120 1.00 0.00 H new ATOM 1778 N THR A 110 -7.864 19.307 7.331 1.00 0.00 N ATOM 1779 CA THR A 110 -7.614 18.288 8.336 1.00 0.00 C ATOM 1780 C THR A 110 -6.175 17.779 8.233 1.00 0.00 C ATOM 1781 O THR A 110 -5.493 17.625 9.245 1.00 0.00 O ATOM 1782 CB THR A 110 -8.662 17.187 8.162 1.00 0.00 C ATOM 1783 OG1 THR A 110 -9.905 17.882 8.199 1.00 0.00 O ATOM 1784 CG2 THR A 110 -8.725 16.245 9.366 1.00 0.00 C ATOM 0 H THR A 110 -8.233 18.954 6.448 1.00 0.00 H new ATOM 0 HA THR A 110 -7.710 18.693 9.343 1.00 0.00 H new ATOM 0 HB THR A 110 -8.440 16.613 7.263 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.101 18.250 7.312 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.484 15.482 9.192 1.00 0.00 H new ATOM 0 HG22 THR A 110 -7.755 15.767 9.505 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.981 16.814 10.260 1.00 0.00 H new ATOM 1792 N VAL A 111 -5.755 17.532 7.001 1.00 0.00 N ATOM 1793 CA VAL A 111 -4.409 17.044 6.753 1.00 0.00 C ATOM 1794 C VAL A 111 -3.434 18.223 6.759 1.00 0.00 C ATOM 1795 O VAL A 111 -2.264 18.068 6.411 1.00 0.00 O ATOM 1796 CB VAL A 111 -4.374 16.247 5.448 1.00 0.00 C ATOM 1797 CG1 VAL A 111 -5.127 14.923 5.594 1.00 0.00 C ATOM 1798 CG2 VAL A 111 -4.934 17.070 4.286 1.00 0.00 C ATOM 0 H VAL A 111 -6.323 17.661 6.164 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.099 16.361 7.544 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.332 16.018 5.224 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.087 14.376 4.652 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -4.665 14.326 6.380 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -6.167 15.122 5.854 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.897 16.479 3.371 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -5.967 17.345 4.499 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -4.337 17.973 4.159 1.00 0.00 H new ATOM 1808 N THR A 112 -3.951 19.375 7.160 1.00 0.00 N ATOM 1809 CA THR A 112 -3.141 20.580 7.216 1.00 0.00 C ATOM 1810 C THR A 112 -3.144 21.159 8.633 1.00 0.00 C ATOM 1811 O THR A 112 -2.086 21.431 9.198 1.00 0.00 O ATOM 1812 CB THR A 112 -3.668 21.554 6.161 1.00 0.00 C ATOM 1813 OG1 THR A 112 -5.025 21.772 6.536 1.00 0.00 O ATOM 1814 CG2 THR A 112 -3.762 20.918 4.772 1.00 0.00 C ATOM 0 H THR A 112 -4.921 19.500 7.449 1.00 0.00 H new ATOM 0 HA THR A 112 -2.097 20.365 6.988 1.00 0.00 H new ATOM 0 HB THR A 112 -3.018 22.428 6.117 1.00 0.00 H new ATOM 0 HG1 THR A 112 -5.549 20.964 6.354 1.00 0.00 H new ATOM 0 HG21 THR A 112 -4.141 21.652 4.061 1.00 0.00 H new ATOM 0 HG22 THR A 112 -2.773 20.585 4.457 1.00 0.00 H new ATOM 0 HG23 THR A 112 -4.438 20.064 4.808 1.00 0.00 H new ATOM 1822 N GLU A 113 -4.345 21.330 9.165 1.00 0.00 N ATOM 1823 CA GLU A 113 -4.500 21.872 10.504 1.00 0.00 C ATOM 1824 C GLU A 113 -4.298 20.771 11.548 1.00 0.00 C ATOM 1825 O GLU A 113 -4.191 21.054 12.741 1.00 0.00 O ATOM 1826 CB GLU A 113 -5.865 22.541 10.671 1.00 0.00 C ATOM 1827 CG GLU A 113 -6.096 23.593 9.584 1.00 0.00 C ATOM 1828 CD GLU A 113 -6.821 24.816 10.149 1.00 0.00 C ATOM 1829 OE1 GLU A 113 -7.887 24.609 10.767 1.00 0.00 O ATOM 1830 OE2 GLU A 113 -6.292 25.931 9.951 1.00 0.00 O ATOM 0 H GLU A 113 -5.220 21.103 8.693 1.00 0.00 H new ATOM 0 HA GLU A 113 -3.737 22.636 10.656 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -6.651 21.788 10.626 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.927 23.008 11.654 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.140 23.897 9.158 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -6.682 23.161 8.773 1.00 0.00 H new ATOM 1837 N LEU A 114 -4.251 19.540 11.062 1.00 0.00 N ATOM 1838 CA LEU A 114 -4.064 18.396 11.938 1.00 0.00 C ATOM 1839 C LEU A 114 -5.263 18.281 12.882 1.00 0.00 C ATOM 1840 O LEU A 114 -5.181 17.621 13.917 1.00 0.00 O ATOM 1841 CB LEU A 114 -2.719 18.489 12.661 1.00 0.00 C ATOM 1842 CG LEU A 114 -1.736 17.346 12.398 1.00 0.00 C ATOM 1843 CD1 LEU A 114 -2.406 15.987 12.612 1.00 0.00 C ATOM 1844 CD2 LEU A 114 -1.114 17.467 11.006 1.00 0.00 C ATOM 0 H LEU A 114 -4.339 19.309 10.072 1.00 0.00 H new ATOM 0 HA LEU A 114 -4.025 17.474 11.358 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -2.240 19.426 12.377 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -2.908 18.540 13.733 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.923 17.421 13.120 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -1.686 15.192 12.419 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -2.760 15.914 13.640 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -3.250 15.886 11.930 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.420 16.642 10.845 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -1.900 17.432 10.252 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.578 18.413 10.928 1.00 0.00 H new ATOM 1856 N SER A 115 -6.348 18.933 12.491 1.00 0.00 N ATOM 1857 CA SER A 115 -7.562 18.911 13.290 1.00 0.00 C ATOM 1858 C SER A 115 -8.784 18.764 12.381 1.00 0.00 C ATOM 1859 O SER A 115 -8.681 18.226 11.279 1.00 0.00 O ATOM 1860 CB SER A 115 -7.683 20.177 14.141 1.00 0.00 C ATOM 1861 OG SER A 115 -8.296 19.916 15.401 1.00 0.00 O ATOM 0 H SER A 115 -6.412 19.479 11.632 1.00 0.00 H new ATOM 0 HA SER A 115 -7.513 18.055 13.964 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.692 20.603 14.301 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.267 20.922 13.601 1.00 0.00 H new ATOM 0 HG SER A 115 -8.354 20.748 15.915 1.00 0.00 H new ATOM 1867 N VAL A 116 -9.912 19.251 12.876 1.00 0.00 N ATOM 1868 CA VAL A 116 -11.152 19.180 12.122 1.00 0.00 C ATOM 1869 C VAL A 116 -11.880 20.522 12.219 1.00 0.00 C ATOM 1870 O VAL A 116 -12.098 21.036 13.315 1.00 0.00 O ATOM 1871 CB VAL A 116 -11.998 18.004 12.615 1.00 0.00 C ATOM 1872 CG1 VAL A 116 -13.260 17.843 11.766 1.00 0.00 C ATOM 1873 CG2 VAL A 116 -11.180 16.711 12.632 1.00 0.00 C ATOM 0 H VAL A 116 -9.993 19.696 13.790 1.00 0.00 H new ATOM 0 HA VAL A 116 -10.948 18.996 11.067 1.00 0.00 H new ATOM 0 HB VAL A 116 -12.308 18.219 13.638 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -13.843 17.000 12.137 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -13.858 18.753 11.826 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -12.980 17.661 10.728 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -11.804 15.890 12.986 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -10.827 16.490 11.624 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -10.325 16.830 13.298 1.00 0.00 H new ATOM 1883 N PRO A 117 -12.246 21.065 11.027 1.00 0.00 N ATOM 1884 CA PRO A 117 -12.946 22.337 10.968 1.00 0.00 C ATOM 1885 C PRO A 117 -14.410 22.179 11.384 1.00 0.00 C ATOM 1886 O PRO A 117 -15.169 21.462 10.734 1.00 0.00 O ATOM 1887 CB PRO A 117 -12.785 22.808 9.531 1.00 0.00 C ATOM 1888 CG PRO A 117 -12.406 21.574 8.728 1.00 0.00 C ATOM 1889 CD PRO A 117 -12.005 20.484 9.710 1.00 0.00 C ATOM 0 HA PRO A 117 -12.540 23.072 11.663 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -13.710 23.248 9.158 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -12.014 23.575 9.455 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -13.245 21.245 8.114 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -11.583 21.798 8.049 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -12.596 19.580 9.562 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -10.959 20.204 9.586 1.00 0.00 H new ATOM 1897 N GLN A 118 -14.761 22.859 12.465 1.00 0.00 N ATOM 1898 CA GLN A 118 -16.120 22.803 12.976 1.00 0.00 C ATOM 1899 C GLN A 118 -16.961 23.930 12.373 1.00 0.00 C ATOM 1900 O GLN A 118 -17.972 24.330 12.948 1.00 0.00 O ATOM 1901 CB GLN A 118 -16.134 22.865 14.504 1.00 0.00 C ATOM 1902 CG GLN A 118 -16.386 21.482 15.107 1.00 0.00 C ATOM 1903 CD GLN A 118 -17.723 20.910 14.628 1.00 0.00 C ATOM 1904 OE1 GLN A 118 -18.791 21.355 15.013 1.00 0.00 O ATOM 1905 NE2 GLN A 118 -17.603 19.901 13.770 1.00 0.00 N ATOM 0 H GLN A 118 -14.128 23.452 13.001 1.00 0.00 H new ATOM 0 HA GLN A 118 -16.560 21.850 12.680 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -15.182 23.255 14.864 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -16.908 23.557 14.836 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -15.577 20.807 14.828 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -16.384 21.550 16.195 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -16.677 19.578 13.489 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -18.437 19.451 13.393 1.00 0.00 H new ATOM 1914 N ASN A 119 -16.512 24.410 11.223 1.00 0.00 N ATOM 1915 CA ASN A 119 -17.210 25.483 10.536 1.00 0.00 C ATOM 1916 C ASN A 119 -17.479 25.067 9.089 1.00 0.00 C ATOM 1917 O ASN A 119 -17.181 25.815 8.158 1.00 0.00 O ATOM 1918 CB ASN A 119 -16.369 26.761 10.512 1.00 0.00 C ATOM 1919 CG ASN A 119 -16.014 27.210 11.931 1.00 0.00 C ATOM 1920 OD1 ASN A 119 -16.752 27.928 12.585 1.00 0.00 O ATOM 1921 ND2 ASN A 119 -14.845 26.750 12.368 1.00 0.00 N ATOM 0 H ASN A 119 -15.673 24.075 10.749 1.00 0.00 H new ATOM 0 HA ASN A 119 -18.141 25.674 11.069 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -15.456 26.589 9.942 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -16.918 27.553 10.003 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -14.518 26.995 13.303 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -14.276 26.152 11.769 1.00 0.00 H new ATOM 1928 N VAL A 120 -18.038 23.875 8.944 1.00 0.00 N ATOM 1929 CA VAL A 120 -18.351 23.350 7.625 1.00 0.00 C ATOM 1930 C VAL A 120 -19.861 23.130 7.513 1.00 0.00 C ATOM 1931 O VAL A 120 -20.556 23.042 8.523 1.00 0.00 O ATOM 1932 CB VAL A 120 -17.540 22.079 7.363 1.00 0.00 C ATOM 1933 CG1 VAL A 120 -16.161 22.415 6.793 1.00 0.00 C ATOM 1934 CG2 VAL A 120 -17.418 21.235 8.633 1.00 0.00 C ATOM 0 H VAL A 120 -18.283 23.257 9.718 1.00 0.00 H new ATOM 0 HA VAL A 120 -18.069 24.065 6.852 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.074 21.489 6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -15.606 21.494 6.616 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -16.277 22.954 5.853 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -15.615 23.037 7.503 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -16.837 20.338 8.419 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -16.918 21.815 9.409 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -18.412 20.950 8.977 1.00 0.00 H new ATOM 1944 N SER A 121 -20.324 23.049 6.274 1.00 0.00 N ATOM 1945 CA SER A 121 -21.739 22.841 6.016 1.00 0.00 C ATOM 1946 C SER A 121 -21.997 21.374 5.667 1.00 0.00 C ATOM 1947 O SER A 121 -23.147 20.958 5.534 1.00 0.00 O ATOM 1948 CB SER A 121 -22.232 23.750 4.888 1.00 0.00 C ATOM 1949 OG SER A 121 -23.539 24.258 5.145 1.00 0.00 O ATOM 0 H SER A 121 -19.744 23.124 5.438 1.00 0.00 H new ATOM 0 HA SER A 121 -22.293 23.095 6.920 1.00 0.00 H new ATOM 0 HB2 SER A 121 -21.538 24.581 4.762 1.00 0.00 H new ATOM 0 HB3 SER A 121 -22.237 23.194 3.950 1.00 0.00 H new ATOM 0 HG SER A 121 -23.818 24.835 4.403 1.00 0.00 H new ATOM 1955 N LEU A 122 -20.909 20.631 5.529 1.00 0.00 N ATOM 1956 CA LEU A 122 -21.004 19.220 5.198 1.00 0.00 C ATOM 1957 C LEU A 122 -21.979 18.539 6.161 1.00 0.00 C ATOM 1958 O LEU A 122 -22.252 19.057 7.243 1.00 0.00 O ATOM 1959 CB LEU A 122 -19.614 18.580 5.176 1.00 0.00 C ATOM 1960 CG LEU A 122 -19.230 17.854 3.885 1.00 0.00 C ATOM 1961 CD1 LEU A 122 -19.664 18.656 2.656 1.00 0.00 C ATOM 1962 CD2 LEU A 122 -17.735 17.533 3.861 1.00 0.00 C ATOM 0 H LEU A 122 -19.957 20.980 5.640 1.00 0.00 H new ATOM 0 HA LEU A 122 -21.405 19.091 4.193 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -18.875 19.358 5.366 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -19.549 17.871 6.001 1.00 0.00 H new ATOM 0 HG LEU A 122 -19.764 16.904 3.855 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -19.379 18.118 1.752 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -20.745 18.791 2.673 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -19.177 19.631 2.667 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -17.488 17.017 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -17.163 18.459 3.925 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -17.486 16.894 4.708 1.00 0.00 H new ATOM 1974 N LEU A 123 -22.477 17.388 5.733 1.00 0.00 N ATOM 1975 CA LEU A 123 -23.416 16.632 6.544 1.00 0.00 C ATOM 1976 C LEU A 123 -22.713 16.152 7.816 1.00 0.00 C ATOM 1977 O LEU A 123 -21.493 16.256 7.933 1.00 0.00 O ATOM 1978 CB LEU A 123 -24.042 15.502 5.724 1.00 0.00 C ATOM 1979 CG LEU A 123 -25.160 15.910 4.763 1.00 0.00 C ATOM 1980 CD1 LEU A 123 -26.014 17.031 5.360 1.00 0.00 C ATOM 1981 CD2 LEU A 123 -24.593 16.289 3.393 1.00 0.00 C ATOM 0 H LEU A 123 -22.248 16.961 4.836 1.00 0.00 H new ATOM 0 HA LEU A 123 -24.246 17.266 6.857 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -23.253 15.018 5.148 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -24.437 14.756 6.413 1.00 0.00 H new ATOM 0 HG LEU A 123 -25.814 15.051 4.615 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -26.801 17.302 4.657 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -26.462 16.689 6.293 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -25.387 17.901 5.556 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -25.408 16.575 2.728 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -23.904 17.126 3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -24.062 15.436 2.970 1.00 0.00 H new ATOM 1993 N PRO A 124 -23.535 15.624 8.762 1.00 0.00 N ATOM 1994 CA PRO A 124 -23.006 15.128 10.021 1.00 0.00 C ATOM 1995 C PRO A 124 -22.305 13.782 9.829 1.00 0.00 C ATOM 1996 O PRO A 124 -21.665 13.274 10.749 1.00 0.00 O ATOM 1997 CB PRO A 124 -24.208 15.045 10.948 1.00 0.00 C ATOM 1998 CG PRO A 124 -25.431 15.052 10.046 1.00 0.00 C ATOM 1999 CD PRO A 124 -24.985 15.485 8.659 1.00 0.00 C ATOM 0 HA PRO A 124 -22.240 15.780 10.441 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -24.173 14.138 11.552 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -24.227 15.888 11.639 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -25.884 14.061 10.009 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -26.188 15.734 10.434 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -25.259 14.746 7.906 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -25.453 16.425 8.368 1.00 0.00 H new ATOM 2007 N GLY A 125 -22.449 13.242 8.628 1.00 0.00 N ATOM 2008 CA GLY A 125 -21.838 11.964 8.304 1.00 0.00 C ATOM 2009 C GLY A 125 -20.505 12.162 7.579 1.00 0.00 C ATOM 2010 O GLY A 125 -19.580 11.369 7.745 1.00 0.00 O ATOM 0 H GLY A 125 -22.980 13.666 7.867 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -21.678 11.391 9.218 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -22.514 11.382 7.678 1.00 0.00 H new ATOM 2014 N GLN A 126 -20.449 13.226 6.791 1.00 0.00 N ATOM 2015 CA GLN A 126 -19.245 13.539 6.040 1.00 0.00 C ATOM 2016 C GLN A 126 -18.170 14.102 6.972 1.00 0.00 C ATOM 2017 O GLN A 126 -16.999 13.743 6.863 1.00 0.00 O ATOM 2018 CB GLN A 126 -19.547 14.512 4.899 1.00 0.00 C ATOM 2019 CG GLN A 126 -20.444 13.860 3.845 1.00 0.00 C ATOM 2020 CD GLN A 126 -19.629 13.419 2.628 1.00 0.00 C ATOM 2021 OE1 GLN A 126 -19.398 14.392 1.750 1.00 0.00 O flip ATOM 2022 NE2 GLN A 126 -19.235 12.272 2.495 1.00 0.00 N flip ATOM 0 H GLN A 126 -21.218 13.882 6.656 1.00 0.00 H new ATOM 0 HA GLN A 126 -18.867 12.618 5.596 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -20.034 15.403 5.295 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -18.615 14.837 4.437 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -20.953 12.999 4.278 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -21.216 14.563 3.534 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -19.448 11.574 3.208 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -18.693 12.011 1.671 1.00 0.00 H new ATOM 2031 N VAL A 127 -18.607 14.975 7.868 1.00 0.00 N ATOM 2032 CA VAL A 127 -17.697 15.592 8.818 1.00 0.00 C ATOM 2033 C VAL A 127 -16.866 14.504 9.501 1.00 0.00 C ATOM 2034 O VAL A 127 -15.699 14.720 9.824 1.00 0.00 O ATOM 2035 CB VAL A 127 -18.480 16.456 9.808 1.00 0.00 C ATOM 2036 CG1 VAL A 127 -17.789 16.491 11.172 1.00 0.00 C ATOM 2037 CG2 VAL A 127 -18.684 17.870 9.260 1.00 0.00 C ATOM 0 H VAL A 127 -19.580 15.270 7.956 1.00 0.00 H new ATOM 0 HA VAL A 127 -17.003 16.258 8.305 1.00 0.00 H new ATOM 0 HB VAL A 127 -19.463 16.004 9.942 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -18.367 17.112 11.857 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -17.720 15.479 11.571 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -16.788 16.907 11.062 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -19.243 18.463 9.983 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -17.714 18.335 9.082 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -19.240 17.821 8.324 1.00 0.00 H new ATOM 2047 N ILE A 128 -17.500 13.358 9.701 1.00 0.00 N ATOM 2048 CA ILE A 128 -16.834 12.236 10.340 1.00 0.00 C ATOM 2049 C ILE A 128 -15.504 11.967 9.632 1.00 0.00 C ATOM 2050 O ILE A 128 -14.473 11.803 10.282 1.00 0.00 O ATOM 2051 CB ILE A 128 -17.761 11.020 10.390 1.00 0.00 C ATOM 2052 CG1 ILE A 128 -18.960 11.281 11.304 1.00 0.00 C ATOM 2053 CG2 ILE A 128 -16.993 9.761 10.798 1.00 0.00 C ATOM 2054 CD1 ILE A 128 -20.162 10.432 10.888 1.00 0.00 C ATOM 0 H ILE A 128 -18.468 13.182 9.432 1.00 0.00 H new ATOM 0 HA ILE A 128 -16.601 12.473 11.378 1.00 0.00 H new ATOM 0 HB ILE A 128 -18.152 10.848 9.387 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -18.691 11.056 12.336 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -19.226 12.337 11.267 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -17.675 8.912 10.826 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -16.201 9.567 10.074 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -16.554 9.906 11.785 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -21.000 10.637 11.554 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -20.444 10.677 9.864 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -19.900 9.376 10.949 1.00 0.00 H new ATOM 2066 N LYS A 129 -15.572 11.931 8.310 1.00 0.00 N ATOM 2067 CA LYS A 129 -14.386 11.684 7.507 1.00 0.00 C ATOM 2068 C LYS A 129 -13.246 12.577 8.001 1.00 0.00 C ATOM 2069 O LYS A 129 -12.158 12.089 8.303 1.00 0.00 O ATOM 2070 CB LYS A 129 -14.701 11.857 6.019 1.00 0.00 C ATOM 2071 CG LYS A 129 -15.782 10.872 5.570 1.00 0.00 C ATOM 2072 CD LYS A 129 -15.228 9.448 5.493 1.00 0.00 C ATOM 2073 CE LYS A 129 -14.564 9.190 4.138 1.00 0.00 C ATOM 2074 NZ LYS A 129 -15.540 8.615 3.185 1.00 0.00 N ATOM 0 H LYS A 129 -16.429 12.069 7.774 1.00 0.00 H new ATOM 0 HA LYS A 129 -14.056 10.651 7.622 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -15.033 12.878 5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.796 11.702 5.432 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -16.620 10.903 6.267 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -16.168 11.169 4.595 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.504 9.292 6.292 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -16.034 8.731 5.649 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -14.163 10.122 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -13.723 8.508 4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -15.074 8.446 2.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.903 7.716 3.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -16.329 9.279 3.054 1.00 0.00 H new ATOM 2088 N LEU A 130 -13.534 13.868 8.069 1.00 0.00 N ATOM 2089 CA LEU A 130 -12.547 14.833 8.522 1.00 0.00 C ATOM 2090 C LEU A 130 -11.930 14.346 9.835 1.00 0.00 C ATOM 2091 O LEU A 130 -10.763 14.617 10.114 1.00 0.00 O ATOM 2092 CB LEU A 130 -13.165 16.230 8.613 1.00 0.00 C ATOM 2093 CG LEU A 130 -13.853 16.743 7.347 1.00 0.00 C ATOM 2094 CD1 LEU A 130 -14.191 18.230 7.471 1.00 0.00 C ATOM 2095 CD2 LEU A 130 -13.007 16.450 6.106 1.00 0.00 C ATOM 0 H LEU A 130 -14.438 14.269 7.818 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.735 14.916 7.799 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -13.893 16.231 9.424 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -12.381 16.935 8.888 1.00 0.00 H new ATOM 0 HG LEU A 130 -14.795 16.207 7.229 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -14.679 18.570 6.558 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -14.860 18.382 8.318 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -13.275 18.800 7.626 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.519 16.825 5.220 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.039 16.942 6.201 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.860 15.374 6.012 1.00 0.00 H new ATOM 2107 N HIS A 131 -12.741 13.637 10.606 1.00 0.00 N ATOM 2108 CA HIS A 131 -12.289 13.111 11.882 1.00 0.00 C ATOM 2109 C HIS A 131 -11.462 11.844 11.652 1.00 0.00 C ATOM 2110 O HIS A 131 -10.353 11.719 12.169 1.00 0.00 O ATOM 2111 CB HIS A 131 -13.472 12.883 12.825 1.00 0.00 C ATOM 2112 CG HIS A 131 -13.585 13.908 13.929 1.00 0.00 C ATOM 2113 ND1 HIS A 131 -12.565 14.152 14.832 1.00 0.00 N ATOM 2114 CD2 HIS A 131 -14.605 14.749 14.263 1.00 0.00 C ATOM 2115 CE1 HIS A 131 -12.965 15.098 15.669 1.00 0.00 C ATOM 2116 NE2 HIS A 131 -14.230 15.466 15.315 1.00 0.00 N ATOM 0 H HIS A 131 -13.708 13.415 10.371 1.00 0.00 H new ATOM 0 HA HIS A 131 -11.644 13.840 12.371 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -14.394 12.888 12.243 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -13.382 11.892 13.271 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -15.557 14.820 13.757 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -12.391 15.506 16.488 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -14.795 16.175 15.782 1.00 0.00 H new ATOM 2124 N GLU A 132 -12.034 10.936 10.874 1.00 0.00 N ATOM 2125 CA GLU A 132 -11.364 9.684 10.568 1.00 0.00 C ATOM 2126 C GLU A 132 -10.045 9.952 9.840 1.00 0.00 C ATOM 2127 O GLU A 132 -9.039 9.299 10.111 1.00 0.00 O ATOM 2128 CB GLU A 132 -12.268 8.765 9.744 1.00 0.00 C ATOM 2129 CG GLU A 132 -13.501 8.345 10.548 1.00 0.00 C ATOM 2130 CD GLU A 132 -14.262 7.223 9.838 1.00 0.00 C ATOM 2131 OE1 GLU A 132 -13.581 6.291 9.359 1.00 0.00 O ATOM 2132 OE2 GLU A 132 -15.507 7.324 9.790 1.00 0.00 O ATOM 0 H GLU A 132 -12.954 11.043 10.447 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.142 9.175 11.506 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.580 9.277 8.834 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.710 7.880 9.437 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.197 8.012 11.540 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.158 9.203 10.688 1.00 0.00 H new ATOM 2139 N VAL A 133 -10.093 10.913 8.929 1.00 0.00 N ATOM 2140 CA VAL A 133 -8.915 11.275 8.160 1.00 0.00 C ATOM 2141 C VAL A 133 -7.821 11.766 9.111 1.00 0.00 C ATOM 2142 O VAL A 133 -6.656 11.402 8.963 1.00 0.00 O ATOM 2143 CB VAL A 133 -9.284 12.305 7.091 1.00 0.00 C ATOM 2144 CG1 VAL A 133 -8.030 12.927 6.473 1.00 0.00 C ATOM 2145 CG2 VAL A 133 -10.175 11.683 6.015 1.00 0.00 C ATOM 0 H VAL A 133 -10.930 11.452 8.706 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.521 10.406 7.633 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.849 13.102 7.574 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -8.320 13.656 5.716 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.449 13.423 7.250 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -7.426 12.146 6.012 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.423 12.437 5.267 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -9.647 10.858 5.537 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -11.092 11.311 6.472 1.00 0.00 H new ATOM 2155 N LEU A 134 -8.236 12.584 10.067 1.00 0.00 N ATOM 2156 CA LEU A 134 -7.307 13.128 11.042 1.00 0.00 C ATOM 2157 C LEU A 134 -6.589 11.979 11.753 1.00 0.00 C ATOM 2158 O LEU A 134 -5.379 11.814 11.609 1.00 0.00 O ATOM 2159 CB LEU A 134 -8.027 14.086 11.993 1.00 0.00 C ATOM 2160 CG LEU A 134 -7.257 14.486 13.253 1.00 0.00 C ATOM 2161 CD1 LEU A 134 -5.803 14.829 12.921 1.00 0.00 C ATOM 2162 CD2 LEU A 134 -7.962 15.628 13.987 1.00 0.00 C ATOM 0 H LEU A 134 -9.204 12.883 10.187 1.00 0.00 H new ATOM 0 HA LEU A 134 -6.541 13.724 10.546 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.279 14.992 11.442 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.967 13.626 12.297 1.00 0.00 H new ATOM 0 HG LEU A 134 -7.240 13.631 13.929 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -5.278 15.110 13.834 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.317 13.961 12.475 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.777 15.661 12.217 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.394 15.893 14.879 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -8.031 16.495 13.330 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -8.964 15.311 14.276 1.00 0.00 H new ATOM 2174 N GLU A 135 -7.367 11.214 12.505 1.00 0.00 N ATOM 2175 CA GLU A 135 -6.821 10.085 13.239 1.00 0.00 C ATOM 2176 C GLU A 135 -5.969 9.212 12.314 1.00 0.00 C ATOM 2177 O GLU A 135 -5.005 8.589 12.756 1.00 0.00 O ATOM 2178 CB GLU A 135 -7.935 9.265 13.893 1.00 0.00 C ATOM 2179 CG GLU A 135 -8.782 10.136 14.823 1.00 0.00 C ATOM 2180 CD GLU A 135 -9.750 9.281 15.644 1.00 0.00 C ATOM 2181 OE1 GLU A 135 -9.250 8.537 16.516 1.00 0.00 O ATOM 2182 OE2 GLU A 135 -10.967 9.390 15.381 1.00 0.00 O ATOM 0 H GLU A 135 -8.371 11.354 12.622 1.00 0.00 H new ATOM 0 HA GLU A 135 -6.183 10.469 14.035 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -8.569 8.826 13.122 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -7.501 8.440 14.457 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -8.132 10.699 15.492 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -9.342 10.864 14.236 1.00 0.00 H new ATOM 2189 N ARG A 136 -6.356 9.195 11.047 1.00 0.00 N ATOM 2190 CA ARG A 136 -5.640 8.410 10.056 1.00 0.00 C ATOM 2191 C ARG A 136 -4.214 8.939 9.888 1.00 0.00 C ATOM 2192 O ARG A 136 -3.248 8.231 10.166 1.00 0.00 O ATOM 2193 CB ARG A 136 -6.354 8.447 8.703 1.00 0.00 C ATOM 2194 CG ARG A 136 -7.107 7.141 8.444 1.00 0.00 C ATOM 2195 CD ARG A 136 -6.171 6.072 7.875 1.00 0.00 C ATOM 2196 NE ARG A 136 -6.919 4.816 7.644 1.00 0.00 N ATOM 2197 CZ ARG A 136 -7.387 4.030 8.622 1.00 0.00 C ATOM 2198 NH1 ARG A 136 -7.189 4.365 9.904 1.00 0.00 N ATOM 2199 NH2 ARG A 136 -8.055 2.908 8.318 1.00 0.00 N ATOM 0 H ARG A 136 -7.156 9.712 10.684 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.609 7.379 10.409 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -7.052 9.284 8.679 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.627 8.615 7.909 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.552 6.783 9.373 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.926 7.321 7.747 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.732 6.421 6.940 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -5.347 5.893 8.566 1.00 0.00 H new ATOM 0 HE ARG A 136 -7.089 4.531 6.679 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -6.682 5.219 10.135 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -7.546 3.766 10.649 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -8.207 2.653 7.342 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -8.412 2.309 9.063 1.00 0.00 H new ATOM 2213 N GLU A 137 -4.128 10.181 9.434 1.00 0.00 N ATOM 2214 CA GLU A 137 -2.837 10.814 9.225 1.00 0.00 C ATOM 2215 C GLU A 137 -2.093 10.952 10.555 1.00 0.00 C ATOM 2216 O GLU A 137 -0.865 11.017 10.580 1.00 0.00 O ATOM 2217 CB GLU A 137 -2.996 12.173 8.542 1.00 0.00 C ATOM 2218 CG GLU A 137 -3.513 13.224 9.526 1.00 0.00 C ATOM 2219 CD GLU A 137 -4.753 13.930 8.974 1.00 0.00 C ATOM 2220 OE1 GLU A 137 -5.454 13.291 8.159 1.00 0.00 O ATOM 2221 OE2 GLU A 137 -4.973 15.091 9.379 1.00 0.00 O ATOM 0 H GLU A 137 -4.932 10.766 9.205 1.00 0.00 H new ATOM 0 HA GLU A 137 -2.246 10.180 8.564 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -2.038 12.493 8.133 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -3.687 12.084 7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -3.754 12.749 10.477 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -2.731 13.957 9.725 1.00 0.00 H new ATOM 2228 N LYS A 138 -2.868 10.993 11.629 1.00 0.00 N ATOM 2229 CA LYS A 138 -2.298 11.123 12.959 1.00 0.00 C ATOM 2230 C LYS A 138 -1.215 10.059 13.151 1.00 0.00 C ATOM 2231 O LYS A 138 -0.058 10.387 13.411 1.00 0.00 O ATOM 2232 CB LYS A 138 -3.399 11.077 14.021 1.00 0.00 C ATOM 2233 CG LYS A 138 -3.888 12.486 14.364 1.00 0.00 C ATOM 2234 CD LYS A 138 -5.065 12.435 15.340 1.00 0.00 C ATOM 2235 CE LYS A 138 -5.114 13.695 16.206 1.00 0.00 C ATOM 2236 NZ LYS A 138 -4.490 13.443 17.524 1.00 0.00 N ATOM 0 H LYS A 138 -3.886 10.938 11.605 1.00 0.00 H new ATOM 0 HA LYS A 138 -1.816 12.094 13.073 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -4.234 10.476 13.659 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -3.022 10.590 14.920 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.072 13.061 14.802 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.189 13.002 13.452 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -5.998 12.334 14.785 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -4.976 11.555 15.977 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -4.596 14.510 15.702 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -6.149 14.010 16.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -4.532 14.309 18.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -5.002 12.679 18.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -3.497 13.164 17.390 1.00 0.00 H new ATOM 2250 N LYS A 139 -1.628 8.808 13.015 1.00 0.00 N ATOM 2251 CA LYS A 139 -0.707 7.695 13.170 1.00 0.00 C ATOM 2252 C LYS A 139 0.620 8.038 12.492 1.00 0.00 C ATOM 2253 O LYS A 139 1.680 7.945 13.110 1.00 0.00 O ATOM 2254 CB LYS A 139 -1.342 6.400 12.659 1.00 0.00 C ATOM 2255 CG LYS A 139 -2.361 5.855 13.662 1.00 0.00 C ATOM 2256 CD LYS A 139 -3.776 6.318 13.312 1.00 0.00 C ATOM 2257 CE LYS A 139 -4.747 5.136 13.280 1.00 0.00 C ATOM 2258 NZ LYS A 139 -5.868 5.359 14.220 1.00 0.00 N ATOM 0 H LYS A 139 -2.588 8.540 12.799 1.00 0.00 H new ATOM 0 HA LYS A 139 -0.491 7.523 14.224 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -1.831 6.584 11.702 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -0.566 5.655 12.483 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -2.322 4.766 13.670 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -2.103 6.190 14.667 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -4.114 7.051 14.044 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -3.770 6.815 12.342 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -5.133 5.003 12.270 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -4.221 4.219 13.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -6.517 4.547 14.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -5.496 5.464 15.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -6.380 6.223 13.951 1.00 0.00 H new ATOM 2272 N ARG A 140 0.520 8.428 11.230 1.00 0.00 N ATOM 2273 CA ARG A 140 1.700 8.786 10.461 1.00 0.00 C ATOM 2274 C ARG A 140 2.682 9.573 11.332 1.00 0.00 C ATOM 2275 O ARG A 140 3.881 9.298 11.326 1.00 0.00 O ATOM 2276 CB ARG A 140 1.327 9.627 9.238 1.00 0.00 C ATOM 2277 CG ARG A 140 2.206 9.270 8.038 1.00 0.00 C ATOM 2278 CD ARG A 140 1.620 9.832 6.742 1.00 0.00 C ATOM 2279 NE ARG A 140 1.751 11.306 6.724 1.00 0.00 N ATOM 2280 CZ ARG A 140 2.906 11.954 6.521 1.00 0.00 C ATOM 2281 NH1 ARG A 140 4.036 11.264 6.318 1.00 0.00 N ATOM 2282 NH2 ARG A 140 2.931 13.294 6.522 1.00 0.00 N ATOM 0 H ARG A 140 -0.360 8.504 10.720 1.00 0.00 H new ATOM 0 HA ARG A 140 2.168 7.862 10.123 1.00 0.00 H new ATOM 0 HB2 ARG A 140 0.279 9.465 8.987 1.00 0.00 H new ATOM 0 HB3 ARG A 140 1.438 10.686 9.473 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.211 9.665 8.188 1.00 0.00 H new ATOM 0 HG3 ARG A 140 2.298 8.187 7.960 1.00 0.00 H new ATOM 0 HD2 ARG A 140 2.136 9.402 5.884 1.00 0.00 H new ATOM 0 HD3 ARG A 140 0.570 9.551 6.656 1.00 0.00 H new ATOM 0 HE ARG A 140 0.910 11.863 6.875 1.00 0.00 H new ATOM 0 HH11 ARG A 140 4.018 10.244 6.318 1.00 0.00 H new ATOM 0 HH12 ARG A 140 4.915 11.758 6.164 1.00 0.00 H new ATOM 0 HH21 ARG A 140 2.071 13.820 6.677 1.00 0.00 H new ATOM 0 HH22 ARG A 140 3.810 13.788 6.368 1.00 0.00 H new