USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 766 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 92 SER OG : rot 141:sc= 0.084 USER MOD Set 1.2: A 94 HIS : no HD1:sc= -2.58 K(o=-2.5,f=-3.4!) USER MOD Set 2.1: A 91 LYS NZ :NH3+ 177:sc= 0.00112 (180deg=0) USER MOD Set 2.2: A 99 THR OG1 : rot -120:sc= 0 USER MOD Set 3.1: A 24 GLN : amide:sc= -1.44 K(o=-1.2,f=-7!) USER MOD Set 3.2: A 26 THR OG1 : rot 80:sc= 0.278 USER MOD Single : A 32 ASN :FLIP amide:sc= -0.664 F(o=-1.7!,f=-0.66) USER MOD Single : A 34 SER OG : rot -79:sc= -2.81! USER MOD Single : A 36 SER OG : rot 90:sc= 0.262 USER MOD Single : A 42 SER OG : rot -179:sc= 0.0092 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -0.119 K(o=-0.12,f=-0.88) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot -170:sc=-0.000401 USER MOD Single : A 51 THR OG1 : rot 180:sc= -1.01 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.247 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 61:sc= 0.199 USER MOD Single : A 64 HIS : no HD1:sc= -3.38! C(o=-3.4!,f=-4.8!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 GLN : amide:sc= -0.0302 K(o=-0.03,f=-1.4!) USER MOD Single : A 84 ASN :FLIP amide:sc= -2.06 F(o=-2.8,f=-2.1) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -0.0299 X(o=-0.03,f=-0.059) USER MOD Single : A 97 MET CE :methyl -126:sc= -11.5! (180deg=-17.2!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -111:sc= -12.4! (180deg=-16.7!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= -0.101 K(o=-0.1,f=-0.7) USER MOD Single : A 113 MET CE :methyl 170:sc= 0 (180deg=-0.0802) USER MOD Single : A 115 GLN : amide:sc= -4.07! C(o=-4.1!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 283 N GLU A 23 -1.751 16.263 -6.013 1.00 0.00 N ATOM 284 CA GLU A 23 -1.645 15.180 -6.976 1.00 0.00 C ATOM 285 C GLU A 23 -2.323 13.920 -6.435 1.00 0.00 C ATOM 286 O GLU A 23 -2.314 13.674 -5.230 1.00 0.00 O ATOM 287 CB GLU A 23 -0.183 14.905 -7.334 1.00 0.00 C ATOM 288 CG GLU A 23 0.656 16.180 -7.229 1.00 0.00 C ATOM 289 CD GLU A 23 1.474 16.193 -5.935 1.00 0.00 C ATOM 290 OE1 GLU A 23 0.906 16.626 -4.910 1.00 0.00 O ATOM 291 OE2 GLU A 23 2.648 15.769 -6.002 1.00 0.00 O ATOM 0 HA GLU A 23 -2.158 15.481 -7.889 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.221 14.143 -6.667 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.121 14.507 -8.347 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.325 16.251 -8.087 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.004 17.053 -7.260 1.00 0.00 H new ATOM 298 N GLN A 24 -2.896 13.155 -7.353 1.00 0.00 N ATOM 299 CA GLN A 24 -3.578 11.926 -6.983 1.00 0.00 C ATOM 300 C GLN A 24 -3.259 10.818 -7.989 1.00 0.00 C ATOM 301 O GLN A 24 -3.118 11.081 -9.183 1.00 0.00 O ATOM 302 CB GLN A 24 -5.087 12.148 -6.872 1.00 0.00 C ATOM 303 CG GLN A 24 -5.838 10.815 -6.846 1.00 0.00 C ATOM 304 CD GLN A 24 -6.340 10.441 -8.243 1.00 0.00 C ATOM 305 OE1 GLN A 24 -5.593 10.008 -9.104 1.00 0.00 O ATOM 306 NE2 GLN A 24 -7.644 10.633 -8.417 1.00 0.00 N ATOM 0 H GLN A 24 -2.902 13.362 -8.352 1.00 0.00 H new ATOM 0 HA GLN A 24 -3.217 11.615 -6.003 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -5.309 12.712 -5.966 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.433 12.748 -7.714 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.181 10.031 -6.470 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -6.681 10.882 -6.158 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -8.212 10.999 -7.653 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.076 10.414 -9.315 1.00 0.00 H new ATOM 315 N LEU A 25 -3.155 9.604 -7.471 1.00 0.00 N ATOM 316 CA LEU A 25 -2.856 8.455 -8.309 1.00 0.00 C ATOM 317 C LEU A 25 -3.984 7.429 -8.184 1.00 0.00 C ATOM 318 O LEU A 25 -4.663 7.371 -7.160 1.00 0.00 O ATOM 319 CB LEU A 25 -1.473 7.893 -7.974 1.00 0.00 C ATOM 320 CG LEU A 25 -0.281 8.644 -8.571 1.00 0.00 C ATOM 321 CD1 LEU A 25 1.011 8.300 -7.827 1.00 0.00 C ATOM 322 CD2 LEU A 25 -0.165 8.382 -10.074 1.00 0.00 C ATOM 0 H LEU A 25 -3.272 9.390 -6.481 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.809 8.750 -9.357 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.362 7.878 -6.890 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -1.432 6.858 -8.313 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.451 9.713 -8.443 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.843 8.847 -8.271 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.912 8.579 -6.778 1.00 0.00 H new ATOM 0 HD13 LEU A 25 1.200 7.229 -7.902 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.690 8.927 -10.473 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.028 7.315 -10.248 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.074 8.717 -10.573 1.00 0.00 H new ATOM 334 N THR A 26 -4.149 6.646 -9.240 1.00 0.00 N ATOM 335 CA THR A 26 -5.183 5.626 -9.260 1.00 0.00 C ATOM 336 C THR A 26 -4.614 4.300 -9.770 1.00 0.00 C ATOM 337 O THR A 26 -4.220 4.195 -10.931 1.00 0.00 O ATOM 338 CB THR A 26 -6.348 6.150 -10.101 1.00 0.00 C ATOM 339 OG1 THR A 26 -6.758 7.336 -9.425 1.00 0.00 O ATOM 340 CG2 THR A 26 -7.576 5.240 -10.033 1.00 0.00 C ATOM 0 H THR A 26 -3.584 6.698 -10.088 1.00 0.00 H new ATOM 0 HA THR A 26 -5.555 5.420 -8.256 1.00 0.00 H new ATOM 0 HB THR A 26 -6.029 6.252 -11.138 1.00 0.00 H new ATOM 0 HG1 THR A 26 -6.151 8.070 -9.656 1.00 0.00 H new ATOM 0 HG21 THR A 26 -8.373 5.658 -10.647 1.00 0.00 H new ATOM 0 HG22 THR A 26 -7.315 4.248 -10.403 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.916 5.164 -9.000 1.00 0.00 H new ATOM 348 N LEU A 27 -4.590 3.321 -8.878 1.00 0.00 N ATOM 349 CA LEU A 27 -4.076 2.006 -9.223 1.00 0.00 C ATOM 350 C LEU A 27 -5.241 1.022 -9.339 1.00 0.00 C ATOM 351 O LEU A 27 -6.265 1.187 -8.677 1.00 0.00 O ATOM 352 CB LEU A 27 -3.001 1.572 -8.225 1.00 0.00 C ATOM 353 CG LEU A 27 -1.631 2.235 -8.385 1.00 0.00 C ATOM 354 CD1 LEU A 27 -0.834 1.580 -9.515 1.00 0.00 C ATOM 355 CD2 LEU A 27 -1.772 3.745 -8.583 1.00 0.00 C ATOM 0 H LEU A 27 -4.918 3.412 -7.917 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.583 2.033 -10.195 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -3.365 1.774 -7.218 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.872 0.493 -8.306 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.068 2.083 -7.464 1.00 0.00 H new ATOM 0 HD11 LEU A 27 0.135 2.070 -9.608 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.687 0.523 -9.291 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.382 1.680 -10.452 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.784 4.191 -8.694 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.361 3.941 -9.479 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.271 4.180 -7.718 1.00 0.00 H new ATOM 367 N GLU A 28 -5.047 0.020 -10.183 1.00 0.00 N ATOM 368 CA GLU A 28 -6.069 -0.991 -10.394 1.00 0.00 C ATOM 369 C GLU A 28 -5.530 -2.375 -10.025 1.00 0.00 C ATOM 370 O GLU A 28 -4.494 -2.798 -10.535 1.00 0.00 O ATOM 371 CB GLU A 28 -6.576 -0.966 -11.837 1.00 0.00 C ATOM 372 CG GLU A 28 -8.049 -0.558 -11.894 1.00 0.00 C ATOM 373 CD GLU A 28 -8.769 -1.263 -13.046 1.00 0.00 C ATOM 374 OE1 GLU A 28 -8.351 -1.034 -14.201 1.00 0.00 O ATOM 375 OE2 GLU A 28 -9.722 -2.014 -12.744 1.00 0.00 O ATOM 0 H GLU A 28 -4.196 -0.114 -10.730 1.00 0.00 H new ATOM 0 HA GLU A 28 -6.914 -0.767 -9.744 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -5.979 -0.268 -12.424 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -6.450 -1.951 -12.287 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.535 -0.806 -10.951 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -8.126 0.522 -12.019 1.00 0.00 H new ATOM 382 N ILE A 29 -6.259 -3.042 -9.142 1.00 0.00 N ATOM 383 CA ILE A 29 -5.867 -4.369 -8.699 1.00 0.00 C ATOM 384 C ILE A 29 -7.006 -5.352 -8.979 1.00 0.00 C ATOM 385 O ILE A 29 -8.099 -5.213 -8.431 1.00 0.00 O ATOM 386 CB ILE A 29 -5.428 -4.338 -7.234 1.00 0.00 C ATOM 387 CG1 ILE A 29 -4.150 -3.514 -7.063 1.00 0.00 C ATOM 388 CG2 ILE A 29 -5.276 -5.754 -6.677 1.00 0.00 C ATOM 389 CD1 ILE A 29 -4.275 -2.548 -5.883 1.00 0.00 C ATOM 0 H ILE A 29 -7.118 -2.688 -8.722 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.999 -4.717 -9.260 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.209 -3.846 -6.653 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.302 -4.180 -6.904 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.949 -2.954 -7.976 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.963 -5.703 -5.634 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.231 -6.276 -6.744 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.526 -6.294 -7.255 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.354 -1.974 -5.783 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.109 -1.868 -6.056 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.452 -3.113 -4.968 1.00 0.00 H new ATOM 401 N PRO A 30 -6.704 -6.349 -9.853 1.00 0.00 N ATOM 402 CA PRO A 30 -7.690 -7.355 -10.211 1.00 0.00 C ATOM 403 C PRO A 30 -7.883 -8.362 -9.076 1.00 0.00 C ATOM 404 O PRO A 30 -6.926 -8.728 -8.396 1.00 0.00 O ATOM 405 CB PRO A 30 -7.157 -7.991 -11.485 1.00 0.00 C ATOM 406 CG PRO A 30 -5.678 -7.646 -11.537 1.00 0.00 C ATOM 407 CD PRO A 30 -5.420 -6.545 -10.520 1.00 0.00 C ATOM 0 HA PRO A 30 -8.681 -6.933 -10.376 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.306 -9.071 -11.474 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.679 -7.606 -12.361 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.073 -8.524 -11.311 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.398 -7.315 -12.537 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.645 -6.835 -9.810 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.082 -5.629 -11.005 1.00 0.00 H new ATOM 415 N LEU A 31 -9.129 -8.781 -8.905 1.00 0.00 N ATOM 416 CA LEU A 31 -9.461 -9.738 -7.864 1.00 0.00 C ATOM 417 C LEU A 31 -10.047 -10.998 -8.504 1.00 0.00 C ATOM 418 O LEU A 31 -10.969 -11.603 -7.959 1.00 0.00 O ATOM 419 CB LEU A 31 -10.374 -9.097 -6.818 1.00 0.00 C ATOM 420 CG LEU A 31 -9.828 -7.846 -6.127 1.00 0.00 C ATOM 421 CD1 LEU A 31 -10.614 -7.537 -4.851 1.00 0.00 C ATOM 422 CD2 LEU A 31 -8.328 -7.979 -5.858 1.00 0.00 C ATOM 0 H LEU A 31 -9.921 -8.475 -9.471 1.00 0.00 H new ATOM 0 HA LEU A 31 -8.563 -10.042 -7.325 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -11.318 -8.840 -7.298 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -10.597 -9.842 -6.054 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.961 -6.999 -6.800 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.205 -6.643 -4.379 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -11.662 -7.369 -5.101 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.536 -8.378 -4.163 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -7.965 -7.076 -5.366 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.149 -8.840 -5.214 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.800 -8.115 -6.802 1.00 0.00 H new ATOM 434 N ASN A 32 -9.489 -11.356 -9.651 1.00 0.00 N ATOM 435 CA ASN A 32 -9.945 -12.532 -10.371 1.00 0.00 C ATOM 436 C ASN A 32 -9.669 -13.779 -9.528 1.00 0.00 C ATOM 437 O ASN A 32 -10.597 -14.477 -9.123 1.00 0.00 O ATOM 438 CB ASN A 32 -9.205 -12.686 -11.701 1.00 0.00 C ATOM 439 CG ASN A 32 -9.455 -11.481 -12.610 1.00 0.00 C ATOM 440 OD1 ASN A 32 -8.419 -10.654 -12.708 1.00 0.00 O flip ATOM 441 ND2 ASN A 32 -10.518 -11.315 -13.185 1.00 0.00 N flip ATOM 0 H ASN A 32 -8.724 -10.851 -10.100 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.012 -12.417 -10.564 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.136 -12.791 -11.516 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.533 -13.597 -12.201 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -11.273 -11.990 -13.066 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -10.651 -10.501 -13.785 1.00 0.00 H new ATOM 448 N ASP A 33 -8.388 -14.021 -9.291 1.00 0.00 N ATOM 449 CA ASP A 33 -7.977 -15.172 -8.504 1.00 0.00 C ATOM 450 C ASP A 33 -7.754 -14.739 -7.053 1.00 0.00 C ATOM 451 O ASP A 33 -7.945 -15.529 -6.130 1.00 0.00 O ATOM 452 CB ASP A 33 -6.665 -15.758 -9.029 1.00 0.00 C ATOM 453 CG ASP A 33 -6.785 -17.146 -9.662 1.00 0.00 C ATOM 454 OD1 ASP A 33 -6.965 -18.110 -8.886 1.00 0.00 O ATOM 455 OD2 ASP A 33 -6.694 -17.213 -10.907 1.00 0.00 O ATOM 0 H ASP A 33 -7.621 -13.440 -9.630 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.762 -15.925 -8.573 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -6.248 -15.073 -9.767 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -5.953 -15.811 -8.206 1.00 0.00 H new ATOM 460 N SER A 34 -7.354 -13.486 -6.898 1.00 0.00 N ATOM 461 CA SER A 34 -7.103 -12.939 -5.576 1.00 0.00 C ATOM 462 C SER A 34 -8.429 -12.648 -4.870 1.00 0.00 C ATOM 463 O SER A 34 -8.470 -12.520 -3.647 1.00 0.00 O ATOM 464 CB SER A 34 -6.255 -11.668 -5.657 1.00 0.00 C ATOM 465 OG SER A 34 -5.323 -11.578 -4.583 1.00 0.00 O ATOM 0 H SER A 34 -7.197 -12.834 -7.666 1.00 0.00 H new ATOM 0 HA SER A 34 -6.546 -13.678 -5.000 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.718 -11.651 -6.605 1.00 0.00 H new ATOM 0 HB3 SER A 34 -6.908 -10.795 -5.644 1.00 0.00 H new ATOM 0 HG SER A 34 -5.782 -11.260 -3.778 1.00 0.00 H new ATOM 471 N GLY A 35 -9.480 -12.552 -5.670 1.00 0.00 N ATOM 472 CA GLY A 35 -10.804 -12.279 -5.137 1.00 0.00 C ATOM 473 C GLY A 35 -11.194 -13.314 -4.080 1.00 0.00 C ATOM 474 O GLY A 35 -11.984 -13.024 -3.183 1.00 0.00 O ATOM 0 H GLY A 35 -9.442 -12.658 -6.684 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.825 -11.281 -4.699 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -11.534 -12.287 -5.946 1.00 0.00 H new ATOM 478 N SER A 36 -10.623 -14.501 -4.222 1.00 0.00 N ATOM 479 CA SER A 36 -10.901 -15.581 -3.291 1.00 0.00 C ATOM 480 C SER A 36 -10.729 -15.090 -1.852 1.00 0.00 C ATOM 481 O SER A 36 -11.662 -15.156 -1.054 1.00 0.00 O ATOM 482 CB SER A 36 -9.992 -16.783 -3.554 1.00 0.00 C ATOM 483 OG SER A 36 -10.131 -17.278 -4.883 1.00 0.00 O ATOM 0 H SER A 36 -9.969 -14.739 -4.968 1.00 0.00 H new ATOM 0 HA SER A 36 -11.933 -15.901 -3.438 1.00 0.00 H new ATOM 0 HB2 SER A 36 -8.954 -16.498 -3.380 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.227 -17.577 -2.845 1.00 0.00 H new ATOM 0 HG SER A 36 -9.491 -16.824 -5.470 1.00 0.00 H new ATOM 489 N ALA A 37 -9.529 -14.607 -1.565 1.00 0.00 N ATOM 490 CA ALA A 37 -9.222 -14.105 -0.237 1.00 0.00 C ATOM 491 C ALA A 37 -9.450 -12.592 -0.203 1.00 0.00 C ATOM 492 O ALA A 37 -10.060 -12.074 0.730 1.00 0.00 O ATOM 493 CB ALA A 37 -7.788 -14.486 0.135 1.00 0.00 C ATOM 0 H ALA A 37 -8.758 -14.553 -2.230 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.882 -14.555 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -7.558 -14.109 1.132 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -7.686 -15.571 0.125 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -7.097 -14.050 -0.586 1.00 0.00 H new ATOM 499 N GLY A 38 -8.949 -11.927 -1.233 1.00 0.00 N ATOM 500 CA GLY A 38 -9.090 -10.484 -1.334 1.00 0.00 C ATOM 501 C GLY A 38 -7.753 -9.825 -1.677 1.00 0.00 C ATOM 502 O GLY A 38 -6.784 -10.509 -1.999 1.00 0.00 O ATOM 0 H GLY A 38 -8.444 -12.361 -2.006 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.827 -10.240 -2.099 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -9.465 -10.085 -0.392 1.00 0.00 H new ATOM 506 N LEU A 39 -7.744 -8.502 -1.596 1.00 0.00 N ATOM 507 CA LEU A 39 -6.542 -7.742 -1.894 1.00 0.00 C ATOM 508 C LEU A 39 -5.327 -8.472 -1.319 1.00 0.00 C ATOM 509 O LEU A 39 -4.473 -8.948 -2.066 1.00 0.00 O ATOM 510 CB LEU A 39 -6.684 -6.301 -1.401 1.00 0.00 C ATOM 511 CG LEU A 39 -7.466 -5.354 -2.314 1.00 0.00 C ATOM 512 CD1 LEU A 39 -7.682 -3.997 -1.640 1.00 0.00 C ATOM 513 CD2 LEU A 39 -6.782 -5.215 -3.675 1.00 0.00 C ATOM 0 H LEU A 39 -8.550 -7.937 -1.328 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.392 -7.673 -2.971 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.171 -6.318 -0.426 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.686 -5.889 -1.252 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.451 -5.786 -2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.240 -3.343 -2.310 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -8.244 -4.135 -0.716 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.716 -3.545 -1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.358 -4.537 -4.304 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -5.777 -4.817 -3.538 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.723 -6.192 -4.154 1.00 0.00 H new ATOM 525 N GLY A 40 -5.287 -8.538 0.004 1.00 0.00 N ATOM 526 CA GLY A 40 -4.191 -9.202 0.688 1.00 0.00 C ATOM 527 C GLY A 40 -3.107 -8.199 1.089 1.00 0.00 C ATOM 528 O GLY A 40 -1.944 -8.356 0.721 1.00 0.00 O ATOM 0 H GLY A 40 -5.997 -8.142 0.620 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.567 -9.711 1.576 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -3.763 -9.966 0.040 1.00 0.00 H new ATOM 532 N VAL A 41 -3.528 -7.190 1.838 1.00 0.00 N ATOM 533 CA VAL A 41 -2.608 -6.162 2.293 1.00 0.00 C ATOM 534 C VAL A 41 -3.031 -5.684 3.684 1.00 0.00 C ATOM 535 O VAL A 41 -4.203 -5.773 4.045 1.00 0.00 O ATOM 536 CB VAL A 41 -2.540 -5.029 1.267 1.00 0.00 C ATOM 537 CG1 VAL A 41 -1.650 -5.414 0.083 1.00 0.00 C ATOM 538 CG2 VAL A 41 -3.940 -4.633 0.794 1.00 0.00 C ATOM 0 H VAL A 41 -4.494 -7.063 2.141 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.599 -6.565 2.380 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.093 -4.162 1.754 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.619 -4.591 -0.631 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.641 -5.624 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -2.055 -6.302 -0.403 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.863 -3.826 0.065 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.425 -5.493 0.333 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.531 -4.297 1.646 1.00 0.00 H new ATOM 548 N SER A 42 -2.052 -5.187 4.427 1.00 0.00 N ATOM 549 CA SER A 42 -2.309 -4.695 5.770 1.00 0.00 C ATOM 550 C SER A 42 -2.422 -3.170 5.755 1.00 0.00 C ATOM 551 O SER A 42 -1.596 -2.488 5.151 1.00 0.00 O ATOM 552 CB SER A 42 -1.208 -5.137 6.737 1.00 0.00 C ATOM 553 OG SER A 42 0.063 -5.217 6.099 1.00 0.00 O ATOM 0 H SER A 42 -1.081 -5.115 4.124 1.00 0.00 H new ATOM 0 HA SER A 42 -3.252 -5.119 6.116 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.152 -4.434 7.569 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.464 -6.109 7.158 1.00 0.00 H new ATOM 0 HG SER A 42 0.736 -5.516 6.746 1.00 0.00 H new ATOM 559 N LEU A 43 -3.453 -2.679 6.428 1.00 0.00 N ATOM 560 CA LEU A 43 -3.685 -1.246 6.500 1.00 0.00 C ATOM 561 C LEU A 43 -3.749 -0.818 7.967 1.00 0.00 C ATOM 562 O LEU A 43 -3.623 -1.648 8.866 1.00 0.00 O ATOM 563 CB LEU A 43 -4.928 -0.864 5.693 1.00 0.00 C ATOM 564 CG LEU A 43 -5.115 -1.597 4.363 1.00 0.00 C ATOM 565 CD1 LEU A 43 -6.166 -0.900 3.496 1.00 0.00 C ATOM 566 CD2 LEU A 43 -3.781 -1.754 3.631 1.00 0.00 C ATOM 0 H LEU A 43 -4.136 -3.248 6.928 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.858 -0.702 6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.808 -1.044 6.311 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.892 0.207 5.493 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.486 -2.600 4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.280 -1.441 2.557 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.120 -0.884 4.023 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.848 0.122 3.290 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.942 -2.278 2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.358 -0.770 3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.091 -2.326 4.251 1.00 0.00 H new ATOM 578 N LYS A 44 -3.946 0.478 8.164 1.00 0.00 N ATOM 579 CA LYS A 44 -4.028 1.027 9.507 1.00 0.00 C ATOM 580 C LYS A 44 -4.969 2.233 9.503 1.00 0.00 C ATOM 581 O LYS A 44 -5.028 2.976 8.525 1.00 0.00 O ATOM 582 CB LYS A 44 -2.630 1.339 10.045 1.00 0.00 C ATOM 583 CG LYS A 44 -2.153 2.712 9.566 1.00 0.00 C ATOM 584 CD LYS A 44 -0.703 2.650 9.081 1.00 0.00 C ATOM 585 CE LYS A 44 0.177 3.632 9.857 1.00 0.00 C ATOM 586 NZ LYS A 44 0.723 2.989 11.073 1.00 0.00 N ATOM 0 H LYS A 44 -4.051 1.163 7.416 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.452 0.294 10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -2.642 1.314 11.135 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.930 0.571 9.716 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.796 3.063 8.759 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.238 3.434 10.378 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -0.318 1.637 9.202 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -0.662 2.882 8.017 1.00 0.00 H new ATOM 0 HE2 LYS A 44 0.994 3.977 9.223 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -0.405 4.511 10.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 1.318 3.669 11.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -0.060 2.681 11.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.295 2.164 10.802 1.00 0.00 H new ATOM 600 N GLY A 45 -5.683 2.390 10.609 1.00 0.00 N ATOM 601 CA GLY A 45 -6.619 3.493 10.745 1.00 0.00 C ATOM 602 C GLY A 45 -6.114 4.517 11.764 1.00 0.00 C ATOM 603 O GLY A 45 -6.101 4.249 12.965 1.00 0.00 O ATOM 0 H GLY A 45 -5.632 1.772 11.419 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -6.761 3.976 9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -7.592 3.113 11.057 1.00 0.00 H new ATOM 607 N ASN A 46 -5.710 5.668 11.247 1.00 0.00 N ATOM 608 CA ASN A 46 -5.206 6.734 12.097 1.00 0.00 C ATOM 609 C ASN A 46 -6.379 7.573 12.606 1.00 0.00 C ATOM 610 O ASN A 46 -7.309 7.866 11.856 1.00 0.00 O ATOM 611 CB ASN A 46 -4.265 7.658 11.321 1.00 0.00 C ATOM 612 CG ASN A 46 -2.807 7.410 11.714 1.00 0.00 C ATOM 613 OD1 ASN A 46 -2.428 6.335 12.148 1.00 0.00 O ATOM 614 ND2 ASN A 46 -2.013 8.463 11.538 1.00 0.00 N ATOM 0 H ASN A 46 -5.721 5.886 10.251 1.00 0.00 H new ATOM 0 HA ASN A 46 -4.663 6.277 12.924 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.390 7.495 10.251 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.527 8.698 11.517 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -1.022 8.399 11.771 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.395 9.334 11.170 1.00 0.00 H new ATOM 621 N LYS A 47 -6.298 7.937 13.877 1.00 0.00 N ATOM 622 CA LYS A 47 -7.342 8.737 14.495 1.00 0.00 C ATOM 623 C LYS A 47 -6.709 9.940 15.196 1.00 0.00 C ATOM 624 O LYS A 47 -5.572 9.865 15.660 1.00 0.00 O ATOM 625 CB LYS A 47 -8.205 7.872 15.417 1.00 0.00 C ATOM 626 CG LYS A 47 -9.560 8.533 15.678 1.00 0.00 C ATOM 627 CD LYS A 47 -10.167 8.038 16.992 1.00 0.00 C ATOM 628 CE LYS A 47 -11.650 7.703 16.819 1.00 0.00 C ATOM 629 NZ LYS A 47 -12.301 7.540 18.138 1.00 0.00 N ATOM 0 H LYS A 47 -5.525 7.693 14.496 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.020 9.129 13.737 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -8.356 6.891 14.966 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.686 7.712 16.362 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.440 9.616 15.714 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -10.240 8.315 14.854 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -9.629 7.155 17.335 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -10.050 8.802 17.761 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -12.145 8.496 16.258 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.757 6.787 16.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.307 7.313 18.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -11.839 6.768 18.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.215 8.424 18.679 1.00 0.00 H new ATOM 643 N SER A 48 -7.472 11.021 15.252 1.00 0.00 N ATOM 644 CA SER A 48 -7.000 12.239 15.888 1.00 0.00 C ATOM 645 C SER A 48 -7.836 12.536 17.135 1.00 0.00 C ATOM 646 O SER A 48 -9.064 12.480 17.091 1.00 0.00 O ATOM 647 CB SER A 48 -7.051 13.423 14.920 1.00 0.00 C ATOM 648 OG SER A 48 -5.766 14.006 14.722 1.00 0.00 O ATOM 0 H SER A 48 -8.415 11.079 14.867 1.00 0.00 H new ATOM 0 HA SER A 48 -5.961 12.090 16.182 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.450 13.091 13.962 1.00 0.00 H new ATOM 0 HB3 SER A 48 -7.736 14.178 15.306 1.00 0.00 H new ATOM 0 HG SER A 48 -5.861 14.847 14.228 1.00 0.00 H new ATOM 654 N ARG A 49 -7.137 12.847 18.217 1.00 0.00 N ATOM 655 CA ARG A 49 -7.800 13.153 19.473 1.00 0.00 C ATOM 656 C ARG A 49 -8.082 14.653 19.573 1.00 0.00 C ATOM 657 O ARG A 49 -9.176 15.059 19.961 1.00 0.00 O ATOM 658 CB ARG A 49 -6.946 12.721 20.666 1.00 0.00 C ATOM 659 CG ARG A 49 -7.596 11.555 21.413 1.00 0.00 C ATOM 660 CD ARG A 49 -6.778 11.168 22.646 1.00 0.00 C ATOM 661 NE ARG A 49 -6.434 9.729 22.596 1.00 0.00 N ATOM 662 CZ ARG A 49 -5.529 9.145 23.392 1.00 0.00 C ATOM 663 NH1 ARG A 49 -4.870 9.872 24.305 1.00 0.00 N ATOM 664 NH2 ARG A 49 -5.282 7.833 23.275 1.00 0.00 N ATOM 0 H ARG A 49 -6.119 12.894 18.250 1.00 0.00 H new ATOM 0 HA ARG A 49 -8.740 12.601 19.495 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.954 12.429 20.321 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -6.812 13.563 21.345 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -8.607 11.830 21.715 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -7.685 10.697 20.747 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -5.868 11.766 22.691 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -7.346 11.383 23.551 1.00 0.00 H new ATOM 0 HE ARG A 49 -6.917 9.146 21.912 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -5.058 10.871 24.394 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -4.181 9.427 24.911 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -5.783 7.280 22.580 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -4.593 7.388 23.881 1.00 0.00 H new ATOM 678 N GLU A 50 -7.075 15.437 19.215 1.00 0.00 N ATOM 679 CA GLU A 50 -7.200 16.884 19.260 1.00 0.00 C ATOM 680 C GLU A 50 -8.527 17.321 18.635 1.00 0.00 C ATOM 681 O GLU A 50 -9.370 17.912 19.309 1.00 0.00 O ATOM 682 CB GLU A 50 -6.018 17.558 18.562 1.00 0.00 C ATOM 683 CG GLU A 50 -5.267 18.480 19.524 1.00 0.00 C ATOM 684 CD GLU A 50 -4.932 19.816 18.856 1.00 0.00 C ATOM 685 OE1 GLU A 50 -4.196 19.777 17.847 1.00 0.00 O ATOM 686 OE2 GLU A 50 -5.422 20.845 19.369 1.00 0.00 O ATOM 0 H GLU A 50 -6.169 15.097 18.893 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.191 17.198 20.304 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.338 16.799 18.175 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.375 18.132 17.707 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.873 18.656 20.412 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.349 17.995 19.856 1.00 0.00 H new ATOM 693 N THR A 51 -8.672 17.014 17.355 1.00 0.00 N ATOM 694 CA THR A 51 -9.882 17.368 16.632 1.00 0.00 C ATOM 695 C THR A 51 -11.059 16.519 17.116 1.00 0.00 C ATOM 696 O THR A 51 -12.161 17.031 17.307 1.00 0.00 O ATOM 697 CB THR A 51 -9.599 17.219 15.136 1.00 0.00 C ATOM 698 OG1 THR A 51 -9.155 15.872 14.999 1.00 0.00 O ATOM 699 CG2 THR A 51 -8.401 18.054 14.680 1.00 0.00 C ATOM 0 H THR A 51 -7.971 16.524 16.799 1.00 0.00 H new ATOM 0 HA THR A 51 -10.169 18.402 16.821 1.00 0.00 H new ATOM 0 HB THR A 51 -10.483 17.512 14.569 1.00 0.00 H new ATOM 0 HG1 THR A 51 -8.951 15.689 14.058 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.244 17.912 13.611 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.594 19.108 14.881 1.00 0.00 H new ATOM 0 HG23 THR A 51 -7.510 17.738 15.223 1.00 0.00 H new ATOM 707 N GLY A 52 -10.786 15.235 17.300 1.00 0.00 N ATOM 708 CA GLY A 52 -11.809 14.311 17.758 1.00 0.00 C ATOM 709 C GLY A 52 -12.517 13.647 16.575 1.00 0.00 C ATOM 710 O GLY A 52 -13.708 13.348 16.648 1.00 0.00 O ATOM 0 H GLY A 52 -9.871 14.813 17.140 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.357 13.547 18.391 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -12.537 14.843 18.370 1.00 0.00 H new ATOM 714 N THR A 53 -11.755 13.438 15.511 1.00 0.00 N ATOM 715 CA THR A 53 -12.295 12.815 14.315 1.00 0.00 C ATOM 716 C THR A 53 -11.366 11.702 13.827 1.00 0.00 C ATOM 717 O THR A 53 -10.517 11.223 14.578 1.00 0.00 O ATOM 718 CB THR A 53 -12.526 13.913 13.274 1.00 0.00 C ATOM 719 OG1 THR A 53 -13.472 13.344 12.373 1.00 0.00 O ATOM 720 CG2 THR A 53 -11.292 14.167 12.407 1.00 0.00 C ATOM 0 H THR A 53 -10.768 13.689 15.453 1.00 0.00 H new ATOM 0 HA THR A 53 -13.251 12.332 14.518 1.00 0.00 H new ATOM 0 HB THR A 53 -12.811 14.836 13.778 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.680 13.990 11.666 1.00 0.00 H new ATOM 0 HG21 THR A 53 -11.510 14.955 11.686 1.00 0.00 H new ATOM 0 HG22 THR A 53 -10.460 14.475 13.040 1.00 0.00 H new ATOM 0 HG23 THR A 53 -11.026 13.253 11.877 1.00 0.00 H new ATOM 728 N ASP A 54 -11.557 11.323 12.572 1.00 0.00 N ATOM 729 CA ASP A 54 -10.747 10.275 11.975 1.00 0.00 C ATOM 730 C ASP A 54 -9.921 10.864 10.830 1.00 0.00 C ATOM 731 O ASP A 54 -10.477 11.356 9.848 1.00 0.00 O ATOM 732 CB ASP A 54 -11.623 9.160 11.401 1.00 0.00 C ATOM 733 CG ASP A 54 -12.940 9.629 10.777 1.00 0.00 C ATOM 734 OD1 ASP A 54 -12.868 10.520 9.904 1.00 0.00 O ATOM 735 OD2 ASP A 54 -13.988 9.085 11.188 1.00 0.00 O ATOM 0 H ASP A 54 -12.261 11.723 11.952 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.103 9.863 12.752 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -11.051 8.622 10.645 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -11.848 8.449 12.196 1.00 0.00 H new ATOM 740 N LEU A 55 -8.608 10.796 10.993 1.00 0.00 N ATOM 741 CA LEU A 55 -7.701 11.316 9.984 1.00 0.00 C ATOM 742 C LEU A 55 -8.005 10.654 8.639 1.00 0.00 C ATOM 743 O LEU A 55 -7.816 11.262 7.587 1.00 0.00 O ATOM 744 CB LEU A 55 -6.248 11.154 10.436 1.00 0.00 C ATOM 745 CG LEU A 55 -5.807 12.033 11.607 1.00 0.00 C ATOM 746 CD1 LEU A 55 -4.347 11.762 11.978 1.00 0.00 C ATOM 747 CD2 LEU A 55 -6.056 13.513 11.307 1.00 0.00 C ATOM 0 H LEU A 55 -8.151 10.389 11.809 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.852 12.387 9.852 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.088 10.111 10.710 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.599 11.363 9.586 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.413 11.774 12.475 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.059 12.400 12.813 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -4.232 10.716 12.264 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -3.708 11.976 11.121 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.733 14.116 12.156 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.493 13.804 10.420 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.119 13.675 11.131 1.00 0.00 H new ATOM 759 N GLY A 56 -8.471 9.416 8.718 1.00 0.00 N ATOM 760 CA GLY A 56 -8.803 8.664 7.520 1.00 0.00 C ATOM 761 C GLY A 56 -8.164 7.274 7.550 1.00 0.00 C ATOM 762 O GLY A 56 -7.930 6.718 8.622 1.00 0.00 O ATOM 0 H GLY A 56 -8.626 8.915 9.593 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -9.885 8.569 7.435 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -8.460 9.207 6.639 1.00 0.00 H new ATOM 766 N ILE A 57 -7.901 6.752 6.361 1.00 0.00 N ATOM 767 CA ILE A 57 -7.294 5.437 6.238 1.00 0.00 C ATOM 768 C ILE A 57 -5.873 5.585 5.692 1.00 0.00 C ATOM 769 O ILE A 57 -5.514 6.636 5.163 1.00 0.00 O ATOM 770 CB ILE A 57 -8.182 4.514 5.401 1.00 0.00 C ATOM 771 CG1 ILE A 57 -9.507 4.233 6.113 1.00 0.00 C ATOM 772 CG2 ILE A 57 -7.442 3.225 5.037 1.00 0.00 C ATOM 773 CD1 ILE A 57 -9.273 3.513 7.442 1.00 0.00 C ATOM 0 H ILE A 57 -8.097 7.216 5.474 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.212 4.962 7.216 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.421 5.024 4.467 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -10.034 5.170 6.291 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -10.146 3.624 5.473 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -8.095 2.586 4.442 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -6.549 3.468 4.461 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.154 2.701 5.948 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -10.231 3.325 7.928 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -8.767 2.565 7.258 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -8.654 4.135 8.089 1.00 0.00 H new ATOM 785 N PHE A 58 -5.103 4.517 5.839 1.00 0.00 N ATOM 786 CA PHE A 58 -3.729 4.515 5.366 1.00 0.00 C ATOM 787 C PHE A 58 -3.203 3.086 5.214 1.00 0.00 C ATOM 788 O PHE A 58 -3.437 2.240 6.075 1.00 0.00 O ATOM 789 CB PHE A 58 -2.892 5.244 6.421 1.00 0.00 C ATOM 790 CG PHE A 58 -3.261 6.718 6.599 1.00 0.00 C ATOM 791 CD1 PHE A 58 -4.307 7.065 7.395 1.00 0.00 C ATOM 792 CD2 PHE A 58 -2.544 7.680 5.960 1.00 0.00 C ATOM 793 CE1 PHE A 58 -4.650 8.433 7.560 1.00 0.00 C ATOM 794 CE2 PHE A 58 -2.886 9.048 6.125 1.00 0.00 C ATOM 795 CZ PHE A 58 -3.932 9.396 6.922 1.00 0.00 C ATOM 0 H PHE A 58 -5.404 3.647 6.279 1.00 0.00 H new ATOM 0 HA PHE A 58 -3.670 5.001 4.392 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -3.007 4.733 7.377 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.839 5.174 6.147 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.877 6.300 7.902 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.714 7.404 5.327 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.481 8.709 8.192 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.316 9.812 5.618 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.192 10.437 7.048 1.00 0.00 H new ATOM 805 N ILE A 59 -2.504 2.862 4.111 1.00 0.00 N ATOM 806 CA ILE A 59 -1.944 1.550 3.835 1.00 0.00 C ATOM 807 C ILE A 59 -0.813 1.264 4.824 1.00 0.00 C ATOM 808 O ILE A 59 -0.111 2.179 5.252 1.00 0.00 O ATOM 809 CB ILE A 59 -1.519 1.447 2.368 1.00 0.00 C ATOM 810 CG1 ILE A 59 -2.686 1.775 1.435 1.00 0.00 C ATOM 811 CG2 ILE A 59 -0.912 0.075 2.068 1.00 0.00 C ATOM 812 CD1 ILE A 59 -2.290 1.571 -0.029 1.00 0.00 C ATOM 0 H ILE A 59 -2.313 3.566 3.398 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.698 0.776 3.980 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.742 2.189 2.184 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.539 1.141 1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -3.002 2.807 1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.619 0.028 1.019 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -0.036 -0.081 2.697 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -1.649 -0.702 2.273 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -3.137 1.811 -0.672 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.452 2.224 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.998 0.533 -0.186 1.00 0.00 H new ATOM 824 N LYS A 60 -0.671 -0.010 5.160 1.00 0.00 N ATOM 825 CA LYS A 60 0.363 -0.428 6.091 1.00 0.00 C ATOM 826 C LYS A 60 1.586 -0.909 5.307 1.00 0.00 C ATOM 827 O LYS A 60 2.694 -0.418 5.515 1.00 0.00 O ATOM 828 CB LYS A 60 -0.187 -1.466 7.072 1.00 0.00 C ATOM 829 CG LYS A 60 0.336 -1.214 8.487 1.00 0.00 C ATOM 830 CD LYS A 60 0.399 -2.516 9.288 1.00 0.00 C ATOM 831 CE LYS A 60 1.617 -3.350 8.884 1.00 0.00 C ATOM 832 NZ LYS A 60 1.885 -4.399 9.893 1.00 0.00 N ATOM 0 H LYS A 60 -1.255 -0.766 4.804 1.00 0.00 H new ATOM 0 HA LYS A 60 0.688 0.414 6.703 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.276 -1.431 7.071 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.100 -2.466 6.747 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.328 -0.765 8.437 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.312 -0.500 8.996 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.446 -2.290 10.353 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -0.511 -3.092 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.444 -3.809 7.911 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.489 -2.704 8.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.714 -4.955 9.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.071 -3.955 10.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.058 -5.025 9.971 1.00 0.00 H new ATOM 846 N SER A 61 1.342 -1.865 4.422 1.00 0.00 N ATOM 847 CA SER A 61 2.410 -2.418 3.606 1.00 0.00 C ATOM 848 C SER A 61 1.833 -3.407 2.591 1.00 0.00 C ATOM 849 O SER A 61 0.713 -3.889 2.755 1.00 0.00 O ATOM 850 CB SER A 61 3.467 -3.104 4.473 1.00 0.00 C ATOM 851 OG SER A 61 4.791 -2.749 4.083 1.00 0.00 O ATOM 0 H SER A 61 0.421 -2.270 4.252 1.00 0.00 H new ATOM 0 HA SER A 61 2.893 -1.599 3.073 1.00 0.00 H new ATOM 0 HB2 SER A 61 3.312 -2.832 5.517 1.00 0.00 H new ATOM 0 HB3 SER A 61 3.346 -4.185 4.404 1.00 0.00 H new ATOM 0 HG SER A 61 4.913 -1.782 4.183 1.00 0.00 H new ATOM 857 N ILE A 62 2.624 -3.680 1.564 1.00 0.00 N ATOM 858 CA ILE A 62 2.206 -4.602 0.522 1.00 0.00 C ATOM 859 C ILE A 62 2.880 -5.958 0.746 1.00 0.00 C ATOM 860 O ILE A 62 4.047 -6.019 1.129 1.00 0.00 O ATOM 861 CB ILE A 62 2.473 -4.005 -0.861 1.00 0.00 C ATOM 862 CG1 ILE A 62 1.782 -2.649 -1.015 1.00 0.00 C ATOM 863 CG2 ILE A 62 2.071 -4.982 -1.968 1.00 0.00 C ATOM 864 CD1 ILE A 62 2.808 -1.515 -1.077 1.00 0.00 C ATOM 0 H ILE A 62 3.552 -3.279 1.431 1.00 0.00 H new ATOM 0 HA ILE A 62 1.130 -4.768 0.570 1.00 0.00 H new ATOM 0 HB ILE A 62 3.545 -3.833 -0.957 1.00 0.00 H new ATOM 0 HG12 ILE A 62 1.176 -2.646 -1.921 1.00 0.00 H new ATOM 0 HG13 ILE A 62 1.104 -2.485 -0.178 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.271 -4.532 -2.941 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.647 -5.902 -1.868 1.00 0.00 H new ATOM 0 HG23 ILE A 62 1.008 -5.208 -1.885 1.00 0.00 H new ATOM 0 HD11 ILE A 62 2.291 -0.562 -1.187 1.00 0.00 H new ATOM 0 HD12 ILE A 62 3.396 -1.505 -0.159 1.00 0.00 H new ATOM 0 HD13 ILE A 62 3.469 -1.669 -1.930 1.00 0.00 H new ATOM 876 N ILE A 63 2.115 -7.011 0.499 1.00 0.00 N ATOM 877 CA ILE A 63 2.623 -8.361 0.670 1.00 0.00 C ATOM 878 C ILE A 63 3.089 -8.901 -0.684 1.00 0.00 C ATOM 879 O ILE A 63 2.269 -9.253 -1.531 1.00 0.00 O ATOM 880 CB ILE A 63 1.579 -9.244 1.357 1.00 0.00 C ATOM 881 CG1 ILE A 63 1.394 -8.835 2.820 1.00 0.00 C ATOM 882 CG2 ILE A 63 1.935 -10.725 1.217 1.00 0.00 C ATOM 883 CD1 ILE A 63 0.478 -7.614 2.936 1.00 0.00 C ATOM 0 H ILE A 63 1.147 -6.956 0.182 1.00 0.00 H new ATOM 0 HA ILE A 63 3.490 -8.360 1.330 1.00 0.00 H new ATOM 0 HB ILE A 63 0.622 -9.095 0.856 1.00 0.00 H new ATOM 0 HG12 ILE A 63 0.971 -9.667 3.383 1.00 0.00 H new ATOM 0 HG13 ILE A 63 2.364 -8.610 3.264 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.177 -11.330 1.714 1.00 0.00 H new ATOM 0 HG22 ILE A 63 1.976 -10.991 0.161 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.906 -10.911 1.676 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.363 -7.344 3.986 1.00 0.00 H new ATOM 0 HD12 ILE A 63 0.916 -6.777 2.392 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.498 -7.850 2.513 1.00 0.00 H new ATOM 895 N HIS A 64 4.403 -8.949 -0.846 1.00 0.00 N ATOM 896 CA HIS A 64 4.987 -9.440 -2.082 1.00 0.00 C ATOM 897 C HIS A 64 4.509 -10.870 -2.344 1.00 0.00 C ATOM 898 O HIS A 64 3.739 -11.424 -1.561 1.00 0.00 O ATOM 899 CB HIS A 64 6.512 -9.322 -2.047 1.00 0.00 C ATOM 900 CG HIS A 64 7.033 -7.968 -2.465 1.00 0.00 C ATOM 901 ND1 HIS A 64 8.036 -7.809 -3.406 1.00 0.00 N ATOM 902 CD2 HIS A 64 6.681 -6.714 -2.062 1.00 0.00 C ATOM 903 CE1 HIS A 64 8.268 -6.513 -3.555 1.00 0.00 C ATOM 904 NE2 HIS A 64 7.428 -5.836 -2.720 1.00 0.00 N ATOM 0 H HIS A 64 5.080 -8.656 -0.141 1.00 0.00 H new ATOM 0 HA HIS A 64 4.652 -8.824 -2.916 1.00 0.00 H new ATOM 0 HB2 HIS A 64 6.860 -9.538 -1.037 1.00 0.00 H new ATOM 0 HB3 HIS A 64 6.940 -10.082 -2.700 1.00 0.00 H new ATOM 0 HD2 HIS A 64 5.923 -6.475 -1.331 1.00 0.00 H new ATOM 0 HE1 HIS A 64 8.994 -6.070 -4.220 1.00 0.00 H new ATOM 0 HE2 HIS A 64 7.382 -4.822 -2.618 1.00 0.00 H new ATOM 912 N GLY A 65 4.986 -11.427 -3.447 1.00 0.00 N ATOM 913 CA GLY A 65 4.617 -12.781 -3.822 1.00 0.00 C ATOM 914 C GLY A 65 3.112 -13.003 -3.662 1.00 0.00 C ATOM 915 O GLY A 65 2.677 -14.095 -3.299 1.00 0.00 O ATOM 0 H GLY A 65 5.625 -10.965 -4.094 1.00 0.00 H new ATOM 0 HA2 GLY A 65 4.908 -12.968 -4.856 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.161 -13.495 -3.204 1.00 0.00 H new ATOM 919 N GLY A 66 2.358 -11.951 -3.942 1.00 0.00 N ATOM 920 CA GLY A 66 0.910 -12.017 -3.834 1.00 0.00 C ATOM 921 C GLY A 66 0.239 -11.262 -4.983 1.00 0.00 C ATOM 922 O GLY A 66 0.806 -11.146 -6.069 1.00 0.00 O ATOM 0 H GLY A 66 2.722 -11.047 -4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.588 -13.058 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.593 -11.593 -2.881 1.00 0.00 H new ATOM 926 N ALA A 67 -0.958 -10.768 -4.705 1.00 0.00 N ATOM 927 CA ALA A 67 -1.712 -10.027 -5.702 1.00 0.00 C ATOM 928 C ALA A 67 -1.318 -8.550 -5.640 1.00 0.00 C ATOM 929 O ALA A 67 -0.839 -7.990 -6.625 1.00 0.00 O ATOM 930 CB ALA A 67 -3.210 -10.241 -5.473 1.00 0.00 C ATOM 0 H ALA A 67 -1.425 -10.866 -3.803 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.481 -10.388 -6.704 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.775 -9.685 -6.221 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -3.443 -11.303 -5.557 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.480 -9.888 -4.478 1.00 0.00 H new ATOM 936 N ALA A 68 -1.535 -7.962 -4.473 1.00 0.00 N ATOM 937 CA ALA A 68 -1.209 -6.560 -4.269 1.00 0.00 C ATOM 938 C ALA A 68 0.246 -6.316 -4.675 1.00 0.00 C ATOM 939 O ALA A 68 0.584 -5.243 -5.172 1.00 0.00 O ATOM 940 CB ALA A 68 -1.480 -6.180 -2.813 1.00 0.00 C ATOM 0 H ALA A 68 -1.933 -8.430 -3.659 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.837 -5.924 -4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.236 -5.129 -2.660 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.533 -6.345 -2.584 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -0.865 -6.795 -2.156 1.00 0.00 H new ATOM 946 N PHE A 69 1.069 -7.330 -4.448 1.00 0.00 N ATOM 947 CA PHE A 69 2.479 -7.238 -4.784 1.00 0.00 C ATOM 948 C PHE A 69 2.684 -6.454 -6.081 1.00 0.00 C ATOM 949 O PHE A 69 3.570 -5.605 -6.164 1.00 0.00 O ATOM 950 CB PHE A 69 2.986 -8.668 -4.981 1.00 0.00 C ATOM 951 CG PHE A 69 4.357 -8.756 -5.655 1.00 0.00 C ATOM 952 CD1 PHE A 69 5.354 -7.911 -5.279 1.00 0.00 C ATOM 953 CD2 PHE A 69 4.578 -9.678 -6.629 1.00 0.00 C ATOM 954 CE1 PHE A 69 6.626 -7.992 -5.904 1.00 0.00 C ATOM 955 CE2 PHE A 69 5.850 -9.760 -7.254 1.00 0.00 C ATOM 956 CZ PHE A 69 6.848 -8.915 -6.879 1.00 0.00 C ATOM 0 H PHE A 69 0.786 -8.219 -4.036 1.00 0.00 H new ATOM 0 HA PHE A 69 3.017 -6.721 -3.990 1.00 0.00 H new ATOM 0 HB2 PHE A 69 3.038 -9.161 -4.010 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.262 -9.220 -5.581 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.178 -7.179 -4.505 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.786 -10.348 -6.928 1.00 0.00 H new ATOM 0 HE1 PHE A 69 7.418 -7.321 -5.606 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.025 -10.493 -8.027 1.00 0.00 H new ATOM 0 HZ PHE A 69 7.816 -8.977 -7.355 1.00 0.00 H new ATOM 966 N LYS A 70 1.850 -6.766 -7.062 1.00 0.00 N ATOM 967 CA LYS A 70 1.929 -6.101 -8.352 1.00 0.00 C ATOM 968 C LYS A 70 1.826 -4.588 -8.148 1.00 0.00 C ATOM 969 O LYS A 70 2.663 -3.833 -8.641 1.00 0.00 O ATOM 970 CB LYS A 70 0.879 -6.665 -9.311 1.00 0.00 C ATOM 971 CG LYS A 70 1.204 -8.111 -9.691 1.00 0.00 C ATOM 972 CD LYS A 70 -0.068 -8.885 -10.044 1.00 0.00 C ATOM 973 CE LYS A 70 0.178 -9.839 -11.214 1.00 0.00 C ATOM 974 NZ LYS A 70 -0.735 -9.528 -12.337 1.00 0.00 N ATOM 0 H LYS A 70 1.116 -7.471 -6.990 1.00 0.00 H new ATOM 0 HA LYS A 70 2.893 -6.295 -8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.105 -6.620 -8.845 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.835 -6.050 -10.210 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.888 -8.123 -10.539 1.00 0.00 H new ATOM 0 HG3 LYS A 70 1.715 -8.602 -8.863 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.408 -9.449 -9.175 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.864 -8.186 -10.301 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.213 -9.758 -11.546 1.00 0.00 H new ATOM 0 HE3 LYS A 70 0.027 -10.869 -10.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -0.555 -10.185 -13.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.721 -9.628 -12.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.572 -8.552 -12.657 1.00 0.00 H new ATOM 988 N ASP A 71 0.793 -4.191 -7.420 1.00 0.00 N ATOM 989 CA ASP A 71 0.569 -2.782 -7.145 1.00 0.00 C ATOM 990 C ASP A 71 1.520 -2.326 -6.036 1.00 0.00 C ATOM 991 O ASP A 71 1.674 -1.129 -5.798 1.00 0.00 O ATOM 992 CB ASP A 71 -0.864 -2.534 -6.670 1.00 0.00 C ATOM 993 CG ASP A 71 -1.554 -1.322 -7.300 1.00 0.00 C ATOM 994 OD1 ASP A 71 -1.581 -1.271 -8.549 1.00 0.00 O ATOM 995 OD2 ASP A 71 -2.037 -0.475 -6.519 1.00 0.00 O ATOM 0 H ASP A 71 0.102 -4.820 -7.012 1.00 0.00 H new ATOM 0 HA ASP A 71 0.744 -2.227 -8.066 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.459 -3.422 -6.881 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.855 -2.406 -5.588 1.00 0.00 H new ATOM 1000 N GLY A 72 2.134 -3.305 -5.387 1.00 0.00 N ATOM 1001 CA GLY A 72 3.065 -3.019 -4.310 1.00 0.00 C ATOM 1002 C GLY A 72 3.881 -1.760 -4.609 1.00 0.00 C ATOM 1003 O GLY A 72 4.275 -1.039 -3.694 1.00 0.00 O ATOM 0 H GLY A 72 2.004 -4.297 -5.587 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.517 -2.888 -3.377 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.736 -3.867 -4.170 1.00 0.00 H new ATOM 1007 N ARG A 73 4.111 -1.535 -5.894 1.00 0.00 N ATOM 1008 CA ARG A 73 4.873 -0.375 -6.326 1.00 0.00 C ATOM 1009 C ARG A 73 4.515 0.843 -5.473 1.00 0.00 C ATOM 1010 O ARG A 73 5.343 1.730 -5.272 1.00 0.00 O ATOM 1011 CB ARG A 73 4.603 -0.055 -7.798 1.00 0.00 C ATOM 1012 CG ARG A 73 3.149 0.374 -8.008 1.00 0.00 C ATOM 1013 CD ARG A 73 2.957 1.001 -9.390 1.00 0.00 C ATOM 1014 NE ARG A 73 2.571 -0.041 -10.368 1.00 0.00 N ATOM 1015 CZ ARG A 73 2.394 0.187 -11.677 1.00 0.00 C ATOM 1016 NH1 ARG A 73 2.568 1.419 -12.173 1.00 0.00 N ATOM 1017 NH2 ARG A 73 2.043 -0.819 -12.490 1.00 0.00 N ATOM 0 H ARG A 73 3.783 -2.136 -6.650 1.00 0.00 H new ATOM 0 HA ARG A 73 5.931 -0.610 -6.205 1.00 0.00 H new ATOM 0 HB2 ARG A 73 5.272 0.739 -8.130 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.820 -0.931 -8.410 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.492 -0.490 -7.902 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.862 1.089 -7.237 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.188 1.772 -9.345 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.879 1.488 -9.709 1.00 0.00 H new ATOM 0 HE ARG A 73 2.431 -0.991 -10.025 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.835 2.185 -11.554 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.433 1.591 -13.169 1.00 0.00 H new ATOM 0 HH21 ARG A 73 1.911 -1.757 -12.113 1.00 0.00 H new ATOM 0 HH22 ARG A 73 1.908 -0.646 -13.486 1.00 0.00 H new ATOM 1031 N LEU A 74 3.280 0.847 -4.993 1.00 0.00 N ATOM 1032 CA LEU A 74 2.802 1.942 -4.166 1.00 0.00 C ATOM 1033 C LEU A 74 3.596 1.971 -2.858 1.00 0.00 C ATOM 1034 O LEU A 74 4.445 1.113 -2.624 1.00 0.00 O ATOM 1035 CB LEU A 74 1.289 1.841 -3.965 1.00 0.00 C ATOM 1036 CG LEU A 74 0.423 2.337 -5.125 1.00 0.00 C ATOM 1037 CD1 LEU A 74 -1.046 2.435 -4.710 1.00 0.00 C ATOM 1038 CD2 LEU A 74 0.953 3.661 -5.677 1.00 0.00 C ATOM 0 H LEU A 74 2.596 0.109 -5.161 1.00 0.00 H new ATOM 0 HA LEU A 74 2.971 2.897 -4.663 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.037 0.799 -3.770 1.00 0.00 H new ATOM 0 HB3 LEU A 74 1.023 2.406 -3.072 1.00 0.00 H new ATOM 0 HG LEU A 74 0.481 1.606 -5.932 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.639 2.790 -5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.404 1.452 -4.403 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.143 3.133 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.320 3.991 -6.500 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.945 4.413 -4.888 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.973 3.523 -6.036 1.00 0.00 H new ATOM 1050 N ARG A 75 3.291 2.968 -2.040 1.00 0.00 N ATOM 1051 CA ARG A 75 3.965 3.121 -0.762 1.00 0.00 C ATOM 1052 C ARG A 75 2.940 3.259 0.366 1.00 0.00 C ATOM 1053 O ARG A 75 2.065 4.121 0.311 1.00 0.00 O ATOM 1054 CB ARG A 75 4.879 4.348 -0.764 1.00 0.00 C ATOM 1055 CG ARG A 75 5.614 4.481 -2.100 1.00 0.00 C ATOM 1056 CD ARG A 75 6.667 3.382 -2.258 1.00 0.00 C ATOM 1057 NE ARG A 75 8.020 3.980 -2.303 1.00 0.00 N ATOM 1058 CZ ARG A 75 9.155 3.285 -2.146 1.00 0.00 C ATOM 1059 NH1 ARG A 75 9.106 1.963 -1.933 1.00 0.00 N ATOM 1060 NH2 ARG A 75 10.338 3.911 -2.202 1.00 0.00 N ATOM 0 H ARG A 75 2.586 3.678 -2.238 1.00 0.00 H new ATOM 0 HA ARG A 75 4.572 2.230 -0.599 1.00 0.00 H new ATOM 0 HB2 ARG A 75 4.289 5.246 -0.578 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.603 4.268 0.047 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.898 4.425 -2.920 1.00 0.00 H new ATOM 0 HG3 ARG A 75 6.092 5.459 -2.161 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.598 2.679 -1.428 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.480 2.816 -3.171 1.00 0.00 H new ATOM 0 HE ARG A 75 8.093 4.985 -2.464 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.205 1.486 -1.890 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.969 1.433 -1.813 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.375 4.917 -2.364 1.00 0.00 H new ATOM 0 HH22 ARG A 75 11.201 3.381 -2.082 1.00 0.00 H new ATOM 1074 N MET A 76 3.083 2.396 1.361 1.00 0.00 N ATOM 1075 CA MET A 76 2.181 2.411 2.500 1.00 0.00 C ATOM 1076 C MET A 76 1.911 3.843 2.966 1.00 0.00 C ATOM 1077 O MET A 76 2.598 4.775 2.551 1.00 0.00 O ATOM 1078 CB MET A 76 2.794 1.607 3.648 1.00 0.00 C ATOM 1079 CG MET A 76 4.195 2.120 3.989 1.00 0.00 C ATOM 1080 SD MET A 76 5.250 0.755 4.447 1.00 0.00 S ATOM 1081 CE MET A 76 6.329 1.573 5.609 1.00 0.00 C ATOM 0 H MET A 76 3.810 1.682 1.402 1.00 0.00 H new ATOM 0 HA MET A 76 1.235 1.963 2.196 1.00 0.00 H new ATOM 0 HB2 MET A 76 2.154 1.675 4.527 1.00 0.00 H new ATOM 0 HB3 MET A 76 2.845 0.554 3.372 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.617 2.645 3.132 1.00 0.00 H new ATOM 0 HG3 MET A 76 4.139 2.838 4.807 1.00 0.00 H new ATOM 0 HE1 MET A 76 7.056 0.859 5.995 1.00 0.00 H new ATOM 0 HE2 MET A 76 6.852 2.388 5.108 1.00 0.00 H new ATOM 0 HE3 MET A 76 5.739 1.973 6.434 1.00 0.00 H new ATOM 1091 N ASN A 77 0.908 3.973 3.823 1.00 0.00 N ATOM 1092 CA ASN A 77 0.539 5.276 4.350 1.00 0.00 C ATOM 1093 C ASN A 77 -0.193 6.071 3.267 1.00 0.00 C ATOM 1094 O ASN A 77 -0.477 7.254 3.446 1.00 0.00 O ATOM 1095 CB ASN A 77 1.776 6.073 4.767 1.00 0.00 C ATOM 1096 CG ASN A 77 1.681 6.510 6.230 1.00 0.00 C ATOM 1097 OD1 ASN A 77 1.077 7.515 6.566 1.00 0.00 O ATOM 1098 ND2 ASN A 77 2.308 5.701 7.078 1.00 0.00 N ATOM 0 H ASN A 77 0.340 3.198 4.165 1.00 0.00 H new ATOM 0 HA ASN A 77 -0.098 5.119 5.220 1.00 0.00 H new ATOM 0 HB2 ASN A 77 2.670 5.466 4.623 1.00 0.00 H new ATOM 0 HB3 ASN A 77 1.880 6.950 4.128 1.00 0.00 H new ATOM 0 HD21 ASN A 77 2.302 5.906 8.077 1.00 0.00 H new ATOM 0 HD22 ASN A 77 2.795 4.875 6.730 1.00 0.00 H new ATOM 1105 N ASP A 78 -0.477 5.388 2.167 1.00 0.00 N ATOM 1106 CA ASP A 78 -1.171 6.016 1.056 1.00 0.00 C ATOM 1107 C ASP A 78 -2.644 6.206 1.421 1.00 0.00 C ATOM 1108 O ASP A 78 -3.457 5.304 1.225 1.00 0.00 O ATOM 1109 CB ASP A 78 -1.103 5.143 -0.199 1.00 0.00 C ATOM 1110 CG ASP A 78 0.013 5.507 -1.181 1.00 0.00 C ATOM 1111 OD1 ASP A 78 0.806 6.407 -0.830 1.00 0.00 O ATOM 1112 OD2 ASP A 78 0.047 4.877 -2.260 1.00 0.00 O ATOM 0 H ASP A 78 -0.239 4.407 2.022 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.690 6.974 0.856 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.974 4.105 0.106 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.059 5.206 -0.719 1.00 0.00 H new ATOM 1117 N GLN A 79 -2.944 7.386 1.944 1.00 0.00 N ATOM 1118 CA GLN A 79 -4.305 7.705 2.339 1.00 0.00 C ATOM 1119 C GLN A 79 -5.291 7.248 1.261 1.00 0.00 C ATOM 1120 O GLN A 79 -5.063 7.467 0.073 1.00 0.00 O ATOM 1121 CB GLN A 79 -4.457 9.201 2.622 1.00 0.00 C ATOM 1122 CG GLN A 79 -5.753 9.486 3.385 1.00 0.00 C ATOM 1123 CD GLN A 79 -5.754 10.907 3.951 1.00 0.00 C ATOM 1124 OE1 GLN A 79 -4.721 11.514 4.177 1.00 0.00 O ATOM 1125 NE2 GLN A 79 -6.970 11.402 4.166 1.00 0.00 N ATOM 0 H GLN A 79 -2.268 8.133 2.103 1.00 0.00 H new ATOM 0 HA GLN A 79 -4.530 7.169 3.261 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.604 9.553 3.202 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.454 9.755 1.683 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.607 9.355 2.720 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.867 8.767 4.196 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -7.794 10.840 3.955 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.078 12.344 4.542 1.00 0.00 H new ATOM 1134 N LEU A 80 -6.366 6.622 1.716 1.00 0.00 N ATOM 1135 CA LEU A 80 -7.388 6.132 0.806 1.00 0.00 C ATOM 1136 C LEU A 80 -8.525 7.152 0.726 1.00 0.00 C ATOM 1137 O LEU A 80 -9.345 7.246 1.638 1.00 0.00 O ATOM 1138 CB LEU A 80 -7.846 4.731 1.218 1.00 0.00 C ATOM 1139 CG LEU A 80 -6.826 3.608 1.022 1.00 0.00 C ATOM 1140 CD1 LEU A 80 -5.799 3.596 2.156 1.00 0.00 C ATOM 1141 CD2 LEU A 80 -7.524 2.255 0.866 1.00 0.00 C ATOM 0 H LEU A 80 -6.552 6.443 2.703 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.983 6.026 -0.200 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.130 4.758 2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.744 4.483 0.652 1.00 0.00 H new ATOM 0 HG LEU A 80 -6.282 3.798 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -5.086 2.788 1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -5.270 4.549 2.178 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.309 3.443 3.107 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.777 1.474 0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -8.110 2.043 1.760 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.183 2.284 -0.002 1.00 0.00 H new ATOM 1153 N ILE A 81 -8.538 7.891 -0.374 1.00 0.00 N ATOM 1154 CA ILE A 81 -9.562 8.901 -0.585 1.00 0.00 C ATOM 1155 C ILE A 81 -10.770 8.261 -1.272 1.00 0.00 C ATOM 1156 O ILE A 81 -11.724 8.951 -1.626 1.00 0.00 O ATOM 1157 CB ILE A 81 -8.985 10.097 -1.345 1.00 0.00 C ATOM 1158 CG1 ILE A 81 -8.563 9.697 -2.760 1.00 0.00 C ATOM 1159 CG2 ILE A 81 -7.837 10.740 -0.564 1.00 0.00 C ATOM 1160 CD1 ILE A 81 -8.302 10.932 -3.624 1.00 0.00 C ATOM 0 H ILE A 81 -7.856 7.811 -1.128 1.00 0.00 H new ATOM 0 HA ILE A 81 -9.910 9.296 0.369 1.00 0.00 H new ATOM 0 HB ILE A 81 -9.768 10.849 -1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.663 9.083 -2.715 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -9.342 9.087 -3.217 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -7.444 11.588 -1.126 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.203 11.084 0.403 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -7.045 10.007 -0.412 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -8.004 10.620 -4.625 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -9.211 11.531 -3.687 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -7.505 11.527 -3.177 1.00 0.00 H new ATOM 1172 N ALA A 82 -10.689 6.949 -1.438 1.00 0.00 N ATOM 1173 CA ALA A 82 -11.764 6.208 -2.076 1.00 0.00 C ATOM 1174 C ALA A 82 -11.281 4.792 -2.398 1.00 0.00 C ATOM 1175 O ALA A 82 -10.096 4.492 -2.265 1.00 0.00 O ATOM 1176 CB ALA A 82 -12.234 6.961 -3.322 1.00 0.00 C ATOM 0 H ALA A 82 -9.896 6.380 -1.142 1.00 0.00 H new ATOM 0 HA ALA A 82 -12.619 6.120 -1.406 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -13.040 6.405 -3.801 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -12.595 7.949 -3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -11.402 7.066 -4.019 1.00 0.00 H new ATOM 1182 N VAL A 83 -12.224 3.960 -2.815 1.00 0.00 N ATOM 1183 CA VAL A 83 -11.909 2.584 -3.158 1.00 0.00 C ATOM 1184 C VAL A 83 -13.036 2.006 -4.017 1.00 0.00 C ATOM 1185 O VAL A 83 -14.187 1.959 -3.587 1.00 0.00 O ATOM 1186 CB VAL A 83 -11.653 1.774 -1.885 1.00 0.00 C ATOM 1187 CG1 VAL A 83 -12.794 1.952 -0.882 1.00 0.00 C ATOM 1188 CG2 VAL A 83 -11.435 0.295 -2.211 1.00 0.00 C ATOM 0 H VAL A 83 -13.206 4.212 -2.923 1.00 0.00 H new ATOM 0 HA VAL A 83 -10.994 2.537 -3.748 1.00 0.00 H new ATOM 0 HB VAL A 83 -10.741 2.154 -1.425 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -12.586 1.366 0.013 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -12.882 3.005 -0.614 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -13.728 1.613 -1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -11.255 -0.258 -1.289 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -12.321 -0.103 -2.706 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -10.573 0.191 -2.870 1.00 0.00 H new ATOM 1198 N ASN A 84 -12.664 1.581 -5.215 1.00 0.00 N ATOM 1199 CA ASN A 84 -13.629 1.008 -6.139 1.00 0.00 C ATOM 1200 C ASN A 84 -14.755 2.015 -6.382 1.00 0.00 C ATOM 1201 O ASN A 84 -15.833 1.646 -6.845 1.00 0.00 O ATOM 1202 CB ASN A 84 -14.250 -0.267 -5.565 1.00 0.00 C ATOM 1203 CG ASN A 84 -13.993 -1.463 -6.484 1.00 0.00 C ATOM 1204 OD1 ASN A 84 -13.792 -2.608 -5.838 1.00 0.00 O flip ATOM 1205 ND2 ASN A 84 -13.979 -1.354 -7.699 1.00 0.00 N flip ATOM 0 H ASN A 84 -11.708 1.622 -5.568 1.00 0.00 H new ATOM 0 HA ASN A 84 -13.109 0.770 -7.067 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -13.833 -0.466 -4.578 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -15.323 -0.127 -5.436 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -14.141 -0.444 -8.131 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -13.805 -2.172 -8.282 1.00 0.00 H new ATOM 1212 N GLY A 85 -14.466 3.267 -6.059 1.00 0.00 N ATOM 1213 CA GLY A 85 -15.441 4.329 -6.237 1.00 0.00 C ATOM 1214 C GLY A 85 -16.080 4.717 -4.901 1.00 0.00 C ATOM 1215 O GLY A 85 -16.687 5.780 -4.785 1.00 0.00 O ATOM 0 H GLY A 85 -13.571 3.570 -5.675 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.958 5.200 -6.680 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.214 4.005 -6.933 1.00 0.00 H new ATOM 1219 N GLU A 86 -15.921 3.833 -3.927 1.00 0.00 N ATOM 1220 CA GLU A 86 -16.474 4.069 -2.605 1.00 0.00 C ATOM 1221 C GLU A 86 -15.727 5.211 -1.913 1.00 0.00 C ATOM 1222 O GLU A 86 -14.621 5.568 -2.317 1.00 0.00 O ATOM 1223 CB GLU A 86 -16.434 2.795 -1.758 1.00 0.00 C ATOM 1224 CG GLU A 86 -17.380 1.733 -2.322 1.00 0.00 C ATOM 1225 CD GLU A 86 -18.758 2.327 -2.618 1.00 0.00 C ATOM 1226 OE1 GLU A 86 -19.559 2.409 -1.662 1.00 0.00 O ATOM 1227 OE2 GLU A 86 -18.980 2.687 -3.794 1.00 0.00 O ATOM 0 H GLU A 86 -15.417 2.952 -4.027 1.00 0.00 H new ATOM 0 HA GLU A 86 -17.519 4.359 -2.716 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.417 2.404 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -16.714 3.028 -0.731 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.958 1.313 -3.235 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -17.479 0.914 -1.610 1.00 0.00 H new ATOM 1234 N THR A 87 -16.360 5.751 -0.882 1.00 0.00 N ATOM 1235 CA THR A 87 -15.769 6.845 -0.131 1.00 0.00 C ATOM 1236 C THR A 87 -15.354 6.371 1.264 1.00 0.00 C ATOM 1237 O THR A 87 -16.106 5.662 1.932 1.00 0.00 O ATOM 1238 CB THR A 87 -16.773 7.999 -0.106 1.00 0.00 C ATOM 1239 OG1 THR A 87 -15.965 9.165 -0.245 1.00 0.00 O ATOM 1240 CG2 THR A 87 -17.438 8.168 1.261 1.00 0.00 C ATOM 0 H THR A 87 -17.276 5.451 -0.549 1.00 0.00 H new ATOM 0 HA THR A 87 -14.854 7.201 -0.605 1.00 0.00 H new ATOM 0 HB THR A 87 -17.539 7.830 -0.863 1.00 0.00 H new ATOM 0 HG1 THR A 87 -16.536 9.961 -0.240 1.00 0.00 H new ATOM 0 HG21 THR A 87 -18.141 9.000 1.223 1.00 0.00 H new ATOM 0 HG22 THR A 87 -17.972 7.254 1.522 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.676 8.370 2.014 1.00 0.00 H new ATOM 1248 N LEU A 88 -14.159 6.781 1.662 1.00 0.00 N ATOM 1249 CA LEU A 88 -13.635 6.407 2.965 1.00 0.00 C ATOM 1250 C LEU A 88 -13.540 7.653 3.848 1.00 0.00 C ATOM 1251 O LEU A 88 -13.733 7.575 5.061 1.00 0.00 O ATOM 1252 CB LEU A 88 -12.310 5.658 2.815 1.00 0.00 C ATOM 1253 CG LEU A 88 -12.317 4.470 1.850 1.00 0.00 C ATOM 1254 CD1 LEU A 88 -10.905 3.914 1.654 1.00 0.00 C ATOM 1255 CD2 LEU A 88 -13.298 3.392 2.315 1.00 0.00 C ATOM 0 H LEU A 88 -13.538 7.369 1.105 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.312 5.713 3.463 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -11.551 6.366 2.483 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -12.004 5.300 3.798 1.00 0.00 H new ATOM 0 HG LEU A 88 -12.662 4.822 0.878 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -10.938 3.071 0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -10.261 4.692 1.245 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -10.508 3.582 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -13.284 2.559 1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -13.007 3.037 3.304 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -14.303 3.810 2.361 1.00 0.00 H new ATOM 1267 N LEU A 89 -13.244 8.774 3.206 1.00 0.00 N ATOM 1268 CA LEU A 89 -13.121 10.034 3.918 1.00 0.00 C ATOM 1269 C LEU A 89 -14.463 10.383 4.564 1.00 0.00 C ATOM 1270 O LEU A 89 -14.507 11.090 5.569 1.00 0.00 O ATOM 1271 CB LEU A 89 -12.583 11.124 2.989 1.00 0.00 C ATOM 1272 CG LEU A 89 -11.470 10.699 2.030 1.00 0.00 C ATOM 1273 CD1 LEU A 89 -10.688 11.913 1.525 1.00 0.00 C ATOM 1274 CD2 LEU A 89 -10.556 9.657 2.678 1.00 0.00 C ATOM 0 H LEU A 89 -13.086 8.835 2.200 1.00 0.00 H new ATOM 0 HA LEU A 89 -12.392 9.947 4.724 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -13.413 11.514 2.400 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -12.213 11.946 3.602 1.00 0.00 H new ATOM 0 HG LEU A 89 -11.929 10.228 1.161 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.903 11.583 0.845 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -11.363 12.588 0.999 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.240 12.435 2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.773 9.372 1.975 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -10.102 10.079 3.575 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.141 8.777 2.947 1.00 0.00 H new ATOM 1286 N GLY A 90 -15.525 9.871 3.960 1.00 0.00 N ATOM 1287 CA GLY A 90 -16.865 10.119 4.463 1.00 0.00 C ATOM 1288 C GLY A 90 -17.181 9.212 5.654 1.00 0.00 C ATOM 1289 O GLY A 90 -17.962 9.581 6.530 1.00 0.00 O ATOM 0 H GLY A 90 -15.484 9.285 3.126 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -16.957 11.163 4.762 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -17.592 9.949 3.669 1.00 0.00 H new ATOM 1293 N LYS A 91 -16.557 8.043 5.648 1.00 0.00 N ATOM 1294 CA LYS A 91 -16.762 7.080 6.717 1.00 0.00 C ATOM 1295 C LYS A 91 -15.659 7.245 7.764 1.00 0.00 C ATOM 1296 O LYS A 91 -14.997 8.281 7.815 1.00 0.00 O ATOM 1297 CB LYS A 91 -16.864 5.663 6.149 1.00 0.00 C ATOM 1298 CG LYS A 91 -17.391 5.684 4.713 1.00 0.00 C ATOM 1299 CD LYS A 91 -17.631 4.264 4.196 1.00 0.00 C ATOM 1300 CE LYS A 91 -18.709 4.251 3.110 1.00 0.00 C ATOM 1301 NZ LYS A 91 -19.684 3.166 3.361 1.00 0.00 N ATOM 0 H LYS A 91 -15.909 7.741 4.920 1.00 0.00 H new ATOM 0 HA LYS A 91 -17.711 7.266 7.221 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -15.884 5.186 6.173 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -17.526 5.064 6.774 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -18.320 6.252 4.671 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -16.676 6.194 4.067 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -16.702 3.857 3.796 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -17.933 3.619 5.021 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -19.223 5.212 3.088 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -18.247 4.114 2.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -20.437 3.203 2.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -19.201 2.246 3.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -20.100 3.285 4.306 1.00 0.00 H new ATOM 1315 N SER A 92 -15.495 6.209 8.573 1.00 0.00 N ATOM 1316 CA SER A 92 -14.483 6.226 9.615 1.00 0.00 C ATOM 1317 C SER A 92 -13.395 5.196 9.306 1.00 0.00 C ATOM 1318 O SER A 92 -13.236 4.781 8.159 1.00 0.00 O ATOM 1319 CB SER A 92 -15.101 5.949 10.987 1.00 0.00 C ATOM 1320 OG SER A 92 -16.525 5.947 10.941 1.00 0.00 O ATOM 0 H SER A 92 -16.046 5.352 8.528 1.00 0.00 H new ATOM 0 HA SER A 92 -14.036 7.220 9.641 1.00 0.00 H new ATOM 0 HB2 SER A 92 -14.749 4.985 11.355 1.00 0.00 H new ATOM 0 HB3 SER A 92 -14.762 6.704 11.696 1.00 0.00 H new ATOM 0 HG SER A 92 -16.870 5.238 11.523 1.00 0.00 H new ATOM 1326 N ASN A 93 -12.674 4.812 10.349 1.00 0.00 N ATOM 1327 CA ASN A 93 -11.605 3.838 10.203 1.00 0.00 C ATOM 1328 C ASN A 93 -12.212 2.448 10.001 1.00 0.00 C ATOM 1329 O ASN A 93 -11.832 1.730 9.077 1.00 0.00 O ATOM 1330 CB ASN A 93 -10.726 3.793 11.454 1.00 0.00 C ATOM 1331 CG ASN A 93 -10.383 5.205 11.934 1.00 0.00 C ATOM 1332 OD1 ASN A 93 -10.810 5.652 12.986 1.00 0.00 O ATOM 1333 ND2 ASN A 93 -9.589 5.879 11.107 1.00 0.00 N ATOM 0 H ASN A 93 -12.809 5.158 11.299 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.998 4.130 9.346 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -11.242 3.251 12.246 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -9.809 3.245 11.239 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -9.302 6.830 11.338 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -9.267 5.445 10.242 1.00 0.00 H new ATOM 1340 N HIS A 94 -13.144 2.111 10.880 1.00 0.00 N ATOM 1341 CA HIS A 94 -13.807 0.820 10.809 1.00 0.00 C ATOM 1342 C HIS A 94 -14.604 0.722 9.507 1.00 0.00 C ATOM 1343 O HIS A 94 -14.255 -0.053 8.618 1.00 0.00 O ATOM 1344 CB HIS A 94 -14.669 0.583 12.051 1.00 0.00 C ATOM 1345 CG HIS A 94 -15.442 1.799 12.503 1.00 0.00 C ATOM 1346 ND1 HIS A 94 -14.858 2.841 13.203 1.00 0.00 N ATOM 1347 CD2 HIS A 94 -16.756 2.129 12.347 1.00 0.00 C ATOM 1348 CE1 HIS A 94 -15.789 3.750 13.452 1.00 0.00 C ATOM 1349 NE2 HIS A 94 -16.964 3.307 12.921 1.00 0.00 N ATOM 0 H HIS A 94 -13.456 2.709 11.645 1.00 0.00 H new ATOM 0 HA HIS A 94 -13.061 0.025 10.798 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -15.371 -0.225 11.845 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -14.028 0.248 12.867 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -17.501 1.532 11.842 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -15.643 4.679 13.983 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -17.856 3.800 12.959 1.00 0.00 H new ATOM 1357 N GLU A 95 -15.659 1.520 9.435 1.00 0.00 N ATOM 1358 CA GLU A 95 -16.508 1.534 8.256 1.00 0.00 C ATOM 1359 C GLU A 95 -15.662 1.387 6.990 1.00 0.00 C ATOM 1360 O GLU A 95 -15.738 0.370 6.303 1.00 0.00 O ATOM 1361 CB GLU A 95 -17.355 2.807 8.205 1.00 0.00 C ATOM 1362 CG GLU A 95 -18.012 3.083 9.559 1.00 0.00 C ATOM 1363 CD GLU A 95 -19.240 3.983 9.400 1.00 0.00 C ATOM 1364 OE1 GLU A 95 -19.909 3.849 8.353 1.00 0.00 O ATOM 1365 OE2 GLU A 95 -19.481 4.783 10.329 1.00 0.00 O ATOM 0 H GLU A 95 -15.945 2.162 10.174 1.00 0.00 H new ATOM 0 HA GLU A 95 -17.190 0.686 8.314 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.729 3.653 7.921 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.123 2.707 7.438 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -18.305 2.141 10.024 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -17.293 3.558 10.226 1.00 0.00 H new ATOM 1372 N ALA A 96 -14.874 2.418 6.721 1.00 0.00 N ATOM 1373 CA ALA A 96 -14.014 2.417 5.550 1.00 0.00 C ATOM 1374 C ALA A 96 -13.408 1.023 5.369 1.00 0.00 C ATOM 1375 O ALA A 96 -13.782 0.294 4.452 1.00 0.00 O ATOM 1376 CB ALA A 96 -12.946 3.502 5.700 1.00 0.00 C ATOM 0 H ALA A 96 -14.813 3.260 7.294 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.588 2.646 4.652 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -12.301 3.501 4.822 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.427 4.475 5.796 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.348 3.303 6.589 1.00 0.00 H new ATOM 1382 N MET A 97 -12.482 0.696 6.258 1.00 0.00 N ATOM 1383 CA MET A 97 -11.820 -0.597 6.209 1.00 0.00 C ATOM 1384 C MET A 97 -12.822 -1.714 5.909 1.00 0.00 C ATOM 1385 O MET A 97 -12.596 -2.532 5.019 1.00 0.00 O ATOM 1386 CB MET A 97 -11.134 -0.871 7.548 1.00 0.00 C ATOM 1387 CG MET A 97 -9.801 -0.127 7.645 1.00 0.00 C ATOM 1388 SD MET A 97 -8.544 -1.007 6.733 1.00 0.00 S ATOM 1389 CE MET A 97 -8.102 0.239 5.533 1.00 0.00 C ATOM 0 H MET A 97 -12.174 1.304 7.017 1.00 0.00 H new ATOM 0 HA MET A 97 -11.079 -0.575 5.410 1.00 0.00 H new ATOM 0 HB2 MET A 97 -11.787 -0.562 8.365 1.00 0.00 H new ATOM 0 HB3 MET A 97 -10.966 -1.942 7.662 1.00 0.00 H new ATOM 0 HG2 MET A 97 -9.909 0.883 7.250 1.00 0.00 H new ATOM 0 HG3 MET A 97 -9.504 -0.030 8.689 1.00 0.00 H new ATOM 0 HE1 MET A 97 -8.187 -0.176 4.529 1.00 0.00 H new ATOM 0 HE2 MET A 97 -8.773 1.092 5.631 1.00 0.00 H new ATOM 0 HE3 MET A 97 -7.076 0.563 5.706 1.00 0.00 H new ATOM 1399 N GLU A 98 -13.907 -1.712 6.669 1.00 0.00 N ATOM 1400 CA GLU A 98 -14.943 -2.715 6.496 1.00 0.00 C ATOM 1401 C GLU A 98 -15.514 -2.649 5.078 1.00 0.00 C ATOM 1402 O GLU A 98 -15.872 -3.675 4.501 1.00 0.00 O ATOM 1403 CB GLU A 98 -16.049 -2.547 7.541 1.00 0.00 C ATOM 1404 CG GLU A 98 -17.360 -2.109 6.885 1.00 0.00 C ATOM 1405 CD GLU A 98 -18.018 -3.274 6.142 1.00 0.00 C ATOM 1406 OE1 GLU A 98 -17.572 -4.419 6.374 1.00 0.00 O ATOM 1407 OE2 GLU A 98 -18.951 -2.993 5.360 1.00 0.00 O ATOM 0 H GLU A 98 -14.091 -1.031 7.406 1.00 0.00 H new ATOM 0 HA GLU A 98 -14.497 -3.699 6.642 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -16.200 -3.488 8.071 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -15.745 -1.808 8.283 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.041 -1.727 7.645 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -17.168 -1.292 6.190 1.00 0.00 H new ATOM 1414 N THR A 99 -15.582 -1.433 4.558 1.00 0.00 N ATOM 1415 CA THR A 99 -16.104 -1.220 3.218 1.00 0.00 C ATOM 1416 C THR A 99 -15.074 -1.649 2.171 1.00 0.00 C ATOM 1417 O THR A 99 -15.433 -2.205 1.134 1.00 0.00 O ATOM 1418 CB THR A 99 -16.516 0.249 3.099 1.00 0.00 C ATOM 1419 OG1 THR A 99 -17.937 0.220 3.202 1.00 0.00 O ATOM 1420 CG2 THR A 99 -16.255 0.819 1.704 1.00 0.00 C ATOM 0 H THR A 99 -15.284 -0.585 5.040 1.00 0.00 H new ATOM 0 HA THR A 99 -16.985 -1.835 3.034 1.00 0.00 H new ATOM 0 HB THR A 99 -15.975 0.839 3.839 1.00 0.00 H new ATOM 0 HG1 THR A 99 -18.332 0.594 2.387 1.00 0.00 H new ATOM 0 HG21 THR A 99 -16.565 1.864 1.674 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.191 0.749 1.476 1.00 0.00 H new ATOM 0 HG23 THR A 99 -16.822 0.251 0.967 1.00 0.00 H new ATOM 1428 N LEU A 100 -13.815 -1.373 2.478 1.00 0.00 N ATOM 1429 CA LEU A 100 -12.731 -1.724 1.576 1.00 0.00 C ATOM 1430 C LEU A 100 -12.846 -3.202 1.197 1.00 0.00 C ATOM 1431 O LEU A 100 -13.081 -3.532 0.036 1.00 0.00 O ATOM 1432 CB LEU A 100 -11.381 -1.349 2.190 1.00 0.00 C ATOM 1433 CG LEU A 100 -10.222 -1.173 1.206 1.00 0.00 C ATOM 1434 CD1 LEU A 100 -10.275 0.203 0.538 1.00 0.00 C ATOM 1435 CD2 LEU A 100 -8.878 -1.426 1.891 1.00 0.00 C ATOM 0 H LEU A 100 -13.521 -0.911 3.338 1.00 0.00 H new ATOM 0 HA LEU A 100 -12.804 -1.152 0.651 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.503 -0.420 2.747 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.106 -2.119 2.911 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.327 -1.918 0.418 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.441 0.303 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -11.214 0.308 -0.006 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.208 0.980 1.300 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.071 -1.294 1.170 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.749 -0.720 2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.854 -2.444 2.280 1.00 0.00 H new ATOM 1447 N ARG A 101 -12.675 -4.051 2.200 1.00 0.00 N ATOM 1448 CA ARG A 101 -12.756 -5.486 1.987 1.00 0.00 C ATOM 1449 C ARG A 101 -14.103 -5.854 1.362 1.00 0.00 C ATOM 1450 O ARG A 101 -14.158 -6.628 0.407 1.00 0.00 O ATOM 1451 CB ARG A 101 -12.586 -6.249 3.302 1.00 0.00 C ATOM 1452 CG ARG A 101 -13.788 -6.028 4.223 1.00 0.00 C ATOM 1453 CD ARG A 101 -13.509 -6.568 5.627 1.00 0.00 C ATOM 1454 NE ARG A 101 -14.624 -7.436 6.066 1.00 0.00 N ATOM 1455 CZ ARG A 101 -14.813 -8.691 5.637 1.00 0.00 C ATOM 1456 NH1 ARG A 101 -13.962 -9.232 4.754 1.00 0.00 N ATOM 1457 NH2 ARG A 101 -15.852 -9.405 6.090 1.00 0.00 N ATOM 0 H ARG A 101 -12.481 -3.773 3.162 1.00 0.00 H new ATOM 0 HA ARG A 101 -11.949 -5.767 1.311 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -12.471 -7.313 3.097 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -11.675 -5.921 3.802 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -14.018 -4.964 4.278 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -14.666 -6.523 3.807 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -12.576 -7.131 5.630 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -13.384 -5.741 6.326 1.00 0.00 H new ATOM 0 HE ARG A 101 -15.291 -7.055 6.737 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -13.171 -8.688 4.409 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.105 -10.187 4.427 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -16.500 -8.993 6.762 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -15.995 -10.360 5.763 1.00 0.00 H new ATOM 1471 N ARG A 102 -15.157 -5.283 1.926 1.00 0.00 N ATOM 1472 CA ARG A 102 -16.501 -5.541 1.436 1.00 0.00 C ATOM 1473 C ARG A 102 -16.574 -5.288 -0.071 1.00 0.00 C ATOM 1474 O ARG A 102 -17.172 -6.072 -0.807 1.00 0.00 O ATOM 1475 CB ARG A 102 -17.526 -4.654 2.146 1.00 0.00 C ATOM 1476 CG ARG A 102 -18.952 -5.132 1.865 1.00 0.00 C ATOM 1477 CD ARG A 102 -19.878 -4.813 3.040 1.00 0.00 C ATOM 1478 NE ARG A 102 -21.290 -4.864 2.600 1.00 0.00 N ATOM 1479 CZ ARG A 102 -22.306 -4.302 3.269 1.00 0.00 C ATOM 1480 NH1 ARG A 102 -22.073 -3.643 4.412 1.00 0.00 N ATOM 1481 NH2 ARG A 102 -23.556 -4.399 2.794 1.00 0.00 N ATOM 0 H ARG A 102 -15.108 -4.642 2.718 1.00 0.00 H new ATOM 0 HA ARG A 102 -16.735 -6.585 1.644 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.340 -4.665 3.220 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -17.412 -3.622 1.813 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.328 -4.654 0.961 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -18.950 -6.206 1.680 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -19.714 -5.527 3.847 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -19.648 -3.824 3.437 1.00 0.00 H new ATOM 0 HE ARG A 102 -21.503 -5.358 1.733 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -21.122 -3.569 4.773 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -22.847 -3.215 4.921 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -23.733 -4.900 1.924 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -24.330 -3.971 3.303 1.00 0.00 H new ATOM 1495 N SER A 103 -15.957 -4.192 -0.485 1.00 0.00 N ATOM 1496 CA SER A 103 -15.945 -3.826 -1.892 1.00 0.00 C ATOM 1497 C SER A 103 -15.218 -4.899 -2.705 1.00 0.00 C ATOM 1498 O SER A 103 -15.690 -5.303 -3.767 1.00 0.00 O ATOM 1499 CB SER A 103 -15.282 -2.462 -2.100 1.00 0.00 C ATOM 1500 OG SER A 103 -16.208 -1.390 -1.944 1.00 0.00 O ATOM 0 H SER A 103 -15.462 -3.545 0.128 1.00 0.00 H new ATOM 0 HA SER A 103 -16.977 -3.755 -2.236 1.00 0.00 H new ATOM 0 HB2 SER A 103 -14.466 -2.343 -1.387 1.00 0.00 H new ATOM 0 HB3 SER A 103 -14.843 -2.420 -3.097 1.00 0.00 H new ATOM 0 HG SER A 103 -15.747 -0.537 -2.083 1.00 0.00 H new ATOM 1506 N MET A 104 -14.082 -5.329 -2.176 1.00 0.00 N ATOM 1507 CA MET A 104 -13.286 -6.347 -2.840 1.00 0.00 C ATOM 1508 C MET A 104 -14.137 -7.571 -3.184 1.00 0.00 C ATOM 1509 O MET A 104 -13.863 -8.268 -4.160 1.00 0.00 O ATOM 1510 CB MET A 104 -12.131 -6.767 -1.929 1.00 0.00 C ATOM 1511 CG MET A 104 -11.084 -5.656 -1.822 1.00 0.00 C ATOM 1512 SD MET A 104 -10.010 -5.961 -0.429 1.00 0.00 S ATOM 1513 CE MET A 104 -10.085 -4.369 0.374 1.00 0.00 C ATOM 0 H MET A 104 -13.694 -4.991 -1.295 1.00 0.00 H new ATOM 0 HA MET A 104 -12.895 -5.928 -3.767 1.00 0.00 H new ATOM 0 HB2 MET A 104 -12.514 -7.007 -0.937 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.667 -7.673 -2.319 1.00 0.00 H new ATOM 0 HG2 MET A 104 -10.498 -5.608 -2.740 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.577 -4.691 -1.707 1.00 0.00 H new ATOM 0 HE1 MET A 104 -9.120 -3.871 0.284 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.854 -3.759 -0.099 1.00 0.00 H new ATOM 0 HE3 MET A 104 -10.327 -4.504 1.428 1.00 0.00 H new ATOM 1523 N SER A 105 -15.152 -7.795 -2.363 1.00 0.00 N ATOM 1524 CA SER A 105 -16.045 -8.923 -2.567 1.00 0.00 C ATOM 1525 C SER A 105 -17.299 -8.469 -3.317 1.00 0.00 C ATOM 1526 O SER A 105 -17.617 -8.998 -4.381 1.00 0.00 O ATOM 1527 CB SER A 105 -16.428 -9.571 -1.235 1.00 0.00 C ATOM 1528 OG SER A 105 -16.448 -10.993 -1.320 1.00 0.00 O ATOM 0 H SER A 105 -15.376 -7.214 -1.555 1.00 0.00 H new ATOM 0 HA SER A 105 -15.522 -9.669 -3.165 1.00 0.00 H new ATOM 0 HB2 SER A 105 -15.720 -9.264 -0.465 1.00 0.00 H new ATOM 0 HB3 SER A 105 -17.410 -9.212 -0.926 1.00 0.00 H new ATOM 0 HG SER A 105 -16.695 -11.369 -0.450 1.00 0.00 H new ATOM 1534 N MET A 106 -17.978 -7.492 -2.732 1.00 0.00 N ATOM 1535 CA MET A 106 -19.190 -6.961 -3.331 1.00 0.00 C ATOM 1536 C MET A 106 -18.874 -6.190 -4.615 1.00 0.00 C ATOM 1537 O MET A 106 -19.372 -6.532 -5.687 1.00 0.00 O ATOM 1538 CB MET A 106 -19.886 -6.031 -2.336 1.00 0.00 C ATOM 1539 CG MET A 106 -21.156 -6.678 -1.778 1.00 0.00 C ATOM 1540 SD MET A 106 -20.780 -7.561 -0.273 1.00 0.00 S ATOM 1541 CE MET A 106 -22.396 -8.212 0.116 1.00 0.00 C ATOM 0 H MET A 106 -17.711 -7.055 -1.850 1.00 0.00 H new ATOM 0 HA MET A 106 -19.845 -7.795 -3.582 1.00 0.00 H new ATOM 0 HB2 MET A 106 -19.206 -5.792 -1.519 1.00 0.00 H new ATOM 0 HB3 MET A 106 -20.138 -5.091 -2.826 1.00 0.00 H new ATOM 0 HG2 MET A 106 -21.908 -5.913 -1.583 1.00 0.00 H new ATOM 0 HG3 MET A 106 -21.580 -7.361 -2.514 1.00 0.00 H new ATOM 0 HE1 MET A 106 -22.342 -8.795 1.036 1.00 0.00 H new ATOM 0 HE2 MET A 106 -23.098 -7.389 0.249 1.00 0.00 H new ATOM 0 HE3 MET A 106 -22.737 -8.851 -0.699 1.00 0.00 H new ATOM 1551 N GLU A 107 -18.049 -5.164 -4.464 1.00 0.00 N ATOM 1552 CA GLU A 107 -17.662 -4.342 -5.598 1.00 0.00 C ATOM 1553 C GLU A 107 -16.791 -5.148 -6.564 1.00 0.00 C ATOM 1554 O GLU A 107 -16.684 -4.806 -7.741 1.00 0.00 O ATOM 1555 CB GLU A 107 -16.940 -3.075 -5.135 1.00 0.00 C ATOM 1556 CG GLU A 107 -17.937 -1.955 -4.835 1.00 0.00 C ATOM 1557 CD GLU A 107 -18.508 -1.368 -6.128 1.00 0.00 C ATOM 1558 OE1 GLU A 107 -18.021 -1.781 -7.202 1.00 0.00 O ATOM 1559 OE2 GLU A 107 -19.419 -0.520 -6.012 1.00 0.00 O ATOM 0 H GLU A 107 -17.638 -4.883 -3.574 1.00 0.00 H new ATOM 0 HA GLU A 107 -18.565 -4.034 -6.125 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -16.352 -3.292 -4.243 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -16.241 -2.748 -5.905 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -18.748 -2.341 -4.217 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -17.445 -1.170 -4.261 1.00 0.00 H new ATOM 1566 N GLY A 108 -16.190 -6.202 -6.031 1.00 0.00 N ATOM 1567 CA GLY A 108 -15.332 -7.058 -6.831 1.00 0.00 C ATOM 1568 C GLY A 108 -16.102 -8.274 -7.351 1.00 0.00 C ATOM 1569 O GLY A 108 -15.591 -9.031 -8.175 1.00 0.00 O ATOM 0 H GLY A 108 -16.281 -6.482 -5.054 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -14.929 -6.492 -7.671 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -14.483 -7.389 -6.233 1.00 0.00 H new ATOM 1573 N ASN A 109 -17.319 -8.423 -6.848 1.00 0.00 N ATOM 1574 CA ASN A 109 -18.164 -9.534 -7.252 1.00 0.00 C ATOM 1575 C ASN A 109 -18.812 -9.213 -8.600 1.00 0.00 C ATOM 1576 O ASN A 109 -18.848 -10.058 -9.493 1.00 0.00 O ATOM 1577 CB ASN A 109 -19.282 -9.773 -6.235 1.00 0.00 C ATOM 1578 CG ASN A 109 -20.478 -10.469 -6.888 1.00 0.00 C ATOM 1579 OD1 ASN A 109 -20.343 -11.439 -7.615 1.00 0.00 O ATOM 1580 ND2 ASN A 109 -21.652 -9.920 -6.589 1.00 0.00 N ATOM 0 H ASN A 109 -17.740 -7.793 -6.165 1.00 0.00 H new ATOM 0 HA ASN A 109 -17.540 -10.425 -7.319 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -18.906 -10.382 -5.413 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -19.599 -8.822 -5.808 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -22.511 -10.311 -6.976 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -21.693 -9.108 -5.973 1.00 0.00 H new ATOM 1587 N ILE A 110 -19.308 -7.989 -8.705 1.00 0.00 N ATOM 1588 CA ILE A 110 -19.953 -7.545 -9.929 1.00 0.00 C ATOM 1589 C ILE A 110 -18.885 -7.127 -10.941 1.00 0.00 C ATOM 1590 O ILE A 110 -19.042 -7.345 -12.141 1.00 0.00 O ATOM 1591 CB ILE A 110 -20.978 -6.449 -9.628 1.00 0.00 C ATOM 1592 CG1 ILE A 110 -20.295 -5.091 -9.460 1.00 0.00 C ATOM 1593 CG2 ILE A 110 -21.832 -6.816 -8.413 1.00 0.00 C ATOM 1594 CD1 ILE A 110 -19.670 -4.960 -8.069 1.00 0.00 C ATOM 0 H ILE A 110 -19.276 -7.291 -7.962 1.00 0.00 H new ATOM 0 HA ILE A 110 -20.517 -8.362 -10.380 1.00 0.00 H new ATOM 0 HB ILE A 110 -21.651 -6.367 -10.481 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.525 -4.971 -10.222 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -21.022 -4.293 -9.613 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -22.552 -6.021 -8.221 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -22.364 -7.747 -8.610 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -21.190 -6.942 -7.542 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.191 -3.985 -7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -20.447 -5.057 -7.311 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -18.927 -5.745 -7.929 1.00 0.00 H new ATOM 1606 N ARG A 111 -17.822 -6.532 -10.419 1.00 0.00 N ATOM 1607 CA ARG A 111 -16.727 -6.081 -11.261 1.00 0.00 C ATOM 1608 C ARG A 111 -15.715 -7.210 -11.466 1.00 0.00 C ATOM 1609 O ARG A 111 -15.620 -7.775 -12.554 1.00 0.00 O ATOM 1610 CB ARG A 111 -16.018 -4.875 -10.644 1.00 0.00 C ATOM 1611 CG ARG A 111 -16.920 -3.639 -10.663 1.00 0.00 C ATOM 1612 CD ARG A 111 -16.479 -2.655 -11.748 1.00 0.00 C ATOM 1613 NE ARG A 111 -16.179 -1.337 -11.144 1.00 0.00 N ATOM 1614 CZ ARG A 111 -17.106 -0.520 -10.625 1.00 0.00 C ATOM 1615 NH1 ARG A 111 -18.397 -0.880 -10.634 1.00 0.00 N ATOM 1616 NH2 ARG A 111 -16.742 0.657 -10.098 1.00 0.00 N ATOM 0 H ARG A 111 -17.696 -6.352 -9.423 1.00 0.00 H new ATOM 0 HA ARG A 111 -17.148 -5.787 -12.223 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -15.730 -5.104 -9.618 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -15.100 -4.668 -11.194 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -17.953 -3.941 -10.839 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -16.892 -3.149 -9.690 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -15.597 -3.038 -12.261 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -17.264 -2.551 -12.497 1.00 0.00 H new ATOM 0 HE ARG A 111 -15.206 -1.032 -11.121 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -18.674 -1.776 -11.036 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -19.103 -0.258 -10.239 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -15.760 0.931 -10.092 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -17.447 1.279 -9.703 1.00 0.00 H new ATOM 1630 N GLY A 112 -14.983 -7.505 -10.401 1.00 0.00 N ATOM 1631 CA GLY A 112 -13.981 -8.556 -10.450 1.00 0.00 C ATOM 1632 C GLY A 112 -12.613 -8.030 -10.011 1.00 0.00 C ATOM 1633 O GLY A 112 -11.614 -8.743 -10.093 1.00 0.00 O ATOM 0 H GLY A 112 -15.064 -7.034 -9.500 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -14.282 -9.381 -9.804 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -13.914 -8.953 -11.463 1.00 0.00 H new ATOM 1637 N MET A 113 -12.611 -6.787 -9.554 1.00 0.00 N ATOM 1638 CA MET A 113 -11.382 -6.157 -9.101 1.00 0.00 C ATOM 1639 C MET A 113 -11.679 -4.996 -8.149 1.00 0.00 C ATOM 1640 O MET A 113 -12.821 -4.809 -7.730 1.00 0.00 O ATOM 1641 CB MET A 113 -10.599 -5.639 -10.309 1.00 0.00 C ATOM 1642 CG MET A 113 -11.358 -4.512 -11.013 1.00 0.00 C ATOM 1643 SD MET A 113 -11.255 -4.719 -12.783 1.00 0.00 S ATOM 1644 CE MET A 113 -12.448 -3.500 -13.307 1.00 0.00 C ATOM 0 H MET A 113 -13.441 -6.198 -9.487 1.00 0.00 H new ATOM 0 HA MET A 113 -10.791 -6.900 -8.565 1.00 0.00 H new ATOM 0 HB2 MET A 113 -9.622 -5.278 -9.986 1.00 0.00 H new ATOM 0 HB3 MET A 113 -10.422 -6.455 -11.009 1.00 0.00 H new ATOM 0 HG2 MET A 113 -12.402 -4.514 -10.699 1.00 0.00 H new ATOM 0 HG3 MET A 113 -10.940 -3.547 -10.727 1.00 0.00 H new ATOM 0 HE1 MET A 113 -12.384 -3.369 -14.387 1.00 0.00 H new ATOM 0 HE2 MET A 113 -13.451 -3.834 -13.041 1.00 0.00 H new ATOM 0 HE3 MET A 113 -12.239 -2.551 -12.814 1.00 0.00 H new ATOM 1654 N ILE A 114 -10.632 -4.248 -7.835 1.00 0.00 N ATOM 1655 CA ILE A 114 -10.766 -3.111 -6.941 1.00 0.00 C ATOM 1656 C ILE A 114 -9.770 -2.024 -7.351 1.00 0.00 C ATOM 1657 O ILE A 114 -8.837 -2.287 -8.108 1.00 0.00 O ATOM 1658 CB ILE A 114 -10.626 -3.556 -5.484 1.00 0.00 C ATOM 1659 CG1 ILE A 114 -10.771 -2.368 -4.531 1.00 0.00 C ATOM 1660 CG2 ILE A 114 -9.312 -4.309 -5.265 1.00 0.00 C ATOM 1661 CD1 ILE A 114 -10.990 -2.842 -3.093 1.00 0.00 C ATOM 0 H ILE A 114 -9.687 -4.407 -8.184 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.763 -2.677 -7.023 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.436 -4.249 -5.259 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.877 -1.746 -4.581 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -11.610 -1.746 -4.844 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.237 -4.614 -4.221 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.288 -5.192 -5.904 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.474 -3.658 -5.514 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.090 -1.978 -2.436 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -11.898 -3.443 -3.042 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -10.138 -3.443 -2.774 1.00 0.00 H new ATOM 1673 N GLN A 115 -10.003 -0.827 -6.833 1.00 0.00 N ATOM 1674 CA GLN A 115 -9.137 0.300 -7.135 1.00 0.00 C ATOM 1675 C GLN A 115 -8.709 1.002 -5.845 1.00 0.00 C ATOM 1676 O GLN A 115 -9.358 0.857 -4.811 1.00 0.00 O ATOM 1677 CB GLN A 115 -9.825 1.279 -8.089 1.00 0.00 C ATOM 1678 CG GLN A 115 -9.132 2.642 -8.070 1.00 0.00 C ATOM 1679 CD GLN A 115 -9.806 3.614 -9.040 1.00 0.00 C ATOM 1680 OE1 GLN A 115 -10.372 4.624 -8.655 1.00 0.00 O ATOM 1681 NE2 GLN A 115 -9.715 3.254 -10.317 1.00 0.00 N ATOM 0 H GLN A 115 -10.779 -0.613 -6.206 1.00 0.00 H new ATOM 0 HA GLN A 115 -8.244 -0.077 -7.634 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -9.813 0.875 -9.101 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -10.871 1.395 -7.805 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -9.158 3.053 -7.061 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -8.082 2.524 -8.339 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -9.227 2.395 -10.571 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -10.133 3.837 -11.042 1.00 0.00 H new ATOM 1690 N LEU A 116 -7.618 1.747 -5.949 1.00 0.00 N ATOM 1691 CA LEU A 116 -7.095 2.472 -4.803 1.00 0.00 C ATOM 1692 C LEU A 116 -6.770 3.908 -5.218 1.00 0.00 C ATOM 1693 O LEU A 116 -5.978 4.129 -6.133 1.00 0.00 O ATOM 1694 CB LEU A 116 -5.908 1.724 -4.193 1.00 0.00 C ATOM 1695 CG LEU A 116 -6.199 0.315 -3.672 1.00 0.00 C ATOM 1696 CD1 LEU A 116 -4.900 -0.450 -3.409 1.00 0.00 C ATOM 1697 CD2 LEU A 116 -7.097 0.363 -2.434 1.00 0.00 C ATOM 0 H LEU A 116 -7.082 1.864 -6.809 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.845 2.530 -4.014 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.121 1.657 -4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.513 2.320 -3.370 1.00 0.00 H new ATOM 0 HG LEU A 116 -6.744 -0.230 -4.443 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.134 -1.448 -3.039 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.331 -0.530 -4.335 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -4.308 0.083 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.288 -0.651 -2.084 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -6.601 0.931 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -8.042 0.843 -2.688 1.00 0.00 H new ATOM 1709 N VAL A 117 -7.398 4.847 -4.526 1.00 0.00 N ATOM 1710 CA VAL A 117 -7.185 6.256 -4.811 1.00 0.00 C ATOM 1711 C VAL A 117 -6.344 6.876 -3.695 1.00 0.00 C ATOM 1712 O VAL A 117 -6.825 7.058 -2.577 1.00 0.00 O ATOM 1713 CB VAL A 117 -8.530 6.959 -5.007 1.00 0.00 C ATOM 1714 CG1 VAL A 117 -8.346 8.312 -5.697 1.00 0.00 C ATOM 1715 CG2 VAL A 117 -9.503 6.073 -5.789 1.00 0.00 C ATOM 0 H VAL A 117 -8.055 4.660 -3.768 1.00 0.00 H new ATOM 0 HA VAL A 117 -6.631 6.378 -5.742 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.960 7.141 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -9.317 8.791 -5.824 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.705 8.948 -5.086 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.884 8.163 -6.673 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.451 6.596 -5.914 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.082 5.846 -6.768 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.670 5.145 -5.242 1.00 0.00 H new ATOM 1725 N ILE A 118 -5.101 7.185 -4.035 1.00 0.00 N ATOM 1726 CA ILE A 118 -4.188 7.782 -3.076 1.00 0.00 C ATOM 1727 C ILE A 118 -4.036 9.273 -3.381 1.00 0.00 C ATOM 1728 O ILE A 118 -4.174 9.692 -4.530 1.00 0.00 O ATOM 1729 CB ILE A 118 -2.861 7.020 -3.054 1.00 0.00 C ATOM 1730 CG1 ILE A 118 -1.945 7.483 -4.188 1.00 0.00 C ATOM 1731 CG2 ILE A 118 -3.095 5.509 -3.087 1.00 0.00 C ATOM 1732 CD1 ILE A 118 -0.941 8.526 -3.692 1.00 0.00 C ATOM 0 H ILE A 118 -4.705 7.033 -4.963 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.592 7.703 -2.067 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.353 7.246 -2.116 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.411 6.627 -4.601 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.544 7.905 -4.995 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -2.136 4.992 -3.071 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.682 5.213 -2.218 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -3.634 5.244 -3.996 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.302 8.838 -4.518 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.478 9.391 -3.302 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -0.327 8.093 -2.902 1.00 0.00 H new ATOM 1744 N LEU A 119 -3.755 10.034 -2.334 1.00 0.00 N ATOM 1745 CA LEU A 119 -3.583 11.470 -2.476 1.00 0.00 C ATOM 1746 C LEU A 119 -2.205 11.869 -1.944 1.00 0.00 C ATOM 1747 O LEU A 119 -1.937 11.748 -0.750 1.00 0.00 O ATOM 1748 CB LEU A 119 -4.740 12.216 -1.808 1.00 0.00 C ATOM 1749 CG LEU A 119 -4.939 13.670 -2.243 1.00 0.00 C ATOM 1750 CD1 LEU A 119 -3.595 14.379 -2.417 1.00 0.00 C ATOM 1751 CD2 LEU A 119 -5.798 13.752 -3.506 1.00 0.00 C ATOM 0 H LEU A 119 -3.642 9.683 -1.383 1.00 0.00 H new ATOM 0 HA LEU A 119 -3.614 11.756 -3.527 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -5.662 11.669 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -4.584 12.198 -0.729 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.478 14.192 -1.453 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -3.765 15.410 -2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -3.053 14.368 -1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -3.008 13.864 -3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.924 14.796 -3.793 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -5.309 13.209 -4.315 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.775 13.309 -3.311 1.00 0.00 H new ATOM 1763 N ARG A 120 -1.367 12.337 -2.857 1.00 0.00 N ATOM 1764 CA ARG A 120 -0.023 12.755 -2.495 1.00 0.00 C ATOM 1765 C ARG A 120 0.037 14.277 -2.347 1.00 0.00 C ATOM 1766 O ARG A 120 0.034 15.002 -3.341 1.00 0.00 O ATOM 1767 CB ARG A 120 0.994 12.312 -3.548 1.00 0.00 C ATOM 1768 CG ARG A 120 2.425 12.574 -3.073 1.00 0.00 C ATOM 1769 CD ARG A 120 3.428 11.734 -3.866 1.00 0.00 C ATOM 1770 NE ARG A 120 3.889 12.485 -5.055 1.00 0.00 N ATOM 1771 CZ ARG A 120 4.631 13.599 -4.999 1.00 0.00 C ATOM 1772 NH1 ARG A 120 5.001 14.098 -3.812 1.00 0.00 N ATOM 1773 NH2 ARG A 120 5.004 14.214 -6.130 1.00 0.00 N ATOM 0 H ARG A 120 -1.592 12.436 -3.847 1.00 0.00 H new ATOM 0 HA ARG A 120 0.226 12.283 -1.545 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.866 11.250 -3.759 1.00 0.00 H new ATOM 0 HB3 ARG A 120 0.813 12.846 -4.481 1.00 0.00 H new ATOM 0 HG2 ARG A 120 2.662 13.632 -3.186 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.508 12.340 -2.012 1.00 0.00 H new ATOM 0 HD2 ARG A 120 4.279 11.478 -3.235 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.966 10.796 -4.175 1.00 0.00 H new ATOM 0 HE ARG A 120 3.625 12.132 -5.975 1.00 0.00 H new ATOM 0 HH11 ARG A 120 4.718 13.630 -2.951 1.00 0.00 H new ATOM 0 HH12 ARG A 120 5.566 14.946 -3.769 1.00 0.00 H new ATOM 0 HH21 ARG A 120 4.723 13.834 -7.034 1.00 0.00 H new ATOM 0 HH22 ARG A 120 5.569 15.062 -6.087 1.00 0.00 H new