USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 700 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 496 TYR OH : rot 165:sc= -0.134 USER MOD Set 1.2: A 505 TYR OH : rot 180:sc= -0.319 USER MOD Set 2.1: A 427 THR OG1 : rot -137:sc= -4.43! USER MOD Set 2.2: A 468 THR OG1 : rot 180:sc= -0.0854 USER MOD Set 3.1: A 440 HIS : no HE2:sc= -15.3! C(o=-19!,f=-23!) USER MOD Set 3.2: A 449 THR OG1 : rot 180:sc= -4.05! USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 ASN : amide:sc= -1.07 X(o=-1.1,f=-1.4) USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 429 TYR OH : rot 180:sc= -0.351 USER MOD Single : A 430 TYR OH : rot 61:sc= -0.0762! USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : A 435 ASN : amide:sc= -3.59! C(o=-3.6!,f=-3.2!) USER MOD Single : A 436 SER OG : rot 60:sc= 0.409 USER MOD Single : A 438 TYR OH : rot 180:sc= 0 USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 447 SER OG : rot 180:sc= -0.0528 USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 MET CE :methyl -150:sc= -6.33! (180deg=-9.74!) USER MOD Single : A 457 GLN : amide:sc= -0.0445 X(o=-0.044,f=-0.2) USER MOD Single : A 462 SER OG : rot 79:sc= 1.1 USER MOD Single : A 464 TYR OH : rot 180:sc= 0 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 473 SER OG : rot -40:sc= 0.00475 USER MOD Single : A 475 SER OG : rot 180:sc= -0.0286 USER MOD Single : A 476 GLN : amide:sc= -0.316 X(o=-0.32,f=0) USER MOD Single : A 482 ASN : amide:sc= -3.02! C(o=-3!,f=-3.9!) USER MOD Single : A 485 ASN : amide:sc= -2.81! K(o=-2.8!,f=-0.92) USER MOD Single : A 486 ASN : amide:sc=-0.000756 X(o=-0.00076,f=-0.13) USER MOD Single : A 487 ASN : amide:sc= -5.07! K(o=-5.1!,f=-1.5) USER MOD Single : A 490 SER OG : rot 180:sc= -0.051 USER MOD Single : A 491 ASN : amide:sc= 0.00331 X(o=0.0033,f=0.015) USER MOD Single : A 492 ASN : amide:sc= -0.0229 K(o=-0.023,f=-0.54) USER MOD Single : A 493 THR OG1 : rot -67:sc= 1.09 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 495 ASN : amide:sc= -7.24! C(o=-7.2!,f=-12!) USER MOD Single : A 497 SER OG : rot 180:sc= 0 USER MOD Single : A 499 SER OG : rot 180:sc= 0.00575 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 THR OG1 : rot 180:sc= -0.0227 USER MOD Single : A 503 SER OG : rot 179:sc= -0.312 USER MOD Single : A 504 THR OG1 : rot 119:sc= -1.33 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 509 ASN : amide:sc= 0.91 K(o=0.91,f=-0.94) USER MOD Single : A 510 SER OG : rot 180:sc= 0 USER MOD Single : A 512 ASN : amide:sc= -0.14 K(o=-0.14,f=-1) USER MOD Single : A 515 THR OG1 : rot 47:sc= 0.56 USER MOD Single : A 517 THR OG1 : rot 180:sc= -1.56! USER MOD Single : A 518 SER OG : rot 50:sc= 0.5 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 420 -17.231 -9.696 12.064 1.00 0.00 N ATOM 2 CA GLY A 420 -17.069 -9.812 13.503 1.00 0.00 C ATOM 3 C GLY A 420 -17.530 -8.537 14.211 1.00 0.00 C ATOM 4 O GLY A 420 -18.422 -7.842 13.727 1.00 0.00 O ATOM 0 HA2 GLY A 420 -17.642 -10.663 13.870 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -16.023 -10.006 13.740 1.00 0.00 H new ATOM 8 N GLY A 421 -16.901 -8.268 15.346 1.00 0.00 N ATOM 9 CA GLY A 421 -17.236 -7.088 16.125 1.00 0.00 C ATOM 10 C GLY A 421 -16.205 -5.978 15.911 1.00 0.00 C ATOM 11 O GLY A 421 -16.559 -4.803 15.832 1.00 0.00 O ATOM 0 H GLY A 421 -16.162 -8.847 15.745 1.00 0.00 H new ATOM 0 HA2 GLY A 421 -18.226 -6.730 15.841 1.00 0.00 H new ATOM 0 HA3 GLY A 421 -17.282 -7.347 17.183 1.00 0.00 H new ATOM 15 N THR A 422 -14.949 -6.391 15.824 1.00 0.00 N ATOM 16 CA THR A 422 -13.863 -5.446 15.621 1.00 0.00 C ATOM 17 C THR A 422 -13.823 -4.985 14.163 1.00 0.00 C ATOM 18 O THR A 422 -14.252 -5.710 13.267 1.00 0.00 O ATOM 19 CB THR A 422 -12.565 -6.111 16.084 1.00 0.00 C ATOM 20 OG1 THR A 422 -12.624 -6.035 17.506 1.00 0.00 O ATOM 21 CG2 THR A 422 -11.325 -5.293 15.718 1.00 0.00 C ATOM 0 H THR A 422 -14.659 -7.367 15.890 1.00 0.00 H new ATOM 0 HA THR A 422 -14.010 -4.541 16.211 1.00 0.00 H new ATOM 0 HB THR A 422 -12.488 -7.104 15.641 1.00 0.00 H new ATOM 0 HG1 THR A 422 -11.821 -6.445 17.889 1.00 0.00 H new ATOM 0 HG21 THR A 422 -10.432 -5.809 16.069 1.00 0.00 H new ATOM 0 HG22 THR A 422 -11.274 -5.175 14.636 1.00 0.00 H new ATOM 0 HG23 THR A 422 -11.385 -4.311 16.188 1.00 0.00 H new ATOM 29 N GLY A 423 -13.304 -3.781 13.971 1.00 0.00 N ATOM 30 CA GLY A 423 -13.203 -3.214 12.637 1.00 0.00 C ATOM 31 C GLY A 423 -11.985 -2.294 12.523 1.00 0.00 C ATOM 32 O GLY A 423 -12.130 -1.084 12.362 1.00 0.00 O ATOM 0 H GLY A 423 -12.949 -3.183 14.717 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -13.128 -4.015 11.902 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -14.109 -2.654 12.406 1.00 0.00 H new ATOM 36 N ASN A 424 -10.813 -2.905 12.611 1.00 0.00 N ATOM 37 CA ASN A 424 -9.571 -2.157 12.520 1.00 0.00 C ATOM 38 C ASN A 424 -9.428 -1.584 11.108 1.00 0.00 C ATOM 39 O ASN A 424 -10.050 -2.076 10.169 1.00 0.00 O ATOM 40 CB ASN A 424 -8.364 -3.058 12.789 1.00 0.00 C ATOM 41 CG ASN A 424 -8.436 -3.668 14.190 1.00 0.00 C ATOM 42 OD1 ASN A 424 -8.549 -4.870 14.367 1.00 0.00 O ATOM 43 ND2 ASN A 424 -8.366 -2.774 15.173 1.00 0.00 N ATOM 0 H ASN A 424 -10.697 -3.910 12.744 1.00 0.00 H new ATOM 0 HA ASN A 424 -9.601 -1.362 13.265 1.00 0.00 H new ATOM 0 HB2 ASN A 424 -8.326 -3.853 12.044 1.00 0.00 H new ATOM 0 HB3 ASN A 424 -7.445 -2.481 12.687 1.00 0.00 H new ATOM 0 HD21 ASN A 424 -8.406 -3.081 16.145 1.00 0.00 H new ATOM 0 HD22 ASN A 424 -8.272 -1.782 14.955 1.00 0.00 H new ATOM 50 N LYS A 425 -8.604 -0.552 11.004 1.00 0.00 N ATOM 51 CA LYS A 425 -8.371 0.094 9.723 1.00 0.00 C ATOM 52 C LYS A 425 -6.865 0.206 9.479 1.00 0.00 C ATOM 53 O LYS A 425 -6.095 0.419 10.414 1.00 0.00 O ATOM 54 CB LYS A 425 -9.106 1.434 9.657 1.00 0.00 C ATOM 55 CG LYS A 425 -8.890 2.112 8.303 1.00 0.00 C ATOM 56 CD LYS A 425 -9.924 1.635 7.280 1.00 0.00 C ATOM 57 CE LYS A 425 -11.054 2.656 7.127 1.00 0.00 C ATOM 58 NZ LYS A 425 -11.772 2.446 5.850 1.00 0.00 N ATOM 0 H LYS A 425 -8.089 -0.147 11.786 1.00 0.00 H new ATOM 0 HA LYS A 425 -8.781 -0.509 8.913 1.00 0.00 H new ATOM 0 HB2 LYS A 425 -10.172 1.277 9.823 1.00 0.00 H new ATOM 0 HB3 LYS A 425 -8.752 2.087 10.455 1.00 0.00 H new ATOM 0 HG2 LYS A 425 -8.960 3.194 8.419 1.00 0.00 H new ATOM 0 HG3 LYS A 425 -7.886 1.894 7.939 1.00 0.00 H new ATOM 0 HD2 LYS A 425 -9.441 1.475 6.316 1.00 0.00 H new ATOM 0 HD3 LYS A 425 -10.336 0.676 7.594 1.00 0.00 H new ATOM 0 HE2 LYS A 425 -11.750 2.565 7.961 1.00 0.00 H new ATOM 0 HE3 LYS A 425 -10.646 3.666 7.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 425 -12.535 3.147 5.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 425 -11.108 2.555 5.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 425 -12.177 1.488 5.833 1.00 0.00 H new ATOM 71 N VAL A 426 -6.490 0.056 8.217 1.00 0.00 N ATOM 72 CA VAL A 426 -5.089 0.138 7.838 1.00 0.00 C ATOM 73 C VAL A 426 -4.926 1.172 6.723 1.00 0.00 C ATOM 74 O VAL A 426 -5.591 1.088 5.691 1.00 0.00 O ATOM 75 CB VAL A 426 -4.571 -1.248 7.449 1.00 0.00 C ATOM 76 CG1 VAL A 426 -3.044 -1.256 7.353 1.00 0.00 C ATOM 77 CG2 VAL A 426 -5.065 -2.314 8.430 1.00 0.00 C ATOM 0 H VAL A 426 -7.131 -0.122 7.444 1.00 0.00 H new ATOM 0 HA VAL A 426 -4.484 0.472 8.681 1.00 0.00 H new ATOM 0 HB VAL A 426 -4.970 -1.490 6.464 1.00 0.00 H new ATOM 0 HG11 VAL A 426 -2.702 -2.253 7.075 1.00 0.00 H new ATOM 0 HG12 VAL A 426 -2.723 -0.539 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 426 -2.617 -0.982 8.318 1.00 0.00 H new ATOM 0 HG21 VAL A 426 -4.682 -3.290 8.130 1.00 0.00 H new ATOM 0 HG22 VAL A 426 -4.710 -2.078 9.433 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -6.155 -2.335 8.426 1.00 0.00 H new ATOM 87 N THR A 427 -4.038 2.124 6.967 1.00 0.00 N ATOM 88 CA THR A 427 -3.779 3.174 5.996 1.00 0.00 C ATOM 89 C THR A 427 -2.355 3.056 5.451 1.00 0.00 C ATOM 90 O THR A 427 -1.413 2.824 6.207 1.00 0.00 O ATOM 91 CB THR A 427 -4.064 4.519 6.667 1.00 0.00 C ATOM 92 OG1 THR A 427 -5.410 4.403 7.120 1.00 0.00 O ATOM 93 CG2 THR A 427 -4.107 5.675 5.666 1.00 0.00 C ATOM 0 H THR A 427 -3.488 2.191 7.824 1.00 0.00 H new ATOM 0 HA THR A 427 -4.434 3.082 5.129 1.00 0.00 H new ATOM 0 HB THR A 427 -3.301 4.718 7.419 1.00 0.00 H new ATOM 0 HG1 THR A 427 -5.893 5.234 6.928 1.00 0.00 H new ATOM 0 HG21 THR A 427 -4.312 6.606 6.194 1.00 0.00 H new ATOM 0 HG22 THR A 427 -3.146 5.751 5.157 1.00 0.00 H new ATOM 0 HG23 THR A 427 -4.893 5.493 4.933 1.00 0.00 H new ATOM 101 N ILE A 428 -2.242 3.222 4.141 1.00 0.00 N ATOM 102 CA ILE A 428 -0.948 3.138 3.485 1.00 0.00 C ATOM 103 C ILE A 428 -0.783 4.326 2.536 1.00 0.00 C ATOM 104 O ILE A 428 -1.601 4.527 1.639 1.00 0.00 O ATOM 105 CB ILE A 428 -0.781 1.778 2.803 1.00 0.00 C ATOM 106 CG1 ILE A 428 -0.353 0.708 3.809 1.00 0.00 C ATOM 107 CG2 ILE A 428 0.186 1.873 1.621 1.00 0.00 C ATOM 108 CD1 ILE A 428 -1.522 -0.217 4.156 1.00 0.00 C ATOM 0 H ILE A 428 -3.025 3.414 3.516 1.00 0.00 H new ATOM 0 HA ILE A 428 -0.144 3.202 4.219 1.00 0.00 H new ATOM 0 HB ILE A 428 -1.749 1.475 2.404 1.00 0.00 H new ATOM 0 HG12 ILE A 428 0.468 0.123 3.395 1.00 0.00 H new ATOM 0 HG13 ILE A 428 0.020 1.184 4.716 1.00 0.00 H new ATOM 0 HG21 ILE A 428 0.287 0.893 1.154 1.00 0.00 H new ATOM 0 HG22 ILE A 428 -0.200 2.585 0.891 1.00 0.00 H new ATOM 0 HG23 ILE A 428 1.161 2.209 1.975 1.00 0.00 H new ATOM 0 HD11 ILE A 428 -1.191 -0.968 4.873 1.00 0.00 H new ATOM 0 HD12 ILE A 428 -2.332 0.368 4.592 1.00 0.00 H new ATOM 0 HD13 ILE A 428 -1.877 -0.710 3.251 1.00 0.00 H new ATOM 120 N TYR A 429 0.280 5.083 2.766 1.00 0.00 N ATOM 121 CA TYR A 429 0.562 6.247 1.943 1.00 0.00 C ATOM 122 C TYR A 429 1.850 6.052 1.140 1.00 0.00 C ATOM 123 O TYR A 429 2.941 6.028 1.707 1.00 0.00 O ATOM 124 CB TYR A 429 0.752 7.414 2.914 1.00 0.00 C ATOM 125 CG TYR A 429 -0.520 7.812 3.665 1.00 0.00 C ATOM 126 CD1 TYR A 429 -1.726 7.228 3.337 1.00 0.00 C ATOM 127 CD2 TYR A 429 -0.460 8.755 4.671 1.00 0.00 C ATOM 128 CE1 TYR A 429 -2.923 7.603 4.044 1.00 0.00 C ATOM 129 CE2 TYR A 429 -1.658 9.130 5.378 1.00 0.00 C ATOM 130 CZ TYR A 429 -2.830 8.535 5.030 1.00 0.00 C ATOM 131 OH TYR A 429 -3.961 8.889 5.698 1.00 0.00 O ATOM 0 H TYR A 429 0.956 4.913 3.510 1.00 0.00 H new ATOM 0 HA TYR A 429 -0.247 6.421 1.234 1.00 0.00 H new ATOM 0 HB2 TYR A 429 1.522 7.149 3.639 1.00 0.00 H new ATOM 0 HB3 TYR A 429 1.120 8.278 2.360 1.00 0.00 H new ATOM 0 HD1 TYR A 429 -1.772 6.490 2.550 1.00 0.00 H new ATOM 0 HD2 TYR A 429 0.484 9.212 4.928 1.00 0.00 H new ATOM 0 HE1 TYR A 429 -3.874 7.154 3.797 1.00 0.00 H new ATOM 0 HE2 TYR A 429 -1.626 9.867 6.167 1.00 0.00 H new ATOM 0 HH TYR A 429 -3.744 9.563 6.375 1.00 0.00 H new ATOM 141 N TYR A 430 1.680 5.917 -0.167 1.00 0.00 N ATOM 142 CA TYR A 430 2.815 5.724 -1.053 1.00 0.00 C ATOM 143 C TYR A 430 3.100 6.991 -1.863 1.00 0.00 C ATOM 144 O TYR A 430 2.175 7.659 -2.323 1.00 0.00 O ATOM 145 CB TYR A 430 2.417 4.599 -2.010 1.00 0.00 C ATOM 146 CG TYR A 430 3.203 4.592 -3.323 1.00 0.00 C ATOM 147 CD1 TYR A 430 4.577 4.471 -3.304 1.00 0.00 C ATOM 148 CD2 TYR A 430 2.536 4.706 -4.526 1.00 0.00 C ATOM 149 CE1 TYR A 430 5.317 4.464 -4.540 1.00 0.00 C ATOM 150 CE2 TYR A 430 3.276 4.699 -5.762 1.00 0.00 C ATOM 151 CZ TYR A 430 4.629 4.578 -5.708 1.00 0.00 C ATOM 152 OH TYR A 430 5.328 4.572 -6.875 1.00 0.00 O ATOM 0 H TYR A 430 0.773 5.937 -0.634 1.00 0.00 H new ATOM 0 HA TYR A 430 3.712 5.488 -0.481 1.00 0.00 H new ATOM 0 HB2 TYR A 430 2.559 3.642 -1.508 1.00 0.00 H new ATOM 0 HB3 TYR A 430 1.354 4.686 -2.235 1.00 0.00 H new ATOM 0 HD1 TYR A 430 5.098 4.381 -2.362 1.00 0.00 H new ATOM 0 HD2 TYR A 430 1.460 4.800 -4.541 1.00 0.00 H new ATOM 0 HE1 TYR A 430 6.393 4.370 -4.539 1.00 0.00 H new ATOM 0 HE2 TYR A 430 2.767 4.788 -6.710 1.00 0.00 H new ATOM 0 HH TYR A 430 5.804 3.720 -6.967 1.00 0.00 H new ATOM 162 N LYS A 431 4.383 7.282 -2.014 1.00 0.00 N ATOM 163 CA LYS A 431 4.801 8.457 -2.761 1.00 0.00 C ATOM 164 C LYS A 431 4.382 8.301 -4.224 1.00 0.00 C ATOM 165 O LYS A 431 4.446 7.205 -4.779 1.00 0.00 O ATOM 166 CB LYS A 431 6.299 8.706 -2.573 1.00 0.00 C ATOM 167 CG LYS A 431 6.779 9.855 -3.463 1.00 0.00 C ATOM 168 CD LYS A 431 7.401 9.324 -4.756 1.00 0.00 C ATOM 169 CE LYS A 431 7.937 10.469 -5.617 1.00 0.00 C ATOM 170 NZ LYS A 431 9.387 10.655 -5.389 1.00 0.00 N ATOM 0 H LYS A 431 5.147 6.725 -1.632 1.00 0.00 H new ATOM 0 HA LYS A 431 4.303 9.349 -2.380 1.00 0.00 H new ATOM 0 HB2 LYS A 431 6.504 8.940 -1.528 1.00 0.00 H new ATOM 0 HB3 LYS A 431 6.855 7.799 -2.812 1.00 0.00 H new ATOM 0 HG2 LYS A 431 5.941 10.510 -3.701 1.00 0.00 H new ATOM 0 HG3 LYS A 431 7.511 10.456 -2.923 1.00 0.00 H new ATOM 0 HD2 LYS A 431 8.210 8.634 -4.518 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.656 8.760 -5.317 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.753 10.257 -6.670 1.00 0.00 H new ATOM 0 HE3 LYS A 431 7.405 11.390 -5.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.734 11.436 -5.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.555 10.879 -4.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 9.892 9.781 -5.638 1.00 0.00 H new ATOM 183 N LYS A 432 3.962 9.414 -4.808 1.00 0.00 N ATOM 184 CA LYS A 432 3.532 9.415 -6.196 1.00 0.00 C ATOM 185 C LYS A 432 4.761 9.400 -7.106 1.00 0.00 C ATOM 186 O LYS A 432 5.470 10.399 -7.215 1.00 0.00 O ATOM 187 CB LYS A 432 2.584 10.586 -6.462 1.00 0.00 C ATOM 188 CG LYS A 432 1.612 10.258 -7.598 1.00 0.00 C ATOM 189 CD LYS A 432 0.427 11.225 -7.602 1.00 0.00 C ATOM 190 CE LYS A 432 -0.790 10.604 -6.914 1.00 0.00 C ATOM 191 NZ LYS A 432 -1.965 10.634 -7.814 1.00 0.00 N ATOM 0 H LYS A 432 3.910 10.321 -4.345 1.00 0.00 H new ATOM 0 HA LYS A 432 2.959 8.514 -6.418 1.00 0.00 H new ATOM 0 HB2 LYS A 432 2.025 10.819 -5.556 1.00 0.00 H new ATOM 0 HB3 LYS A 432 3.161 11.475 -6.718 1.00 0.00 H new ATOM 0 HG2 LYS A 432 2.133 10.312 -8.554 1.00 0.00 H new ATOM 0 HG3 LYS A 432 1.251 9.235 -7.489 1.00 0.00 H new ATOM 0 HD2 LYS A 432 0.705 12.148 -7.094 1.00 0.00 H new ATOM 0 HD3 LYS A 432 0.173 11.490 -8.628 1.00 0.00 H new ATOM 0 HE2 LYS A 432 -0.569 9.575 -6.629 1.00 0.00 H new ATOM 0 HE3 LYS A 432 -1.013 11.148 -5.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 -2.783 10.209 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 -2.185 11.619 -8.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 -1.754 10.095 -8.678 1.00 0.00 H new ATOM 204 N GLY A 433 4.977 8.254 -7.736 1.00 0.00 N ATOM 205 CA GLY A 433 6.109 8.096 -8.633 1.00 0.00 C ATOM 206 C GLY A 433 5.645 7.692 -10.035 1.00 0.00 C ATOM 207 O GLY A 433 6.464 7.366 -10.893 1.00 0.00 O ATOM 0 H GLY A 433 4.388 7.427 -7.643 1.00 0.00 H new ATOM 0 HA2 GLY A 433 6.669 9.030 -8.686 1.00 0.00 H new ATOM 0 HA3 GLY A 433 6.788 7.340 -8.238 1.00 0.00 H new ATOM 211 N PHE A 434 4.334 7.727 -10.223 1.00 0.00 N ATOM 212 CA PHE A 434 3.752 7.369 -11.505 1.00 0.00 C ATOM 213 C PHE A 434 2.593 8.302 -11.861 1.00 0.00 C ATOM 214 O PHE A 434 2.648 9.011 -12.864 1.00 0.00 O ATOM 215 CB PHE A 434 3.219 5.941 -11.371 1.00 0.00 C ATOM 216 CG PHE A 434 4.241 4.859 -11.727 1.00 0.00 C ATOM 217 CD1 PHE A 434 5.108 4.405 -10.782 1.00 0.00 C ATOM 218 CD2 PHE A 434 4.282 4.351 -12.988 1.00 0.00 C ATOM 219 CE1 PHE A 434 6.056 3.401 -11.113 1.00 0.00 C ATOM 220 CE2 PHE A 434 5.230 3.347 -13.318 1.00 0.00 C ATOM 221 CZ PHE A 434 6.097 2.893 -12.374 1.00 0.00 C ATOM 0 H PHE A 434 3.658 7.998 -9.509 1.00 0.00 H new ATOM 0 HA PHE A 434 4.503 7.451 -12.290 1.00 0.00 H new ATOM 0 HB2 PHE A 434 2.882 5.785 -10.346 1.00 0.00 H new ATOM 0 HB3 PHE A 434 2.346 5.828 -12.014 1.00 0.00 H new ATOM 0 HD1 PHE A 434 5.075 4.808 -9.781 1.00 0.00 H new ATOM 0 HD2 PHE A 434 3.594 4.711 -13.738 1.00 0.00 H new ATOM 0 HE1 PHE A 434 6.745 3.041 -10.363 1.00 0.00 H new ATOM 0 HE2 PHE A 434 5.263 2.944 -14.319 1.00 0.00 H new ATOM 0 HZ PHE A 434 6.818 2.129 -12.625 1.00 0.00 H new ATOM 231 N ASN A 435 1.571 8.272 -11.018 1.00 0.00 N ATOM 232 CA ASN A 435 0.400 9.105 -11.231 1.00 0.00 C ATOM 233 C ASN A 435 -0.838 8.387 -10.691 1.00 0.00 C ATOM 234 O ASN A 435 -1.509 8.891 -9.792 1.00 0.00 O ATOM 235 CB ASN A 435 0.179 9.373 -12.721 1.00 0.00 C ATOM 236 CG ASN A 435 0.798 10.710 -13.136 1.00 0.00 C ATOM 237 OD1 ASN A 435 0.653 11.723 -12.473 1.00 0.00 O ATOM 238 ND2 ASN A 435 1.495 10.655 -14.268 1.00 0.00 N ATOM 0 H ASN A 435 1.530 7.684 -10.186 1.00 0.00 H new ATOM 0 HA ASN A 435 0.561 10.051 -10.714 1.00 0.00 H new ATOM 0 HB2 ASN A 435 0.619 8.567 -13.308 1.00 0.00 H new ATOM 0 HB3 ASN A 435 -0.889 9.380 -12.938 1.00 0.00 H new ATOM 0 HD21 ASN A 435 1.948 11.495 -14.630 1.00 0.00 H new ATOM 0 HD22 ASN A 435 1.577 9.773 -14.774 1.00 0.00 H new ATOM 245 N SER A 436 -1.102 7.221 -11.262 1.00 0.00 N ATOM 246 CA SER A 436 -2.248 6.429 -10.850 1.00 0.00 C ATOM 247 C SER A 436 -1.828 4.972 -10.639 1.00 0.00 C ATOM 248 O SER A 436 -2.321 4.076 -11.322 1.00 0.00 O ATOM 249 CB SER A 436 -3.376 6.512 -11.880 1.00 0.00 C ATOM 250 OG SER A 436 -2.976 6.006 -13.151 1.00 0.00 O ATOM 0 H SER A 436 -0.542 6.806 -12.007 1.00 0.00 H new ATOM 0 HA SER A 436 -2.622 6.833 -9.910 1.00 0.00 H new ATOM 0 HB2 SER A 436 -4.238 5.949 -11.520 1.00 0.00 H new ATOM 0 HB3 SER A 436 -3.694 7.549 -11.986 1.00 0.00 H new ATOM 0 HG SER A 436 -2.711 5.067 -13.061 1.00 0.00 H new ATOM 256 N PRO A 437 -0.899 4.777 -9.665 1.00 0.00 N ATOM 257 CA PRO A 437 -0.408 3.445 -9.356 1.00 0.00 C ATOM 258 C PRO A 437 -1.449 2.645 -8.570 1.00 0.00 C ATOM 259 O PRO A 437 -2.320 3.223 -7.921 1.00 0.00 O ATOM 260 CB PRO A 437 0.878 3.671 -8.578 1.00 0.00 C ATOM 261 CG PRO A 437 0.817 5.106 -8.080 1.00 0.00 C ATOM 262 CD PRO A 437 -0.294 5.816 -8.836 1.00 0.00 C ATOM 0 HA PRO A 437 -0.219 2.849 -10.249 1.00 0.00 H new ATOM 0 HB2 PRO A 437 0.959 2.972 -7.746 1.00 0.00 H new ATOM 0 HB3 PRO A 437 1.751 3.514 -9.212 1.00 0.00 H new ATOM 0 HG2 PRO A 437 0.624 5.130 -7.007 1.00 0.00 H new ATOM 0 HG3 PRO A 437 1.771 5.608 -8.244 1.00 0.00 H new ATOM 0 HD2 PRO A 437 -1.023 6.252 -8.152 1.00 0.00 H new ATOM 0 HD3 PRO A 437 0.099 6.630 -9.445 1.00 0.00 H new ATOM 270 N TYR A 438 -1.324 1.329 -8.655 1.00 0.00 N ATOM 271 CA TYR A 438 -2.244 0.444 -7.961 1.00 0.00 C ATOM 272 C TYR A 438 -1.580 -0.184 -6.734 1.00 0.00 C ATOM 273 O TYR A 438 -0.366 -0.381 -6.714 1.00 0.00 O ATOM 274 CB TYR A 438 -2.598 -0.662 -8.957 1.00 0.00 C ATOM 275 CG TYR A 438 -3.210 -0.151 -10.263 1.00 0.00 C ATOM 276 CD1 TYR A 438 -2.419 0.499 -11.188 1.00 0.00 C ATOM 277 CD2 TYR A 438 -4.554 -0.342 -10.515 1.00 0.00 C ATOM 278 CE1 TYR A 438 -2.996 0.980 -12.416 1.00 0.00 C ATOM 279 CE2 TYR A 438 -5.130 0.139 -11.744 1.00 0.00 C ATOM 280 CZ TYR A 438 -4.323 0.776 -12.634 1.00 0.00 C ATOM 281 OH TYR A 438 -4.867 1.230 -13.795 1.00 0.00 O ATOM 0 H TYR A 438 -0.600 0.854 -9.194 1.00 0.00 H new ATOM 0 HA TYR A 438 -3.121 0.994 -7.618 1.00 0.00 H new ATOM 0 HB2 TYR A 438 -1.697 -1.231 -9.188 1.00 0.00 H new ATOM 0 HB3 TYR A 438 -3.298 -1.351 -8.485 1.00 0.00 H new ATOM 0 HD1 TYR A 438 -1.367 0.647 -10.991 1.00 0.00 H new ATOM 0 HD2 TYR A 438 -5.173 -0.852 -9.791 1.00 0.00 H new ATOM 0 HE1 TYR A 438 -2.389 1.492 -13.148 1.00 0.00 H new ATOM 0 HE2 TYR A 438 -6.180 -0.003 -11.954 1.00 0.00 H new ATOM 0 HH TYR A 438 -5.823 1.013 -13.815 1.00 0.00 H new ATOM 291 N ILE A 439 -2.405 -0.480 -5.741 1.00 0.00 N ATOM 292 CA ILE A 439 -1.913 -1.082 -4.513 1.00 0.00 C ATOM 293 C ILE A 439 -2.811 -2.260 -4.131 1.00 0.00 C ATOM 294 O ILE A 439 -4.019 -2.097 -3.969 1.00 0.00 O ATOM 295 CB ILE A 439 -1.783 -0.026 -3.414 1.00 0.00 C ATOM 296 CG1 ILE A 439 -0.859 -0.509 -2.294 1.00 0.00 C ATOM 297 CG2 ILE A 439 -3.159 0.385 -2.884 1.00 0.00 C ATOM 298 CD1 ILE A 439 -1.017 0.354 -1.041 1.00 0.00 C ATOM 0 H ILE A 439 -3.411 -0.314 -5.761 1.00 0.00 H new ATOM 0 HA ILE A 439 -0.910 -1.481 -4.660 1.00 0.00 H new ATOM 0 HB ILE A 439 -1.325 0.863 -3.848 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -1.085 -1.548 -2.055 1.00 0.00 H new ATOM 0 HG13 ILE A 439 0.176 -0.477 -2.633 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -3.039 1.137 -2.104 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -3.754 0.799 -3.698 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -3.666 -0.488 -2.472 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -0.349 -0.011 -0.261 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -0.767 1.388 -1.278 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -2.048 0.301 -0.690 1.00 0.00 H new ATOM 310 N HIS A 440 -2.185 -3.421 -3.999 1.00 0.00 N ATOM 311 CA HIS A 440 -2.913 -4.626 -3.640 1.00 0.00 C ATOM 312 C HIS A 440 -2.831 -4.844 -2.127 1.00 0.00 C ATOM 313 O HIS A 440 -1.741 -4.866 -1.558 1.00 0.00 O ATOM 314 CB HIS A 440 -2.404 -5.827 -4.440 1.00 0.00 C ATOM 315 CG HIS A 440 -3.491 -6.783 -4.870 1.00 0.00 C ATOM 316 ND1 HIS A 440 -3.502 -7.395 -6.111 1.00 0.00 N ATOM 317 CD2 HIS A 440 -4.601 -7.225 -4.212 1.00 0.00 C ATOM 318 CE1 HIS A 440 -4.575 -8.169 -6.186 1.00 0.00 C ATOM 319 NE2 HIS A 440 -5.255 -8.062 -5.008 1.00 0.00 N ATOM 0 H HIS A 440 -1.183 -3.552 -4.134 1.00 0.00 H new ATOM 0 HA HIS A 440 -3.965 -4.510 -3.899 1.00 0.00 H new ATOM 0 HB2 HIS A 440 -1.881 -5.466 -5.325 1.00 0.00 H new ATOM 0 HB3 HIS A 440 -1.675 -6.369 -3.838 1.00 0.00 H new ATOM 0 HD1 HIS A 440 -2.803 -7.271 -6.844 1.00 0.00 H new ATOM 0 HD2 HIS A 440 -4.897 -6.942 -3.213 1.00 0.00 H new ATOM 0 HE1 HIS A 440 -4.861 -8.778 -7.031 1.00 0.00 H new ATOM 327 N TYR A 441 -3.998 -4.999 -1.520 1.00 0.00 N ATOM 328 CA TYR A 441 -4.072 -5.214 -0.085 1.00 0.00 C ATOM 329 C TYR A 441 -4.898 -6.460 0.241 1.00 0.00 C ATOM 330 O TYR A 441 -5.790 -6.834 -0.519 1.00 0.00 O ATOM 331 CB TYR A 441 -4.778 -3.984 0.490 1.00 0.00 C ATOM 332 CG TYR A 441 -6.235 -3.839 0.048 1.00 0.00 C ATOM 333 CD1 TYR A 441 -7.195 -4.699 0.544 1.00 0.00 C ATOM 334 CD2 TYR A 441 -6.590 -2.850 -0.846 1.00 0.00 C ATOM 335 CE1 TYR A 441 -8.567 -4.563 0.128 1.00 0.00 C ATOM 336 CE2 TYR A 441 -7.962 -2.714 -1.262 1.00 0.00 C ATOM 337 CZ TYR A 441 -8.883 -3.577 -0.754 1.00 0.00 C ATOM 338 OH TYR A 441 -10.179 -3.449 -1.147 1.00 0.00 O ATOM 0 H TYR A 441 -4.900 -4.980 -1.996 1.00 0.00 H new ATOM 0 HA TYR A 441 -3.076 -5.358 0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -4.743 -4.033 1.578 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -4.228 -3.091 0.193 1.00 0.00 H new ATOM 0 HD1 TYR A 441 -6.917 -5.473 1.244 1.00 0.00 H new ATOM 0 HD2 TYR A 441 -5.839 -2.178 -1.234 1.00 0.00 H new ATOM 0 HE1 TYR A 441 -9.328 -5.229 0.508 1.00 0.00 H new ATOM 0 HE2 TYR A 441 -8.253 -1.944 -1.961 1.00 0.00 H new ATOM 0 HH TYR A 441 -10.257 -2.703 -1.777 1.00 0.00 H new ATOM 348 N ARG A 442 -4.572 -7.067 1.373 1.00 0.00 N ATOM 349 CA ARG A 442 -5.273 -8.263 1.808 1.00 0.00 C ATOM 350 C ARG A 442 -5.151 -8.427 3.325 1.00 0.00 C ATOM 351 O ARG A 442 -4.045 -8.447 3.863 1.00 0.00 O ATOM 352 CB ARG A 442 -4.714 -9.510 1.121 1.00 0.00 C ATOM 353 CG ARG A 442 -4.517 -10.648 2.125 1.00 0.00 C ATOM 354 CD ARG A 442 -4.023 -11.917 1.426 1.00 0.00 C ATOM 355 NE ARG A 442 -3.111 -12.665 2.320 1.00 0.00 N ATOM 356 CZ ARG A 442 -2.479 -13.806 1.973 1.00 0.00 C ATOM 357 NH1 ARG A 442 -2.655 -14.341 0.747 1.00 0.00 N ATOM 358 NH2 ARG A 442 -1.686 -14.391 2.852 1.00 0.00 N ATOM 0 H ARG A 442 -3.832 -6.753 2.001 1.00 0.00 H new ATOM 0 HA ARG A 442 -6.322 -8.151 1.534 1.00 0.00 H new ATOM 0 HB2 ARG A 442 -5.394 -9.830 0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 442 -3.763 -9.272 0.645 1.00 0.00 H new ATOM 0 HG2 ARG A 442 -3.799 -10.345 2.887 1.00 0.00 H new ATOM 0 HG3 ARG A 442 -5.457 -10.853 2.637 1.00 0.00 H new ATOM 0 HD2 ARG A 442 -4.871 -12.544 1.151 1.00 0.00 H new ATOM 0 HD3 ARG A 442 -3.507 -11.656 0.502 1.00 0.00 H new ATOM 0 HE ARG A 442 -2.950 -12.295 3.257 1.00 0.00 H new ATOM 0 HH11 ARG A 442 -3.270 -13.883 0.074 1.00 0.00 H new ATOM 0 HH12 ARG A 442 -2.173 -15.204 0.493 1.00 0.00 H new ATOM 0 HH21 ARG A 442 -1.559 -13.980 3.777 1.00 0.00 H new ATOM 0 HH22 ARG A 442 -1.201 -15.254 2.606 1.00 0.00 H new ATOM 371 N PRO A 443 -6.333 -8.543 3.987 1.00 0.00 N ATOM 372 CA PRO A 443 -6.369 -8.705 5.431 1.00 0.00 C ATOM 373 C PRO A 443 -5.964 -10.124 5.834 1.00 0.00 C ATOM 374 O PRO A 443 -6.435 -11.098 5.249 1.00 0.00 O ATOM 375 CB PRO A 443 -7.794 -8.358 5.830 1.00 0.00 C ATOM 376 CG PRO A 443 -8.621 -8.467 4.559 1.00 0.00 C ATOM 377 CD PRO A 443 -7.661 -8.524 3.382 1.00 0.00 C ATOM 0 HA PRO A 443 -5.657 -8.059 5.945 1.00 0.00 H new ATOM 0 HB2 PRO A 443 -8.163 -9.041 6.595 1.00 0.00 H new ATOM 0 HB3 PRO A 443 -7.849 -7.352 6.247 1.00 0.00 H new ATOM 0 HG2 PRO A 443 -9.246 -9.360 4.586 1.00 0.00 H new ATOM 0 HG3 PRO A 443 -9.290 -7.612 4.465 1.00 0.00 H new ATOM 0 HD2 PRO A 443 -7.832 -9.413 2.774 1.00 0.00 H new ATOM 0 HD3 PRO A 443 -7.786 -7.661 2.727 1.00 0.00 H new ATOM 385 N ALA A 444 -5.094 -10.196 6.831 1.00 0.00 N ATOM 386 CA ALA A 444 -4.620 -11.480 7.319 1.00 0.00 C ATOM 387 C ALA A 444 -5.818 -12.388 7.600 1.00 0.00 C ATOM 388 O ALA A 444 -6.558 -12.168 8.557 1.00 0.00 O ATOM 389 CB ALA A 444 -3.748 -11.265 8.558 1.00 0.00 C ATOM 0 H ALA A 444 -4.705 -9.386 7.314 1.00 0.00 H new ATOM 0 HA ALA A 444 -4.003 -11.972 6.567 1.00 0.00 H new ATOM 0 HB1 ALA A 444 -3.392 -12.228 8.924 1.00 0.00 H new ATOM 0 HB2 ALA A 444 -2.895 -10.638 8.298 1.00 0.00 H new ATOM 0 HB3 ALA A 444 -4.335 -10.775 9.335 1.00 0.00 H new ATOM 395 N GLY A 445 -5.973 -13.391 6.747 1.00 0.00 N ATOM 396 CA GLY A 445 -7.069 -14.333 6.891 1.00 0.00 C ATOM 397 C GLY A 445 -8.151 -14.080 5.839 1.00 0.00 C ATOM 398 O GLY A 445 -9.165 -14.775 5.808 1.00 0.00 O ATOM 0 H GLY A 445 -5.357 -13.571 5.954 1.00 0.00 H new ATOM 0 HA2 GLY A 445 -6.693 -15.351 6.794 1.00 0.00 H new ATOM 0 HA3 GLY A 445 -7.499 -14.246 7.889 1.00 0.00 H new ATOM 402 N GLY A 446 -7.898 -13.083 5.004 1.00 0.00 N ATOM 403 CA GLY A 446 -8.838 -12.730 3.954 1.00 0.00 C ATOM 404 C GLY A 446 -8.328 -13.185 2.585 1.00 0.00 C ATOM 405 O GLY A 446 -7.804 -14.289 2.450 1.00 0.00 O ATOM 0 H GLY A 446 -7.056 -12.509 5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -9.805 -13.190 4.157 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -8.993 -11.651 3.948 1.00 0.00 H new ATOM 409 N SER A 447 -8.499 -12.310 1.605 1.00 0.00 N ATOM 410 CA SER A 447 -8.062 -12.608 0.252 1.00 0.00 C ATOM 411 C SER A 447 -7.634 -11.320 -0.455 1.00 0.00 C ATOM 412 O SER A 447 -8.091 -10.233 -0.104 1.00 0.00 O ATOM 413 CB SER A 447 -9.168 -13.307 -0.542 1.00 0.00 C ATOM 414 OG SER A 447 -10.173 -13.851 0.308 1.00 0.00 O ATOM 0 H SER A 447 -8.934 -11.395 1.721 1.00 0.00 H new ATOM 0 HA SER A 447 -7.209 -13.284 0.309 1.00 0.00 H new ATOM 0 HB2 SER A 447 -9.623 -12.597 -1.232 1.00 0.00 H new ATOM 0 HB3 SER A 447 -8.733 -14.104 -1.145 1.00 0.00 H new ATOM 0 HG SER A 447 -10.861 -14.287 -0.237 1.00 0.00 H new ATOM 420 N TRP A 448 -6.762 -11.485 -1.439 1.00 0.00 N ATOM 421 CA TRP A 448 -6.266 -10.350 -2.198 1.00 0.00 C ATOM 422 C TRP A 448 -7.429 -9.784 -3.016 1.00 0.00 C ATOM 423 O TRP A 448 -8.404 -10.486 -3.283 1.00 0.00 O ATOM 424 CB TRP A 448 -5.067 -10.748 -3.061 1.00 0.00 C ATOM 425 CG TRP A 448 -3.798 -11.050 -2.260 1.00 0.00 C ATOM 426 CD1 TRP A 448 -3.282 -12.248 -1.954 1.00 0.00 C ATOM 427 CD2 TRP A 448 -2.901 -10.083 -1.674 1.00 0.00 C ATOM 428 NE1 TRP A 448 -2.122 -12.125 -1.216 1.00 0.00 N ATOM 429 CE2 TRP A 448 -1.883 -10.767 -1.040 1.00 0.00 C ATOM 430 CE3 TRP A 448 -2.948 -8.678 -1.679 1.00 0.00 C ATOM 431 CZ2 TRP A 448 -0.836 -10.129 -0.364 1.00 0.00 C ATOM 432 CZ3 TRP A 448 -1.894 -8.055 -1.000 1.00 0.00 C ATOM 433 CH2 TRP A 448 -0.862 -8.729 -0.356 1.00 0.00 C ATOM 0 H TRP A 448 -6.386 -12.388 -1.728 1.00 0.00 H new ATOM 0 HA TRP A 448 -5.898 -9.571 -1.530 1.00 0.00 H new ATOM 0 HB2 TRP A 448 -5.331 -11.627 -3.649 1.00 0.00 H new ATOM 0 HB3 TRP A 448 -4.857 -9.944 -3.766 1.00 0.00 H new ATOM 0 HD1 TRP A 448 -3.719 -13.191 -2.248 1.00 0.00 H new ATOM 0 HE1 TRP A 448 -1.546 -12.890 -0.864 1.00 0.00 H new ATOM 0 HE3 TRP A 448 -3.735 -8.123 -2.168 1.00 0.00 H new ATOM 0 HZ2 TRP A 448 -0.051 -10.687 0.125 1.00 0.00 H new ATOM 0 HZ3 TRP A 448 -1.881 -6.975 -0.975 1.00 0.00 H new ATOM 0 HH2 TRP A 448 -0.084 -8.175 0.148 1.00 0.00 H new ATOM 444 N THR A 449 -7.288 -8.521 -3.391 1.00 0.00 N ATOM 445 CA THR A 449 -8.315 -7.854 -4.173 1.00 0.00 C ATOM 446 C THR A 449 -8.170 -8.205 -5.655 1.00 0.00 C ATOM 447 O THR A 449 -7.307 -8.999 -6.027 1.00 0.00 O ATOM 448 CB THR A 449 -8.221 -6.353 -3.893 1.00 0.00 C ATOM 449 OG1 THR A 449 -6.821 -6.103 -3.801 1.00 0.00 O ATOM 450 CG2 THR A 449 -8.757 -5.981 -2.509 1.00 0.00 C ATOM 0 H THR A 449 -6.478 -7.942 -3.168 1.00 0.00 H new ATOM 0 HA THR A 449 -9.311 -8.192 -3.887 1.00 0.00 H new ATOM 0 HB THR A 449 -8.775 -5.807 -4.656 1.00 0.00 H new ATOM 0 HG1 THR A 449 -6.670 -5.151 -3.622 1.00 0.00 H new ATOM 0 HG21 THR A 449 -8.667 -4.905 -2.361 1.00 0.00 H new ATOM 0 HG22 THR A 449 -9.805 -6.271 -2.435 1.00 0.00 H new ATOM 0 HG23 THR A 449 -8.181 -6.502 -1.744 1.00 0.00 H new ATOM 458 N ALA A 450 -9.028 -7.598 -6.461 1.00 0.00 N ATOM 459 CA ALA A 450 -9.007 -7.837 -7.894 1.00 0.00 C ATOM 460 C ALA A 450 -7.802 -7.121 -8.509 1.00 0.00 C ATOM 461 O ALA A 450 -7.869 -5.930 -8.806 1.00 0.00 O ATOM 462 CB ALA A 450 -10.332 -7.380 -8.508 1.00 0.00 C ATOM 0 H ALA A 450 -9.743 -6.941 -6.149 1.00 0.00 H new ATOM 0 HA ALA A 450 -8.901 -8.901 -8.103 1.00 0.00 H new ATOM 0 HB1 ALA A 450 -10.316 -7.559 -9.583 1.00 0.00 H new ATOM 0 HB2 ALA A 450 -11.153 -7.939 -8.059 1.00 0.00 H new ATOM 0 HB3 ALA A 450 -10.472 -6.316 -8.320 1.00 0.00 H new ATOM 468 N ALA A 451 -6.728 -7.879 -8.680 1.00 0.00 N ATOM 469 CA ALA A 451 -5.511 -7.332 -9.253 1.00 0.00 C ATOM 470 C ALA A 451 -5.835 -6.674 -10.596 1.00 0.00 C ATOM 471 O ALA A 451 -6.421 -7.304 -11.475 1.00 0.00 O ATOM 472 CB ALA A 451 -4.465 -8.441 -9.385 1.00 0.00 C ATOM 0 H ALA A 451 -6.676 -8.867 -8.432 1.00 0.00 H new ATOM 0 HA ALA A 451 -5.092 -6.564 -8.602 1.00 0.00 H new ATOM 0 HB1 ALA A 451 -3.552 -8.030 -9.815 1.00 0.00 H new ATOM 0 HB2 ALA A 451 -4.248 -8.856 -8.401 1.00 0.00 H new ATOM 0 HB3 ALA A 451 -4.849 -9.228 -10.034 1.00 0.00 H new ATOM 478 N PRO A 452 -5.429 -5.381 -10.716 1.00 0.00 N ATOM 479 CA PRO A 452 -4.741 -4.709 -9.627 1.00 0.00 C ATOM 480 C PRO A 452 -5.717 -4.335 -8.510 1.00 0.00 C ATOM 481 O PRO A 452 -6.809 -3.835 -8.776 1.00 0.00 O ATOM 482 CB PRO A 452 -4.079 -3.499 -10.267 1.00 0.00 C ATOM 483 CG PRO A 452 -4.798 -3.281 -11.588 1.00 0.00 C ATOM 484 CD PRO A 452 -5.613 -4.529 -11.887 1.00 0.00 C ATOM 0 HA PRO A 452 -3.998 -5.344 -9.143 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.165 -2.622 -9.626 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -3.015 -3.674 -10.426 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -5.446 -2.407 -11.530 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -4.080 -3.093 -12.387 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -6.665 -4.288 -12.040 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -5.264 -5.022 -12.794 1.00 0.00 H new ATOM 492 N GLY A 453 -5.289 -4.593 -7.282 1.00 0.00 N ATOM 493 CA GLY A 453 -6.112 -4.290 -6.124 1.00 0.00 C ATOM 494 C GLY A 453 -6.930 -3.017 -6.350 1.00 0.00 C ATOM 495 O GLY A 453 -7.927 -3.036 -7.070 1.00 0.00 O ATOM 0 H GLY A 453 -4.383 -5.008 -7.065 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -6.782 -5.126 -5.921 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -5.479 -4.168 -5.245 1.00 0.00 H new ATOM 499 N VAL A 454 -6.478 -1.942 -5.721 1.00 0.00 N ATOM 500 CA VAL A 454 -7.156 -0.662 -5.845 1.00 0.00 C ATOM 501 C VAL A 454 -6.129 0.426 -6.164 1.00 0.00 C ATOM 502 O VAL A 454 -4.982 0.350 -5.726 1.00 0.00 O ATOM 503 CB VAL A 454 -7.960 -0.372 -4.576 1.00 0.00 C ATOM 504 CG1 VAL A 454 -7.061 0.199 -3.476 1.00 0.00 C ATOM 505 CG2 VAL A 454 -9.129 0.569 -4.871 1.00 0.00 C ATOM 0 H VAL A 454 -5.651 -1.931 -5.124 1.00 0.00 H new ATOM 0 HA VAL A 454 -7.870 -0.686 -6.668 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.371 -1.315 -4.217 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -7.657 0.396 -2.585 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -6.278 -0.520 -3.237 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -6.608 1.128 -3.822 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -9.684 0.759 -3.952 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.747 1.511 -5.266 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.790 0.109 -5.606 1.00 0.00 H new ATOM 515 N LYS A 455 -6.578 1.413 -6.926 1.00 0.00 N ATOM 516 CA LYS A 455 -5.712 2.515 -7.310 1.00 0.00 C ATOM 517 C LYS A 455 -5.524 3.450 -6.114 1.00 0.00 C ATOM 518 O LYS A 455 -6.493 4.002 -5.594 1.00 0.00 O ATOM 519 CB LYS A 455 -6.255 3.213 -8.558 1.00 0.00 C ATOM 520 CG LYS A 455 -5.419 4.448 -8.902 1.00 0.00 C ATOM 521 CD LYS A 455 -6.295 5.555 -9.493 1.00 0.00 C ATOM 522 CE LYS A 455 -5.953 6.912 -8.876 1.00 0.00 C ATOM 523 NZ LYS A 455 -6.582 8.006 -9.649 1.00 0.00 N ATOM 0 H LYS A 455 -7.530 1.472 -7.288 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.724 2.146 -7.585 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -6.249 2.519 -9.399 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -7.292 3.505 -8.393 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -4.919 4.814 -8.005 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -4.639 4.177 -9.614 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -6.155 5.597 -10.573 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -7.346 5.326 -9.316 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.297 6.945 -7.842 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -4.872 7.047 -8.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -6.340 8.920 -9.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -6.234 7.983 -10.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -7.615 7.884 -9.645 1.00 0.00 H new ATOM 536 N MET A 456 -4.270 3.601 -5.712 1.00 0.00 N ATOM 537 CA MET A 456 -3.943 4.460 -4.587 1.00 0.00 C ATOM 538 C MET A 456 -4.562 5.849 -4.759 1.00 0.00 C ATOM 539 O MET A 456 -4.287 6.538 -5.740 1.00 0.00 O ATOM 540 CB MET A 456 -2.424 4.589 -4.468 1.00 0.00 C ATOM 541 CG MET A 456 -1.795 3.270 -4.015 1.00 0.00 C ATOM 542 SD MET A 456 -0.317 2.942 -4.961 1.00 0.00 S ATOM 543 CE MET A 456 0.718 2.242 -3.686 1.00 0.00 C ATOM 0 H MET A 456 -3.469 3.143 -6.146 1.00 0.00 H new ATOM 0 HA MET A 456 -4.350 4.011 -3.681 1.00 0.00 H new ATOM 0 HB2 MET A 456 -2.004 4.885 -5.429 1.00 0.00 H new ATOM 0 HB3 MET A 456 -2.177 5.377 -3.756 1.00 0.00 H new ATOM 0 HG2 MET A 456 -1.554 3.318 -2.953 1.00 0.00 H new ATOM 0 HG3 MET A 456 -2.507 2.455 -4.143 1.00 0.00 H new ATOM 0 HE1 MET A 456 1.763 2.464 -3.903 1.00 0.00 H new ATOM 0 HE2 MET A 456 0.449 2.672 -2.722 1.00 0.00 H new ATOM 0 HE3 MET A 456 0.575 1.162 -3.654 1.00 0.00 H new ATOM 553 N GLN A 457 -5.387 6.218 -3.790 1.00 0.00 N ATOM 554 CA GLN A 457 -6.048 7.512 -3.823 1.00 0.00 C ATOM 555 C GLN A 457 -5.014 8.632 -3.957 1.00 0.00 C ATOM 556 O GLN A 457 -3.811 8.379 -3.919 1.00 0.00 O ATOM 557 CB GLN A 457 -6.918 7.714 -2.581 1.00 0.00 C ATOM 558 CG GLN A 457 -7.797 6.489 -2.322 1.00 0.00 C ATOM 559 CD GLN A 457 -9.280 6.839 -2.459 1.00 0.00 C ATOM 560 OE1 GLN A 457 -9.757 7.843 -1.956 1.00 0.00 O ATOM 561 NE2 GLN A 457 -9.981 5.957 -3.166 1.00 0.00 N ATOM 0 H GLN A 457 -5.613 5.644 -2.978 1.00 0.00 H new ATOM 0 HA GLN A 457 -6.703 7.543 -4.694 1.00 0.00 H new ATOM 0 HB2 GLN A 457 -6.283 7.900 -1.715 1.00 0.00 H new ATOM 0 HB3 GLN A 457 -7.546 8.595 -2.712 1.00 0.00 H new ATOM 0 HG2 GLN A 457 -7.540 5.697 -3.026 1.00 0.00 H new ATOM 0 HG3 GLN A 457 -7.602 6.102 -1.322 1.00 0.00 H new ATOM 0 HE21 GLN A 457 -9.520 5.137 -3.560 1.00 0.00 H new ATOM 0 HE22 GLN A 457 -10.980 6.101 -3.314 1.00 0.00 H new ATOM 570 N ASP A 458 -5.522 9.847 -4.110 1.00 0.00 N ATOM 571 CA ASP A 458 -4.658 11.006 -4.250 1.00 0.00 C ATOM 572 C ASP A 458 -4.277 11.524 -2.861 1.00 0.00 C ATOM 573 O ASP A 458 -5.127 11.626 -1.979 1.00 0.00 O ATOM 574 CB ASP A 458 -5.369 12.136 -4.997 1.00 0.00 C ATOM 575 CG ASP A 458 -6.628 11.716 -5.758 1.00 0.00 C ATOM 576 OD1 ASP A 458 -6.702 10.606 -6.306 1.00 0.00 O ATOM 577 OD2 ASP A 458 -7.573 12.594 -5.776 1.00 0.00 O ATOM 0 H ASP A 458 -6.521 10.053 -4.140 1.00 0.00 H new ATOM 0 HA ASP A 458 -3.775 10.702 -4.812 1.00 0.00 H new ATOM 0 HB2 ASP A 458 -5.638 12.912 -4.280 1.00 0.00 H new ATOM 0 HB3 ASP A 458 -4.668 12.582 -5.702 1.00 0.00 H new ATOM 583 N ALA A 459 -2.998 11.836 -2.712 1.00 0.00 N ATOM 584 CA ALA A 459 -2.494 12.340 -1.445 1.00 0.00 C ATOM 585 C ALA A 459 -2.000 13.776 -1.633 1.00 0.00 C ATOM 586 O ALA A 459 -0.912 13.998 -2.163 1.00 0.00 O ATOM 587 CB ALA A 459 -1.397 11.409 -0.925 1.00 0.00 C ATOM 0 H ALA A 459 -2.296 11.750 -3.447 1.00 0.00 H new ATOM 0 HA ALA A 459 -3.286 12.359 -0.697 1.00 0.00 H new ATOM 0 HB1 ALA A 459 -1.019 11.787 0.025 1.00 0.00 H new ATOM 0 HB2 ALA A 459 -1.806 10.409 -0.781 1.00 0.00 H new ATOM 0 HB3 ALA A 459 -0.583 11.367 -1.648 1.00 0.00 H new ATOM 593 N GLU A 460 -2.823 14.714 -1.188 1.00 0.00 N ATOM 594 CA GLU A 460 -2.484 16.122 -1.301 1.00 0.00 C ATOM 595 C GLU A 460 -1.164 16.409 -0.582 1.00 0.00 C ATOM 596 O GLU A 460 -0.556 17.459 -0.788 1.00 0.00 O ATOM 597 CB GLU A 460 -3.609 17.003 -0.754 1.00 0.00 C ATOM 598 CG GLU A 460 -3.749 16.836 0.760 1.00 0.00 C ATOM 599 CD GLU A 460 -4.869 17.723 1.308 1.00 0.00 C ATOM 600 OE1 GLU A 460 -6.045 17.331 1.271 1.00 0.00 O ATOM 601 OE2 GLU A 460 -4.483 18.857 1.787 1.00 0.00 O ATOM 0 H GLU A 460 -3.724 14.526 -0.748 1.00 0.00 H new ATOM 0 HA GLU A 460 -2.360 16.362 -2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 460 -3.406 18.047 -0.991 1.00 0.00 H new ATOM 0 HB3 GLU A 460 -4.549 16.743 -1.241 1.00 0.00 H new ATOM 0 HG2 GLU A 460 -3.958 15.793 0.997 1.00 0.00 H new ATOM 0 HG3 GLU A 460 -2.807 17.091 1.246 1.00 0.00 H new ATOM 609 N ILE A 461 -0.760 15.458 0.247 1.00 0.00 N ATOM 610 CA ILE A 461 0.477 15.596 0.998 1.00 0.00 C ATOM 611 C ILE A 461 1.452 16.472 0.209 1.00 0.00 C ATOM 612 O ILE A 461 2.054 17.391 0.763 1.00 0.00 O ATOM 613 CB ILE A 461 1.040 14.220 1.360 1.00 0.00 C ATOM 614 CG1 ILE A 461 0.023 13.406 2.163 1.00 0.00 C ATOM 615 CG2 ILE A 461 2.377 14.350 2.092 1.00 0.00 C ATOM 616 CD1 ILE A 461 -0.817 14.313 3.064 1.00 0.00 C ATOM 0 H ILE A 461 -1.267 14.589 0.415 1.00 0.00 H new ATOM 0 HA ILE A 461 0.293 16.099 1.947 1.00 0.00 H new ATOM 0 HB ILE A 461 1.231 13.675 0.436 1.00 0.00 H new ATOM 0 HG12 ILE A 461 -0.629 12.859 1.482 1.00 0.00 H new ATOM 0 HG13 ILE A 461 0.543 12.665 2.770 1.00 0.00 H new ATOM 0 HG21 ILE A 461 2.755 13.358 2.338 1.00 0.00 H new ATOM 0 HG22 ILE A 461 3.094 14.863 1.451 1.00 0.00 H new ATOM 0 HG23 ILE A 461 2.236 14.922 3.009 1.00 0.00 H new ATOM 0 HD11 ILE A 461 -1.532 13.709 3.623 1.00 0.00 H new ATOM 0 HD12 ILE A 461 -0.164 14.840 3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 461 -1.355 15.037 2.452 1.00 0.00 H new ATOM 628 N SER A 462 1.579 16.156 -1.071 1.00 0.00 N ATOM 629 CA SER A 462 2.472 16.902 -1.941 1.00 0.00 C ATOM 630 C SER A 462 2.913 16.025 -3.115 1.00 0.00 C ATOM 631 O SER A 462 4.089 16.006 -3.473 1.00 0.00 O ATOM 632 CB SER A 462 3.692 17.411 -1.172 1.00 0.00 C ATOM 633 OG SER A 462 3.480 18.715 -0.636 1.00 0.00 O ATOM 0 H SER A 462 1.078 15.393 -1.527 1.00 0.00 H new ATOM 0 HA SER A 462 1.931 17.767 -2.325 1.00 0.00 H new ATOM 0 HB2 SER A 462 3.924 16.720 -0.362 1.00 0.00 H new ATOM 0 HB3 SER A 462 4.557 17.428 -1.835 1.00 0.00 H new ATOM 0 HG SER A 462 2.945 18.649 0.182 1.00 0.00 H new ATOM 639 N GLY A 463 1.944 15.321 -3.682 1.00 0.00 N ATOM 640 CA GLY A 463 2.218 14.444 -4.808 1.00 0.00 C ATOM 641 C GLY A 463 2.418 13.000 -4.342 1.00 0.00 C ATOM 642 O GLY A 463 3.372 12.340 -4.749 1.00 0.00 O ATOM 0 H GLY A 463 0.969 15.340 -3.383 1.00 0.00 H new ATOM 0 HA2 GLY A 463 1.393 14.490 -5.518 1.00 0.00 H new ATOM 0 HA3 GLY A 463 3.110 14.787 -5.333 1.00 0.00 H new ATOM 646 N TYR A 464 1.502 12.553 -3.496 1.00 0.00 N ATOM 647 CA TYR A 464 1.566 11.200 -2.970 1.00 0.00 C ATOM 648 C TYR A 464 0.236 10.471 -3.168 1.00 0.00 C ATOM 649 O TYR A 464 -0.718 11.044 -3.694 1.00 0.00 O ATOM 650 CB TYR A 464 1.838 11.342 -1.471 1.00 0.00 C ATOM 651 CG TYR A 464 3.321 11.275 -1.099 1.00 0.00 C ATOM 652 CD1 TYR A 464 4.207 12.192 -1.626 1.00 0.00 C ATOM 653 CD2 TYR A 464 3.772 10.297 -0.235 1.00 0.00 C ATOM 654 CE1 TYR A 464 5.602 12.129 -1.275 1.00 0.00 C ATOM 655 CE2 TYR A 464 5.167 10.234 0.115 1.00 0.00 C ATOM 656 CZ TYR A 464 6.013 11.153 -0.422 1.00 0.00 C ATOM 657 OH TYR A 464 7.331 11.094 -0.091 1.00 0.00 O ATOM 0 H TYR A 464 0.711 13.104 -3.162 1.00 0.00 H new ATOM 0 HA TYR A 464 2.338 10.626 -3.482 1.00 0.00 H new ATOM 0 HB2 TYR A 464 1.430 12.292 -1.126 1.00 0.00 H new ATOM 0 HB3 TYR A 464 1.304 10.554 -0.939 1.00 0.00 H new ATOM 0 HD1 TYR A 464 3.854 12.957 -2.302 1.00 0.00 H new ATOM 0 HD2 TYR A 464 3.078 9.580 0.178 1.00 0.00 H new ATOM 0 HE1 TYR A 464 6.306 12.841 -1.680 1.00 0.00 H new ATOM 0 HE2 TYR A 464 5.533 9.474 0.789 1.00 0.00 H new ATOM 0 HH TYR A 464 7.480 10.348 0.527 1.00 0.00 H new ATOM 667 N ALA A 465 0.214 9.218 -2.736 1.00 0.00 N ATOM 668 CA ALA A 465 -0.984 8.405 -2.860 1.00 0.00 C ATOM 669 C ALA A 465 -1.396 7.899 -1.476 1.00 0.00 C ATOM 670 O ALA A 465 -0.545 7.648 -0.624 1.00 0.00 O ATOM 671 CB ALA A 465 -0.727 7.264 -3.846 1.00 0.00 C ATOM 0 H ALA A 465 1.006 8.746 -2.300 1.00 0.00 H new ATOM 0 HA ALA A 465 -1.811 8.996 -3.255 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -1.626 6.654 -3.939 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -0.466 7.677 -4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 465 0.094 6.647 -3.482 1.00 0.00 H new ATOM 677 N LYS A 466 -2.702 7.763 -1.296 1.00 0.00 N ATOM 678 CA LYS A 466 -3.237 7.291 -0.030 1.00 0.00 C ATOM 679 C LYS A 466 -4.203 6.134 -0.290 1.00 0.00 C ATOM 680 O LYS A 466 -4.919 6.130 -1.290 1.00 0.00 O ATOM 681 CB LYS A 466 -3.861 8.449 0.753 1.00 0.00 C ATOM 682 CG LYS A 466 -2.789 9.437 1.218 1.00 0.00 C ATOM 683 CD LYS A 466 -3.406 10.795 1.557 1.00 0.00 C ATOM 684 CE LYS A 466 -4.315 10.693 2.784 1.00 0.00 C ATOM 685 NZ LYS A 466 -5.033 11.968 3.005 1.00 0.00 N ATOM 0 H LYS A 466 -3.405 7.971 -2.005 1.00 0.00 H new ATOM 0 HA LYS A 466 -2.437 6.904 0.601 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -4.589 8.965 0.127 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -4.401 8.060 1.616 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -2.276 9.038 2.093 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -2.038 9.559 0.437 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -2.615 11.521 1.745 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -3.979 11.161 0.705 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -5.032 9.884 2.646 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -3.721 10.446 3.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -5.645 11.881 3.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -4.344 12.732 3.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -5.615 12.188 2.171 1.00 0.00 H new ATOM 698 N ILE A 467 -4.192 5.178 0.628 1.00 0.00 N ATOM 699 CA ILE A 467 -5.057 4.017 0.511 1.00 0.00 C ATOM 700 C ILE A 467 -5.378 3.482 1.908 1.00 0.00 C ATOM 701 O ILE A 467 -4.475 3.257 2.713 1.00 0.00 O ATOM 702 CB ILE A 467 -4.433 2.975 -0.419 1.00 0.00 C ATOM 703 CG1 ILE A 467 -5.449 2.482 -1.451 1.00 0.00 C ATOM 704 CG2 ILE A 467 -3.823 1.822 0.381 1.00 0.00 C ATOM 705 CD1 ILE A 467 -6.228 1.277 -0.921 1.00 0.00 C ATOM 0 H ILE A 467 -3.597 5.184 1.456 1.00 0.00 H new ATOM 0 HA ILE A 467 -6.005 4.294 0.050 1.00 0.00 H new ATOM 0 HB ILE A 467 -3.621 3.451 -0.969 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -6.141 3.287 -1.698 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -4.934 2.210 -2.372 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -3.386 1.095 -0.304 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -3.048 2.208 1.043 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -4.600 1.340 0.975 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -6.943 0.946 -1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -5.535 0.466 -0.698 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -6.761 1.559 -0.013 1.00 0.00 H new ATOM 717 N THR A 468 -6.666 3.293 2.154 1.00 0.00 N ATOM 718 CA THR A 468 -7.116 2.789 3.440 1.00 0.00 C ATOM 719 C THR A 468 -7.977 1.538 3.251 1.00 0.00 C ATOM 720 O THR A 468 -8.931 1.549 2.473 1.00 0.00 O ATOM 721 CB THR A 468 -7.843 3.923 4.164 1.00 0.00 C ATOM 722 OG1 THR A 468 -7.079 5.084 3.848 1.00 0.00 O ATOM 723 CG2 THR A 468 -7.737 3.810 5.686 1.00 0.00 C ATOM 0 H THR A 468 -7.412 3.480 1.484 1.00 0.00 H new ATOM 0 HA THR A 468 -6.275 2.476 4.058 1.00 0.00 H new ATOM 0 HB THR A 468 -8.893 3.924 3.873 1.00 0.00 H new ATOM 0 HG1 THR A 468 -7.482 5.868 4.277 1.00 0.00 H new ATOM 0 HG21 THR A 468 -8.270 4.640 6.150 1.00 0.00 H new ATOM 0 HG22 THR A 468 -8.177 2.868 6.012 1.00 0.00 H new ATOM 0 HG23 THR A 468 -6.688 3.842 5.981 1.00 0.00 H new ATOM 731 N VAL A 469 -7.611 0.491 3.975 1.00 0.00 N ATOM 732 CA VAL A 469 -8.337 -0.765 3.896 1.00 0.00 C ATOM 733 C VAL A 469 -8.604 -1.284 5.310 1.00 0.00 C ATOM 734 O VAL A 469 -7.716 -1.264 6.160 1.00 0.00 O ATOM 735 CB VAL A 469 -7.567 -1.762 3.028 1.00 0.00 C ATOM 736 CG1 VAL A 469 -8.499 -2.840 2.472 1.00 0.00 C ATOM 737 CG2 VAL A 469 -6.822 -1.045 1.900 1.00 0.00 C ATOM 0 H VAL A 469 -6.821 0.487 4.620 1.00 0.00 H new ATOM 0 HA VAL A 469 -9.304 -0.617 3.416 1.00 0.00 H new ATOM 0 HB VAL A 469 -6.827 -2.254 3.659 1.00 0.00 H new ATOM 0 HG11 VAL A 469 -7.926 -3.535 1.859 1.00 0.00 H new ATOM 0 HG12 VAL A 469 -8.963 -3.381 3.297 1.00 0.00 H new ATOM 0 HG13 VAL A 469 -9.273 -2.373 1.864 1.00 0.00 H new ATOM 0 HG21 VAL A 469 -6.283 -1.776 1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 469 -7.537 -0.514 1.272 1.00 0.00 H new ATOM 0 HG23 VAL A 469 -6.115 -0.333 2.326 1.00 0.00 H new ATOM 747 N ASP A 470 -9.831 -1.738 5.517 1.00 0.00 N ATOM 748 CA ASP A 470 -10.226 -2.262 6.814 1.00 0.00 C ATOM 749 C ASP A 470 -9.820 -3.733 6.910 1.00 0.00 C ATOM 750 O ASP A 470 -9.841 -4.453 5.913 1.00 0.00 O ATOM 751 CB ASP A 470 -11.742 -2.177 7.004 1.00 0.00 C ATOM 752 CG ASP A 470 -12.282 -2.913 8.231 1.00 0.00 C ATOM 753 OD1 ASP A 470 -12.482 -4.137 8.205 1.00 0.00 O ATOM 754 OD2 ASP A 470 -12.504 -2.168 9.261 1.00 0.00 O ATOM 0 H ASP A 470 -10.565 -1.754 4.809 1.00 0.00 H new ATOM 0 HA ASP A 470 -9.732 -1.667 7.582 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -12.026 -1.127 7.075 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -12.228 -2.579 6.115 1.00 0.00 H new ATOM 760 N ILE A 471 -9.458 -4.137 8.120 1.00 0.00 N ATOM 761 CA ILE A 471 -9.047 -5.509 8.359 1.00 0.00 C ATOM 762 C ILE A 471 -9.992 -6.150 9.377 1.00 0.00 C ATOM 763 O ILE A 471 -9.939 -7.358 9.604 1.00 0.00 O ATOM 764 CB ILE A 471 -7.574 -5.563 8.768 1.00 0.00 C ATOM 765 CG1 ILE A 471 -7.357 -4.894 10.127 1.00 0.00 C ATOM 766 CG2 ILE A 471 -6.680 -4.959 7.683 1.00 0.00 C ATOM 767 CD1 ILE A 471 -5.868 -4.826 10.474 1.00 0.00 C ATOM 0 H ILE A 471 -9.441 -3.537 8.945 1.00 0.00 H new ATOM 0 HA ILE A 471 -9.121 -6.094 7.442 1.00 0.00 H new ATOM 0 HB ILE A 471 -7.288 -6.609 8.875 1.00 0.00 H new ATOM 0 HG12 ILE A 471 -7.777 -3.888 10.112 1.00 0.00 H new ATOM 0 HG13 ILE A 471 -7.889 -5.450 10.899 1.00 0.00 H new ATOM 0 HG21 ILE A 471 -5.638 -5.010 8.000 1.00 0.00 H new ATOM 0 HG22 ILE A 471 -6.805 -5.518 6.756 1.00 0.00 H new ATOM 0 HG23 ILE A 471 -6.959 -3.918 7.520 1.00 0.00 H new ATOM 0 HD11 ILE A 471 -5.742 -4.346 11.445 1.00 0.00 H new ATOM 0 HD12 ILE A 471 -5.457 -5.835 10.512 1.00 0.00 H new ATOM 0 HD13 ILE A 471 -5.343 -4.249 9.713 1.00 0.00 H new ATOM 779 N GLY A 472 -10.835 -5.313 9.964 1.00 0.00 N ATOM 780 CA GLY A 472 -11.790 -5.783 10.953 1.00 0.00 C ATOM 781 C GLY A 472 -11.706 -7.301 11.118 1.00 0.00 C ATOM 782 O GLY A 472 -12.124 -8.049 10.235 1.00 0.00 O ATOM 0 H GLY A 472 -10.876 -4.312 9.773 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -11.596 -5.298 11.910 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -12.799 -5.502 10.652 1.00 0.00 H new ATOM 786 N SER A 473 -11.164 -7.712 12.255 1.00 0.00 N ATOM 787 CA SER A 473 -11.020 -9.128 12.546 1.00 0.00 C ATOM 788 C SER A 473 -9.580 -9.573 12.282 1.00 0.00 C ATOM 789 O SER A 473 -9.189 -10.678 12.656 1.00 0.00 O ATOM 790 CB SER A 473 -11.994 -9.964 11.714 1.00 0.00 C ATOM 791 OG SER A 473 -12.213 -11.252 12.282 1.00 0.00 O ATOM 0 H SER A 473 -10.819 -7.089 12.986 1.00 0.00 H new ATOM 0 HA SER A 473 -11.256 -9.286 13.598 1.00 0.00 H new ATOM 0 HB2 SER A 473 -12.945 -9.438 11.632 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.603 -10.076 10.703 1.00 0.00 H new ATOM 0 HG SER A 473 -11.367 -11.604 12.630 1.00 0.00 H new ATOM 797 N ALA A 474 -8.830 -8.690 11.640 1.00 0.00 N ATOM 798 CA ALA A 474 -7.442 -8.978 11.321 1.00 0.00 C ATOM 799 C ALA A 474 -6.535 -8.032 12.111 1.00 0.00 C ATOM 800 O ALA A 474 -6.806 -6.835 12.198 1.00 0.00 O ATOM 801 CB ALA A 474 -7.230 -8.863 9.810 1.00 0.00 C ATOM 0 H ALA A 474 -9.157 -7.774 11.332 1.00 0.00 H new ATOM 0 HA ALA A 474 -7.186 -9.998 11.609 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -6.189 -9.079 9.571 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -7.875 -9.576 9.297 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -7.475 -7.852 9.484 1.00 0.00 H new ATOM 807 N SER A 475 -5.477 -8.604 12.666 1.00 0.00 N ATOM 808 CA SER A 475 -4.528 -7.827 13.446 1.00 0.00 C ATOM 809 C SER A 475 -3.467 -7.220 12.526 1.00 0.00 C ATOM 810 O SER A 475 -2.683 -6.373 12.951 1.00 0.00 O ATOM 811 CB SER A 475 -3.867 -8.687 14.525 1.00 0.00 C ATOM 812 OG SER A 475 -2.453 -8.508 14.558 1.00 0.00 O ATOM 0 H SER A 475 -5.256 -9.597 12.591 1.00 0.00 H new ATOM 0 HA SER A 475 -5.071 -7.023 13.943 1.00 0.00 H new ATOM 0 HB2 SER A 475 -4.287 -8.434 15.498 1.00 0.00 H new ATOM 0 HB3 SER A 475 -4.095 -9.737 14.342 1.00 0.00 H new ATOM 0 HG SER A 475 -2.068 -9.073 15.261 1.00 0.00 H new ATOM 818 N GLN A 476 -3.476 -7.678 11.282 1.00 0.00 N ATOM 819 CA GLN A 476 -2.524 -7.191 10.299 1.00 0.00 C ATOM 820 C GLN A 476 -3.090 -7.354 8.886 1.00 0.00 C ATOM 821 O GLN A 476 -4.020 -8.130 8.672 1.00 0.00 O ATOM 822 CB GLN A 476 -1.179 -7.906 10.437 1.00 0.00 C ATOM 823 CG GLN A 476 -0.211 -7.093 11.299 1.00 0.00 C ATOM 824 CD GLN A 476 1.102 -7.849 11.510 1.00 0.00 C ATOM 825 OE1 GLN A 476 1.570 -8.034 12.621 1.00 0.00 O ATOM 826 NE2 GLN A 476 1.670 -8.273 10.384 1.00 0.00 N ATOM 0 H GLN A 476 -4.128 -8.381 10.933 1.00 0.00 H new ATOM 0 HA GLN A 476 -2.354 -6.130 10.481 1.00 0.00 H new ATOM 0 HB2 GLN A 476 -1.330 -8.889 10.882 1.00 0.00 H new ATOM 0 HB3 GLN A 476 -0.746 -8.066 9.450 1.00 0.00 H new ATOM 0 HG2 GLN A 476 -0.010 -6.134 10.821 1.00 0.00 H new ATOM 0 HG3 GLN A 476 -0.670 -6.878 12.264 1.00 0.00 H new ATOM 0 HE21 GLN A 476 1.225 -8.084 9.486 1.00 0.00 H new ATOM 0 HE22 GLN A 476 2.550 -8.787 10.419 1.00 0.00 H new ATOM 835 N LEU A 477 -2.504 -6.610 7.959 1.00 0.00 N ATOM 836 CA LEU A 477 -2.938 -6.662 6.574 1.00 0.00 C ATOM 837 C LEU A 477 -1.719 -6.549 5.657 1.00 0.00 C ATOM 838 O LEU A 477 -0.781 -5.811 5.954 1.00 0.00 O ATOM 839 CB LEU A 477 -4.008 -5.601 6.307 1.00 0.00 C ATOM 840 CG LEU A 477 -3.941 -4.908 4.944 1.00 0.00 C ATOM 841 CD1 LEU A 477 -5.171 -4.029 4.715 1.00 0.00 C ATOM 842 CD2 LEU A 477 -2.637 -4.121 4.793 1.00 0.00 C ATOM 0 H LEU A 477 -1.732 -5.968 8.140 1.00 0.00 H new ATOM 0 HA LEU A 477 -3.411 -7.620 6.360 1.00 0.00 H new ATOM 0 HB2 LEU A 477 -4.988 -6.068 6.407 1.00 0.00 H new ATOM 0 HB3 LEU A 477 -3.938 -4.839 7.083 1.00 0.00 H new ATOM 0 HG LEU A 477 -3.946 -5.675 4.170 1.00 0.00 H new ATOM 0 HD11 LEU A 477 -5.098 -3.548 3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 477 -6.070 -4.645 4.750 1.00 0.00 H new ATOM 0 HD13 LEU A 477 -5.223 -3.267 5.492 1.00 0.00 H new ATOM 0 HD21 LEU A 477 -2.614 -3.638 3.816 1.00 0.00 H new ATOM 0 HD22 LEU A 477 -2.577 -3.363 5.574 1.00 0.00 H new ATOM 0 HD23 LEU A 477 -1.789 -4.801 4.881 1.00 0.00 H new ATOM 854 N GLU A 478 -1.771 -7.293 4.562 1.00 0.00 N ATOM 855 CA GLU A 478 -0.681 -7.287 3.601 1.00 0.00 C ATOM 856 C GLU A 478 -1.015 -6.365 2.426 1.00 0.00 C ATOM 857 O GLU A 478 -2.112 -6.430 1.874 1.00 0.00 O ATOM 858 CB GLU A 478 -0.371 -8.704 3.114 1.00 0.00 C ATOM 859 CG GLU A 478 0.944 -9.212 3.707 1.00 0.00 C ATOM 860 CD GLU A 478 0.819 -10.672 4.147 1.00 0.00 C ATOM 861 OE1 GLU A 478 -0.300 -11.198 4.242 1.00 0.00 O ATOM 862 OE2 GLU A 478 1.938 -11.265 4.394 1.00 0.00 O ATOM 0 H GLU A 478 -2.551 -7.904 4.319 1.00 0.00 H new ATOM 0 HA GLU A 478 0.212 -6.905 4.096 1.00 0.00 H new ATOM 0 HB2 GLU A 478 -1.183 -9.375 3.394 1.00 0.00 H new ATOM 0 HB3 GLU A 478 -0.311 -8.713 2.026 1.00 0.00 H new ATOM 0 HG2 GLU A 478 1.740 -9.118 2.969 1.00 0.00 H new ATOM 0 HG3 GLU A 478 1.225 -8.594 4.560 1.00 0.00 H new ATOM 870 N ALA A 479 -0.049 -5.527 2.080 1.00 0.00 N ATOM 871 CA ALA A 479 -0.227 -4.592 0.982 1.00 0.00 C ATOM 872 C ALA A 479 0.885 -4.803 -0.047 1.00 0.00 C ATOM 873 O ALA A 479 1.918 -5.395 0.262 1.00 0.00 O ATOM 874 CB ALA A 479 -0.253 -3.163 1.527 1.00 0.00 C ATOM 0 H ALA A 479 0.860 -5.476 2.541 1.00 0.00 H new ATOM 0 HA ALA A 479 -1.179 -4.767 0.480 1.00 0.00 H new ATOM 0 HB1 ALA A 479 -0.386 -2.462 0.703 1.00 0.00 H new ATOM 0 HB2 ALA A 479 -1.078 -3.057 2.231 1.00 0.00 H new ATOM 0 HB3 ALA A 479 0.687 -2.950 2.036 1.00 0.00 H new ATOM 880 N ALA A 480 0.635 -4.309 -1.251 1.00 0.00 N ATOM 881 CA ALA A 480 1.603 -4.436 -2.328 1.00 0.00 C ATOM 882 C ALA A 480 1.510 -3.211 -3.239 1.00 0.00 C ATOM 883 O ALA A 480 0.477 -2.543 -3.284 1.00 0.00 O ATOM 884 CB ALA A 480 1.356 -5.744 -3.082 1.00 0.00 C ATOM 0 H ALA A 480 -0.224 -3.820 -1.505 1.00 0.00 H new ATOM 0 HA ALA A 480 2.617 -4.474 -1.931 1.00 0.00 H new ATOM 0 HB1 ALA A 480 2.081 -5.841 -3.890 1.00 0.00 H new ATOM 0 HB2 ALA A 480 1.462 -6.585 -2.397 1.00 0.00 H new ATOM 0 HB3 ALA A 480 0.348 -5.740 -3.497 1.00 0.00 H new ATOM 890 N PHE A 481 2.602 -2.952 -3.943 1.00 0.00 N ATOM 891 CA PHE A 481 2.657 -1.819 -4.850 1.00 0.00 C ATOM 892 C PHE A 481 2.687 -2.283 -6.307 1.00 0.00 C ATOM 893 O PHE A 481 3.215 -3.353 -6.611 1.00 0.00 O ATOM 894 CB PHE A 481 3.949 -1.061 -4.541 1.00 0.00 C ATOM 895 CG PHE A 481 4.286 0.034 -5.555 1.00 0.00 C ATOM 896 CD1 PHE A 481 3.307 0.857 -6.018 1.00 0.00 C ATOM 897 CD2 PHE A 481 5.564 0.184 -5.995 1.00 0.00 C ATOM 898 CE1 PHE A 481 3.620 1.874 -6.959 1.00 0.00 C ATOM 899 CE2 PHE A 481 5.877 1.200 -6.936 1.00 0.00 C ATOM 900 CZ PHE A 481 4.898 2.024 -7.398 1.00 0.00 C ATOM 0 H PHE A 481 3.456 -3.508 -3.903 1.00 0.00 H new ATOM 0 HA PHE A 481 1.776 -1.192 -4.715 1.00 0.00 H new ATOM 0 HB2 PHE A 481 3.867 -0.612 -3.551 1.00 0.00 H new ATOM 0 HB3 PHE A 481 4.774 -1.772 -4.501 1.00 0.00 H new ATOM 0 HD1 PHE A 481 2.292 0.737 -5.670 1.00 0.00 H new ATOM 0 HD2 PHE A 481 6.341 -0.470 -5.628 1.00 0.00 H new ATOM 0 HE1 PHE A 481 2.843 2.528 -7.326 1.00 0.00 H new ATOM 0 HE2 PHE A 481 6.892 1.319 -7.285 1.00 0.00 H new ATOM 0 HZ PHE A 481 5.136 2.797 -8.113 1.00 0.00 H new ATOM 910 N ASN A 482 2.116 -1.457 -7.171 1.00 0.00 N ATOM 911 CA ASN A 482 2.071 -1.770 -8.589 1.00 0.00 C ATOM 912 C ASN A 482 1.889 -0.478 -9.387 1.00 0.00 C ATOM 913 O ASN A 482 1.410 0.523 -8.855 1.00 0.00 O ATOM 914 CB ASN A 482 0.895 -2.694 -8.912 1.00 0.00 C ATOM 915 CG ASN A 482 0.417 -3.432 -7.660 1.00 0.00 C ATOM 916 OD1 ASN A 482 -0.177 -2.861 -6.760 1.00 0.00 O ATOM 917 ND2 ASN A 482 0.708 -4.730 -7.652 1.00 0.00 N ATOM 0 H ASN A 482 1.680 -0.571 -6.916 1.00 0.00 H new ATOM 0 HA ASN A 482 3.004 -2.267 -8.854 1.00 0.00 H new ATOM 0 HB2 ASN A 482 0.074 -2.111 -9.330 1.00 0.00 H new ATOM 0 HB3 ASN A 482 1.193 -3.416 -9.672 1.00 0.00 H new ATOM 0 HD21 ASN A 482 0.431 -5.310 -6.860 1.00 0.00 H new ATOM 0 HD22 ASN A 482 1.208 -5.145 -8.438 1.00 0.00 H new ATOM 924 N ASP A 483 2.282 -0.540 -10.651 1.00 0.00 N ATOM 925 CA ASP A 483 2.169 0.613 -11.527 1.00 0.00 C ATOM 926 C ASP A 483 1.519 0.186 -12.845 1.00 0.00 C ATOM 927 O ASP A 483 2.086 0.394 -13.917 1.00 0.00 O ATOM 928 CB ASP A 483 3.546 1.199 -11.847 1.00 0.00 C ATOM 929 CG ASP A 483 4.664 0.168 -12.016 1.00 0.00 C ATOM 930 OD1 ASP A 483 5.224 0.007 -13.110 1.00 0.00 O ATOM 931 OD2 ASP A 483 4.958 -0.496 -10.949 1.00 0.00 O ATOM 0 H ASP A 483 2.679 -1.371 -11.089 1.00 0.00 H new ATOM 0 HA ASP A 483 1.566 1.365 -11.018 1.00 0.00 H new ATOM 0 HB2 ASP A 483 3.471 1.785 -12.763 1.00 0.00 H new ATOM 0 HB3 ASP A 483 3.825 1.888 -11.050 1.00 0.00 H new ATOM 937 N GLY A 484 0.339 -0.404 -12.722 1.00 0.00 N ATOM 938 CA GLY A 484 -0.394 -0.863 -13.889 1.00 0.00 C ATOM 939 C GLY A 484 -1.004 -2.245 -13.645 1.00 0.00 C ATOM 940 O GLY A 484 -2.220 -2.376 -13.515 1.00 0.00 O ATOM 0 H GLY A 484 -0.128 -0.575 -11.831 1.00 0.00 H new ATOM 0 HA2 GLY A 484 -1.183 -0.151 -14.131 1.00 0.00 H new ATOM 0 HA3 GLY A 484 0.274 -0.903 -14.750 1.00 0.00 H new ATOM 944 N ASN A 485 -0.132 -3.241 -13.591 1.00 0.00 N ATOM 945 CA ASN A 485 -0.570 -4.608 -13.366 1.00 0.00 C ATOM 946 C ASN A 485 0.646 -5.536 -13.374 1.00 0.00 C ATOM 947 O ASN A 485 1.013 -6.093 -12.340 1.00 0.00 O ATOM 948 CB ASN A 485 -1.525 -5.069 -14.469 1.00 0.00 C ATOM 949 CG ASN A 485 -2.480 -6.146 -13.952 1.00 0.00 C ATOM 950 OD1 ASN A 485 -2.634 -7.208 -14.533 1.00 0.00 O ATOM 951 ND2 ASN A 485 -3.113 -5.814 -12.830 1.00 0.00 N ATOM 0 H ASN A 485 0.876 -3.129 -13.699 1.00 0.00 H new ATOM 0 HA ASN A 485 -1.085 -4.644 -12.406 1.00 0.00 H new ATOM 0 HB2 ASN A 485 -2.097 -4.218 -14.839 1.00 0.00 H new ATOM 0 HB3 ASN A 485 -0.953 -5.459 -15.311 1.00 0.00 H new ATOM 0 HD21 ASN A 485 -3.773 -6.465 -12.405 1.00 0.00 H new ATOM 0 HD22 ASN A 485 -2.938 -4.908 -12.395 1.00 0.00 H new ATOM 958 N ASN A 486 1.237 -5.675 -14.552 1.00 0.00 N ATOM 959 CA ASN A 486 2.404 -6.527 -14.708 1.00 0.00 C ATOM 960 C ASN A 486 3.540 -5.993 -13.834 1.00 0.00 C ATOM 961 O ASN A 486 4.462 -6.730 -13.489 1.00 0.00 O ATOM 962 CB ASN A 486 2.888 -6.537 -16.159 1.00 0.00 C ATOM 963 CG ASN A 486 2.669 -7.909 -16.800 1.00 0.00 C ATOM 964 OD1 ASN A 486 3.050 -8.939 -16.269 1.00 0.00 O ATOM 965 ND2 ASN A 486 2.035 -7.865 -17.969 1.00 0.00 N ATOM 0 H ASN A 486 0.930 -5.212 -15.407 1.00 0.00 H new ATOM 0 HA ASN A 486 2.125 -7.539 -14.414 1.00 0.00 H new ATOM 0 HB2 ASN A 486 2.355 -5.776 -16.729 1.00 0.00 H new ATOM 0 HB3 ASN A 486 3.947 -6.280 -16.195 1.00 0.00 H new ATOM 0 HD21 ASN A 486 1.841 -8.728 -18.477 1.00 0.00 H new ATOM 0 HD22 ASN A 486 1.743 -6.968 -18.357 1.00 0.00 H new ATOM 972 N ASN A 487 3.437 -4.714 -13.501 1.00 0.00 N ATOM 973 CA ASN A 487 4.446 -4.073 -12.675 1.00 0.00 C ATOM 974 C ASN A 487 4.052 -4.205 -11.202 1.00 0.00 C ATOM 975 O ASN A 487 3.251 -3.420 -10.697 1.00 0.00 O ATOM 976 CB ASN A 487 4.559 -2.582 -13.001 1.00 0.00 C ATOM 977 CG ASN A 487 4.009 -2.284 -14.397 1.00 0.00 C ATOM 978 OD1 ASN A 487 4.710 -2.338 -15.394 1.00 0.00 O ATOM 979 ND2 ASN A 487 2.717 -1.966 -14.413 1.00 0.00 N ATOM 0 H ASN A 487 2.671 -4.105 -13.788 1.00 0.00 H new ATOM 0 HA ASN A 487 5.401 -4.559 -12.872 1.00 0.00 H new ATOM 0 HB2 ASN A 487 4.012 -2.001 -12.259 1.00 0.00 H new ATOM 0 HB3 ASN A 487 5.602 -2.271 -12.943 1.00 0.00 H new ATOM 0 HD21 ASN A 487 2.256 -1.749 -15.297 1.00 0.00 H new ATOM 0 HD22 ASN A 487 2.188 -1.939 -13.542 1.00 0.00 H new ATOM 986 N TRP A 488 4.633 -5.205 -10.555 1.00 0.00 N ATOM 987 CA TRP A 488 4.352 -5.450 -9.150 1.00 0.00 C ATOM 988 C TRP A 488 5.531 -4.918 -8.333 1.00 0.00 C ATOM 989 O TRP A 488 6.604 -4.662 -8.877 1.00 0.00 O ATOM 990 CB TRP A 488 4.072 -6.933 -8.899 1.00 0.00 C ATOM 991 CG TRP A 488 2.761 -7.431 -9.511 1.00 0.00 C ATOM 992 CD1 TRP A 488 2.488 -7.657 -10.804 1.00 0.00 C ATOM 993 CD2 TRP A 488 1.549 -7.758 -8.800 1.00 0.00 C ATOM 994 NE1 TRP A 488 1.194 -8.104 -10.977 1.00 0.00 N ATOM 995 CE2 TRP A 488 0.605 -8.167 -9.719 1.00 0.00 C ATOM 996 CE3 TRP A 488 1.260 -7.711 -7.425 1.00 0.00 C ATOM 997 CZ2 TRP A 488 -0.691 -8.560 -9.364 1.00 0.00 C ATOM 998 CZ3 TRP A 488 -0.040 -8.106 -7.086 1.00 0.00 C ATOM 999 CH2 TRP A 488 -1.002 -8.520 -8.000 1.00 0.00 C ATOM 0 H TRP A 488 5.297 -5.855 -10.977 1.00 0.00 H new ATOM 0 HA TRP A 488 3.448 -4.926 -8.839 1.00 0.00 H new ATOM 0 HB2 TRP A 488 4.896 -7.521 -9.303 1.00 0.00 H new ATOM 0 HB3 TRP A 488 4.050 -7.111 -7.824 1.00 0.00 H new ATOM 0 HD1 TRP A 488 3.192 -7.508 -11.609 1.00 0.00 H new ATOM 0 HE1 TRP A 488 0.751 -8.344 -11.864 1.00 0.00 H new ATOM 0 HE3 TRP A 488 1.984 -7.395 -6.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 488 -1.412 -8.877 -10.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 488 -0.314 -8.088 -6.042 1.00 0.00 H new ATOM 0 HH2 TRP A 488 -1.985 -8.810 -7.659 1.00 0.00 H new ATOM 1010 N ASP A 489 5.291 -4.767 -7.038 1.00 0.00 N ATOM 1011 CA ASP A 489 6.319 -4.269 -6.140 1.00 0.00 C ATOM 1012 C ASP A 489 5.934 -4.601 -4.697 1.00 0.00 C ATOM 1013 O ASP A 489 5.467 -3.734 -3.960 1.00 0.00 O ATOM 1014 CB ASP A 489 6.461 -2.750 -6.254 1.00 0.00 C ATOM 1015 CG ASP A 489 7.364 -2.268 -7.392 1.00 0.00 C ATOM 1016 OD1 ASP A 489 8.546 -1.957 -7.182 1.00 0.00 O ATOM 1017 OD2 ASP A 489 6.799 -2.216 -8.551 1.00 0.00 O ATOM 0 H ASP A 489 4.400 -4.981 -6.590 1.00 0.00 H new ATOM 0 HA ASP A 489 7.263 -4.741 -6.413 1.00 0.00 H new ATOM 0 HB2 ASP A 489 5.470 -2.317 -6.388 1.00 0.00 H new ATOM 0 HB3 ASP A 489 6.852 -2.365 -5.312 1.00 0.00 H new ATOM 1023 N SER A 490 6.144 -5.859 -4.337 1.00 0.00 N ATOM 1024 CA SER A 490 5.824 -6.316 -2.995 1.00 0.00 C ATOM 1025 C SER A 490 7.023 -7.051 -2.393 1.00 0.00 C ATOM 1026 O SER A 490 7.499 -8.035 -2.957 1.00 0.00 O ATOM 1027 CB SER A 490 4.593 -7.225 -3.002 1.00 0.00 C ATOM 1028 OG SER A 490 4.026 -7.346 -4.304 1.00 0.00 O ATOM 0 H SER A 490 6.532 -6.576 -4.951 1.00 0.00 H new ATOM 0 HA SER A 490 5.595 -5.444 -2.382 1.00 0.00 H new ATOM 0 HB2 SER A 490 4.870 -8.213 -2.634 1.00 0.00 H new ATOM 0 HB3 SER A 490 3.845 -6.827 -2.316 1.00 0.00 H new ATOM 0 HG SER A 490 3.244 -7.935 -4.267 1.00 0.00 H new ATOM 1034 N ASN A 491 7.477 -6.544 -1.256 1.00 0.00 N ATOM 1035 CA ASN A 491 8.612 -7.140 -0.572 1.00 0.00 C ATOM 1036 C ASN A 491 9.597 -7.686 -1.607 1.00 0.00 C ATOM 1037 O ASN A 491 10.210 -8.731 -1.394 1.00 0.00 O ATOM 1038 CB ASN A 491 8.169 -8.302 0.320 1.00 0.00 C ATOM 1039 CG ASN A 491 9.129 -8.486 1.497 1.00 0.00 C ATOM 1040 OD1 ASN A 491 10.055 -9.280 1.458 1.00 0.00 O ATOM 1041 ND2 ASN A 491 8.858 -7.711 2.543 1.00 0.00 N ATOM 0 H ASN A 491 7.080 -5.727 -0.792 1.00 0.00 H new ATOM 0 HA ASN A 491 9.077 -6.370 0.044 1.00 0.00 H new ATOM 0 HB2 ASN A 491 7.162 -8.115 0.693 1.00 0.00 H new ATOM 0 HB3 ASN A 491 8.127 -9.220 -0.266 1.00 0.00 H new ATOM 0 HD21 ASN A 491 9.441 -7.760 3.379 1.00 0.00 H new ATOM 0 HD22 ASN A 491 8.067 -7.068 2.510 1.00 0.00 H new ATOM 1048 N ASN A 492 9.718 -6.956 -2.706 1.00 0.00 N ATOM 1049 CA ASN A 492 10.617 -7.355 -3.775 1.00 0.00 C ATOM 1050 C ASN A 492 9.880 -8.293 -4.732 1.00 0.00 C ATOM 1051 O ASN A 492 10.031 -8.190 -5.948 1.00 0.00 O ATOM 1052 CB ASN A 492 11.832 -8.102 -3.222 1.00 0.00 C ATOM 1053 CG ASN A 492 13.009 -8.032 -4.197 1.00 0.00 C ATOM 1054 OD1 ASN A 492 12.872 -8.234 -5.392 1.00 0.00 O ATOM 1055 ND2 ASN A 492 14.171 -7.734 -3.622 1.00 0.00 N ATOM 0 H ASN A 492 9.208 -6.090 -2.879 1.00 0.00 H new ATOM 0 HA ASN A 492 10.951 -6.454 -4.289 1.00 0.00 H new ATOM 0 HB2 ASN A 492 12.123 -7.672 -2.264 1.00 0.00 H new ATOM 0 HB3 ASN A 492 11.570 -9.144 -3.037 1.00 0.00 H new ATOM 0 HD21 ASN A 492 15.017 -7.663 -4.188 1.00 0.00 H new ATOM 0 HD22 ASN A 492 14.216 -7.577 -2.615 1.00 0.00 H new ATOM 1062 N THR A 493 9.098 -9.189 -4.147 1.00 0.00 N ATOM 1063 CA THR A 493 8.338 -10.146 -4.932 1.00 0.00 C ATOM 1064 C THR A 493 7.611 -11.131 -4.015 1.00 0.00 C ATOM 1065 O THR A 493 7.516 -12.318 -4.324 1.00 0.00 O ATOM 1066 CB THR A 493 9.298 -10.823 -5.912 1.00 0.00 C ATOM 1067 OG1 THR A 493 8.553 -11.925 -6.423 1.00 0.00 O ATOM 1068 CG2 THR A 493 10.491 -11.473 -5.208 1.00 0.00 C ATOM 0 H THR A 493 8.975 -9.272 -3.138 1.00 0.00 H new ATOM 0 HA THR A 493 7.557 -9.652 -5.509 1.00 0.00 H new ATOM 0 HB THR A 493 9.658 -10.089 -6.633 1.00 0.00 H new ATOM 0 HG1 THR A 493 8.393 -12.573 -5.705 1.00 0.00 H new ATOM 0 HG21 THR A 493 11.141 -11.939 -5.949 1.00 0.00 H new ATOM 0 HG22 THR A 493 11.050 -10.713 -4.662 1.00 0.00 H new ATOM 0 HG23 THR A 493 10.133 -12.231 -4.511 1.00 0.00 H new ATOM 1076 N LYS A 494 7.117 -10.603 -2.905 1.00 0.00 N ATOM 1077 CA LYS A 494 6.402 -11.421 -1.940 1.00 0.00 C ATOM 1078 C LYS A 494 5.128 -10.694 -1.506 1.00 0.00 C ATOM 1079 O LYS A 494 4.029 -11.063 -1.916 1.00 0.00 O ATOM 1080 CB LYS A 494 7.320 -11.803 -0.777 1.00 0.00 C ATOM 1081 CG LYS A 494 8.774 -11.918 -1.240 1.00 0.00 C ATOM 1082 CD LYS A 494 9.589 -12.781 -0.276 1.00 0.00 C ATOM 1083 CE LYS A 494 9.463 -14.265 -0.628 1.00 0.00 C ATOM 1084 NZ LYS A 494 10.724 -14.978 -0.326 1.00 0.00 N ATOM 0 H LYS A 494 7.198 -9.618 -2.652 1.00 0.00 H new ATOM 0 HA LYS A 494 6.093 -12.363 -2.393 1.00 0.00 H new ATOM 0 HB2 LYS A 494 7.244 -11.055 0.012 1.00 0.00 H new ATOM 0 HB3 LYS A 494 6.995 -12.751 -0.349 1.00 0.00 H new ATOM 0 HG2 LYS A 494 8.808 -12.352 -2.239 1.00 0.00 H new ATOM 0 HG3 LYS A 494 9.217 -10.925 -1.308 1.00 0.00 H new ATOM 0 HD2 LYS A 494 10.637 -12.483 -0.312 1.00 0.00 H new ATOM 0 HD3 LYS A 494 9.246 -12.615 0.745 1.00 0.00 H new ATOM 0 HE2 LYS A 494 8.643 -14.710 -0.065 1.00 0.00 H new ATOM 0 HE3 LYS A 494 9.220 -14.375 -1.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 10.621 -15.984 -0.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 11.499 -14.564 -0.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 10.939 -14.889 0.688 1.00 0.00 H new ATOM 1097 N ASN A 495 5.319 -9.675 -0.681 1.00 0.00 N ATOM 1098 CA ASN A 495 4.198 -8.893 -0.187 1.00 0.00 C ATOM 1099 C ASN A 495 4.575 -8.263 1.156 1.00 0.00 C ATOM 1100 O ASN A 495 5.330 -8.848 1.930 1.00 0.00 O ATOM 1101 CB ASN A 495 2.967 -9.774 0.034 1.00 0.00 C ATOM 1102 CG ASN A 495 3.311 -10.994 0.889 1.00 0.00 C ATOM 1103 OD1 ASN A 495 4.340 -11.630 0.724 1.00 0.00 O ATOM 1104 ND2 ASN A 495 2.397 -11.285 1.810 1.00 0.00 N ATOM 0 H ASN A 495 6.232 -9.373 -0.342 1.00 0.00 H new ATOM 0 HA ASN A 495 3.966 -8.129 -0.929 1.00 0.00 H new ATOM 0 HB2 ASN A 495 2.183 -9.194 0.521 1.00 0.00 H new ATOM 0 HB3 ASN A 495 2.571 -10.100 -0.928 1.00 0.00 H new ATOM 0 HD21 ASN A 495 2.535 -12.082 2.432 1.00 0.00 H new ATOM 0 HD22 ASN A 495 1.558 -10.711 1.895 1.00 0.00 H new ATOM 1111 N TYR A 496 4.032 -7.077 1.390 1.00 0.00 N ATOM 1112 CA TYR A 496 4.302 -6.361 2.625 1.00 0.00 C ATOM 1113 C TYR A 496 3.208 -6.624 3.661 1.00 0.00 C ATOM 1114 O TYR A 496 2.079 -6.959 3.306 1.00 0.00 O ATOM 1115 CB TYR A 496 4.296 -4.875 2.260 1.00 0.00 C ATOM 1116 CG TYR A 496 5.511 -4.430 1.443 1.00 0.00 C ATOM 1117 CD1 TYR A 496 6.784 -4.753 1.868 1.00 0.00 C ATOM 1118 CD2 TYR A 496 5.334 -3.705 0.283 1.00 0.00 C ATOM 1119 CE1 TYR A 496 7.927 -4.335 1.099 1.00 0.00 C ATOM 1120 CE2 TYR A 496 6.477 -3.286 -0.486 1.00 0.00 C ATOM 1121 CZ TYR A 496 7.717 -3.622 -0.040 1.00 0.00 C ATOM 1122 OH TYR A 496 8.797 -3.226 -0.767 1.00 0.00 O ATOM 0 H TYR A 496 3.406 -6.594 0.745 1.00 0.00 H new ATOM 0 HA TYR A 496 5.250 -6.682 3.056 1.00 0.00 H new ATOM 0 HB2 TYR A 496 3.390 -4.654 1.695 1.00 0.00 H new ATOM 0 HB3 TYR A 496 4.252 -4.286 3.176 1.00 0.00 H new ATOM 0 HD1 TYR A 496 6.922 -5.319 2.777 1.00 0.00 H new ATOM 0 HD2 TYR A 496 4.338 -3.452 -0.049 1.00 0.00 H new ATOM 0 HE1 TYR A 496 8.928 -4.582 1.419 1.00 0.00 H new ATOM 0 HE2 TYR A 496 6.352 -2.718 -1.396 1.00 0.00 H new ATOM 0 HH TYR A 496 8.505 -2.943 -1.659 1.00 0.00 H new ATOM 1132 N SER A 497 3.580 -6.461 4.922 1.00 0.00 N ATOM 1133 CA SER A 497 2.645 -6.677 6.013 1.00 0.00 C ATOM 1134 C SER A 497 2.651 -5.471 6.955 1.00 0.00 C ATOM 1135 O SER A 497 3.714 -4.983 7.337 1.00 0.00 O ATOM 1136 CB SER A 497 2.983 -7.954 6.784 1.00 0.00 C ATOM 1137 OG SER A 497 4.055 -8.673 6.181 1.00 0.00 O ATOM 0 H SER A 497 4.517 -6.182 5.213 1.00 0.00 H new ATOM 0 HA SER A 497 1.648 -6.794 5.589 1.00 0.00 H new ATOM 0 HB2 SER A 497 3.249 -7.699 7.810 1.00 0.00 H new ATOM 0 HB3 SER A 497 2.101 -8.592 6.833 1.00 0.00 H new ATOM 0 HG SER A 497 4.242 -9.481 6.703 1.00 0.00 H new ATOM 1143 N PHE A 498 1.453 -5.024 7.301 1.00 0.00 N ATOM 1144 CA PHE A 498 1.307 -3.885 8.191 1.00 0.00 C ATOM 1145 C PHE A 498 0.230 -4.146 9.245 1.00 0.00 C ATOM 1146 O PHE A 498 -0.708 -4.905 9.005 1.00 0.00 O ATOM 1147 CB PHE A 498 0.881 -2.695 7.327 1.00 0.00 C ATOM 1148 CG PHE A 498 1.727 -2.507 6.066 1.00 0.00 C ATOM 1149 CD1 PHE A 498 3.082 -2.601 6.135 1.00 0.00 C ATOM 1150 CD2 PHE A 498 1.123 -2.247 4.875 1.00 0.00 C ATOM 1151 CE1 PHE A 498 3.866 -2.427 4.965 1.00 0.00 C ATOM 1152 CE2 PHE A 498 1.908 -2.073 3.705 1.00 0.00 C ATOM 1153 CZ PHE A 498 3.263 -2.166 3.774 1.00 0.00 C ATOM 0 H PHE A 498 0.574 -5.430 6.981 1.00 0.00 H new ATOM 0 HA PHE A 498 2.246 -3.696 8.711 1.00 0.00 H new ATOM 0 HB2 PHE A 498 -0.162 -2.825 7.037 1.00 0.00 H new ATOM 0 HB3 PHE A 498 0.934 -1.786 7.927 1.00 0.00 H new ATOM 0 HD1 PHE A 498 3.561 -2.808 7.080 1.00 0.00 H new ATOM 0 HD2 PHE A 498 0.047 -2.173 4.820 1.00 0.00 H new ATOM 0 HE1 PHE A 498 4.942 -2.502 5.020 1.00 0.00 H new ATOM 0 HE2 PHE A 498 1.429 -1.867 2.759 1.00 0.00 H new ATOM 0 HZ PHE A 498 3.860 -2.033 2.884 1.00 0.00 H new ATOM 1163 N SER A 499 0.400 -3.502 10.391 1.00 0.00 N ATOM 1164 CA SER A 499 -0.545 -3.656 11.483 1.00 0.00 C ATOM 1165 C SER A 499 -1.426 -2.410 11.592 1.00 0.00 C ATOM 1166 O SER A 499 -0.998 -1.311 11.244 1.00 0.00 O ATOM 1167 CB SER A 499 0.178 -3.912 12.807 1.00 0.00 C ATOM 1168 OG SER A 499 1.552 -3.539 12.744 1.00 0.00 O ATOM 0 H SER A 499 1.178 -2.873 10.586 1.00 0.00 H new ATOM 0 HA SER A 499 -1.174 -4.521 11.271 1.00 0.00 H new ATOM 0 HB2 SER A 499 -0.314 -3.353 13.603 1.00 0.00 H new ATOM 0 HB3 SER A 499 0.100 -4.968 13.065 1.00 0.00 H new ATOM 0 HG SER A 499 1.979 -3.716 13.608 1.00 0.00 H new ATOM 1174 N THR A 500 -2.640 -2.623 12.077 1.00 0.00 N ATOM 1175 CA THR A 500 -3.585 -1.530 12.236 1.00 0.00 C ATOM 1176 C THR A 500 -2.842 -0.207 12.432 1.00 0.00 C ATOM 1177 O THR A 500 -1.842 -0.152 13.146 1.00 0.00 O ATOM 1178 CB THR A 500 -4.520 -1.879 13.396 1.00 0.00 C ATOM 1179 OG1 THR A 500 -3.639 -2.172 14.477 1.00 0.00 O ATOM 1180 CG2 THR A 500 -5.276 -3.189 13.165 1.00 0.00 C ATOM 0 H THR A 500 -2.992 -3.536 12.365 1.00 0.00 H new ATOM 0 HA THR A 500 -4.191 -1.397 11.340 1.00 0.00 H new ATOM 0 HB THR A 500 -5.234 -1.069 13.542 1.00 0.00 H new ATOM 0 HG1 THR A 500 -4.163 -2.407 15.271 1.00 0.00 H new ATOM 0 HG21 THR A 500 -5.925 -3.390 14.017 1.00 0.00 H new ATOM 0 HG22 THR A 500 -5.879 -3.106 12.261 1.00 0.00 H new ATOM 0 HG23 THR A 500 -4.563 -4.006 13.052 1.00 0.00 H new ATOM 1188 N GLY A 501 -3.360 0.827 11.785 1.00 0.00 N ATOM 1189 CA GLY A 501 -2.758 2.146 11.878 1.00 0.00 C ATOM 1190 C GLY A 501 -2.471 2.718 10.488 1.00 0.00 C ATOM 1191 O GLY A 501 -3.203 2.445 9.538 1.00 0.00 O ATOM 0 H GLY A 501 -4.190 0.778 11.194 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -3.425 2.816 12.420 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -1.832 2.087 12.449 1.00 0.00 H new ATOM 1195 N THR A 502 -1.405 3.500 10.413 1.00 0.00 N ATOM 1196 CA THR A 502 -1.013 4.113 9.156 1.00 0.00 C ATOM 1197 C THR A 502 0.459 3.822 8.856 1.00 0.00 C ATOM 1198 O THR A 502 1.299 3.870 9.753 1.00 0.00 O ATOM 1199 CB THR A 502 -1.333 5.607 9.238 1.00 0.00 C ATOM 1200 OG1 THR A 502 -2.625 5.653 9.837 1.00 0.00 O ATOM 1201 CG2 THR A 502 -1.539 6.238 7.859 1.00 0.00 C ATOM 0 H THR A 502 -0.800 3.723 11.203 1.00 0.00 H new ATOM 0 HA THR A 502 -1.571 3.692 8.320 1.00 0.00 H new ATOM 0 HB THR A 502 -0.525 6.123 9.757 1.00 0.00 H new ATOM 0 HG1 THR A 502 -2.910 6.586 9.929 1.00 0.00 H new ATOM 0 HG21 THR A 502 -1.763 7.298 7.974 1.00 0.00 H new ATOM 0 HG22 THR A 502 -0.632 6.121 7.266 1.00 0.00 H new ATOM 0 HG23 THR A 502 -2.369 5.744 7.353 1.00 0.00 H new ATOM 1209 N SER A 503 0.725 3.528 7.592 1.00 0.00 N ATOM 1210 CA SER A 503 2.081 3.230 7.164 1.00 0.00 C ATOM 1211 C SER A 503 2.416 4.022 5.898 1.00 0.00 C ATOM 1212 O SER A 503 1.538 4.293 5.081 1.00 0.00 O ATOM 1213 CB SER A 503 2.263 1.731 6.915 1.00 0.00 C ATOM 1214 OG SER A 503 1.016 1.042 6.873 1.00 0.00 O ATOM 0 H SER A 503 0.025 3.490 6.851 1.00 0.00 H new ATOM 0 HA SER A 503 2.764 3.524 7.961 1.00 0.00 H new ATOM 0 HB2 SER A 503 2.792 1.581 5.974 1.00 0.00 H new ATOM 0 HB3 SER A 503 2.886 1.306 7.702 1.00 0.00 H new ATOM 0 HG SER A 503 1.173 0.092 6.691 1.00 0.00 H new ATOM 1220 N THR A 504 3.689 4.370 5.776 1.00 0.00 N ATOM 1221 CA THR A 504 4.151 5.126 4.624 1.00 0.00 C ATOM 1222 C THR A 504 5.047 4.256 3.740 1.00 0.00 C ATOM 1223 O THR A 504 5.880 3.504 4.244 1.00 0.00 O ATOM 1224 CB THR A 504 4.845 6.390 5.136 1.00 0.00 C ATOM 1225 OG1 THR A 504 3.770 7.260 5.482 1.00 0.00 O ATOM 1226 CG2 THR A 504 5.588 7.139 4.028 1.00 0.00 C ATOM 0 H THR A 504 4.415 4.142 6.456 1.00 0.00 H new ATOM 0 HA THR A 504 3.318 5.429 3.989 1.00 0.00 H new ATOM 0 HB THR A 504 5.545 6.124 5.928 1.00 0.00 H new ATOM 0 HG1 THR A 504 3.810 7.464 6.440 1.00 0.00 H new ATOM 0 HG21 THR A 504 6.063 8.028 4.444 1.00 0.00 H new ATOM 0 HG22 THR A 504 6.350 6.489 3.597 1.00 0.00 H new ATOM 0 HG23 THR A 504 4.882 7.435 3.252 1.00 0.00 H new ATOM 1234 N TYR A 505 4.846 4.387 2.438 1.00 0.00 N ATOM 1235 CA TYR A 505 5.625 3.623 1.479 1.00 0.00 C ATOM 1236 C TYR A 505 6.389 4.549 0.530 1.00 0.00 C ATOM 1237 O TYR A 505 5.798 5.431 -0.091 1.00 0.00 O ATOM 1238 CB TYR A 505 4.615 2.805 0.671 1.00 0.00 C ATOM 1239 CG TYR A 505 5.252 1.758 -0.245 1.00 0.00 C ATOM 1240 CD1 TYR A 505 6.088 0.796 0.284 1.00 0.00 C ATOM 1241 CD2 TYR A 505 4.991 1.777 -1.600 1.00 0.00 C ATOM 1242 CE1 TYR A 505 6.687 -0.190 -0.577 1.00 0.00 C ATOM 1243 CE2 TYR A 505 5.591 0.791 -2.462 1.00 0.00 C ATOM 1244 CZ TYR A 505 6.409 -0.144 -1.908 1.00 0.00 C ATOM 1245 OH TYR A 505 6.976 -1.074 -2.722 1.00 0.00 O ATOM 0 H TYR A 505 4.154 5.012 2.024 1.00 0.00 H new ATOM 0 HA TYR A 505 6.356 2.997 1.991 1.00 0.00 H new ATOM 0 HB2 TYR A 505 3.935 2.304 1.360 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.014 3.484 0.066 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.293 0.783 1.344 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.337 2.531 -2.014 1.00 0.00 H new ATOM 0 HE1 TYR A 505 7.342 -0.949 -0.176 1.00 0.00 H new ATOM 0 HE2 TYR A 505 5.396 0.794 -3.524 1.00 0.00 H new ATOM 0 HH TYR A 505 6.687 -0.920 -3.646 1.00 0.00 H new ATOM 1255 N THR A 506 7.690 4.316 0.448 1.00 0.00 N ATOM 1256 CA THR A 506 8.541 5.118 -0.414 1.00 0.00 C ATOM 1257 C THR A 506 9.469 4.219 -1.234 1.00 0.00 C ATOM 1258 O THR A 506 9.898 3.168 -0.761 1.00 0.00 O ATOM 1259 CB THR A 506 9.289 6.124 0.463 1.00 0.00 C ATOM 1260 OG1 THR A 506 8.312 7.116 0.764 1.00 0.00 O ATOM 1261 CG2 THR A 506 10.368 6.886 -0.309 1.00 0.00 C ATOM 0 H THR A 506 8.176 3.583 0.965 1.00 0.00 H new ATOM 0 HA THR A 506 7.952 5.675 -1.143 1.00 0.00 H new ATOM 0 HB THR A 506 9.745 5.603 1.305 1.00 0.00 H new ATOM 0 HG1 THR A 506 8.712 7.808 1.332 1.00 0.00 H new ATOM 0 HG21 THR A 506 10.868 7.586 0.360 1.00 0.00 H new ATOM 0 HG22 THR A 506 11.098 6.181 -0.707 1.00 0.00 H new ATOM 0 HG23 THR A 506 9.908 7.435 -1.131 1.00 0.00 H new ATOM 1269 N PRO A 507 9.758 4.678 -2.481 1.00 0.00 N ATOM 1270 CA PRO A 507 10.627 3.927 -3.371 1.00 0.00 C ATOM 1271 C PRO A 507 12.092 4.056 -2.947 1.00 0.00 C ATOM 1272 O PRO A 507 12.510 5.106 -2.461 1.00 0.00 O ATOM 1273 CB PRO A 507 10.358 4.495 -4.755 1.00 0.00 C ATOM 1274 CG PRO A 507 9.700 5.846 -4.531 1.00 0.00 C ATOM 1275 CD PRO A 507 9.268 5.918 -3.075 1.00 0.00 C ATOM 0 HA PRO A 507 10.427 2.856 -3.348 1.00 0.00 H new ATOM 0 HB2 PRO A 507 11.284 4.601 -5.320 1.00 0.00 H new ATOM 0 HB3 PRO A 507 9.708 3.834 -5.329 1.00 0.00 H new ATOM 0 HG2 PRO A 507 10.395 6.653 -4.763 1.00 0.00 H new ATOM 0 HG3 PRO A 507 8.841 5.966 -5.191 1.00 0.00 H new ATOM 0 HD2 PRO A 507 9.693 6.790 -2.578 1.00 0.00 H new ATOM 0 HD3 PRO A 507 8.185 5.998 -2.987 1.00 0.00 H new ATOM 1283 N GLY A 508 12.830 2.974 -3.145 1.00 0.00 N ATOM 1284 CA GLY A 508 14.238 2.954 -2.787 1.00 0.00 C ATOM 1285 C GLY A 508 15.111 3.365 -3.975 1.00 0.00 C ATOM 1286 O GLY A 508 14.856 4.385 -4.613 1.00 0.00 O ATOM 0 H GLY A 508 12.480 2.105 -3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 508 14.414 3.630 -1.950 1.00 0.00 H new ATOM 0 HA3 GLY A 508 14.518 1.955 -2.454 1.00 0.00 H new ATOM 1290 N ASN A 509 16.123 2.550 -4.235 1.00 0.00 N ATOM 1291 CA ASN A 509 17.035 2.816 -5.335 1.00 0.00 C ATOM 1292 C ASN A 509 18.291 1.960 -5.168 1.00 0.00 C ATOM 1293 O ASN A 509 19.298 2.425 -4.637 1.00 0.00 O ATOM 1294 CB ASN A 509 17.462 4.285 -5.352 1.00 0.00 C ATOM 1295 CG ASN A 509 17.060 4.958 -6.665 1.00 0.00 C ATOM 1296 OD1 ASN A 509 17.888 5.337 -7.478 1.00 0.00 O ATOM 1297 ND2 ASN A 509 15.746 5.086 -6.828 1.00 0.00 N ATOM 0 H ASN A 509 16.332 1.705 -3.703 1.00 0.00 H new ATOM 0 HA ASN A 509 16.520 2.579 -6.266 1.00 0.00 H new ATOM 0 HB2 ASN A 509 17.003 4.810 -4.515 1.00 0.00 H new ATOM 0 HB3 ASN A 509 18.542 4.355 -5.219 1.00 0.00 H new ATOM 0 HD21 ASN A 509 15.377 5.523 -7.673 1.00 0.00 H new ATOM 0 HD22 ASN A 509 15.107 4.747 -6.108 1.00 0.00 H new ATOM 1304 N SER A 510 18.191 0.723 -5.632 1.00 0.00 N ATOM 1305 CA SER A 510 19.307 -0.203 -5.541 1.00 0.00 C ATOM 1306 C SER A 510 19.579 -0.553 -4.076 1.00 0.00 C ATOM 1307 O SER A 510 19.115 -1.580 -3.584 1.00 0.00 O ATOM 1308 CB SER A 510 20.564 0.383 -6.188 1.00 0.00 C ATOM 1309 OG SER A 510 20.852 -0.227 -7.443 1.00 0.00 O ATOM 0 H SER A 510 17.354 0.340 -6.072 1.00 0.00 H new ATOM 0 HA SER A 510 19.042 -1.111 -6.082 1.00 0.00 H new ATOM 0 HB2 SER A 510 20.433 1.456 -6.328 1.00 0.00 H new ATOM 0 HB3 SER A 510 21.413 0.250 -5.517 1.00 0.00 H new ATOM 0 HG SER A 510 21.660 0.175 -7.825 1.00 0.00 H new ATOM 1315 N GLY A 511 20.329 0.322 -3.421 1.00 0.00 N ATOM 1316 CA GLY A 511 20.667 0.118 -2.023 1.00 0.00 C ATOM 1317 C GLY A 511 19.409 -0.095 -1.180 1.00 0.00 C ATOM 1318 O GLY A 511 19.466 -0.717 -0.120 1.00 0.00 O ATOM 0 H GLY A 511 20.712 1.173 -3.833 1.00 0.00 H new ATOM 0 HA2 GLY A 511 21.324 -0.746 -1.927 1.00 0.00 H new ATOM 0 HA3 GLY A 511 21.218 0.981 -1.649 1.00 0.00 H new ATOM 1322 N ASN A 512 18.302 0.433 -1.681 1.00 0.00 N ATOM 1323 CA ASN A 512 17.032 0.309 -0.987 1.00 0.00 C ATOM 1324 C ASN A 512 16.059 -0.496 -1.852 1.00 0.00 C ATOM 1325 O ASN A 512 16.269 -0.643 -3.055 1.00 0.00 O ATOM 1326 CB ASN A 512 16.410 1.682 -0.727 1.00 0.00 C ATOM 1327 CG ASN A 512 16.897 2.263 0.602 1.00 0.00 C ATOM 1328 OD1 ASN A 512 17.084 1.563 1.583 1.00 0.00 O ATOM 1329 ND2 ASN A 512 17.092 3.578 0.578 1.00 0.00 N ATOM 0 H ASN A 512 18.259 0.948 -2.560 1.00 0.00 H new ATOM 0 HA ASN A 512 17.215 -0.189 -0.035 1.00 0.00 H new ATOM 0 HB2 ASN A 512 16.666 2.361 -1.540 1.00 0.00 H new ATOM 0 HB3 ASN A 512 15.323 1.596 -0.714 1.00 0.00 H new ATOM 0 HD21 ASN A 512 17.418 4.061 1.415 1.00 0.00 H new ATOM 0 HD22 ASN A 512 16.916 4.104 -0.278 1.00 0.00 H new ATOM 1336 N ALA A 513 15.016 -0.994 -1.205 1.00 0.00 N ATOM 1337 CA ALA A 513 14.011 -1.780 -1.900 1.00 0.00 C ATOM 1338 C ALA A 513 12.658 -1.596 -1.208 1.00 0.00 C ATOM 1339 O ALA A 513 12.332 -2.323 -0.271 1.00 0.00 O ATOM 1340 CB ALA A 513 14.448 -3.245 -1.944 1.00 0.00 C ATOM 0 H ALA A 513 14.845 -0.869 -0.207 1.00 0.00 H new ATOM 0 HA ALA A 513 13.904 -1.441 -2.930 1.00 0.00 H new ATOM 0 HB1 ALA A 513 13.694 -3.834 -2.465 1.00 0.00 H new ATOM 0 HB2 ALA A 513 15.399 -3.325 -2.470 1.00 0.00 H new ATOM 0 HB3 ALA A 513 14.563 -3.621 -0.927 1.00 0.00 H new ATOM 1346 N GLY A 514 11.908 -0.620 -1.698 1.00 0.00 N ATOM 1347 CA GLY A 514 10.598 -0.331 -1.138 1.00 0.00 C ATOM 1348 C GLY A 514 10.673 -0.178 0.382 1.00 0.00 C ATOM 1349 O GLY A 514 10.683 -1.170 1.109 1.00 0.00 O ATOM 0 H GLY A 514 12.182 -0.020 -2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 514 10.203 0.584 -1.580 1.00 0.00 H new ATOM 0 HA3 GLY A 514 9.905 -1.133 -1.393 1.00 0.00 H new ATOM 1353 N THR A 515 10.723 1.072 0.818 1.00 0.00 N ATOM 1354 CA THR A 515 10.797 1.367 2.238 1.00 0.00 C ATOM 1355 C THR A 515 9.395 1.583 2.812 1.00 0.00 C ATOM 1356 O THR A 515 8.556 2.229 2.185 1.00 0.00 O ATOM 1357 CB THR A 515 11.721 2.573 2.423 1.00 0.00 C ATOM 1358 OG1 THR A 515 11.574 3.312 1.214 1.00 0.00 O ATOM 1359 CG2 THR A 515 13.199 2.179 2.443 1.00 0.00 C ATOM 0 H THR A 515 10.714 1.892 0.212 1.00 0.00 H new ATOM 0 HA THR A 515 11.217 0.529 2.794 1.00 0.00 H new ATOM 0 HB THR A 515 11.469 3.085 3.352 1.00 0.00 H new ATOM 0 HG1 THR A 515 10.622 3.395 0.995 1.00 0.00 H new ATOM 0 HG21 THR A 515 13.811 3.071 2.577 1.00 0.00 H new ATOM 0 HG22 THR A 515 13.380 1.488 3.266 1.00 0.00 H new ATOM 0 HG23 THR A 515 13.460 1.697 1.501 1.00 0.00 H new ATOM 1367 N ILE A 516 9.184 1.029 3.997 1.00 0.00 N ATOM 1368 CA ILE A 516 7.898 1.152 4.662 1.00 0.00 C ATOM 1369 C ILE A 516 8.102 1.762 6.050 1.00 0.00 C ATOM 1370 O ILE A 516 9.049 1.412 6.753 1.00 0.00 O ATOM 1371 CB ILE A 516 7.174 -0.196 4.683 1.00 0.00 C ATOM 1372 CG1 ILE A 516 7.307 -0.911 3.337 1.00 0.00 C ATOM 1373 CG2 ILE A 516 5.712 -0.027 5.101 1.00 0.00 C ATOM 1374 CD1 ILE A 516 7.463 -2.420 3.530 1.00 0.00 C ATOM 0 H ILE A 516 9.882 0.494 4.514 1.00 0.00 H new ATOM 0 HA ILE A 516 7.247 1.829 4.109 1.00 0.00 H new ATOM 0 HB ILE A 516 7.651 -0.828 5.432 1.00 0.00 H new ATOM 0 HG12 ILE A 516 6.428 -0.708 2.725 1.00 0.00 H new ATOM 0 HG13 ILE A 516 8.169 -0.519 2.797 1.00 0.00 H new ATOM 0 HG21 ILE A 516 5.221 -1.000 5.108 1.00 0.00 H new ATOM 0 HG22 ILE A 516 5.667 0.409 6.099 1.00 0.00 H new ATOM 0 HG23 ILE A 516 5.205 0.630 4.395 1.00 0.00 H new ATOM 0 HD11 ILE A 516 7.555 -2.904 2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 516 8.356 -2.621 4.121 1.00 0.00 H new ATOM 0 HD13 ILE A 516 6.589 -2.813 4.049 1.00 0.00 H new ATOM 1386 N THR A 517 7.199 2.664 6.404 1.00 0.00 N ATOM 1387 CA THR A 517 7.269 3.327 7.695 1.00 0.00 C ATOM 1388 C THR A 517 5.924 3.229 8.418 1.00 0.00 C ATOM 1389 O THR A 517 4.900 2.951 7.796 1.00 0.00 O ATOM 1390 CB THR A 517 7.731 4.767 7.464 1.00 0.00 C ATOM 1391 OG1 THR A 517 7.378 5.031 6.109 1.00 0.00 O ATOM 1392 CG2 THR A 517 9.255 4.903 7.484 1.00 0.00 C ATOM 0 H THR A 517 6.414 2.952 5.819 1.00 0.00 H new ATOM 0 HA THR A 517 7.992 2.841 8.350 1.00 0.00 H new ATOM 0 HB THR A 517 7.298 5.414 8.227 1.00 0.00 H new ATOM 0 HG1 THR A 517 7.640 5.946 5.875 1.00 0.00 H new ATOM 0 HG21 THR A 517 9.530 5.944 7.315 1.00 0.00 H new ATOM 0 HG22 THR A 517 9.636 4.579 8.452 1.00 0.00 H new ATOM 0 HG23 THR A 517 9.686 4.282 6.699 1.00 0.00 H new ATOM 1400 N SER A 518 5.970 3.464 9.721 1.00 0.00 N ATOM 1401 CA SER A 518 4.768 3.406 10.535 1.00 0.00 C ATOM 1402 C SER A 518 4.324 4.820 10.915 1.00 0.00 C ATOM 1403 O SER A 518 4.781 5.370 11.916 1.00 0.00 O ATOM 1404 CB SER A 518 4.995 2.565 11.793 1.00 0.00 C ATOM 1405 OG SER A 518 6.102 3.035 12.557 1.00 0.00 O ATOM 0 H SER A 518 6.821 3.695 10.233 1.00 0.00 H new ATOM 0 HA SER A 518 3.981 2.930 9.949 1.00 0.00 H new ATOM 0 HB2 SER A 518 4.096 2.584 12.409 1.00 0.00 H new ATOM 0 HB3 SER A 518 5.165 1.527 11.509 1.00 0.00 H new ATOM 0 HG SER A 518 6.013 4.000 12.703 1.00 0.00 H new ATOM 1411 N GLY A 519 3.440 5.368 10.096 1.00 0.00 N ATOM 1412 CA GLY A 519 2.929 6.708 10.333 1.00 0.00 C ATOM 1413 C GLY A 519 3.041 7.568 9.073 1.00 0.00 C ATOM 1414 O GLY A 519 4.097 7.620 8.444 1.00 0.00 O ATOM 0 H GLY A 519 3.064 4.909 9.267 1.00 0.00 H new ATOM 0 HA2 GLY A 519 1.887 6.653 10.649 1.00 0.00 H new ATOM 0 HA3 GLY A 519 3.485 7.174 11.147 1.00 0.00 H new ATOM 1418 N ALA A 520 1.938 8.223 8.742 1.00 0.00 N ATOM 1419 CA ALA A 520 1.899 9.079 7.568 1.00 0.00 C ATOM 1420 C ALA A 520 2.962 10.171 7.703 1.00 0.00 C ATOM 1421 O ALA A 520 3.371 10.511 8.812 1.00 0.00 O ATOM 1422 CB ALA A 520 0.491 9.653 7.401 1.00 0.00 C ATOM 0 H ALA A 520 1.064 8.178 9.266 1.00 0.00 H new ATOM 0 HA ALA A 520 2.126 8.507 6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 520 0.462 10.295 6.521 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -0.222 8.838 7.279 1.00 0.00 H new ATOM 0 HB3 ALA A 520 0.229 10.236 8.284 1.00 0.00 H new ATOM 1428 N PRO A 521 3.389 10.705 6.527 1.00 0.00 N ATOM 1429 CA PRO A 521 4.397 11.751 6.503 1.00 0.00 C ATOM 1430 C PRO A 521 3.803 13.093 6.937 1.00 0.00 C ATOM 1431 O PRO A 521 2.615 13.343 6.742 1.00 0.00 O ATOM 1432 CB PRO A 521 4.916 11.765 5.075 1.00 0.00 C ATOM 1433 CG PRO A 521 3.863 11.052 4.242 1.00 0.00 C ATOM 1434 CD PRO A 521 2.927 10.327 5.195 1.00 0.00 C ATOM 0 HA PRO A 521 5.210 11.569 7.206 1.00 0.00 H new ATOM 0 HB2 PRO A 521 5.066 12.786 4.724 1.00 0.00 H new ATOM 0 HB3 PRO A 521 5.879 11.259 5.004 1.00 0.00 H new ATOM 0 HG2 PRO A 521 3.309 11.767 3.633 1.00 0.00 H new ATOM 0 HG3 PRO A 521 4.332 10.346 3.557 1.00 0.00 H new ATOM 0 HD2 PRO A 521 1.891 10.625 5.036 1.00 0.00 H new ATOM 0 HD3 PRO A 521 2.974 9.248 5.051 1.00 0.00 H new ATOM 1442 N ALA A 522 4.659 13.923 7.516 1.00 0.00 N ATOM 1443 CA ALA A 522 4.234 15.233 7.979 1.00 0.00 C ATOM 1444 C ALA A 522 4.776 16.305 7.031 1.00 0.00 C ATOM 1445 O ALA A 522 5.433 17.249 7.467 1.00 0.00 O ATOM 1446 CB ALA A 522 4.700 15.441 9.422 1.00 0.00 C ATOM 0 H ALA A 522 5.645 13.713 7.675 1.00 0.00 H new ATOM 0 HA ALA A 522 3.147 15.308 7.974 1.00 0.00 H new ATOM 0 HB1 ALA A 522 4.381 16.424 9.769 1.00 0.00 H new ATOM 0 HB2 ALA A 522 4.264 14.672 10.060 1.00 0.00 H new ATOM 0 HB3 ALA A 522 5.787 15.376 9.466 1.00 0.00 H new ATOM 1452 N GLY A 523 4.480 16.122 5.753 1.00 0.00 N ATOM 1453 CA GLY A 523 4.930 17.062 4.739 1.00 0.00 C ATOM 1454 C GLY A 523 3.745 17.643 3.966 1.00 0.00 C ATOM 1455 O GLY A 523 2.595 17.301 4.236 1.00 0.00 O ATOM 0 H GLY A 523 3.935 15.338 5.396 1.00 0.00 H new ATOM 0 HA2 GLY A 523 5.492 17.868 5.210 1.00 0.00 H new ATOM 0 HA3 GLY A 523 5.609 16.561 4.049 1.00 0.00 H new TER 1459 GLY A 523