USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=33 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 150:sc= 0.333 USER MOD Set 1.2: A 505 TYR OH : rot 37:sc= -1.32! USER MOD Set 2.1: A 476 GLN :FLIP amide:sc= 0 F(o=-0.88,f=0.01) USER MOD Set 2.2: A 499 SER OG : rot 180:sc= 0.00998 USER MOD Set 3.1: A 427 THR OG1 : rot -117:sc= -1.81! USER MOD Set 3.2: A 468 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 464 TYR OH : rot 180:sc= -0.321 USER MOD Set 4.2: A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 422 THR OG1 : rot 27:sc= 1.06 USER MOD Single : A 424 ASN : amide:sc= -3.31! C(o=-3.3!,f=-3.3!) USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 429 TYR OH : rot 180:sc= -0.169 USER MOD Single : A 430 TYR OH : rot 68:sc= -2.11! USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 LYS NZ :NH3+ -121:sc= 1.22 (180deg=-0.578) USER MOD Single : A 435 ASN : amide:sc= -5! C(o=-5!,f=-16!) USER MOD Single : A 436 SER OG : rot 61:sc= 0.999 USER MOD Single : A 438 TYR OH : rot 180:sc= 0 USER MOD Single : A 440 HIS : no HD1:sc= -8.73! C(o=-8.7!,f=-14!) USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 447 SER OG : rot 180:sc= 0 USER MOD Single : A 449 THR OG1 : rot 174:sc= 0.0125 USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 MET CE :methyl -139:sc= -2.77 (180deg=-4.83) USER MOD Single : A 457 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 462 SER OG : rot 82:sc= 1.07 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 473 SER OG : rot 180:sc= 0 USER MOD Single : A 475 SER OG : rot 5:sc= 0.775! USER MOD Single : A 482 ASN : amide:sc= -3.8! C(o=-3.8!,f=-9.4!) USER MOD Single : A 485 ASN : amide:sc=-0.00472 X(o=-0.0047,f=0) USER MOD Single : A 486 ASN : amide:sc= -0.0965 X(o=-0.097,f=-0.024) USER MOD Single : A 487 ASN : amide:sc= 0.155 X(o=0.15,f=0) USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 491 ASN : amide:sc= 0.0176 K(o=0.018,f=-0.81) USER MOD Single : A 492 ASN : amide:sc=-0.00834 K(o=-0.0083,f=-0.57) USER MOD Single : A 493 THR OG1 : rot -65:sc= 1.19 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 495 ASN : amide:sc= -13.1! C(o=-13!,f=-14!) USER MOD Single : A 497 SER OG : rot 176:sc= 0 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 THR OG1 : rot 180:sc= -0.0238 USER MOD Single : A 503 SER OG : rot -81:sc= -1.45! USER MOD Single : A 504 THR OG1 : rot 59:sc= -1.83 USER MOD Single : A 509 ASN :FLIP amide:sc= -2.12! C(o=-3.2!,f=-2.1!) USER MOD Single : A 510 SER OG : rot 180:sc= 0 USER MOD Single : A 512 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.8!) USER MOD Single : A 515 THR OG1 : rot 47:sc= 0.3 USER MOD Single : A 517 THR OG1 : rot 180:sc= -0.661 USER MOD Single : A 518 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 420 -17.212 -5.456 8.995 1.00 0.00 N ATOM 2 CA GLY A 420 -18.495 -5.903 9.511 1.00 0.00 C ATOM 3 C GLY A 420 -18.689 -5.453 10.960 1.00 0.00 C ATOM 4 O GLY A 420 -19.031 -6.260 11.823 1.00 0.00 O ATOM 0 HA2 GLY A 420 -19.299 -5.505 8.892 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -18.556 -6.990 9.452 1.00 0.00 H new ATOM 8 N GLY A 421 -18.463 -4.167 11.183 1.00 0.00 N ATOM 9 CA GLY A 421 -18.609 -3.601 12.513 1.00 0.00 C ATOM 10 C GLY A 421 -17.271 -3.070 13.032 1.00 0.00 C ATOM 11 O GLY A 421 -16.234 -3.269 12.402 1.00 0.00 O ATOM 0 H GLY A 421 -18.180 -3.501 10.465 1.00 0.00 H new ATOM 0 HA2 GLY A 421 -19.341 -2.793 12.490 1.00 0.00 H new ATOM 0 HA3 GLY A 421 -18.993 -4.360 13.195 1.00 0.00 H new ATOM 15 N THR A 422 -17.339 -2.405 14.176 1.00 0.00 N ATOM 16 CA THR A 422 -16.146 -1.844 14.788 1.00 0.00 C ATOM 17 C THR A 422 -15.003 -2.860 14.756 1.00 0.00 C ATOM 18 O THR A 422 -15.000 -3.821 15.525 1.00 0.00 O ATOM 19 CB THR A 422 -16.511 -1.383 16.200 1.00 0.00 C ATOM 20 OG1 THR A 422 -16.871 -2.585 16.876 1.00 0.00 O ATOM 21 CG2 THR A 422 -17.789 -0.542 16.230 1.00 0.00 C ATOM 0 H THR A 422 -18.202 -2.242 14.695 1.00 0.00 H new ATOM 0 HA THR A 422 -15.785 -0.979 14.232 1.00 0.00 H new ATOM 0 HB THR A 422 -15.686 -0.805 16.617 1.00 0.00 H new ATOM 0 HG1 THR A 422 -16.404 -3.343 16.466 1.00 0.00 H new ATOM 0 HG21 THR A 422 -18.002 -0.241 17.256 1.00 0.00 H new ATOM 0 HG22 THR A 422 -17.655 0.346 15.612 1.00 0.00 H new ATOM 0 HG23 THR A 422 -18.621 -1.131 15.844 1.00 0.00 H new ATOM 29 N GLY A 423 -14.059 -2.613 13.860 1.00 0.00 N ATOM 30 CA GLY A 423 -12.912 -3.494 13.718 1.00 0.00 C ATOM 31 C GLY A 423 -11.603 -2.707 13.795 1.00 0.00 C ATOM 32 O GLY A 423 -11.449 -1.832 14.645 1.00 0.00 O ATOM 0 H GLY A 423 -14.065 -1.815 13.225 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -12.932 -4.251 14.502 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -12.969 -4.020 12.765 1.00 0.00 H new ATOM 36 N ASN A 424 -10.692 -3.047 12.894 1.00 0.00 N ATOM 37 CA ASN A 424 -9.400 -2.383 12.849 1.00 0.00 C ATOM 38 C ASN A 424 -9.262 -1.635 11.522 1.00 0.00 C ATOM 39 O ASN A 424 -9.958 -1.944 10.556 1.00 0.00 O ATOM 40 CB ASN A 424 -8.257 -3.396 12.942 1.00 0.00 C ATOM 41 CG ASN A 424 -7.804 -3.581 14.391 1.00 0.00 C ATOM 42 OD1 ASN A 424 -7.333 -2.664 15.044 1.00 0.00 O ATOM 43 ND2 ASN A 424 -7.972 -4.815 14.857 1.00 0.00 N ATOM 0 H ASN A 424 -10.823 -3.773 12.190 1.00 0.00 H new ATOM 0 HA ASN A 424 -9.344 -1.697 13.694 1.00 0.00 H new ATOM 0 HB2 ASN A 424 -8.581 -4.353 12.534 1.00 0.00 H new ATOM 0 HB3 ASN A 424 -7.417 -3.058 12.335 1.00 0.00 H new ATOM 0 HD21 ASN A 424 -7.701 -5.040 15.814 1.00 0.00 H new ATOM 0 HD22 ASN A 424 -8.372 -5.536 14.257 1.00 0.00 H new ATOM 50 N LYS A 425 -8.360 -0.664 11.518 1.00 0.00 N ATOM 51 CA LYS A 425 -8.123 0.131 10.325 1.00 0.00 C ATOM 52 C LYS A 425 -6.620 0.182 10.043 1.00 0.00 C ATOM 53 O LYS A 425 -5.818 0.354 10.959 1.00 0.00 O ATOM 54 CB LYS A 425 -8.770 1.511 10.464 1.00 0.00 C ATOM 55 CG LYS A 425 -10.290 1.421 10.317 1.00 0.00 C ATOM 56 CD LYS A 425 -10.691 1.279 8.848 1.00 0.00 C ATOM 57 CE LYS A 425 -11.464 2.510 8.369 1.00 0.00 C ATOM 58 NZ LYS A 425 -12.903 2.195 8.225 1.00 0.00 N ATOM 0 H LYS A 425 -7.785 -0.410 12.321 1.00 0.00 H new ATOM 0 HA LYS A 425 -8.595 -0.331 9.458 1.00 0.00 H new ATOM 0 HB2 LYS A 425 -8.520 1.938 11.435 1.00 0.00 H new ATOM 0 HB3 LYS A 425 -8.367 2.184 9.707 1.00 0.00 H new ATOM 0 HG2 LYS A 425 -10.664 0.568 10.884 1.00 0.00 H new ATOM 0 HG3 LYS A 425 -10.753 2.313 10.740 1.00 0.00 H new ATOM 0 HD2 LYS A 425 -9.800 1.144 8.235 1.00 0.00 H new ATOM 0 HD3 LYS A 425 -11.304 0.387 8.719 1.00 0.00 H new ATOM 0 HE2 LYS A 425 -11.334 3.327 9.078 1.00 0.00 H new ATOM 0 HE3 LYS A 425 -11.063 2.850 7.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 425 -13.413 3.041 7.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 425 -13.023 1.430 7.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 425 -13.286 1.892 9.143 1.00 0.00 H new ATOM 71 N VAL A 426 -6.284 0.031 8.770 1.00 0.00 N ATOM 72 CA VAL A 426 -4.892 0.057 8.355 1.00 0.00 C ATOM 73 C VAL A 426 -4.729 1.036 7.191 1.00 0.00 C ATOM 74 O VAL A 426 -5.259 0.808 6.104 1.00 0.00 O ATOM 75 CB VAL A 426 -4.420 -1.358 8.016 1.00 0.00 C ATOM 76 CG1 VAL A 426 -2.901 -1.402 7.837 1.00 0.00 C ATOM 77 CG2 VAL A 426 -4.875 -2.358 9.082 1.00 0.00 C ATOM 0 H VAL A 426 -6.952 -0.110 8.012 1.00 0.00 H new ATOM 0 HA VAL A 426 -4.258 0.411 9.168 1.00 0.00 H new ATOM 0 HB VAL A 426 -4.877 -1.645 7.069 1.00 0.00 H new ATOM 0 HG11 VAL A 426 -2.592 -2.419 7.597 1.00 0.00 H new ATOM 0 HG12 VAL A 426 -2.611 -0.734 7.026 1.00 0.00 H new ATOM 0 HG13 VAL A 426 -2.416 -1.084 8.760 1.00 0.00 H new ATOM 0 HG21 VAL A 426 -4.526 -3.356 8.817 1.00 0.00 H new ATOM 0 HG22 VAL A 426 -4.460 -2.073 10.049 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -5.963 -2.357 9.140 1.00 0.00 H new ATOM 87 N THR A 427 -3.994 2.106 7.457 1.00 0.00 N ATOM 88 CA THR A 427 -3.756 3.121 6.445 1.00 0.00 C ATOM 89 C THR A 427 -2.363 2.950 5.836 1.00 0.00 C ATOM 90 O THR A 427 -1.389 2.733 6.556 1.00 0.00 O ATOM 91 CB THR A 427 -3.974 4.491 7.089 1.00 0.00 C ATOM 92 OG1 THR A 427 -5.367 4.517 7.388 1.00 0.00 O ATOM 93 CG2 THR A 427 -3.783 5.641 6.098 1.00 0.00 C ATOM 0 H THR A 427 -3.555 2.292 8.359 1.00 0.00 H new ATOM 0 HA THR A 427 -4.454 3.022 5.614 1.00 0.00 H new ATOM 0 HB THR A 427 -3.284 4.613 7.924 1.00 0.00 H new ATOM 0 HG1 THR A 427 -5.798 5.234 6.877 1.00 0.00 H new ATOM 0 HG21 THR A 427 -3.949 6.591 6.606 1.00 0.00 H new ATOM 0 HG22 THR A 427 -2.768 5.615 5.701 1.00 0.00 H new ATOM 0 HG23 THR A 427 -4.495 5.538 5.279 1.00 0.00 H new ATOM 101 N ILE A 428 -2.312 3.055 4.516 1.00 0.00 N ATOM 102 CA ILE A 428 -1.054 2.914 3.802 1.00 0.00 C ATOM 103 C ILE A 428 -0.900 4.073 2.816 1.00 0.00 C ATOM 104 O ILE A 428 -1.749 4.272 1.949 1.00 0.00 O ATOM 105 CB ILE A 428 -0.961 1.534 3.148 1.00 0.00 C ATOM 106 CG1 ILE A 428 -0.432 0.493 4.138 1.00 0.00 C ATOM 107 CG2 ILE A 428 -0.121 1.588 1.870 1.00 0.00 C ATOM 108 CD1 ILE A 428 -1.551 -0.444 4.597 1.00 0.00 C ATOM 0 H ILE A 428 -3.121 3.236 3.922 1.00 0.00 H new ATOM 0 HA ILE A 428 -0.214 2.970 4.495 1.00 0.00 H new ATOM 0 HB ILE A 428 -1.966 1.224 2.860 1.00 0.00 H new ATOM 0 HG12 ILE A 428 0.364 -0.087 3.671 1.00 0.00 H new ATOM 0 HG13 ILE A 428 0.004 0.995 5.002 1.00 0.00 H new ATOM 0 HG21 ILE A 428 -0.071 0.594 1.425 1.00 0.00 H new ATOM 0 HG22 ILE A 428 -0.579 2.279 1.163 1.00 0.00 H new ATOM 0 HG23 ILE A 428 0.886 1.929 2.111 1.00 0.00 H new ATOM 0 HD11 ILE A 428 -1.149 -1.174 5.300 1.00 0.00 H new ATOM 0 HD12 ILE A 428 -2.334 0.136 5.085 1.00 0.00 H new ATOM 0 HD13 ILE A 428 -1.968 -0.963 3.734 1.00 0.00 H new ATOM 120 N TYR A 429 0.190 4.808 2.982 1.00 0.00 N ATOM 121 CA TYR A 429 0.466 5.943 2.117 1.00 0.00 C ATOM 122 C TYR A 429 1.707 5.690 1.259 1.00 0.00 C ATOM 123 O TYR A 429 2.827 5.680 1.769 1.00 0.00 O ATOM 124 CB TYR A 429 0.737 7.126 3.048 1.00 0.00 C ATOM 125 CG TYR A 429 -0.493 7.604 3.822 1.00 0.00 C ATOM 126 CD1 TYR A 429 -1.727 7.038 3.574 1.00 0.00 C ATOM 127 CD2 TYR A 429 -0.369 8.601 4.769 1.00 0.00 C ATOM 128 CE1 TYR A 429 -2.885 7.488 4.302 1.00 0.00 C ATOM 129 CE2 TYR A 429 -1.527 9.050 5.497 1.00 0.00 C ATOM 130 CZ TYR A 429 -2.728 8.472 5.228 1.00 0.00 C ATOM 131 OH TYR A 429 -3.822 8.896 5.916 1.00 0.00 O ATOM 0 H TYR A 429 0.892 4.640 3.702 1.00 0.00 H new ATOM 0 HA TYR A 429 -0.371 6.124 1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 429 1.514 6.845 3.759 1.00 0.00 H new ATOM 0 HB3 TYR A 429 1.128 7.956 2.460 1.00 0.00 H new ATOM 0 HD1 TYR A 429 -1.824 6.258 2.834 1.00 0.00 H new ATOM 0 HD2 TYR A 429 0.597 9.044 4.964 1.00 0.00 H new ATOM 0 HE1 TYR A 429 -3.856 7.054 4.117 1.00 0.00 H new ATOM 0 HE2 TYR A 429 -1.444 9.829 6.241 1.00 0.00 H new ATOM 0 HH TYR A 429 -3.560 9.601 6.544 1.00 0.00 H new ATOM 141 N TYR A 430 1.467 5.490 -0.028 1.00 0.00 N ATOM 142 CA TYR A 430 2.551 5.237 -0.961 1.00 0.00 C ATOM 143 C TYR A 430 2.787 6.445 -1.869 1.00 0.00 C ATOM 144 O TYR A 430 1.836 7.091 -2.309 1.00 0.00 O ATOM 145 CB TYR A 430 2.102 4.051 -1.818 1.00 0.00 C ATOM 146 CG TYR A 430 2.728 4.018 -3.213 1.00 0.00 C ATOM 147 CD1 TYR A 430 4.011 3.540 -3.383 1.00 0.00 C ATOM 148 CD2 TYR A 430 2.009 4.468 -4.302 1.00 0.00 C ATOM 149 CE1 TYR A 430 4.600 3.510 -4.697 1.00 0.00 C ATOM 150 CE2 TYR A 430 2.598 4.437 -5.616 1.00 0.00 C ATOM 151 CZ TYR A 430 3.865 3.960 -5.748 1.00 0.00 C ATOM 152 OH TYR A 430 4.421 3.932 -6.989 1.00 0.00 O ATOM 0 H TYR A 430 0.537 5.498 -0.447 1.00 0.00 H new ATOM 0 HA TYR A 430 3.479 5.039 -0.425 1.00 0.00 H new ATOM 0 HB2 TYR A 430 2.350 3.126 -1.298 1.00 0.00 H new ATOM 0 HB3 TYR A 430 1.017 4.079 -1.919 1.00 0.00 H new ATOM 0 HD1 TYR A 430 4.574 3.188 -2.531 1.00 0.00 H new ATOM 0 HD2 TYR A 430 1.005 4.843 -4.169 1.00 0.00 H new ATOM 0 HE1 TYR A 430 5.603 3.138 -4.844 1.00 0.00 H new ATOM 0 HE2 TYR A 430 2.046 4.785 -6.477 1.00 0.00 H new ATOM 0 HH TYR A 430 4.535 3.002 -7.275 1.00 0.00 H new ATOM 162 N LYS A 431 4.059 6.715 -2.124 1.00 0.00 N ATOM 163 CA LYS A 431 4.431 7.835 -2.971 1.00 0.00 C ATOM 164 C LYS A 431 3.895 7.600 -4.385 1.00 0.00 C ATOM 165 O LYS A 431 3.932 6.478 -4.888 1.00 0.00 O ATOM 166 CB LYS A 431 5.943 8.068 -2.917 1.00 0.00 C ATOM 167 CG LYS A 431 6.385 9.051 -4.003 1.00 0.00 C ATOM 168 CD LYS A 431 7.695 9.741 -3.618 1.00 0.00 C ATOM 169 CE LYS A 431 8.150 10.704 -4.716 1.00 0.00 C ATOM 170 NZ LYS A 431 9.290 10.132 -5.467 1.00 0.00 N ATOM 0 H LYS A 431 4.845 6.177 -1.759 1.00 0.00 H new ATOM 0 HA LYS A 431 3.976 8.756 -2.607 1.00 0.00 H new ATOM 0 HB2 LYS A 431 6.220 8.455 -1.936 1.00 0.00 H new ATOM 0 HB3 LYS A 431 6.466 7.120 -3.045 1.00 0.00 H new ATOM 0 HG2 LYS A 431 6.512 8.522 -4.947 1.00 0.00 H new ATOM 0 HG3 LYS A 431 5.608 9.799 -4.159 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.562 10.286 -2.683 1.00 0.00 H new ATOM 0 HD3 LYS A 431 8.467 8.992 -3.443 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.323 10.906 -5.397 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.439 11.658 -4.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 9.587 10.798 -6.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 10.084 9.962 -4.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 9.002 9.233 -5.904 1.00 0.00 H new ATOM 183 N LYS A 432 3.410 8.676 -4.985 1.00 0.00 N ATOM 184 CA LYS A 432 2.867 8.601 -6.331 1.00 0.00 C ATOM 185 C LYS A 432 3.960 8.963 -7.339 1.00 0.00 C ATOM 186 O LYS A 432 4.456 10.088 -7.345 1.00 0.00 O ATOM 187 CB LYS A 432 1.610 9.466 -6.451 1.00 0.00 C ATOM 188 CG LYS A 432 1.664 10.342 -7.704 1.00 0.00 C ATOM 189 CD LYS A 432 0.374 11.147 -7.866 1.00 0.00 C ATOM 190 CE LYS A 432 -0.852 10.289 -7.546 1.00 0.00 C ATOM 191 NZ LYS A 432 -2.039 10.789 -8.274 1.00 0.00 N ATOM 0 H LYS A 432 3.381 9.605 -4.564 1.00 0.00 H new ATOM 0 HA LYS A 432 2.549 7.583 -6.557 1.00 0.00 H new ATOM 0 HB2 LYS A 432 0.727 8.828 -6.487 1.00 0.00 H new ATOM 0 HB3 LYS A 432 1.512 10.096 -5.567 1.00 0.00 H new ATOM 0 HG2 LYS A 432 2.515 11.020 -7.641 1.00 0.00 H new ATOM 0 HG3 LYS A 432 1.819 9.716 -8.583 1.00 0.00 H new ATOM 0 HD2 LYS A 432 0.397 12.015 -7.206 1.00 0.00 H new ATOM 0 HD3 LYS A 432 0.302 11.524 -8.886 1.00 0.00 H new ATOM 0 HE2 LYS A 432 -0.659 9.252 -7.821 1.00 0.00 H new ATOM 0 HE3 LYS A 432 -1.043 10.304 -6.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 -2.782 11.045 -7.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 -1.777 11.627 -8.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 -2.394 10.047 -8.911 1.00 0.00 H new ATOM 204 N GLY A 433 4.304 7.987 -8.166 1.00 0.00 N ATOM 205 CA GLY A 433 5.329 8.188 -9.175 1.00 0.00 C ATOM 206 C GLY A 433 4.767 7.966 -10.581 1.00 0.00 C ATOM 207 O GLY A 433 5.460 8.186 -11.573 1.00 0.00 O ATOM 0 H GLY A 433 3.891 7.055 -8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 433 5.729 9.199 -9.095 1.00 0.00 H new ATOM 0 HA3 GLY A 433 6.157 7.502 -8.998 1.00 0.00 H new ATOM 211 N PHE A 434 3.515 7.532 -10.621 1.00 0.00 N ATOM 212 CA PHE A 434 2.852 7.278 -11.888 1.00 0.00 C ATOM 213 C PHE A 434 1.676 8.235 -12.093 1.00 0.00 C ATOM 214 O PHE A 434 1.693 9.059 -13.007 1.00 0.00 O ATOM 215 CB PHE A 434 2.323 5.843 -11.836 1.00 0.00 C ATOM 216 CG PHE A 434 3.084 4.866 -12.734 1.00 0.00 C ATOM 217 CD1 PHE A 434 4.274 4.351 -12.325 1.00 0.00 C ATOM 218 CD2 PHE A 434 2.570 4.513 -13.943 1.00 0.00 C ATOM 219 CE1 PHE A 434 4.980 3.444 -13.159 1.00 0.00 C ATOM 220 CE2 PHE A 434 3.276 3.607 -14.777 1.00 0.00 C ATOM 221 CZ PHE A 434 4.466 3.092 -14.368 1.00 0.00 C ATOM 0 H PHE A 434 2.943 7.350 -9.796 1.00 0.00 H new ATOM 0 HA PHE A 434 3.552 7.424 -12.710 1.00 0.00 H new ATOM 0 HB2 PHE A 434 2.370 5.487 -10.807 1.00 0.00 H new ATOM 0 HB3 PHE A 434 1.272 5.843 -12.126 1.00 0.00 H new ATOM 0 HD1 PHE A 434 4.682 4.632 -11.365 1.00 0.00 H new ATOM 0 HD2 PHE A 434 1.625 4.922 -14.268 1.00 0.00 H new ATOM 0 HE1 PHE A 434 5.925 3.034 -12.833 1.00 0.00 H new ATOM 0 HE2 PHE A 434 2.868 3.327 -15.737 1.00 0.00 H new ATOM 0 HZ PHE A 434 5.003 2.403 -15.003 1.00 0.00 H new ATOM 231 N ASN A 435 0.682 8.095 -11.228 1.00 0.00 N ATOM 232 CA ASN A 435 -0.500 8.937 -11.303 1.00 0.00 C ATOM 233 C ASN A 435 -1.700 8.175 -10.738 1.00 0.00 C ATOM 234 O ASN A 435 -2.446 8.706 -9.917 1.00 0.00 O ATOM 235 CB ASN A 435 -0.818 9.312 -12.752 1.00 0.00 C ATOM 236 CG ASN A 435 -0.599 8.121 -13.687 1.00 0.00 C ATOM 237 OD1 ASN A 435 -0.476 6.982 -13.266 1.00 0.00 O ATOM 238 ND2 ASN A 435 -0.558 8.446 -14.976 1.00 0.00 N ATOM 0 H ASN A 435 0.671 7.411 -10.471 1.00 0.00 H new ATOM 0 HA ASN A 435 -0.305 9.844 -10.730 1.00 0.00 H new ATOM 0 HB2 ASN A 435 -1.851 9.651 -12.825 1.00 0.00 H new ATOM 0 HB3 ASN A 435 -0.186 10.144 -13.063 1.00 0.00 H new ATOM 0 HD21 ASN A 435 -0.417 7.722 -15.680 1.00 0.00 H new ATOM 0 HD22 ASN A 435 -0.668 9.419 -15.260 1.00 0.00 H new ATOM 245 N SER A 436 -1.848 6.942 -11.199 1.00 0.00 N ATOM 246 CA SER A 436 -2.945 6.102 -10.750 1.00 0.00 C ATOM 247 C SER A 436 -2.446 4.677 -10.501 1.00 0.00 C ATOM 248 O SER A 436 -2.915 3.732 -11.133 1.00 0.00 O ATOM 249 CB SER A 436 -4.086 6.094 -11.769 1.00 0.00 C ATOM 250 OG SER A 436 -3.751 5.354 -12.940 1.00 0.00 O ATOM 0 H SER A 436 -1.226 6.504 -11.879 1.00 0.00 H new ATOM 0 HA SER A 436 -3.330 6.513 -9.817 1.00 0.00 H new ATOM 0 HB2 SER A 436 -4.977 5.665 -11.312 1.00 0.00 H new ATOM 0 HB3 SER A 436 -4.332 7.119 -12.046 1.00 0.00 H new ATOM 0 HG SER A 436 -3.571 4.422 -12.697 1.00 0.00 H new ATOM 256 N PRO A 437 -1.475 4.565 -9.555 1.00 0.00 N ATOM 257 CA PRO A 437 -0.906 3.272 -9.216 1.00 0.00 C ATOM 258 C PRO A 437 -1.878 2.452 -8.364 1.00 0.00 C ATOM 259 O PRO A 437 -2.678 3.012 -7.617 1.00 0.00 O ATOM 260 CB PRO A 437 0.393 3.590 -8.494 1.00 0.00 C ATOM 261 CG PRO A 437 0.276 5.039 -8.046 1.00 0.00 C ATOM 262 CD PRO A 437 -0.895 5.663 -8.787 1.00 0.00 C ATOM 0 HA PRO A 437 -0.717 2.653 -10.093 1.00 0.00 H new ATOM 0 HB2 PRO A 437 0.538 2.928 -7.641 1.00 0.00 H new ATOM 0 HB3 PRO A 437 1.250 3.453 -9.153 1.00 0.00 H new ATOM 0 HG2 PRO A 437 0.119 5.094 -6.969 1.00 0.00 H new ATOM 0 HG3 PRO A 437 1.197 5.581 -8.262 1.00 0.00 H new ATOM 0 HD2 PRO A 437 -1.621 6.088 -8.094 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -0.565 6.472 -9.439 1.00 0.00 H new ATOM 270 N TYR A 438 -1.777 1.139 -8.507 1.00 0.00 N ATOM 271 CA TYR A 438 -2.637 0.237 -7.760 1.00 0.00 C ATOM 272 C TYR A 438 -1.873 -0.425 -6.612 1.00 0.00 C ATOM 273 O TYR A 438 -0.662 -0.622 -6.699 1.00 0.00 O ATOM 274 CB TYR A 438 -3.078 -0.842 -8.752 1.00 0.00 C ATOM 275 CG TYR A 438 -3.807 -0.297 -9.981 1.00 0.00 C ATOM 276 CD1 TYR A 438 -3.114 0.427 -10.930 1.00 0.00 C ATOM 277 CD2 TYR A 438 -5.158 -0.530 -10.142 1.00 0.00 C ATOM 278 CE1 TYR A 438 -3.801 0.941 -12.087 1.00 0.00 C ATOM 279 CE2 TYR A 438 -5.844 -0.016 -11.299 1.00 0.00 C ATOM 280 CZ TYR A 438 -5.132 0.693 -12.215 1.00 0.00 C ATOM 281 OH TYR A 438 -5.780 1.178 -13.308 1.00 0.00 O ATOM 0 H TYR A 438 -1.113 0.678 -9.129 1.00 0.00 H new ATOM 0 HA TYR A 438 -3.479 0.779 -7.329 1.00 0.00 H new ATOM 0 HB2 TYR A 438 -2.201 -1.400 -9.080 1.00 0.00 H new ATOM 0 HB3 TYR A 438 -3.731 -1.548 -8.239 1.00 0.00 H new ATOM 0 HD1 TYR A 438 -2.057 0.608 -10.805 1.00 0.00 H new ATOM 0 HD2 TYR A 438 -5.700 -1.098 -9.400 1.00 0.00 H new ATOM 0 HE1 TYR A 438 -3.271 1.511 -12.836 1.00 0.00 H new ATOM 0 HE2 TYR A 438 -6.901 -0.190 -11.436 1.00 0.00 H new ATOM 0 HH TYR A 438 -6.725 0.923 -13.268 1.00 0.00 H new ATOM 291 N ILE A 439 -2.612 -0.749 -5.561 1.00 0.00 N ATOM 292 CA ILE A 439 -2.020 -1.384 -4.396 1.00 0.00 C ATOM 293 C ILE A 439 -2.844 -2.616 -4.017 1.00 0.00 C ATOM 294 O ILE A 439 -4.028 -2.502 -3.703 1.00 0.00 O ATOM 295 CB ILE A 439 -1.863 -0.374 -3.257 1.00 0.00 C ATOM 296 CG1 ILE A 439 -0.860 -0.874 -2.216 1.00 0.00 C ATOM 297 CG2 ILE A 439 -3.219 -0.038 -2.633 1.00 0.00 C ATOM 298 CD1 ILE A 439 -0.995 -0.094 -0.906 1.00 0.00 C ATOM 0 H ILE A 439 -3.616 -0.583 -5.492 1.00 0.00 H new ATOM 0 HA ILE A 439 -1.012 -1.732 -4.623 1.00 0.00 H new ATOM 0 HB ILE A 439 -1.462 0.551 -3.672 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -1.022 -1.936 -2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 439 0.154 -0.770 -2.603 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -3.080 0.682 -1.826 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -3.873 0.390 -3.393 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -3.671 -0.946 -2.235 1.00 0.00 H new ATOM 0 HD11 ILE A 439 -0.271 -0.469 -0.183 1.00 0.00 H new ATOM 0 HD12 ILE A 439 -0.808 0.964 -1.091 1.00 0.00 H new ATOM 0 HD13 ILE A 439 -2.002 -0.220 -0.509 1.00 0.00 H new ATOM 310 N HIS A 440 -2.186 -3.765 -4.059 1.00 0.00 N ATOM 311 CA HIS A 440 -2.843 -5.017 -3.724 1.00 0.00 C ATOM 312 C HIS A 440 -2.593 -5.349 -2.252 1.00 0.00 C ATOM 313 O HIS A 440 -1.451 -5.552 -1.842 1.00 0.00 O ATOM 314 CB HIS A 440 -2.396 -6.134 -4.668 1.00 0.00 C ATOM 315 CG HIS A 440 -3.499 -7.092 -5.051 1.00 0.00 C ATOM 316 ND1 HIS A 440 -3.598 -7.657 -6.311 1.00 0.00 N ATOM 317 CD2 HIS A 440 -4.548 -7.579 -4.328 1.00 0.00 C ATOM 318 CE1 HIS A 440 -4.662 -8.446 -6.333 1.00 0.00 C ATOM 319 NE2 HIS A 440 -5.250 -8.396 -5.103 1.00 0.00 N ATOM 0 H HIS A 440 -1.204 -3.855 -4.320 1.00 0.00 H new ATOM 0 HA HIS A 440 -3.920 -4.915 -3.860 1.00 0.00 H new ATOM 0 HB2 HIS A 440 -1.985 -5.688 -5.574 1.00 0.00 H new ATOM 0 HB3 HIS A 440 -1.590 -6.695 -4.195 1.00 0.00 H new ATOM 0 HD2 HIS A 440 -4.770 -7.340 -3.298 1.00 0.00 H new ATOM 0 HE1 HIS A 440 -5.004 -9.027 -7.177 1.00 0.00 H new ATOM 0 HE2 HIS A 440 -6.090 -8.903 -4.825 1.00 0.00 H new ATOM 327 N TYR A 441 -3.681 -5.395 -1.496 1.00 0.00 N ATOM 328 CA TYR A 441 -3.594 -5.700 -0.078 1.00 0.00 C ATOM 329 C TYR A 441 -4.671 -6.706 0.333 1.00 0.00 C ATOM 330 O TYR A 441 -5.729 -6.778 -0.289 1.00 0.00 O ATOM 331 CB TYR A 441 -3.842 -4.379 0.653 1.00 0.00 C ATOM 332 CG TYR A 441 -5.277 -3.860 0.532 1.00 0.00 C ATOM 333 CD1 TYR A 441 -6.314 -4.557 1.119 1.00 0.00 C ATOM 334 CD2 TYR A 441 -5.534 -2.697 -0.164 1.00 0.00 C ATOM 335 CE1 TYR A 441 -7.664 -4.069 1.005 1.00 0.00 C ATOM 336 CE2 TYR A 441 -6.884 -2.209 -0.278 1.00 0.00 C ATOM 337 CZ TYR A 441 -7.882 -2.919 0.313 1.00 0.00 C ATOM 338 OH TYR A 441 -9.157 -2.458 0.205 1.00 0.00 O ATOM 0 H TYR A 441 -4.627 -5.226 -1.839 1.00 0.00 H new ATOM 0 HA TYR A 441 -2.624 -6.136 0.162 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -3.601 -4.509 1.708 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -3.160 -3.625 0.261 1.00 0.00 H new ATOM 0 HD1 TYR A 441 -6.113 -5.468 1.663 1.00 0.00 H new ATOM 0 HD2 TYR A 441 -4.722 -2.152 -0.624 1.00 0.00 H new ATOM 0 HE1 TYR A 441 -8.485 -4.604 1.459 1.00 0.00 H new ATOM 0 HE2 TYR A 441 -7.099 -1.300 -0.820 1.00 0.00 H new ATOM 0 HH TYR A 441 -9.162 -1.628 -0.315 1.00 0.00 H new ATOM 348 N ARG A 442 -4.363 -7.458 1.380 1.00 0.00 N ATOM 349 CA ARG A 442 -5.291 -8.458 1.882 1.00 0.00 C ATOM 350 C ARG A 442 -5.109 -8.642 3.389 1.00 0.00 C ATOM 351 O ARG A 442 -3.984 -8.759 3.872 1.00 0.00 O ATOM 352 CB ARG A 442 -5.084 -9.802 1.182 1.00 0.00 C ATOM 353 CG ARG A 442 -4.092 -10.675 1.953 1.00 0.00 C ATOM 354 CD ARG A 442 -4.801 -11.477 3.046 1.00 0.00 C ATOM 355 NE ARG A 442 -3.870 -11.737 4.167 1.00 0.00 N ATOM 356 CZ ARG A 442 -2.990 -12.760 4.198 1.00 0.00 C ATOM 357 NH1 ARG A 442 -2.912 -13.628 3.168 1.00 0.00 N ATOM 358 NH2 ARG A 442 -2.206 -12.898 5.251 1.00 0.00 N ATOM 0 H ARG A 442 -3.484 -7.395 1.894 1.00 0.00 H new ATOM 0 HA ARG A 442 -6.302 -8.106 1.675 1.00 0.00 H new ATOM 0 HB2 ARG A 442 -6.038 -10.321 1.094 1.00 0.00 H new ATOM 0 HB3 ARG A 442 -4.717 -9.636 0.169 1.00 0.00 H new ATOM 0 HG2 ARG A 442 -3.590 -11.356 1.265 1.00 0.00 H new ATOM 0 HG3 ARG A 442 -3.321 -10.048 2.400 1.00 0.00 H new ATOM 0 HD2 ARG A 442 -5.671 -10.928 3.405 1.00 0.00 H new ATOM 0 HD3 ARG A 442 -5.165 -12.420 2.638 1.00 0.00 H new ATOM 0 HE ARG A 442 -3.895 -11.103 4.966 1.00 0.00 H new ATOM 0 HH11 ARG A 442 -3.521 -13.514 2.358 1.00 0.00 H new ATOM 0 HH12 ARG A 442 -2.244 -14.398 3.200 1.00 0.00 H new ATOM 0 HH21 ARG A 442 -2.271 -12.237 6.025 1.00 0.00 H new ATOM 0 HH22 ARG A 442 -1.535 -13.666 5.290 1.00 0.00 H new ATOM 371 N PRO A 443 -6.262 -8.663 4.110 1.00 0.00 N ATOM 372 CA PRO A 443 -6.240 -8.831 5.553 1.00 0.00 C ATOM 373 C PRO A 443 -5.937 -10.282 5.931 1.00 0.00 C ATOM 374 O PRO A 443 -6.523 -11.208 5.373 1.00 0.00 O ATOM 375 CB PRO A 443 -7.609 -8.367 6.024 1.00 0.00 C ATOM 376 CG PRO A 443 -8.504 -8.397 4.796 1.00 0.00 C ATOM 377 CD PRO A 443 -7.612 -8.527 3.572 1.00 0.00 C ATOM 0 HA PRO A 443 -5.451 -8.251 6.032 1.00 0.00 H new ATOM 0 HB2 PRO A 443 -7.996 -9.021 6.805 1.00 0.00 H new ATOM 0 HB3 PRO A 443 -7.558 -7.363 6.445 1.00 0.00 H new ATOM 0 HG2 PRO A 443 -9.200 -9.234 4.851 1.00 0.00 H new ATOM 0 HG3 PRO A 443 -9.102 -7.488 4.737 1.00 0.00 H new ATOM 0 HD2 PRO A 443 -7.888 -9.394 2.971 1.00 0.00 H new ATOM 0 HD3 PRO A 443 -7.695 -7.652 2.927 1.00 0.00 H new ATOM 385 N ALA A 444 -5.023 -10.435 6.878 1.00 0.00 N ATOM 386 CA ALA A 444 -4.635 -11.757 7.337 1.00 0.00 C ATOM 387 C ALA A 444 -5.874 -12.651 7.410 1.00 0.00 C ATOM 388 O ALA A 444 -6.900 -12.253 7.960 1.00 0.00 O ATOM 389 CB ALA A 444 -3.920 -11.641 8.685 1.00 0.00 C ATOM 0 H ALA A 444 -4.540 -9.664 7.340 1.00 0.00 H new ATOM 0 HA ALA A 444 -3.938 -12.216 6.637 1.00 0.00 H new ATOM 0 HB1 ALA A 444 -3.629 -12.633 9.029 1.00 0.00 H new ATOM 0 HB2 ALA A 444 -3.031 -11.021 8.573 1.00 0.00 H new ATOM 0 HB3 ALA A 444 -4.590 -11.186 9.414 1.00 0.00 H new ATOM 395 N GLY A 445 -5.739 -13.843 6.847 1.00 0.00 N ATOM 396 CA GLY A 445 -6.836 -14.796 6.841 1.00 0.00 C ATOM 397 C GLY A 445 -8.042 -14.239 6.082 1.00 0.00 C ATOM 398 O GLY A 445 -9.180 -14.616 6.357 1.00 0.00 O ATOM 0 H GLY A 445 -4.887 -14.170 6.392 1.00 0.00 H new ATOM 0 HA2 GLY A 445 -6.510 -15.728 6.379 1.00 0.00 H new ATOM 0 HA3 GLY A 445 -7.124 -15.031 7.866 1.00 0.00 H new ATOM 402 N GLY A 446 -7.752 -13.352 5.143 1.00 0.00 N ATOM 403 CA GLY A 446 -8.799 -12.739 4.343 1.00 0.00 C ATOM 404 C GLY A 446 -8.622 -13.073 2.860 1.00 0.00 C ATOM 405 O GLY A 446 -8.342 -14.217 2.507 1.00 0.00 O ATOM 0 H GLY A 446 -6.807 -13.042 4.918 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -9.774 -13.088 4.684 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -8.781 -11.658 4.481 1.00 0.00 H new ATOM 409 N SER A 447 -8.794 -12.053 2.032 1.00 0.00 N ATOM 410 CA SER A 447 -8.658 -12.224 0.596 1.00 0.00 C ATOM 411 C SER A 447 -8.056 -10.962 -0.027 1.00 0.00 C ATOM 412 O SER A 447 -8.289 -9.856 0.457 1.00 0.00 O ATOM 413 CB SER A 447 -10.007 -12.543 -0.051 1.00 0.00 C ATOM 414 OG SER A 447 -11.061 -12.591 0.907 1.00 0.00 O ATOM 0 H SER A 447 -9.026 -11.105 2.329 1.00 0.00 H new ATOM 0 HA SER A 447 -7.990 -13.066 0.414 1.00 0.00 H new ATOM 0 HB2 SER A 447 -10.235 -11.788 -0.804 1.00 0.00 H new ATOM 0 HB3 SER A 447 -9.944 -13.500 -0.568 1.00 0.00 H new ATOM 0 HG SER A 447 -11.906 -12.796 0.454 1.00 0.00 H new ATOM 420 N TRP A 448 -7.295 -11.171 -1.091 1.00 0.00 N ATOM 421 CA TRP A 448 -6.658 -10.065 -1.784 1.00 0.00 C ATOM 422 C TRP A 448 -7.729 -9.339 -2.601 1.00 0.00 C ATOM 423 O TRP A 448 -8.785 -9.901 -2.885 1.00 0.00 O ATOM 424 CB TRP A 448 -5.485 -10.554 -2.637 1.00 0.00 C ATOM 425 CG TRP A 448 -4.307 -11.093 -1.823 1.00 0.00 C ATOM 426 CD1 TRP A 448 -4.131 -12.333 -1.346 1.00 0.00 C ATOM 427 CD2 TRP A 448 -3.139 -10.354 -1.408 1.00 0.00 C ATOM 428 NE1 TRP A 448 -2.941 -12.447 -0.657 1.00 0.00 N ATOM 429 CE2 TRP A 448 -2.318 -11.204 -0.696 1.00 0.00 C ATOM 430 CE3 TRP A 448 -2.787 -9.010 -1.627 1.00 0.00 C ATOM 431 CZ2 TRP A 448 -1.094 -10.806 -0.146 1.00 0.00 C ATOM 432 CZ3 TRP A 448 -1.561 -8.628 -1.071 1.00 0.00 C ATOM 433 CH2 TRP A 448 -0.724 -9.472 -0.351 1.00 0.00 C ATOM 0 H TRP A 448 -7.105 -12.090 -1.490 1.00 0.00 H new ATOM 0 HA TRP A 448 -6.226 -9.362 -1.072 1.00 0.00 H new ATOM 0 HB2 TRP A 448 -5.838 -11.337 -3.308 1.00 0.00 H new ATOM 0 HB3 TRP A 448 -5.136 -9.732 -3.262 1.00 0.00 H new ATOM 0 HD1 TRP A 448 -4.833 -13.142 -1.484 1.00 0.00 H new ATOM 0 HE1 TRP A 448 -2.584 -13.288 -0.203 1.00 0.00 H new ATOM 0 HE3 TRP A 448 -3.414 -8.327 -2.181 1.00 0.00 H new ATOM 0 HZ2 TRP A 448 -0.469 -11.491 0.407 1.00 0.00 H new ATOM 0 HZ3 TRP A 448 -1.243 -7.605 -1.211 1.00 0.00 H new ATOM 0 HH2 TRP A 448 0.208 -9.100 0.049 1.00 0.00 H new ATOM 444 N THR A 449 -7.419 -8.101 -2.956 1.00 0.00 N ATOM 445 CA THR A 449 -8.342 -7.292 -3.734 1.00 0.00 C ATOM 446 C THR A 449 -8.364 -7.761 -5.190 1.00 0.00 C ATOM 447 O THR A 449 -7.750 -8.770 -5.531 1.00 0.00 O ATOM 448 CB THR A 449 -7.936 -5.826 -3.574 1.00 0.00 C ATOM 449 OG1 THR A 449 -7.560 -5.717 -2.204 1.00 0.00 O ATOM 450 CG2 THR A 449 -9.124 -4.871 -3.711 1.00 0.00 C ATOM 0 H THR A 449 -6.541 -7.638 -2.719 1.00 0.00 H new ATOM 0 HA THR A 449 -9.365 -7.402 -3.374 1.00 0.00 H new ATOM 0 HB THR A 449 -7.181 -5.576 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 449 -7.185 -4.827 -2.037 1.00 0.00 H new ATOM 0 HG21 THR A 449 -8.781 -3.844 -3.589 1.00 0.00 H new ATOM 0 HG22 THR A 449 -9.574 -4.989 -4.697 1.00 0.00 H new ATOM 0 HG23 THR A 449 -9.865 -5.099 -2.945 1.00 0.00 H new ATOM 458 N ALA A 450 -9.079 -7.005 -6.010 1.00 0.00 N ATOM 459 CA ALA A 450 -9.191 -7.331 -7.422 1.00 0.00 C ATOM 460 C ALA A 450 -7.971 -6.782 -8.165 1.00 0.00 C ATOM 461 O ALA A 450 -7.874 -5.580 -8.405 1.00 0.00 O ATOM 462 CB ALA A 450 -10.506 -6.776 -7.972 1.00 0.00 C ATOM 0 H ALA A 450 -9.587 -6.168 -5.724 1.00 0.00 H new ATOM 0 HA ALA A 450 -9.208 -8.411 -7.566 1.00 0.00 H new ATOM 0 HB1 ALA A 450 -10.590 -7.021 -9.031 1.00 0.00 H new ATOM 0 HB2 ALA A 450 -11.342 -7.218 -7.430 1.00 0.00 H new ATOM 0 HB3 ALA A 450 -10.524 -5.693 -7.847 1.00 0.00 H new ATOM 468 N ALA A 451 -7.069 -7.691 -8.509 1.00 0.00 N ATOM 469 CA ALA A 451 -5.860 -7.313 -9.219 1.00 0.00 C ATOM 470 C ALA A 451 -6.237 -6.540 -10.484 1.00 0.00 C ATOM 471 O ALA A 451 -7.192 -6.896 -11.173 1.00 0.00 O ATOM 472 CB ALA A 451 -5.035 -8.565 -9.525 1.00 0.00 C ATOM 0 H ALA A 451 -7.152 -8.688 -8.309 1.00 0.00 H new ATOM 0 HA ALA A 451 -5.243 -6.658 -8.604 1.00 0.00 H new ATOM 0 HB1 ALA A 451 -4.127 -8.281 -10.058 1.00 0.00 H new ATOM 0 HB2 ALA A 451 -4.768 -9.062 -8.592 1.00 0.00 H new ATOM 0 HB3 ALA A 451 -5.621 -9.245 -10.143 1.00 0.00 H new ATOM 478 N PRO A 452 -5.447 -5.467 -10.759 1.00 0.00 N ATOM 479 CA PRO A 452 -4.336 -5.114 -9.892 1.00 0.00 C ATOM 480 C PRO A 452 -4.835 -4.459 -8.601 1.00 0.00 C ATOM 481 O PRO A 452 -5.497 -3.423 -8.642 1.00 0.00 O ATOM 482 CB PRO A 452 -3.463 -4.191 -10.726 1.00 0.00 C ATOM 483 CG PRO A 452 -4.347 -3.692 -11.858 1.00 0.00 C ATOM 484 CD PRO A 452 -5.590 -4.566 -11.899 1.00 0.00 C ATOM 0 HA PRO A 452 -3.769 -5.984 -9.560 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -3.089 -3.360 -10.127 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.593 -4.721 -11.114 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -4.619 -2.649 -11.698 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -3.815 -3.741 -12.808 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -6.498 -3.968 -11.819 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -5.654 -5.120 -12.836 1.00 0.00 H new ATOM 492 N GLY A 453 -4.499 -5.092 -7.487 1.00 0.00 N ATOM 493 CA GLY A 453 -4.904 -4.584 -6.187 1.00 0.00 C ATOM 494 C GLY A 453 -6.051 -3.581 -6.324 1.00 0.00 C ATOM 495 O GLY A 453 -7.042 -3.854 -7.001 1.00 0.00 O ATOM 0 H GLY A 453 -3.951 -5.952 -7.457 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -5.214 -5.412 -5.550 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -4.055 -4.106 -5.698 1.00 0.00 H new ATOM 499 N VAL A 454 -5.880 -2.442 -5.670 1.00 0.00 N ATOM 500 CA VAL A 454 -6.888 -1.397 -5.710 1.00 0.00 C ATOM 501 C VAL A 454 -6.216 -0.056 -6.012 1.00 0.00 C ATOM 502 O VAL A 454 -5.154 0.246 -5.470 1.00 0.00 O ATOM 503 CB VAL A 454 -7.682 -1.386 -4.402 1.00 0.00 C ATOM 504 CG1 VAL A 454 -6.759 -1.169 -3.201 1.00 0.00 C ATOM 505 CG2 VAL A 454 -8.789 -0.330 -4.441 1.00 0.00 C ATOM 0 H VAL A 454 -5.058 -2.220 -5.109 1.00 0.00 H new ATOM 0 HA VAL A 454 -7.604 -1.588 -6.509 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.154 -2.362 -4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -7.349 -1.165 -2.285 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -6.025 -1.973 -3.157 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -6.245 -0.213 -3.305 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -9.338 -0.343 -3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.347 0.655 -4.589 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.472 -0.549 -5.262 1.00 0.00 H new ATOM 515 N LYS A 455 -6.862 0.712 -6.876 1.00 0.00 N ATOM 516 CA LYS A 455 -6.340 2.014 -7.257 1.00 0.00 C ATOM 517 C LYS A 455 -6.176 2.879 -6.006 1.00 0.00 C ATOM 518 O LYS A 455 -7.162 3.320 -5.418 1.00 0.00 O ATOM 519 CB LYS A 455 -7.222 2.650 -8.334 1.00 0.00 C ATOM 520 CG LYS A 455 -6.772 4.082 -8.634 1.00 0.00 C ATOM 521 CD LYS A 455 -7.913 4.897 -9.246 1.00 0.00 C ATOM 522 CE LYS A 455 -7.535 5.408 -10.638 1.00 0.00 C ATOM 523 NZ LYS A 455 -8.751 5.706 -11.428 1.00 0.00 N ATOM 0 H LYS A 455 -7.743 0.458 -7.324 1.00 0.00 H new ATOM 0 HA LYS A 455 -5.352 1.912 -7.706 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -7.178 2.053 -9.245 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -8.261 2.653 -8.004 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -6.431 4.560 -7.716 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -5.924 4.065 -9.319 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -8.810 4.281 -9.312 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -8.152 5.740 -8.597 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.923 6.306 -10.549 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -6.932 4.661 -11.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -8.477 6.052 -12.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -9.320 4.841 -11.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -9.311 6.435 -10.941 1.00 0.00 H new ATOM 536 N MET A 456 -4.922 3.095 -5.636 1.00 0.00 N ATOM 537 CA MET A 456 -4.616 3.899 -4.465 1.00 0.00 C ATOM 538 C MET A 456 -5.258 5.284 -4.568 1.00 0.00 C ATOM 539 O MET A 456 -5.236 5.906 -5.629 1.00 0.00 O ATOM 540 CB MET A 456 -3.099 4.049 -4.331 1.00 0.00 C ATOM 541 CG MET A 456 -2.510 2.922 -3.479 1.00 0.00 C ATOM 542 SD MET A 456 -0.728 3.011 -3.497 1.00 0.00 S ATOM 543 CE MET A 456 -0.413 2.579 -5.201 1.00 0.00 C ATOM 0 H MET A 456 -4.107 2.727 -6.126 1.00 0.00 H new ATOM 0 HA MET A 456 -5.020 3.396 -3.586 1.00 0.00 H new ATOM 0 HB2 MET A 456 -2.640 4.040 -5.320 1.00 0.00 H new ATOM 0 HB3 MET A 456 -2.864 5.013 -3.879 1.00 0.00 H new ATOM 0 HG2 MET A 456 -2.876 3.000 -2.455 1.00 0.00 H new ATOM 0 HG3 MET A 456 -2.838 1.956 -3.862 1.00 0.00 H new ATOM 0 HE1 MET A 456 0.448 1.912 -5.254 1.00 0.00 H new ATOM 0 HE2 MET A 456 -1.287 2.077 -5.617 1.00 0.00 H new ATOM 0 HE3 MET A 456 -0.207 3.483 -5.774 1.00 0.00 H new ATOM 553 N GLN A 457 -5.816 5.726 -3.450 1.00 0.00 N ATOM 554 CA GLN A 457 -6.464 7.026 -3.401 1.00 0.00 C ATOM 555 C GLN A 457 -5.438 8.139 -3.625 1.00 0.00 C ATOM 556 O GLN A 457 -4.236 7.882 -3.668 1.00 0.00 O ATOM 557 CB GLN A 457 -7.202 7.220 -2.075 1.00 0.00 C ATOM 558 CG GLN A 457 -8.074 6.006 -1.750 1.00 0.00 C ATOM 559 CD GLN A 457 -8.899 6.246 -0.484 1.00 0.00 C ATOM 560 OE1 GLN A 457 -9.086 7.366 -0.037 1.00 0.00 O ATOM 561 NE2 GLN A 457 -9.380 5.135 0.067 1.00 0.00 N ATOM 0 H GLN A 457 -5.833 5.207 -2.572 1.00 0.00 H new ATOM 0 HA GLN A 457 -7.203 7.073 -4.201 1.00 0.00 H new ATOM 0 HB2 GLN A 457 -6.481 7.379 -1.273 1.00 0.00 H new ATOM 0 HB3 GLN A 457 -7.823 8.114 -2.128 1.00 0.00 H new ATOM 0 HG2 GLN A 457 -8.739 5.797 -2.588 1.00 0.00 H new ATOM 0 HG3 GLN A 457 -7.444 5.127 -1.616 1.00 0.00 H new ATOM 0 HE21 GLN A 457 -9.186 4.229 -0.359 1.00 0.00 H new ATOM 0 HE22 GLN A 457 -9.943 5.189 0.916 1.00 0.00 H new ATOM 570 N ASP A 458 -5.951 9.353 -3.763 1.00 0.00 N ATOM 571 CA ASP A 458 -5.095 10.507 -3.982 1.00 0.00 C ATOM 572 C ASP A 458 -4.632 11.057 -2.632 1.00 0.00 C ATOM 573 O ASP A 458 -5.442 11.252 -1.727 1.00 0.00 O ATOM 574 CB ASP A 458 -5.848 11.620 -4.714 1.00 0.00 C ATOM 575 CG ASP A 458 -7.134 11.178 -5.414 1.00 0.00 C ATOM 576 OD1 ASP A 458 -7.120 10.790 -6.592 1.00 0.00 O ATOM 577 OD2 ASP A 458 -8.200 11.246 -4.690 1.00 0.00 O ATOM 0 H ASP A 458 -6.949 9.563 -3.727 1.00 0.00 H new ATOM 0 HA ASP A 458 -4.246 10.188 -4.587 1.00 0.00 H new ATOM 0 HB2 ASP A 458 -6.093 12.404 -3.998 1.00 0.00 H new ATOM 0 HB3 ASP A 458 -5.182 12.062 -5.455 1.00 0.00 H new ATOM 583 N ALA A 459 -3.332 11.294 -2.539 1.00 0.00 N ATOM 584 CA ALA A 459 -2.752 11.818 -1.315 1.00 0.00 C ATOM 585 C ALA A 459 -2.257 13.245 -1.560 1.00 0.00 C ATOM 586 O ALA A 459 -1.198 13.445 -2.154 1.00 0.00 O ATOM 587 CB ALA A 459 -1.635 10.887 -0.839 1.00 0.00 C ATOM 0 H ALA A 459 -2.664 11.132 -3.292 1.00 0.00 H new ATOM 0 HA ALA A 459 -3.500 11.860 -0.524 1.00 0.00 H new ATOM 0 HB1 ALA A 459 -1.200 11.281 0.080 1.00 0.00 H new ATOM 0 HB2 ALA A 459 -2.044 9.894 -0.650 1.00 0.00 H new ATOM 0 HB3 ALA A 459 -0.864 10.822 -1.607 1.00 0.00 H new ATOM 593 N GLU A 460 -3.046 14.200 -1.090 1.00 0.00 N ATOM 594 CA GLU A 460 -2.701 15.602 -1.251 1.00 0.00 C ATOM 595 C GLU A 460 -1.332 15.887 -0.631 1.00 0.00 C ATOM 596 O GLU A 460 -0.723 16.919 -0.908 1.00 0.00 O ATOM 597 CB GLU A 460 -3.777 16.504 -0.644 1.00 0.00 C ATOM 598 CG GLU A 460 -3.856 16.319 0.873 1.00 0.00 C ATOM 599 CD GLU A 460 -4.957 17.194 1.475 1.00 0.00 C ATOM 600 OE1 GLU A 460 -6.109 16.751 1.589 1.00 0.00 O ATOM 601 OE2 GLU A 460 -4.580 18.375 1.833 1.00 0.00 O ATOM 0 H GLU A 460 -3.923 14.030 -0.598 1.00 0.00 H new ATOM 0 HA GLU A 460 -2.647 15.823 -2.317 1.00 0.00 H new ATOM 0 HB2 GLU A 460 -3.556 17.546 -0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 460 -4.744 16.275 -1.093 1.00 0.00 H new ATOM 0 HG2 GLU A 460 -4.051 15.272 1.106 1.00 0.00 H new ATOM 0 HG3 GLU A 460 -2.897 16.573 1.324 1.00 0.00 H new ATOM 609 N ILE A 461 -0.888 14.953 0.198 1.00 0.00 N ATOM 610 CA ILE A 461 0.398 15.091 0.861 1.00 0.00 C ATOM 611 C ILE A 461 1.331 15.929 -0.015 1.00 0.00 C ATOM 612 O ILE A 461 1.988 16.848 0.473 1.00 0.00 O ATOM 613 CB ILE A 461 0.964 13.717 1.224 1.00 0.00 C ATOM 614 CG1 ILE A 461 -0.015 12.935 2.103 1.00 0.00 C ATOM 615 CG2 ILE A 461 2.342 13.846 1.875 1.00 0.00 C ATOM 616 CD1 ILE A 461 -0.775 13.872 3.043 1.00 0.00 C ATOM 0 H ILE A 461 -1.396 14.098 0.426 1.00 0.00 H new ATOM 0 HA ILE A 461 0.284 15.623 1.806 1.00 0.00 H new ATOM 0 HB ILE A 461 1.095 13.148 0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 461 -0.721 12.393 1.474 1.00 0.00 H new ATOM 0 HG13 ILE A 461 0.528 12.191 2.686 1.00 0.00 H new ATOM 0 HG21 ILE A 461 2.721 12.855 2.123 1.00 0.00 H new ATOM 0 HG22 ILE A 461 3.027 14.334 1.182 1.00 0.00 H new ATOM 0 HG23 ILE A 461 2.260 14.441 2.784 1.00 0.00 H new ATOM 0 HD11 ILE A 461 -1.464 13.292 3.657 1.00 0.00 H new ATOM 0 HD12 ILE A 461 -0.067 14.394 3.687 1.00 0.00 H new ATOM 0 HD13 ILE A 461 -1.336 14.599 2.456 1.00 0.00 H new ATOM 628 N SER A 462 1.360 15.582 -1.294 1.00 0.00 N ATOM 629 CA SER A 462 2.202 16.291 -2.242 1.00 0.00 C ATOM 630 C SER A 462 2.566 15.370 -3.408 1.00 0.00 C ATOM 631 O SER A 462 3.722 15.320 -3.827 1.00 0.00 O ATOM 632 CB SER A 462 3.470 16.818 -1.567 1.00 0.00 C ATOM 633 OG SER A 462 3.300 18.144 -1.073 1.00 0.00 O ATOM 0 H SER A 462 0.814 14.820 -1.695 1.00 0.00 H new ATOM 0 HA SER A 462 1.643 17.146 -2.622 1.00 0.00 H new ATOM 0 HB2 SER A 462 3.744 16.157 -0.745 1.00 0.00 H new ATOM 0 HB3 SER A 462 4.295 16.799 -2.280 1.00 0.00 H new ATOM 0 HG SER A 462 2.857 18.113 -0.199 1.00 0.00 H new ATOM 639 N GLY A 463 1.559 14.663 -3.899 1.00 0.00 N ATOM 640 CA GLY A 463 1.759 13.746 -5.009 1.00 0.00 C ATOM 641 C GLY A 463 1.971 12.316 -4.507 1.00 0.00 C ATOM 642 O GLY A 463 2.879 11.623 -4.963 1.00 0.00 O ATOM 0 H GLY A 463 0.602 14.706 -3.549 1.00 0.00 H new ATOM 0 HA2 GLY A 463 0.895 13.778 -5.672 1.00 0.00 H new ATOM 0 HA3 GLY A 463 2.622 14.061 -5.595 1.00 0.00 H new ATOM 646 N TYR A 464 1.119 11.918 -3.574 1.00 0.00 N ATOM 647 CA TYR A 464 1.202 10.584 -3.005 1.00 0.00 C ATOM 648 C TYR A 464 -0.139 9.856 -3.114 1.00 0.00 C ATOM 649 O TYR A 464 -1.119 10.423 -3.596 1.00 0.00 O ATOM 650 CB TYR A 464 1.545 10.777 -1.526 1.00 0.00 C ATOM 651 CG TYR A 464 3.039 10.666 -1.214 1.00 0.00 C ATOM 652 CD1 TYR A 464 3.919 11.605 -1.711 1.00 0.00 C ATOM 653 CD2 TYR A 464 3.506 9.626 -0.436 1.00 0.00 C ATOM 654 CE1 TYR A 464 5.325 11.501 -1.418 1.00 0.00 C ATOM 655 CE2 TYR A 464 4.912 9.522 -0.142 1.00 0.00 C ATOM 656 CZ TYR A 464 5.752 10.464 -0.648 1.00 0.00 C ATOM 657 OH TYR A 464 7.080 10.365 -0.370 1.00 0.00 O ATOM 0 H TYR A 464 0.368 12.496 -3.198 1.00 0.00 H new ATOM 0 HA TYR A 464 1.946 9.988 -3.533 1.00 0.00 H new ATOM 0 HB2 TYR A 464 1.189 11.756 -1.206 1.00 0.00 H new ATOM 0 HB3 TYR A 464 1.005 10.034 -0.939 1.00 0.00 H new ATOM 0 HD1 TYR A 464 3.553 12.418 -2.320 1.00 0.00 H new ATOM 0 HD2 TYR A 464 2.817 8.890 -0.048 1.00 0.00 H new ATOM 0 HE1 TYR A 464 6.024 12.230 -1.801 1.00 0.00 H new ATOM 0 HE2 TYR A 464 5.291 8.714 0.467 1.00 0.00 H new ATOM 0 HH TYR A 464 7.239 9.577 0.190 1.00 0.00 H new ATOM 667 N ALA A 465 -0.140 8.612 -2.660 1.00 0.00 N ATOM 668 CA ALA A 465 -1.345 7.801 -2.701 1.00 0.00 C ATOM 669 C ALA A 465 -1.713 7.369 -1.280 1.00 0.00 C ATOM 670 O ALA A 465 -0.840 7.227 -0.425 1.00 0.00 O ATOM 671 CB ALA A 465 -1.126 6.608 -3.634 1.00 0.00 C ATOM 0 H ALA A 465 0.675 8.145 -2.262 1.00 0.00 H new ATOM 0 HA ALA A 465 -2.181 8.377 -3.098 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -2.030 6.000 -3.665 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -0.896 6.968 -4.637 1.00 0.00 H new ATOM 0 HB3 ALA A 465 -0.296 6.006 -3.266 1.00 0.00 H new ATOM 677 N LYS A 466 -3.006 7.173 -1.072 1.00 0.00 N ATOM 678 CA LYS A 466 -3.500 6.761 0.231 1.00 0.00 C ATOM 679 C LYS A 466 -4.439 5.565 0.061 1.00 0.00 C ATOM 680 O LYS A 466 -5.144 5.462 -0.941 1.00 0.00 O ATOM 681 CB LYS A 466 -4.139 7.945 0.961 1.00 0.00 C ATOM 682 CG LYS A 466 -3.087 8.990 1.335 1.00 0.00 C ATOM 683 CD LYS A 466 -3.737 10.349 1.605 1.00 0.00 C ATOM 684 CE LYS A 466 -4.550 10.320 2.900 1.00 0.00 C ATOM 685 NZ LYS A 466 -5.283 11.593 3.081 1.00 0.00 N ATOM 0 H LYS A 466 -3.727 7.292 -1.784 1.00 0.00 H new ATOM 0 HA LYS A 466 -2.676 6.433 0.864 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -4.900 8.400 0.327 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -4.643 7.593 1.861 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -2.541 8.662 2.220 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -2.360 9.084 0.528 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -2.967 11.118 1.672 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -4.385 10.619 0.771 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -5.254 9.488 2.876 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -3.887 10.151 3.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -5.830 11.556 3.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -4.605 12.381 3.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -5.930 11.738 2.280 1.00 0.00 H new ATOM 698 N ILE A 467 -4.417 4.690 1.056 1.00 0.00 N ATOM 699 CA ILE A 467 -5.257 3.504 1.029 1.00 0.00 C ATOM 700 C ILE A 467 -5.582 3.082 2.463 1.00 0.00 C ATOM 701 O ILE A 467 -4.687 2.969 3.299 1.00 0.00 O ATOM 702 CB ILE A 467 -4.599 2.401 0.197 1.00 0.00 C ATOM 703 CG1 ILE A 467 -5.653 1.543 -0.506 1.00 0.00 C ATOM 704 CG2 ILE A 467 -3.653 1.558 1.054 1.00 0.00 C ATOM 705 CD1 ILE A 467 -6.077 2.174 -1.834 1.00 0.00 C ATOM 0 H ILE A 467 -3.831 4.779 1.886 1.00 0.00 H new ATOM 0 HA ILE A 467 -6.206 3.720 0.537 1.00 0.00 H new ATOM 0 HB ILE A 467 -3.996 2.872 -0.579 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.254 0.544 -0.685 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -6.523 1.428 0.140 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -3.199 0.782 0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -2.872 2.196 1.469 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -4.213 1.095 1.867 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -6.827 1.544 -2.313 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -6.498 3.162 -1.649 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -5.209 2.265 -2.487 1.00 0.00 H new ATOM 717 N THR A 468 -6.866 2.861 2.703 1.00 0.00 N ATOM 718 CA THR A 468 -7.321 2.454 4.022 1.00 0.00 C ATOM 719 C THR A 468 -8.089 1.133 3.937 1.00 0.00 C ATOM 720 O THR A 468 -9.072 1.028 3.206 1.00 0.00 O ATOM 721 CB THR A 468 -8.147 3.599 4.611 1.00 0.00 C ATOM 722 OG1 THR A 468 -7.426 4.772 4.244 1.00 0.00 O ATOM 723 CG2 THR A 468 -8.123 3.612 6.141 1.00 0.00 C ATOM 0 H THR A 468 -7.606 2.956 2.007 1.00 0.00 H new ATOM 0 HA THR A 468 -6.480 2.263 4.689 1.00 0.00 H new ATOM 0 HB THR A 468 -9.177 3.518 4.264 1.00 0.00 H new ATOM 0 HG1 THR A 468 -7.893 5.563 4.585 1.00 0.00 H new ATOM 0 HG21 THR A 468 -8.724 4.444 6.507 1.00 0.00 H new ATOM 0 HG22 THR A 468 -8.531 2.675 6.519 1.00 0.00 H new ATOM 0 HG23 THR A 468 -7.096 3.726 6.488 1.00 0.00 H new ATOM 731 N VAL A 469 -7.610 0.158 4.696 1.00 0.00 N ATOM 732 CA VAL A 469 -8.238 -1.152 4.716 1.00 0.00 C ATOM 733 C VAL A 469 -8.432 -1.598 6.166 1.00 0.00 C ATOM 734 O VAL A 469 -7.531 -1.452 6.990 1.00 0.00 O ATOM 735 CB VAL A 469 -7.411 -2.141 3.892 1.00 0.00 C ATOM 736 CG1 VAL A 469 -8.194 -3.431 3.637 1.00 0.00 C ATOM 737 CG2 VAL A 469 -6.952 -1.510 2.576 1.00 0.00 C ATOM 0 H VAL A 469 -6.794 0.249 5.302 1.00 0.00 H new ATOM 0 HA VAL A 469 -9.225 -1.110 4.254 1.00 0.00 H new ATOM 0 HB VAL A 469 -6.522 -2.396 4.469 1.00 0.00 H new ATOM 0 HG11 VAL A 469 -7.584 -4.117 3.049 1.00 0.00 H new ATOM 0 HG12 VAL A 469 -8.448 -3.896 4.589 1.00 0.00 H new ATOM 0 HG13 VAL A 469 -9.108 -3.200 3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 469 -6.366 -2.234 2.010 1.00 0.00 H new ATOM 0 HG22 VAL A 469 -7.823 -1.212 1.992 1.00 0.00 H new ATOM 0 HG23 VAL A 469 -6.339 -0.634 2.787 1.00 0.00 H new ATOM 747 N ASP A 470 -9.614 -2.133 6.434 1.00 0.00 N ATOM 748 CA ASP A 470 -9.938 -2.601 7.771 1.00 0.00 C ATOM 749 C ASP A 470 -9.386 -4.015 7.960 1.00 0.00 C ATOM 750 O ASP A 470 -9.357 -4.805 7.017 1.00 0.00 O ATOM 751 CB ASP A 470 -11.452 -2.653 7.985 1.00 0.00 C ATOM 752 CG ASP A 470 -11.902 -3.389 9.248 1.00 0.00 C ATOM 753 OD1 ASP A 470 -11.873 -4.627 9.311 1.00 0.00 O ATOM 754 OD2 ASP A 470 -12.302 -2.628 10.209 1.00 0.00 O ATOM 0 H ASP A 470 -10.359 -2.253 5.748 1.00 0.00 H new ATOM 0 HA ASP A 470 -9.496 -1.908 8.486 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -11.834 -1.633 8.022 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -11.910 -3.133 7.120 1.00 0.00 H new ATOM 760 N ILE A 471 -8.960 -4.292 9.184 1.00 0.00 N ATOM 761 CA ILE A 471 -8.410 -5.597 9.508 1.00 0.00 C ATOM 762 C ILE A 471 -8.907 -6.026 10.889 1.00 0.00 C ATOM 763 O ILE A 471 -8.233 -6.781 11.589 1.00 0.00 O ATOM 764 CB ILE A 471 -6.885 -5.582 9.380 1.00 0.00 C ATOM 765 CG1 ILE A 471 -6.244 -4.846 10.558 1.00 0.00 C ATOM 766 CG2 ILE A 471 -6.453 -4.996 8.035 1.00 0.00 C ATOM 767 CD1 ILE A 471 -4.738 -5.109 10.615 1.00 0.00 C ATOM 0 H ILE A 471 -8.985 -3.634 9.963 1.00 0.00 H new ATOM 0 HA ILE A 471 -8.759 -6.345 8.797 1.00 0.00 H new ATOM 0 HB ILE A 471 -6.529 -6.612 9.411 1.00 0.00 H new ATOM 0 HG12 ILE A 471 -6.427 -3.775 10.465 1.00 0.00 H new ATOM 0 HG13 ILE A 471 -6.709 -5.169 11.490 1.00 0.00 H new ATOM 0 HG21 ILE A 471 -5.365 -4.997 7.970 1.00 0.00 H new ATOM 0 HG22 ILE A 471 -6.865 -5.599 7.226 1.00 0.00 H new ATOM 0 HG23 ILE A 471 -6.821 -3.973 7.949 1.00 0.00 H new ATOM 0 HD11 ILE A 471 -4.307 -4.574 11.461 1.00 0.00 H new ATOM 0 HD12 ILE A 471 -4.559 -6.178 10.732 1.00 0.00 H new ATOM 0 HD13 ILE A 471 -4.273 -4.763 9.692 1.00 0.00 H new ATOM 779 N GLY A 472 -10.083 -5.528 11.241 1.00 0.00 N ATOM 780 CA GLY A 472 -10.679 -5.850 12.527 1.00 0.00 C ATOM 781 C GLY A 472 -10.752 -7.365 12.733 1.00 0.00 C ATOM 782 O GLY A 472 -10.945 -7.834 13.853 1.00 0.00 O ATOM 0 H GLY A 472 -10.640 -4.903 10.658 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -10.093 -5.398 13.327 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -11.680 -5.423 12.585 1.00 0.00 H new ATOM 786 N SER A 473 -10.594 -8.087 11.634 1.00 0.00 N ATOM 787 CA SER A 473 -10.640 -9.539 11.679 1.00 0.00 C ATOM 788 C SER A 473 -9.240 -10.114 11.457 1.00 0.00 C ATOM 789 O SER A 473 -9.065 -11.331 11.411 1.00 0.00 O ATOM 790 CB SER A 473 -11.613 -10.092 10.637 1.00 0.00 C ATOM 791 OG SER A 473 -12.707 -10.778 11.239 1.00 0.00 O ATOM 0 H SER A 473 -10.434 -7.694 10.706 1.00 0.00 H new ATOM 0 HA SER A 473 -10.997 -9.839 12.664 1.00 0.00 H new ATOM 0 HB2 SER A 473 -11.991 -9.274 10.024 1.00 0.00 H new ATOM 0 HB3 SER A 473 -11.082 -10.771 9.970 1.00 0.00 H new ATOM 0 HG SER A 473 -13.306 -11.115 10.540 1.00 0.00 H new ATOM 797 N ALA A 474 -8.278 -9.212 11.324 1.00 0.00 N ATOM 798 CA ALA A 474 -6.899 -9.615 11.107 1.00 0.00 C ATOM 799 C ALA A 474 -5.971 -8.683 11.887 1.00 0.00 C ATOM 800 O ALA A 474 -6.068 -7.462 11.768 1.00 0.00 O ATOM 801 CB ALA A 474 -6.598 -9.616 9.607 1.00 0.00 C ATOM 0 H ALA A 474 -8.427 -8.204 11.362 1.00 0.00 H new ATOM 0 HA ALA A 474 -6.733 -10.628 11.474 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -5.564 -9.918 9.444 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -7.264 -10.316 9.103 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -6.751 -8.615 9.204 1.00 0.00 H new ATOM 807 N SER A 475 -5.092 -9.293 12.669 1.00 0.00 N ATOM 808 CA SER A 475 -4.147 -8.532 13.469 1.00 0.00 C ATOM 809 C SER A 475 -3.120 -7.853 12.561 1.00 0.00 C ATOM 810 O SER A 475 -2.331 -7.028 13.019 1.00 0.00 O ATOM 811 CB SER A 475 -3.443 -9.428 14.489 1.00 0.00 C ATOM 812 OG SER A 475 -2.189 -8.889 14.898 1.00 0.00 O ATOM 0 H SER A 475 -5.014 -10.305 12.766 1.00 0.00 H new ATOM 0 HA SER A 475 -4.699 -7.768 14.016 1.00 0.00 H new ATOM 0 HB2 SER A 475 -4.084 -9.557 15.361 1.00 0.00 H new ATOM 0 HB3 SER A 475 -3.289 -10.417 14.057 1.00 0.00 H new ATOM 0 HG SER A 475 -2.065 -8.005 14.494 1.00 0.00 H new ATOM 818 N GLN A 476 -3.164 -8.224 11.290 1.00 0.00 N ATOM 819 CA GLN A 476 -2.247 -7.661 10.313 1.00 0.00 C ATOM 820 C GLN A 476 -2.863 -7.714 8.914 1.00 0.00 C ATOM 821 O GLN A 476 -3.821 -8.449 8.681 1.00 0.00 O ATOM 822 CB GLN A 476 -0.899 -8.385 10.346 1.00 0.00 C ATOM 823 CG GLN A 476 0.120 -7.609 11.184 1.00 0.00 C ATOM 824 CD GLN A 476 1.544 -8.085 10.894 1.00 0.00 C ATOM 825 OE1 GLN A 476 1.634 -9.381 10.607 1.00 0.00 O flip ATOM 826 NE2 GLN A 476 2.499 -7.326 10.928 1.00 0.00 N flip ATOM 0 H GLN A 476 -3.821 -8.908 10.914 1.00 0.00 H new ATOM 0 HA GLN A 476 -2.069 -6.617 10.571 1.00 0.00 H new ATOM 0 HB2 GLN A 476 -1.029 -9.385 10.760 1.00 0.00 H new ATOM 0 HB3 GLN A 476 -0.523 -8.507 9.330 1.00 0.00 H new ATOM 0 HG2 GLN A 476 0.038 -6.544 10.968 1.00 0.00 H new ATOM 0 HG3 GLN A 476 -0.102 -7.738 12.243 1.00 0.00 H new ATOM 0 HE21 GLN A 476 2.360 -6.341 11.155 1.00 0.00 H new ATOM 0 HE22 GLN A 476 3.436 -7.676 10.729 1.00 0.00 H new ATOM 835 N LEU A 477 -2.288 -6.924 8.019 1.00 0.00 N ATOM 836 CA LEU A 477 -2.769 -6.871 6.649 1.00 0.00 C ATOM 837 C LEU A 477 -1.578 -6.730 5.700 1.00 0.00 C ATOM 838 O LEU A 477 -0.616 -6.027 6.005 1.00 0.00 O ATOM 839 CB LEU A 477 -3.815 -5.765 6.491 1.00 0.00 C ATOM 840 CG LEU A 477 -3.891 -5.106 5.112 1.00 0.00 C ATOM 841 CD1 LEU A 477 -4.857 -5.861 4.196 1.00 0.00 C ATOM 842 CD2 LEU A 477 -4.255 -3.625 5.232 1.00 0.00 C ATOM 0 H LEU A 477 -1.493 -6.315 8.216 1.00 0.00 H new ATOM 0 HA LEU A 477 -3.277 -7.799 6.388 1.00 0.00 H new ATOM 0 HB2 LEU A 477 -4.794 -6.182 6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 477 -3.611 -4.991 7.231 1.00 0.00 H new ATOM 0 HG LEU A 477 -2.904 -5.159 4.653 1.00 0.00 H new ATOM 0 HD11 LEU A 477 -4.892 -5.372 3.222 1.00 0.00 H new ATOM 0 HD12 LEU A 477 -4.514 -6.889 4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 477 -5.853 -5.861 4.639 1.00 0.00 H new ATOM 0 HD21 LEU A 477 -4.302 -3.180 4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 477 -5.225 -3.527 5.720 1.00 0.00 H new ATOM 0 HD23 LEU A 477 -3.498 -3.111 5.824 1.00 0.00 H new ATOM 854 N GLU A 478 -1.681 -7.411 4.567 1.00 0.00 N ATOM 855 CA GLU A 478 -0.623 -7.371 3.572 1.00 0.00 C ATOM 856 C GLU A 478 -0.965 -6.360 2.475 1.00 0.00 C ATOM 857 O GLU A 478 -2.135 -6.162 2.151 1.00 0.00 O ATOM 858 CB GLU A 478 -0.375 -8.760 2.979 1.00 0.00 C ATOM 859 CG GLU A 478 0.630 -9.545 3.824 1.00 0.00 C ATOM 860 CD GLU A 478 -0.072 -10.287 4.964 1.00 0.00 C ATOM 861 OE1 GLU A 478 -1.262 -10.615 4.849 1.00 0.00 O ATOM 862 OE2 GLU A 478 0.665 -10.521 5.996 1.00 0.00 O ATOM 0 H GLU A 478 -2.480 -7.993 4.317 1.00 0.00 H new ATOM 0 HA GLU A 478 0.297 -7.051 4.061 1.00 0.00 H new ATOM 0 HB2 GLU A 478 -1.315 -9.309 2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 478 -0.001 -8.663 1.960 1.00 0.00 H new ATOM 0 HG2 GLU A 478 1.161 -10.258 3.194 1.00 0.00 H new ATOM 0 HG3 GLU A 478 1.376 -8.864 4.234 1.00 0.00 H new ATOM 870 N ALA A 479 0.078 -5.748 1.934 1.00 0.00 N ATOM 871 CA ALA A 479 -0.097 -4.762 0.881 1.00 0.00 C ATOM 872 C ALA A 479 0.989 -4.957 -0.179 1.00 0.00 C ATOM 873 O ALA A 479 2.047 -5.517 0.106 1.00 0.00 O ATOM 874 CB ALA A 479 -0.074 -3.357 1.487 1.00 0.00 C ATOM 0 H ALA A 479 1.047 -5.916 2.205 1.00 0.00 H new ATOM 0 HA ALA A 479 -1.063 -4.890 0.392 1.00 0.00 H new ATOM 0 HB1 ALA A 479 -0.205 -2.618 0.697 1.00 0.00 H new ATOM 0 HB2 ALA A 479 -0.882 -3.260 2.212 1.00 0.00 H new ATOM 0 HB3 ALA A 479 0.882 -3.191 1.984 1.00 0.00 H new ATOM 880 N ALA A 480 0.690 -4.484 -1.380 1.00 0.00 N ATOM 881 CA ALA A 480 1.627 -4.599 -2.485 1.00 0.00 C ATOM 882 C ALA A 480 1.512 -3.362 -3.377 1.00 0.00 C ATOM 883 O ALA A 480 0.446 -2.756 -3.470 1.00 0.00 O ATOM 884 CB ALA A 480 1.358 -5.897 -3.249 1.00 0.00 C ATOM 0 H ALA A 480 -0.188 -4.020 -1.612 1.00 0.00 H new ATOM 0 HA ALA A 480 2.652 -4.644 -2.116 1.00 0.00 H new ATOM 0 HB1 ALA A 480 2.061 -5.984 -4.078 1.00 0.00 H new ATOM 0 HB2 ALA A 480 1.482 -6.747 -2.578 1.00 0.00 H new ATOM 0 HB3 ALA A 480 0.339 -5.887 -3.636 1.00 0.00 H new ATOM 890 N PHE A 481 2.626 -3.023 -4.011 1.00 0.00 N ATOM 891 CA PHE A 481 2.663 -1.868 -4.892 1.00 0.00 C ATOM 892 C PHE A 481 2.794 -2.299 -6.354 1.00 0.00 C ATOM 893 O PHE A 481 3.560 -3.207 -6.672 1.00 0.00 O ATOM 894 CB PHE A 481 3.895 -1.048 -4.502 1.00 0.00 C ATOM 895 CG PHE A 481 4.388 -0.105 -5.602 1.00 0.00 C ATOM 896 CD1 PHE A 481 3.495 0.622 -6.324 1.00 0.00 C ATOM 897 CD2 PHE A 481 5.719 0.005 -5.856 1.00 0.00 C ATOM 898 CE1 PHE A 481 3.952 1.498 -7.345 1.00 0.00 C ATOM 899 CE2 PHE A 481 6.177 0.881 -6.876 1.00 0.00 C ATOM 900 CZ PHE A 481 5.284 1.608 -7.599 1.00 0.00 C ATOM 0 H PHE A 481 3.509 -3.528 -3.932 1.00 0.00 H new ATOM 0 HA PHE A 481 1.743 -1.293 -4.791 1.00 0.00 H new ATOM 0 HB2 PHE A 481 3.662 -0.462 -3.613 1.00 0.00 H new ATOM 0 HB3 PHE A 481 4.702 -1.729 -4.233 1.00 0.00 H new ATOM 0 HD1 PHE A 481 2.438 0.534 -6.122 1.00 0.00 H new ATOM 0 HD2 PHE A 481 6.428 -0.574 -5.282 1.00 0.00 H new ATOM 0 HE1 PHE A 481 3.243 2.076 -7.919 1.00 0.00 H new ATOM 0 HE2 PHE A 481 7.234 0.970 -7.077 1.00 0.00 H new ATOM 0 HZ PHE A 481 5.632 2.273 -8.375 1.00 0.00 H new ATOM 910 N ASN A 482 2.034 -1.626 -7.206 1.00 0.00 N ATOM 911 CA ASN A 482 2.055 -1.928 -8.627 1.00 0.00 C ATOM 912 C ASN A 482 1.469 -0.747 -9.404 1.00 0.00 C ATOM 913 O ASN A 482 0.427 -0.210 -9.030 1.00 0.00 O ATOM 914 CB ASN A 482 1.211 -3.165 -8.940 1.00 0.00 C ATOM 915 CG ASN A 482 0.123 -3.369 -7.883 1.00 0.00 C ATOM 916 OD1 ASN A 482 -0.887 -2.685 -7.855 1.00 0.00 O ATOM 917 ND2 ASN A 482 0.385 -4.344 -7.018 1.00 0.00 N ATOM 0 H ASN A 482 1.400 -0.873 -6.939 1.00 0.00 H new ATOM 0 HA ASN A 482 3.089 -2.114 -8.917 1.00 0.00 H new ATOM 0 HB2 ASN A 482 0.752 -3.057 -9.923 1.00 0.00 H new ATOM 0 HB3 ASN A 482 1.852 -4.046 -8.982 1.00 0.00 H new ATOM 0 HD21 ASN A 482 -0.279 -4.558 -6.274 1.00 0.00 H new ATOM 0 HD22 ASN A 482 1.250 -4.878 -7.098 1.00 0.00 H new ATOM 924 N ASP A 483 2.163 -0.379 -10.470 1.00 0.00 N ATOM 925 CA ASP A 483 1.724 0.729 -11.302 1.00 0.00 C ATOM 926 C ASP A 483 0.450 0.328 -12.048 1.00 0.00 C ATOM 927 O ASP A 483 -0.195 1.165 -12.677 1.00 0.00 O ATOM 928 CB ASP A 483 2.787 1.091 -12.342 1.00 0.00 C ATOM 929 CG ASP A 483 3.358 -0.094 -13.122 1.00 0.00 C ATOM 930 OD1 ASP A 483 3.063 -1.260 -12.820 1.00 0.00 O ATOM 931 OD2 ASP A 483 4.149 0.222 -14.092 1.00 0.00 O ATOM 0 H ASP A 483 3.026 -0.828 -10.777 1.00 0.00 H new ATOM 0 HA ASP A 483 1.546 1.587 -10.654 1.00 0.00 H new ATOM 0 HB2 ASP A 483 2.355 1.798 -13.050 1.00 0.00 H new ATOM 0 HB3 ASP A 483 3.606 1.604 -11.839 1.00 0.00 H new ATOM 937 N GLY A 484 0.126 -0.953 -11.953 1.00 0.00 N ATOM 938 CA GLY A 484 -1.059 -1.476 -12.611 1.00 0.00 C ATOM 939 C GLY A 484 -0.774 -1.799 -14.079 1.00 0.00 C ATOM 940 O GLY A 484 -1.590 -2.428 -14.751 1.00 0.00 O ATOM 0 H GLY A 484 0.664 -1.644 -11.430 1.00 0.00 H new ATOM 0 HA2 GLY A 484 -1.398 -2.375 -12.096 1.00 0.00 H new ATOM 0 HA3 GLY A 484 -1.867 -0.747 -12.546 1.00 0.00 H new ATOM 944 N ASN A 485 0.388 -1.353 -14.535 1.00 0.00 N ATOM 945 CA ASN A 485 0.791 -1.586 -15.911 1.00 0.00 C ATOM 946 C ASN A 485 1.387 -2.990 -16.033 1.00 0.00 C ATOM 947 O ASN A 485 0.693 -3.932 -16.413 1.00 0.00 O ATOM 948 CB ASN A 485 1.857 -0.581 -16.351 1.00 0.00 C ATOM 949 CG ASN A 485 1.292 0.405 -17.375 1.00 0.00 C ATOM 950 OD1 ASN A 485 1.768 0.520 -18.493 1.00 0.00 O ATOM 951 ND2 ASN A 485 0.253 1.108 -16.934 1.00 0.00 N ATOM 0 H ASN A 485 1.063 -0.832 -13.975 1.00 0.00 H new ATOM 0 HA ASN A 485 -0.090 -1.477 -16.543 1.00 0.00 H new ATOM 0 HB2 ASN A 485 2.229 -0.036 -15.483 1.00 0.00 H new ATOM 0 HB3 ASN A 485 2.706 -1.111 -16.782 1.00 0.00 H new ATOM 0 HD21 ASN A 485 -0.195 1.793 -17.543 1.00 0.00 H new ATOM 0 HD22 ASN A 485 -0.096 0.963 -15.987 1.00 0.00 H new ATOM 958 N ASN A 486 2.667 -3.086 -15.702 1.00 0.00 N ATOM 959 CA ASN A 486 3.364 -4.359 -15.770 1.00 0.00 C ATOM 960 C ASN A 486 4.538 -4.345 -14.789 1.00 0.00 C ATOM 961 O ASN A 486 5.452 -5.161 -14.898 1.00 0.00 O ATOM 962 CB ASN A 486 3.922 -4.607 -17.173 1.00 0.00 C ATOM 963 CG ASN A 486 3.708 -6.061 -17.599 1.00 0.00 C ATOM 964 OD1 ASN A 486 4.640 -6.794 -17.887 1.00 0.00 O ATOM 965 ND2 ASN A 486 2.433 -6.436 -17.621 1.00 0.00 N ATOM 0 H ASN A 486 3.239 -2.303 -15.386 1.00 0.00 H new ATOM 0 HA ASN A 486 2.653 -5.147 -15.521 1.00 0.00 H new ATOM 0 HB2 ASN A 486 3.435 -3.940 -17.885 1.00 0.00 H new ATOM 0 HB3 ASN A 486 4.986 -4.372 -17.192 1.00 0.00 H new ATOM 0 HD21 ASN A 486 2.186 -7.388 -17.891 1.00 0.00 H new ATOM 0 HD22 ASN A 486 1.702 -5.772 -17.368 1.00 0.00 H new ATOM 972 N ASN A 487 4.475 -3.410 -13.854 1.00 0.00 N ATOM 973 CA ASN A 487 5.522 -3.279 -12.855 1.00 0.00 C ATOM 974 C ASN A 487 4.905 -3.386 -11.459 1.00 0.00 C ATOM 975 O ASN A 487 4.056 -2.578 -11.087 1.00 0.00 O ATOM 976 CB ASN A 487 6.218 -1.920 -12.961 1.00 0.00 C ATOM 977 CG ASN A 487 7.090 -1.847 -14.216 1.00 0.00 C ATOM 978 OD1 ASN A 487 8.257 -2.202 -14.214 1.00 0.00 O ATOM 979 ND2 ASN A 487 6.460 -1.368 -15.285 1.00 0.00 N ATOM 0 H ASN A 487 3.715 -2.735 -13.767 1.00 0.00 H new ATOM 0 HA ASN A 487 6.251 -4.072 -13.025 1.00 0.00 H new ATOM 0 HB2 ASN A 487 5.472 -1.126 -12.986 1.00 0.00 H new ATOM 0 HB3 ASN A 487 6.833 -1.752 -12.077 1.00 0.00 H new ATOM 0 HD21 ASN A 487 6.956 -1.280 -16.172 1.00 0.00 H new ATOM 0 HD22 ASN A 487 5.481 -1.089 -15.218 1.00 0.00 H new ATOM 986 N TRP A 488 5.357 -4.392 -10.723 1.00 0.00 N ATOM 987 CA TRP A 488 4.859 -4.616 -9.376 1.00 0.00 C ATOM 988 C TRP A 488 6.011 -4.366 -8.400 1.00 0.00 C ATOM 989 O TRP A 488 7.122 -4.040 -8.815 1.00 0.00 O ATOM 990 CB TRP A 488 4.253 -6.014 -9.241 1.00 0.00 C ATOM 991 CG TRP A 488 3.111 -6.294 -10.220 1.00 0.00 C ATOM 992 CD1 TRP A 488 3.136 -6.228 -11.558 1.00 0.00 C ATOM 993 CD2 TRP A 488 1.765 -6.690 -9.880 1.00 0.00 C ATOM 994 NE1 TRP A 488 1.910 -6.551 -12.103 1.00 0.00 N ATOM 995 CE2 TRP A 488 1.050 -6.841 -11.050 1.00 0.00 C ATOM 996 CE3 TRP A 488 1.172 -6.914 -8.625 1.00 0.00 C ATOM 997 CZ2 TRP A 488 -0.297 -7.221 -11.082 1.00 0.00 C ATOM 998 CZ3 TRP A 488 -0.175 -7.293 -8.673 1.00 0.00 C ATOM 999 CH2 TRP A 488 -0.909 -7.449 -9.843 1.00 0.00 C ATOM 0 H TRP A 488 6.062 -5.060 -11.034 1.00 0.00 H new ATOM 0 HA TRP A 488 4.049 -3.925 -9.143 1.00 0.00 H new ATOM 0 HB2 TRP A 488 5.038 -6.755 -9.392 1.00 0.00 H new ATOM 0 HB3 TRP A 488 3.885 -6.143 -8.223 1.00 0.00 H new ATOM 0 HD1 TRP A 488 4.006 -5.956 -12.137 1.00 0.00 H new ATOM 0 HE1 TRP A 488 1.678 -6.573 -13.096 1.00 0.00 H new ATOM 0 HE3 TRP A 488 1.713 -6.802 -7.697 1.00 0.00 H new ATOM 0 HZ2 TRP A 488 -0.835 -7.332 -12.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 488 -0.679 -7.477 -7.736 1.00 0.00 H new ATOM 0 HH2 TRP A 488 -1.947 -7.745 -9.797 1.00 0.00 H new ATOM 1010 N ASP A 489 5.705 -4.530 -7.121 1.00 0.00 N ATOM 1011 CA ASP A 489 6.701 -4.326 -6.082 1.00 0.00 C ATOM 1012 C ASP A 489 6.144 -4.820 -4.745 1.00 0.00 C ATOM 1013 O ASP A 489 5.420 -4.095 -4.064 1.00 0.00 O ATOM 1014 CB ASP A 489 7.045 -2.843 -5.932 1.00 0.00 C ATOM 1015 CG ASP A 489 8.341 -2.408 -6.618 1.00 0.00 C ATOM 1016 OD1 ASP A 489 8.319 -1.710 -7.643 1.00 0.00 O ATOM 1017 OD2 ASP A 489 9.424 -2.821 -6.050 1.00 0.00 O ATOM 0 H ASP A 489 4.783 -4.802 -6.781 1.00 0.00 H new ATOM 0 HA ASP A 489 7.599 -4.877 -6.362 1.00 0.00 H new ATOM 0 HB2 ASP A 489 6.222 -2.252 -6.335 1.00 0.00 H new ATOM 0 HB3 ASP A 489 7.117 -2.608 -4.870 1.00 0.00 H new ATOM 1023 N SER A 490 6.504 -6.050 -4.409 1.00 0.00 N ATOM 1024 CA SER A 490 6.049 -6.649 -3.165 1.00 0.00 C ATOM 1025 C SER A 490 7.219 -7.332 -2.455 1.00 0.00 C ATOM 1026 O SER A 490 7.828 -8.252 -2.998 1.00 0.00 O ATOM 1027 CB SER A 490 4.923 -7.653 -3.418 1.00 0.00 C ATOM 1028 OG SER A 490 4.685 -7.851 -4.809 1.00 0.00 O ATOM 0 H SER A 490 7.105 -6.648 -4.976 1.00 0.00 H new ATOM 0 HA SER A 490 5.657 -5.857 -2.527 1.00 0.00 H new ATOM 0 HB2 SER A 490 5.177 -8.606 -2.955 1.00 0.00 H new ATOM 0 HB3 SER A 490 4.009 -7.300 -2.941 1.00 0.00 H new ATOM 0 HG SER A 490 3.960 -8.500 -4.928 1.00 0.00 H new ATOM 1034 N ASN A 491 7.499 -6.854 -1.251 1.00 0.00 N ATOM 1035 CA ASN A 491 8.586 -7.407 -0.461 1.00 0.00 C ATOM 1036 C ASN A 491 9.644 -7.993 -1.397 1.00 0.00 C ATOM 1037 O ASN A 491 10.132 -9.100 -1.172 1.00 0.00 O ATOM 1038 CB ASN A 491 8.088 -8.529 0.452 1.00 0.00 C ATOM 1039 CG ASN A 491 8.935 -8.619 1.723 1.00 0.00 C ATOM 1040 OD1 ASN A 491 10.076 -8.189 1.771 1.00 0.00 O ATOM 1041 ND2 ASN A 491 8.315 -9.201 2.746 1.00 0.00 N ATOM 0 H ASN A 491 6.992 -6.090 -0.804 1.00 0.00 H new ATOM 0 HA ASN A 491 9.002 -6.605 0.148 1.00 0.00 H new ATOM 0 HB2 ASN A 491 7.046 -8.351 0.717 1.00 0.00 H new ATOM 0 HB3 ASN A 491 8.124 -9.479 -0.081 1.00 0.00 H new ATOM 0 HD21 ASN A 491 8.796 -9.310 3.639 1.00 0.00 H new ATOM 0 HD22 ASN A 491 7.359 -9.539 2.637 1.00 0.00 H new ATOM 1048 N ASN A 492 9.968 -7.226 -2.427 1.00 0.00 N ATOM 1049 CA ASN A 492 10.960 -7.656 -3.398 1.00 0.00 C ATOM 1050 C ASN A 492 10.285 -8.532 -4.455 1.00 0.00 C ATOM 1051 O ASN A 492 10.512 -8.353 -5.651 1.00 0.00 O ATOM 1052 CB ASN A 492 12.061 -8.482 -2.732 1.00 0.00 C ATOM 1053 CG ASN A 492 13.347 -8.452 -3.560 1.00 0.00 C ATOM 1054 OD1 ASN A 492 13.355 -8.715 -4.751 1.00 0.00 O ATOM 1055 ND2 ASN A 492 14.430 -8.116 -2.865 1.00 0.00 N ATOM 0 H ASN A 492 9.561 -6.309 -2.611 1.00 0.00 H new ATOM 0 HA ASN A 492 11.400 -6.766 -3.848 1.00 0.00 H new ATOM 0 HB2 ASN A 492 12.258 -8.093 -1.733 1.00 0.00 H new ATOM 0 HB3 ASN A 492 11.725 -9.512 -2.612 1.00 0.00 H new ATOM 0 HD21 ASN A 492 15.338 -8.066 -3.328 1.00 0.00 H new ATOM 0 HD22 ASN A 492 14.353 -7.908 -1.869 1.00 0.00 H new ATOM 1062 N THR A 493 9.469 -9.459 -3.976 1.00 0.00 N ATOM 1063 CA THR A 493 8.760 -10.364 -4.865 1.00 0.00 C ATOM 1064 C THR A 493 7.898 -11.337 -4.059 1.00 0.00 C ATOM 1065 O THR A 493 7.844 -12.527 -4.367 1.00 0.00 O ATOM 1066 CB THR A 493 9.794 -11.060 -5.753 1.00 0.00 C ATOM 1067 OG1 THR A 493 9.034 -12.020 -6.483 1.00 0.00 O ATOM 1068 CG2 THR A 493 10.784 -11.904 -4.948 1.00 0.00 C ATOM 0 H THR A 493 9.283 -9.603 -2.984 1.00 0.00 H new ATOM 0 HA THR A 493 8.067 -9.823 -5.510 1.00 0.00 H new ATOM 0 HB THR A 493 10.339 -10.313 -6.330 1.00 0.00 H new ATOM 0 HG1 THR A 493 8.678 -12.693 -5.866 1.00 0.00 H new ATOM 0 HG21 THR A 493 11.495 -12.376 -5.626 1.00 0.00 H new ATOM 0 HG22 THR A 493 11.320 -11.265 -4.246 1.00 0.00 H new ATOM 0 HG23 THR A 493 10.243 -12.673 -4.397 1.00 0.00 H new ATOM 1076 N LYS A 494 7.243 -10.795 -3.043 1.00 0.00 N ATOM 1077 CA LYS A 494 6.386 -11.600 -2.190 1.00 0.00 C ATOM 1078 C LYS A 494 5.152 -10.784 -1.799 1.00 0.00 C ATOM 1079 O LYS A 494 4.055 -11.036 -2.296 1.00 0.00 O ATOM 1080 CB LYS A 494 7.173 -12.136 -0.992 1.00 0.00 C ATOM 1081 CG LYS A 494 8.428 -12.881 -1.451 1.00 0.00 C ATOM 1082 CD LYS A 494 8.881 -13.893 -0.396 1.00 0.00 C ATOM 1083 CE LYS A 494 10.371 -14.209 -0.543 1.00 0.00 C ATOM 1084 NZ LYS A 494 10.576 -15.295 -1.527 1.00 0.00 N ATOM 0 H LYS A 494 7.289 -9.808 -2.791 1.00 0.00 H new ATOM 0 HA LYS A 494 6.031 -12.479 -2.728 1.00 0.00 H new ATOM 0 HB2 LYS A 494 7.454 -11.311 -0.338 1.00 0.00 H new ATOM 0 HB3 LYS A 494 6.542 -12.805 -0.407 1.00 0.00 H new ATOM 0 HG2 LYS A 494 8.227 -13.395 -2.391 1.00 0.00 H new ATOM 0 HG3 LYS A 494 9.229 -12.167 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 494 8.686 -13.497 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 494 8.300 -14.810 -0.493 1.00 0.00 H new ATOM 0 HE2 LYS A 494 10.909 -13.316 -0.861 1.00 0.00 H new ATOM 0 HE3 LYS A 494 10.784 -14.502 0.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 11.592 -15.497 -1.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 10.079 -16.151 -1.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 10.201 -15.001 -2.451 1.00 0.00 H new ATOM 1097 N ASN A 495 5.372 -9.824 -0.913 1.00 0.00 N ATOM 1098 CA ASN A 495 4.291 -8.971 -0.450 1.00 0.00 C ATOM 1099 C ASN A 495 4.658 -8.388 0.917 1.00 0.00 C ATOM 1100 O ASN A 495 5.295 -9.056 1.729 1.00 0.00 O ATOM 1101 CB ASN A 495 2.992 -9.763 -0.293 1.00 0.00 C ATOM 1102 CG ASN A 495 2.021 -9.456 -1.435 1.00 0.00 C ATOM 1103 OD1 ASN A 495 1.957 -8.352 -1.949 1.00 0.00 O ATOM 1104 ND2 ASN A 495 1.272 -10.492 -1.801 1.00 0.00 N ATOM 0 H ASN A 495 6.283 -9.618 -0.503 1.00 0.00 H new ATOM 0 HA ASN A 495 4.144 -8.182 -1.188 1.00 0.00 H new ATOM 0 HB2 ASN A 495 3.213 -10.830 -0.275 1.00 0.00 H new ATOM 0 HB3 ASN A 495 2.526 -9.518 0.661 1.00 0.00 H new ATOM 0 HD21 ASN A 495 0.593 -10.389 -2.555 1.00 0.00 H new ATOM 0 HD22 ASN A 495 1.377 -11.390 -1.328 1.00 0.00 H new ATOM 1111 N TYR A 496 4.238 -7.149 1.128 1.00 0.00 N ATOM 1112 CA TYR A 496 4.515 -6.469 2.381 1.00 0.00 C ATOM 1113 C TYR A 496 3.409 -6.735 3.405 1.00 0.00 C ATOM 1114 O TYR A 496 2.288 -7.084 3.036 1.00 0.00 O ATOM 1115 CB TYR A 496 4.541 -4.975 2.053 1.00 0.00 C ATOM 1116 CG TYR A 496 5.759 -4.538 1.237 1.00 0.00 C ATOM 1117 CD1 TYR A 496 6.992 -4.421 1.846 1.00 0.00 C ATOM 1118 CD2 TYR A 496 5.625 -4.262 -0.108 1.00 0.00 C ATOM 1119 CE1 TYR A 496 8.139 -4.010 1.078 1.00 0.00 C ATOM 1120 CE2 TYR A 496 6.772 -3.852 -0.877 1.00 0.00 C ATOM 1121 CZ TYR A 496 7.972 -3.746 -0.246 1.00 0.00 C ATOM 1122 OH TYR A 496 9.055 -3.358 -0.972 1.00 0.00 O ATOM 0 H TYR A 496 3.708 -6.599 0.452 1.00 0.00 H new ATOM 0 HA TYR A 496 5.454 -6.820 2.809 1.00 0.00 H new ATOM 0 HB2 TYR A 496 3.636 -4.719 1.502 1.00 0.00 H new ATOM 0 HB3 TYR A 496 4.518 -4.409 2.984 1.00 0.00 H new ATOM 0 HD1 TYR A 496 7.097 -4.638 2.899 1.00 0.00 H new ATOM 0 HD2 TYR A 496 4.660 -4.353 -0.584 1.00 0.00 H new ATOM 0 HE1 TYR A 496 9.109 -3.914 1.542 1.00 0.00 H new ATOM 0 HE2 TYR A 496 6.681 -3.634 -1.931 1.00 0.00 H new ATOM 0 HH TYR A 496 8.950 -3.654 -1.900 1.00 0.00 H new ATOM 1132 N SER A 497 3.762 -6.559 4.669 1.00 0.00 N ATOM 1133 CA SER A 497 2.813 -6.775 5.749 1.00 0.00 C ATOM 1134 C SER A 497 2.831 -5.584 6.708 1.00 0.00 C ATOM 1135 O SER A 497 3.894 -5.053 7.025 1.00 0.00 O ATOM 1136 CB SER A 497 3.125 -8.069 6.504 1.00 0.00 C ATOM 1137 OG SER A 497 2.495 -8.106 7.782 1.00 0.00 O ATOM 0 H SER A 497 4.692 -6.269 4.971 1.00 0.00 H new ATOM 0 HA SER A 497 1.817 -6.869 5.316 1.00 0.00 H new ATOM 0 HB2 SER A 497 2.795 -8.923 5.912 1.00 0.00 H new ATOM 0 HB3 SER A 497 4.204 -8.165 6.628 1.00 0.00 H new ATOM 0 HG SER A 497 2.665 -8.973 8.206 1.00 0.00 H new ATOM 1143 N PHE A 498 1.640 -5.198 7.144 1.00 0.00 N ATOM 1144 CA PHE A 498 1.505 -4.079 8.060 1.00 0.00 C ATOM 1145 C PHE A 498 0.466 -4.379 9.142 1.00 0.00 C ATOM 1146 O PHE A 498 -0.509 -5.086 8.893 1.00 0.00 O ATOM 1147 CB PHE A 498 1.033 -2.880 7.235 1.00 0.00 C ATOM 1148 CG PHE A 498 1.848 -2.641 5.962 1.00 0.00 C ATOM 1149 CD1 PHE A 498 3.207 -2.689 6.005 1.00 0.00 C ATOM 1150 CD2 PHE A 498 1.214 -2.381 4.788 1.00 0.00 C ATOM 1151 CE1 PHE A 498 3.963 -2.467 4.824 1.00 0.00 C ATOM 1152 CE2 PHE A 498 1.970 -2.159 3.606 1.00 0.00 C ATOM 1153 CZ PHE A 498 3.328 -2.207 3.649 1.00 0.00 C ATOM 0 H PHE A 498 0.760 -5.641 6.879 1.00 0.00 H new ATOM 0 HA PHE A 498 2.458 -3.884 8.553 1.00 0.00 H new ATOM 0 HB2 PHE A 498 -0.012 -3.028 6.963 1.00 0.00 H new ATOM 0 HB3 PHE A 498 1.077 -1.985 7.856 1.00 0.00 H new ATOM 0 HD1 PHE A 498 3.711 -2.896 6.938 1.00 0.00 H new ATOM 0 HD2 PHE A 498 0.135 -2.343 4.754 1.00 0.00 H new ATOM 0 HE1 PHE A 498 5.042 -2.504 4.858 1.00 0.00 H new ATOM 0 HE2 PHE A 498 1.466 -1.952 2.673 1.00 0.00 H new ATOM 0 HZ PHE A 498 3.903 -2.039 2.750 1.00 0.00 H new ATOM 1163 N SER A 499 0.710 -3.825 10.321 1.00 0.00 N ATOM 1164 CA SER A 499 -0.192 -4.025 11.443 1.00 0.00 C ATOM 1165 C SER A 499 -1.056 -2.778 11.647 1.00 0.00 C ATOM 1166 O SER A 499 -0.641 -1.669 11.315 1.00 0.00 O ATOM 1167 CB SER A 499 0.582 -4.350 12.721 1.00 0.00 C ATOM 1168 OG SER A 499 1.963 -4.015 12.609 1.00 0.00 O ATOM 0 H SER A 499 1.519 -3.238 10.524 1.00 0.00 H new ATOM 0 HA SER A 499 -0.837 -4.874 11.217 1.00 0.00 H new ATOM 0 HB2 SER A 499 0.144 -3.807 13.558 1.00 0.00 H new ATOM 0 HB3 SER A 499 0.484 -5.412 12.944 1.00 0.00 H new ATOM 0 HG SER A 499 2.422 -4.236 13.446 1.00 0.00 H new ATOM 1174 N THR A 500 -2.242 -3.003 12.194 1.00 0.00 N ATOM 1175 CA THR A 500 -3.168 -1.912 12.446 1.00 0.00 C ATOM 1176 C THR A 500 -2.405 -0.604 12.664 1.00 0.00 C ATOM 1177 O THR A 500 -1.358 -0.592 13.310 1.00 0.00 O ATOM 1178 CB THR A 500 -4.050 -2.306 13.633 1.00 0.00 C ATOM 1179 OG1 THR A 500 -3.122 -2.716 14.634 1.00 0.00 O ATOM 1180 CG2 THR A 500 -4.879 -3.562 13.356 1.00 0.00 C ATOM 0 H THR A 500 -2.583 -3.924 12.469 1.00 0.00 H new ATOM 0 HA THR A 500 -3.814 -1.735 11.586 1.00 0.00 H new ATOM 0 HB THR A 500 -4.716 -1.479 13.880 1.00 0.00 H new ATOM 0 HG1 THR A 500 -3.609 -2.987 15.440 1.00 0.00 H new ATOM 0 HG21 THR A 500 -5.486 -3.797 14.230 1.00 0.00 H new ATOM 0 HG22 THR A 500 -5.529 -3.387 12.499 1.00 0.00 H new ATOM 0 HG23 THR A 500 -4.213 -4.398 13.142 1.00 0.00 H new ATOM 1188 N GLY A 501 -2.959 0.466 12.112 1.00 0.00 N ATOM 1189 CA GLY A 501 -2.343 1.776 12.237 1.00 0.00 C ATOM 1190 C GLY A 501 -2.140 2.420 10.864 1.00 0.00 C ATOM 1191 O GLY A 501 -2.903 2.160 9.934 1.00 0.00 O ATOM 0 H GLY A 501 -3.828 0.452 11.577 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -2.970 2.419 12.855 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -1.383 1.683 12.745 1.00 0.00 H new ATOM 1195 N THR A 502 -1.109 3.247 10.780 1.00 0.00 N ATOM 1196 CA THR A 502 -0.797 3.931 9.537 1.00 0.00 C ATOM 1197 C THR A 502 0.676 3.730 9.173 1.00 0.00 C ATOM 1198 O THR A 502 1.554 3.882 10.020 1.00 0.00 O ATOM 1199 CB THR A 502 -1.189 5.401 9.694 1.00 0.00 C ATOM 1200 OG1 THR A 502 -2.442 5.356 10.371 1.00 0.00 O ATOM 1201 CG2 THR A 502 -1.513 6.067 8.355 1.00 0.00 C ATOM 0 H THR A 502 -0.478 3.459 11.553 1.00 0.00 H new ATOM 0 HA THR A 502 -1.365 3.516 8.704 1.00 0.00 H new ATOM 0 HB THR A 502 -0.378 5.942 10.182 1.00 0.00 H new ATOM 0 HG1 THR A 502 -2.769 6.269 10.515 1.00 0.00 H new ATOM 0 HG21 THR A 502 -1.785 7.109 8.523 1.00 0.00 H new ATOM 0 HG22 THR A 502 -0.639 6.020 7.705 1.00 0.00 H new ATOM 0 HG23 THR A 502 -2.346 5.547 7.882 1.00 0.00 H new ATOM 1209 N SER A 503 0.900 3.392 7.912 1.00 0.00 N ATOM 1210 CA SER A 503 2.251 3.169 7.425 1.00 0.00 C ATOM 1211 C SER A 503 2.445 3.871 6.080 1.00 0.00 C ATOM 1212 O SER A 503 1.500 4.009 5.305 1.00 0.00 O ATOM 1213 CB SER A 503 2.548 1.674 7.292 1.00 0.00 C ATOM 1214 OG SER A 503 1.642 1.027 6.402 1.00 0.00 O ATOM 0 H SER A 503 0.168 3.267 7.212 1.00 0.00 H new ATOM 0 HA SER A 503 2.950 3.588 8.149 1.00 0.00 H new ATOM 0 HB2 SER A 503 3.568 1.538 6.933 1.00 0.00 H new ATOM 0 HB3 SER A 503 2.490 1.204 8.274 1.00 0.00 H new ATOM 0 HG SER A 503 0.806 0.829 6.873 1.00 0.00 H new ATOM 1220 N THR A 504 3.678 4.296 5.843 1.00 0.00 N ATOM 1221 CA THR A 504 4.008 4.981 4.605 1.00 0.00 C ATOM 1222 C THR A 504 5.011 4.159 3.793 1.00 0.00 C ATOM 1223 O THR A 504 5.957 3.602 4.348 1.00 0.00 O ATOM 1224 CB THR A 504 4.514 6.380 4.959 1.00 0.00 C ATOM 1225 OG1 THR A 504 3.334 7.099 5.306 1.00 0.00 O ATOM 1226 CG2 THR A 504 5.063 7.130 3.744 1.00 0.00 C ATOM 0 H THR A 504 4.460 4.179 6.487 1.00 0.00 H new ATOM 0 HA THR A 504 3.131 5.089 3.967 1.00 0.00 H new ATOM 0 HB THR A 504 5.292 6.302 5.719 1.00 0.00 H new ATOM 0 HG1 THR A 504 2.887 6.652 6.055 1.00 0.00 H new ATOM 0 HG21 THR A 504 5.409 8.117 4.051 1.00 0.00 H new ATOM 0 HG22 THR A 504 5.895 6.571 3.317 1.00 0.00 H new ATOM 0 HG23 THR A 504 4.277 7.237 2.997 1.00 0.00 H new ATOM 1234 N TYR A 505 4.771 4.111 2.491 1.00 0.00 N ATOM 1235 CA TYR A 505 5.642 3.366 1.596 1.00 0.00 C ATOM 1236 C TYR A 505 6.265 4.287 0.546 1.00 0.00 C ATOM 1237 O TYR A 505 5.558 5.037 -0.126 1.00 0.00 O ATOM 1238 CB TYR A 505 4.748 2.342 0.894 1.00 0.00 C ATOM 1239 CG TYR A 505 5.519 1.263 0.131 1.00 0.00 C ATOM 1240 CD1 TYR A 505 6.642 0.690 0.693 1.00 0.00 C ATOM 1241 CD2 TYR A 505 5.092 0.863 -1.119 1.00 0.00 C ATOM 1242 CE1 TYR A 505 7.367 -0.326 -0.025 1.00 0.00 C ATOM 1243 CE2 TYR A 505 5.818 -0.153 -1.837 1.00 0.00 C ATOM 1244 CZ TYR A 505 6.920 -0.697 -1.254 1.00 0.00 C ATOM 1245 OH TYR A 505 7.605 -1.656 -1.932 1.00 0.00 O ATOM 0 H TYR A 505 3.986 4.575 2.034 1.00 0.00 H new ATOM 0 HA TYR A 505 6.455 2.899 2.152 1.00 0.00 H new ATOM 0 HB2 TYR A 505 4.110 1.862 1.636 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.091 2.865 0.199 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.977 1.004 1.671 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.214 1.312 -1.559 1.00 0.00 H new ATOM 0 HE1 TYR A 505 8.247 -0.783 0.403 1.00 0.00 H new ATOM 0 HE2 TYR A 505 5.495 -0.475 -2.816 1.00 0.00 H new ATOM 0 HH TYR A 505 7.926 -2.335 -1.303 1.00 0.00 H new ATOM 1255 N THR A 506 7.582 4.201 0.437 1.00 0.00 N ATOM 1256 CA THR A 506 8.309 5.018 -0.521 1.00 0.00 C ATOM 1257 C THR A 506 9.306 4.162 -1.304 1.00 0.00 C ATOM 1258 O THR A 506 9.866 3.207 -0.768 1.00 0.00 O ATOM 1259 CB THR A 506 8.966 6.169 0.243 1.00 0.00 C ATOM 1260 OG1 THR A 506 7.900 7.086 0.475 1.00 0.00 O ATOM 1261 CG2 THR A 506 9.953 6.957 -0.621 1.00 0.00 C ATOM 0 H THR A 506 8.165 3.578 0.996 1.00 0.00 H new ATOM 0 HA THR A 506 7.638 5.444 -1.267 1.00 0.00 H new ATOM 0 HB THR A 506 9.483 5.775 1.118 1.00 0.00 H new ATOM 0 HG1 THR A 506 8.238 7.863 0.968 1.00 0.00 H new ATOM 0 HG21 THR A 506 10.391 7.762 -0.031 1.00 0.00 H new ATOM 0 HG22 THR A 506 10.743 6.292 -0.970 1.00 0.00 H new ATOM 0 HG23 THR A 506 9.429 7.379 -1.479 1.00 0.00 H new ATOM 1269 N PRO A 507 9.501 4.543 -2.595 1.00 0.00 N ATOM 1270 CA PRO A 507 10.420 3.821 -3.458 1.00 0.00 C ATOM 1271 C PRO A 507 11.873 4.146 -3.106 1.00 0.00 C ATOM 1272 O PRO A 507 12.188 5.276 -2.736 1.00 0.00 O ATOM 1273 CB PRO A 507 10.043 4.238 -4.871 1.00 0.00 C ATOM 1274 CG PRO A 507 9.244 5.523 -4.726 1.00 0.00 C ATOM 1275 CD PRO A 507 8.854 5.668 -3.264 1.00 0.00 C ATOM 0 HA PRO A 507 10.344 2.740 -3.343 1.00 0.00 H new ATOM 0 HB2 PRO A 507 10.932 4.397 -5.482 1.00 0.00 H new ATOM 0 HB3 PRO A 507 9.453 3.464 -5.362 1.00 0.00 H new ATOM 0 HG2 PRO A 507 9.836 6.379 -5.050 1.00 0.00 H new ATOM 0 HG3 PRO A 507 8.356 5.493 -5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 507 9.194 6.620 -2.856 1.00 0.00 H new ATOM 0 HD3 PRO A 507 7.772 5.635 -3.138 1.00 0.00 H new ATOM 1283 N GLY A 508 12.720 3.135 -3.233 1.00 0.00 N ATOM 1284 CA GLY A 508 14.132 3.299 -2.933 1.00 0.00 C ATOM 1285 C GLY A 508 14.970 3.281 -4.212 1.00 0.00 C ATOM 1286 O GLY A 508 14.553 3.812 -5.240 1.00 0.00 O ATOM 0 H GLY A 508 12.455 2.199 -3.540 1.00 0.00 H new ATOM 0 HA2 GLY A 508 14.288 4.240 -2.405 1.00 0.00 H new ATOM 0 HA3 GLY A 508 14.461 2.501 -2.267 1.00 0.00 H new ATOM 1290 N ASN A 509 16.138 2.663 -4.108 1.00 0.00 N ATOM 1291 CA ASN A 509 17.039 2.569 -5.243 1.00 0.00 C ATOM 1292 C ASN A 509 18.470 2.368 -4.739 1.00 0.00 C ATOM 1293 O ASN A 509 18.799 2.765 -3.622 1.00 0.00 O ATOM 1294 CB ASN A 509 17.009 3.851 -6.078 1.00 0.00 C ATOM 1295 CG ASN A 509 17.026 5.090 -5.181 1.00 0.00 C ATOM 1296 OD1 ASN A 509 18.237 5.426 -4.746 1.00 0.00 O flip ATOM 1297 ND2 ASN A 509 16.007 5.701 -4.903 1.00 0.00 N flip ATOM 0 H ASN A 509 16.481 2.222 -3.254 1.00 0.00 H new ATOM 0 HA ASN A 509 16.718 1.729 -5.859 1.00 0.00 H new ATOM 0 HB2 ASN A 509 17.867 3.872 -6.750 1.00 0.00 H new ATOM 0 HB3 ASN A 509 16.116 3.862 -6.702 1.00 0.00 H new ATOM 0 HD21 ASN A 509 15.109 5.389 -5.271 1.00 0.00 H new ATOM 0 HD22 ASN A 509 16.054 6.524 -4.302 1.00 0.00 H new ATOM 1304 N SER A 510 19.280 1.751 -5.586 1.00 0.00 N ATOM 1305 CA SER A 510 20.667 1.492 -5.240 1.00 0.00 C ATOM 1306 C SER A 510 20.743 0.427 -4.143 1.00 0.00 C ATOM 1307 O SER A 510 20.917 -0.756 -4.432 1.00 0.00 O ATOM 1308 CB SER A 510 21.371 2.772 -4.786 1.00 0.00 C ATOM 1309 OG SER A 510 22.241 3.288 -5.789 1.00 0.00 O ATOM 0 H SER A 510 19.003 1.423 -6.511 1.00 0.00 H new ATOM 0 HA SER A 510 21.178 1.125 -6.130 1.00 0.00 H new ATOM 0 HB2 SER A 510 20.625 3.525 -4.531 1.00 0.00 H new ATOM 0 HB3 SER A 510 21.942 2.570 -3.880 1.00 0.00 H new ATOM 0 HG SER A 510 22.670 4.106 -5.461 1.00 0.00 H new ATOM 1315 N GLY A 511 20.608 0.886 -2.907 1.00 0.00 N ATOM 1316 CA GLY A 511 20.659 -0.012 -1.766 1.00 0.00 C ATOM 1317 C GLY A 511 19.283 -0.145 -1.111 1.00 0.00 C ATOM 1318 O GLY A 511 19.045 -1.075 -0.342 1.00 0.00 O ATOM 0 H GLY A 511 20.463 1.868 -2.671 1.00 0.00 H new ATOM 0 HA2 GLY A 511 21.010 -0.993 -2.086 1.00 0.00 H new ATOM 0 HA3 GLY A 511 21.378 0.361 -1.037 1.00 0.00 H new ATOM 1322 N ASN A 512 18.413 0.799 -1.440 1.00 0.00 N ATOM 1323 CA ASN A 512 17.067 0.799 -0.893 1.00 0.00 C ATOM 1324 C ASN A 512 16.118 0.124 -1.885 1.00 0.00 C ATOM 1325 O ASN A 512 16.439 -0.009 -3.064 1.00 0.00 O ATOM 1326 CB ASN A 512 16.568 2.226 -0.658 1.00 0.00 C ATOM 1327 CG ASN A 512 17.096 2.781 0.667 1.00 0.00 C ATOM 1328 OD1 ASN A 512 17.653 2.072 1.488 1.00 0.00 O ATOM 1329 ND2 ASN A 512 16.891 4.085 0.827 1.00 0.00 N ATOM 0 H ASN A 512 18.614 1.569 -2.078 1.00 0.00 H new ATOM 0 HA ASN A 512 17.089 0.264 0.056 1.00 0.00 H new ATOM 0 HB2 ASN A 512 16.890 2.867 -1.479 1.00 0.00 H new ATOM 0 HB3 ASN A 512 15.478 2.238 -0.653 1.00 0.00 H new ATOM 0 HD21 ASN A 512 17.207 4.550 1.678 1.00 0.00 H new ATOM 0 HD22 ASN A 512 16.417 4.620 0.099 1.00 0.00 H new ATOM 1336 N ALA A 513 14.968 -0.285 -1.369 1.00 0.00 N ATOM 1337 CA ALA A 513 13.970 -0.944 -2.195 1.00 0.00 C ATOM 1338 C ALA A 513 12.642 -1.000 -1.436 1.00 0.00 C ATOM 1339 O ALA A 513 12.473 -1.820 -0.535 1.00 0.00 O ATOM 1340 CB ALA A 513 14.473 -2.333 -2.593 1.00 0.00 C ATOM 0 H ALA A 513 14.705 -0.173 -0.390 1.00 0.00 H new ATOM 0 HA ALA A 513 13.801 -0.383 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 513 13.725 -2.827 -3.212 1.00 0.00 H new ATOM 0 HB2 ALA A 513 15.402 -2.236 -3.154 1.00 0.00 H new ATOM 0 HB3 ALA A 513 14.651 -2.926 -1.696 1.00 0.00 H new ATOM 1346 N GLY A 514 11.735 -0.118 -1.828 1.00 0.00 N ATOM 1347 CA GLY A 514 10.429 -0.056 -1.196 1.00 0.00 C ATOM 1348 C GLY A 514 10.560 0.032 0.326 1.00 0.00 C ATOM 1349 O GLY A 514 10.573 -0.990 1.011 1.00 0.00 O ATOM 0 H GLY A 514 11.879 0.560 -2.576 1.00 0.00 H new ATOM 0 HA2 GLY A 514 9.882 0.810 -1.568 1.00 0.00 H new ATOM 0 HA3 GLY A 514 9.849 -0.939 -1.464 1.00 0.00 H new ATOM 1353 N THR A 515 10.653 1.261 0.811 1.00 0.00 N ATOM 1354 CA THR A 515 10.783 1.495 2.239 1.00 0.00 C ATOM 1355 C THR A 515 9.406 1.705 2.872 1.00 0.00 C ATOM 1356 O THR A 515 8.550 2.377 2.298 1.00 0.00 O ATOM 1357 CB THR A 515 11.731 2.679 2.440 1.00 0.00 C ATOM 1358 OG1 THR A 515 11.539 3.479 1.276 1.00 0.00 O ATOM 1359 CG2 THR A 515 13.203 2.268 2.371 1.00 0.00 C ATOM 0 H THR A 515 10.641 2.106 0.240 1.00 0.00 H new ATOM 0 HA THR A 515 11.210 0.629 2.745 1.00 0.00 H new ATOM 0 HB THR A 515 11.529 3.146 3.404 1.00 0.00 H new ATOM 0 HG1 THR A 515 10.580 3.592 1.111 1.00 0.00 H new ATOM 0 HG21 THR A 515 13.833 3.145 2.520 1.00 0.00 H new ATOM 0 HG22 THR A 515 13.413 1.534 3.149 1.00 0.00 H new ATOM 0 HG23 THR A 515 13.414 1.832 1.395 1.00 0.00 H new ATOM 1367 N ILE A 516 9.235 1.118 4.047 1.00 0.00 N ATOM 1368 CA ILE A 516 7.977 1.232 4.765 1.00 0.00 C ATOM 1369 C ILE A 516 8.226 1.895 6.121 1.00 0.00 C ATOM 1370 O ILE A 516 9.208 1.587 6.795 1.00 0.00 O ATOM 1371 CB ILE A 516 7.291 -0.132 4.864 1.00 0.00 C ATOM 1372 CG1 ILE A 516 7.447 -0.920 3.562 1.00 0.00 C ATOM 1373 CG2 ILE A 516 5.824 0.020 5.269 1.00 0.00 C ATOM 1374 CD1 ILE A 516 7.287 -2.422 3.807 1.00 0.00 C ATOM 0 H ILE A 516 9.947 0.562 4.520 1.00 0.00 H new ATOM 0 HA ILE A 516 7.284 1.873 4.219 1.00 0.00 H new ATOM 0 HB ILE A 516 7.784 -0.706 5.649 1.00 0.00 H new ATOM 0 HG12 ILE A 516 6.704 -0.585 2.839 1.00 0.00 H new ATOM 0 HG13 ILE A 516 8.427 -0.721 3.128 1.00 0.00 H new ATOM 0 HG21 ILE A 516 5.360 -0.964 5.332 1.00 0.00 H new ATOM 0 HG22 ILE A 516 5.764 0.512 6.240 1.00 0.00 H new ATOM 0 HG23 ILE A 516 5.301 0.620 4.524 1.00 0.00 H new ATOM 0 HD11 ILE A 516 7.402 -2.959 2.865 1.00 0.00 H new ATOM 0 HD12 ILE A 516 8.047 -2.759 4.512 1.00 0.00 H new ATOM 0 HD13 ILE A 516 6.297 -2.620 4.218 1.00 0.00 H new ATOM 1386 N THR A 517 7.320 2.793 6.480 1.00 0.00 N ATOM 1387 CA THR A 517 7.430 3.502 7.744 1.00 0.00 C ATOM 1388 C THR A 517 6.126 3.385 8.536 1.00 0.00 C ATOM 1389 O THR A 517 5.084 3.046 7.977 1.00 0.00 O ATOM 1390 CB THR A 517 7.829 4.947 7.441 1.00 0.00 C ATOM 1391 OG1 THR A 517 7.269 5.201 6.156 1.00 0.00 O ATOM 1392 CG2 THR A 517 9.336 5.106 7.229 1.00 0.00 C ATOM 0 H THR A 517 6.507 3.046 5.918 1.00 0.00 H new ATOM 0 HA THR A 517 8.200 3.063 8.379 1.00 0.00 H new ATOM 0 HB THR A 517 7.507 5.591 8.260 1.00 0.00 H new ATOM 0 HG1 THR A 517 7.479 6.118 5.883 1.00 0.00 H new ATOM 0 HG21 THR A 517 9.565 6.150 7.017 1.00 0.00 H new ATOM 0 HG22 THR A 517 9.865 4.794 8.129 1.00 0.00 H new ATOM 0 HG23 THR A 517 9.653 4.487 6.389 1.00 0.00 H new ATOM 1400 N SER A 518 6.227 3.672 9.825 1.00 0.00 N ATOM 1401 CA SER A 518 5.069 3.603 10.700 1.00 0.00 C ATOM 1402 C SER A 518 4.584 5.014 11.039 1.00 0.00 C ATOM 1403 O SER A 518 5.044 5.617 12.006 1.00 0.00 O ATOM 1404 CB SER A 518 5.391 2.831 11.981 1.00 0.00 C ATOM 1405 OG SER A 518 5.324 1.421 11.786 1.00 0.00 O ATOM 0 H SER A 518 7.093 3.953 10.285 1.00 0.00 H new ATOM 0 HA SER A 518 4.276 3.069 10.176 1.00 0.00 H new ATOM 0 HB2 SER A 518 6.389 3.102 12.327 1.00 0.00 H new ATOM 0 HB3 SER A 518 4.692 3.122 12.765 1.00 0.00 H new ATOM 0 HG SER A 518 5.538 0.964 12.626 1.00 0.00 H new ATOM 1411 N GLY A 519 3.659 5.499 10.223 1.00 0.00 N ATOM 1412 CA GLY A 519 3.107 6.828 10.423 1.00 0.00 C ATOM 1413 C GLY A 519 3.159 7.644 9.130 1.00 0.00 C ATOM 1414 O GLY A 519 4.172 7.646 8.433 1.00 0.00 O ATOM 0 H GLY A 519 3.278 4.995 9.422 1.00 0.00 H new ATOM 0 HA2 GLY A 519 2.075 6.749 10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 519 3.665 7.343 11.205 1.00 0.00 H new ATOM 1418 N ALA A 520 2.053 8.318 8.849 1.00 0.00 N ATOM 1419 CA ALA A 520 1.959 9.136 7.652 1.00 0.00 C ATOM 1420 C ALA A 520 3.051 10.207 7.684 1.00 0.00 C ATOM 1421 O ALA A 520 3.545 10.563 8.753 1.00 0.00 O ATOM 1422 CB ALA A 520 0.556 9.737 7.552 1.00 0.00 C ATOM 0 H ALA A 520 1.215 8.314 9.430 1.00 0.00 H new ATOM 0 HA ALA A 520 2.118 8.530 6.760 1.00 0.00 H new ATOM 0 HB1 ALA A 520 0.486 10.351 6.654 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -0.181 8.935 7.502 1.00 0.00 H new ATOM 0 HB3 ALA A 520 0.361 10.354 8.429 1.00 0.00 H new ATOM 1428 N PRO A 521 3.406 10.704 6.469 1.00 0.00 N ATOM 1429 CA PRO A 521 4.430 11.728 6.348 1.00 0.00 C ATOM 1430 C PRO A 521 3.896 13.092 6.790 1.00 0.00 C ATOM 1431 O PRO A 521 2.705 13.369 6.657 1.00 0.00 O ATOM 1432 CB PRO A 521 4.847 11.697 4.887 1.00 0.00 C ATOM 1433 CG PRO A 521 3.723 10.989 4.148 1.00 0.00 C ATOM 1434 CD PRO A 521 2.842 10.307 5.182 1.00 0.00 C ATOM 0 HA PRO A 521 5.287 11.545 6.996 1.00 0.00 H new ATOM 0 HB2 PRO A 521 4.994 12.706 4.501 1.00 0.00 H new ATOM 0 HB3 PRO A 521 5.791 11.167 4.761 1.00 0.00 H new ATOM 0 HG2 PRO A 521 3.142 11.702 3.563 1.00 0.00 H new ATOM 0 HG3 PRO A 521 4.127 10.257 3.449 1.00 0.00 H new ATOM 0 HD2 PRO A 521 1.804 10.625 5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 521 2.855 9.224 5.061 1.00 0.00 H new ATOM 1442 N ALA A 522 4.804 13.908 7.305 1.00 0.00 N ATOM 1443 CA ALA A 522 4.440 15.237 7.767 1.00 0.00 C ATOM 1444 C ALA A 522 5.084 16.284 6.856 1.00 0.00 C ATOM 1445 O ALA A 522 5.808 17.160 7.326 1.00 0.00 O ATOM 1446 CB ALA A 522 4.857 15.401 9.230 1.00 0.00 C ATOM 0 H ALA A 522 5.791 13.675 7.413 1.00 0.00 H new ATOM 0 HA ALA A 522 3.360 15.378 7.718 1.00 0.00 H new ATOM 0 HB1 ALA A 522 4.584 16.398 9.577 1.00 0.00 H new ATOM 0 HB2 ALA A 522 4.349 14.653 9.839 1.00 0.00 H new ATOM 0 HB3 ALA A 522 5.935 15.269 9.318 1.00 0.00 H new ATOM 1452 N GLY A 523 4.797 16.158 5.568 1.00 0.00 N ATOM 1453 CA GLY A 523 5.340 17.081 4.587 1.00 0.00 C ATOM 1454 C GLY A 523 6.607 16.515 3.943 1.00 0.00 C ATOM 1455 O GLY A 523 7.077 15.444 4.325 1.00 0.00 O ATOM 0 H GLY A 523 4.195 15.430 5.182 1.00 0.00 H new ATOM 0 HA2 GLY A 523 4.594 17.279 3.817 1.00 0.00 H new ATOM 0 HA3 GLY A 523 5.566 18.034 5.065 1.00 0.00 H new TER 1459 GLY A 523