USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 918 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 NoAdj-H: A 44 HIS HD1 : A 44 HIS ND1 : A 54 ZNZN :(H bumps) USER MOD NoAdj-H: B 44 HIS HD1 : B 44 HIS ND1 : B 154 ZNZN :(H bumps) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.0963 (180deg=-0.00199) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 15 MET CE :methyl -148:sc= -0.435 (180deg=-2.45) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 ASN : amide:sc= 0.123 K(o=0.12,f=-4!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -44:sc= 0.0164 USER MOD Single : A 35 GLN : amide:sc= 0.7 K(o=0.7,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.075 K(o=-0.075,f=-0.92) USER MOD Single : B 1 MET CE :methyl 173:sc= 0 (180deg=-0.0639) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 TYR OH : rot 180:sc= 0 USER MOD Single : B 8 TYR OH : rot -15:sc= 0 USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 15 MET CE :methyl -146:sc= -1.37 (180deg=-4!) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 ASN : amide:sc=-0.00631 X(o=-0.0063,f=-0.17) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 79:sc= 0.493 USER MOD Single : B 35 GLN : amide:sc= 1.13 K(o=1.1,f=-0.16) USER MOD Single : B 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 THR OG1 : rot 91:sc= 0.0344 USER MOD Single : B 52 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.025) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.607 23.132 -0.435 1.00 0.00 N ATOM 2 CA MET A 1 6.517 22.195 -1.593 1.00 0.00 C ATOM 3 C MET A 1 7.581 21.089 -1.479 1.00 0.00 C ATOM 4 O MET A 1 8.382 21.102 -0.548 1.00 0.00 O ATOM 5 CB MET A 1 6.590 22.952 -2.943 1.00 0.00 C ATOM 6 CG MET A 1 5.285 23.706 -3.248 1.00 0.00 C ATOM 7 SD MET A 1 5.240 24.553 -4.855 1.00 0.00 S ATOM 8 CE MET A 1 6.273 26.004 -4.501 1.00 0.00 C ATOM 0 H1 MET A 1 5.707 23.128 0.086 1.00 0.00 H new ATOM 0 H2 MET A 1 7.374 22.829 0.198 1.00 0.00 H new ATOM 0 H3 MET A 1 6.803 24.093 -0.781 1.00 0.00 H new ATOM 0 HA MET A 1 5.542 21.709 -1.567 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.420 23.658 -2.919 1.00 0.00 H new ATOM 0 HB3 MET A 1 6.797 22.244 -3.746 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.457 22.999 -3.204 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.117 24.442 -2.462 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.343 26.627 -5.393 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.826 26.580 -3.691 1.00 0.00 H new ATOM 0 HE3 MET A 1 7.270 25.677 -4.207 1.00 0.00 H new ATOM 20 N ASP A 2 7.580 20.118 -2.404 1.00 0.00 N ATOM 21 CA ASP A 2 8.491 18.954 -2.452 1.00 0.00 C ATOM 22 C ASP A 2 8.454 18.051 -1.194 1.00 0.00 C ATOM 23 O ASP A 2 9.375 18.020 -0.373 1.00 0.00 O ATOM 24 CB ASP A 2 9.905 19.380 -2.884 1.00 0.00 C ATOM 25 CG ASP A 2 10.838 18.188 -3.177 1.00 0.00 C ATOM 26 OD1 ASP A 2 10.345 17.075 -3.478 1.00 0.00 O ATOM 27 OD2 ASP A 2 12.078 18.377 -3.142 1.00 0.00 O ATOM 0 H ASP A 2 6.915 20.118 -3.177 1.00 0.00 H new ATOM 0 HA ASP A 2 8.107 18.292 -3.228 1.00 0.00 H new ATOM 0 HB2 ASP A 2 9.833 20.004 -3.775 1.00 0.00 H new ATOM 0 HB3 ASP A 2 10.347 19.995 -2.100 1.00 0.00 H new ATOM 32 N TYR A 3 7.350 17.307 -1.062 1.00 0.00 N ATOM 33 CA TYR A 3 7.012 16.410 0.061 1.00 0.00 C ATOM 34 C TYR A 3 6.508 15.029 -0.413 1.00 0.00 C ATOM 35 O TYR A 3 6.042 14.222 0.389 1.00 0.00 O ATOM 36 CB TYR A 3 5.945 17.125 0.920 1.00 0.00 C ATOM 37 CG TYR A 3 4.723 17.605 0.139 1.00 0.00 C ATOM 38 CD1 TYR A 3 3.681 16.712 -0.183 1.00 0.00 C ATOM 39 CD2 TYR A 3 4.647 18.942 -0.306 1.00 0.00 C ATOM 40 CE1 TYR A 3 2.592 17.144 -0.965 1.00 0.00 C ATOM 41 CE2 TYR A 3 3.558 19.378 -1.087 1.00 0.00 C ATOM 42 CZ TYR A 3 2.528 18.473 -1.425 1.00 0.00 C ATOM 43 OH TYR A 3 1.482 18.868 -2.200 1.00 0.00 O ATOM 0 H TYR A 3 6.622 17.312 -1.776 1.00 0.00 H new ATOM 0 HA TYR A 3 7.911 16.209 0.644 1.00 0.00 H new ATOM 0 HB2 TYR A 3 5.615 16.446 1.706 1.00 0.00 H new ATOM 0 HB3 TYR A 3 6.406 17.982 1.411 1.00 0.00 H new ATOM 0 HD1 TYR A 3 3.718 15.692 0.171 1.00 0.00 H new ATOM 0 HD2 TYR A 3 5.431 19.638 -0.046 1.00 0.00 H new ATOM 0 HE1 TYR A 3 1.801 16.451 -1.213 1.00 0.00 H new ATOM 0 HE2 TYR A 3 3.511 20.402 -1.426 1.00 0.00 H new ATOM 0 HH TYR A 3 1.586 19.814 -2.433 1.00 0.00 H new ATOM 53 N LEU A 4 6.591 14.722 -1.712 1.00 0.00 N ATOM 54 CA LEU A 4 6.073 13.477 -2.305 1.00 0.00 C ATOM 55 C LEU A 4 6.652 12.194 -1.678 1.00 0.00 C ATOM 56 O LEU A 4 5.925 11.220 -1.479 1.00 0.00 O ATOM 57 CB LEU A 4 6.245 13.538 -3.838 1.00 0.00 C ATOM 58 CG LEU A 4 7.716 13.518 -4.299 1.00 0.00 C ATOM 59 CD1 LEU A 4 8.146 12.123 -4.757 1.00 0.00 C ATOM 60 CD2 LEU A 4 7.965 14.498 -5.443 1.00 0.00 C ATOM 0 H LEU A 4 7.027 15.341 -2.396 1.00 0.00 H new ATOM 0 HA LEU A 4 5.010 13.411 -2.072 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.721 12.694 -4.287 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.769 14.444 -4.212 1.00 0.00 H new ATOM 0 HG LEU A 4 8.306 13.815 -3.432 1.00 0.00 H new ATOM 0 HD11 LEU A 4 9.188 12.149 -5.074 1.00 0.00 H new ATOM 0 HD12 LEU A 4 8.035 11.419 -3.932 1.00 0.00 H new ATOM 0 HD13 LEU A 4 7.521 11.805 -5.591 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.013 14.453 -5.739 1.00 0.00 H new ATOM 0 HD22 LEU A 4 7.337 14.232 -6.293 1.00 0.00 H new ATOM 0 HD23 LEU A 4 7.723 15.509 -5.115 1.00 0.00 H new ATOM 72 N ARG A 5 7.938 12.204 -1.300 1.00 0.00 N ATOM 73 CA ARG A 5 8.609 11.089 -0.606 1.00 0.00 C ATOM 74 C ARG A 5 8.099 10.911 0.828 1.00 0.00 C ATOM 75 O ARG A 5 8.033 9.790 1.326 1.00 0.00 O ATOM 76 CB ARG A 5 10.135 11.306 -0.681 1.00 0.00 C ATOM 77 CG ARG A 5 10.971 10.060 -0.327 1.00 0.00 C ATOM 78 CD ARG A 5 11.395 9.961 1.149 1.00 0.00 C ATOM 79 NE ARG A 5 12.383 10.996 1.524 1.00 0.00 N ATOM 80 CZ ARG A 5 13.691 10.963 1.334 1.00 0.00 C ATOM 81 NH1 ARG A 5 14.289 9.968 0.740 1.00 0.00 N ATOM 82 NH2 ARG A 5 14.441 11.947 1.742 1.00 0.00 N ATOM 0 H ARG A 5 8.554 12.999 -1.469 1.00 0.00 H new ATOM 0 HA ARG A 5 8.367 10.151 -1.107 1.00 0.00 H new ATOM 0 HB2 ARG A 5 10.395 11.629 -1.689 1.00 0.00 H new ATOM 0 HB3 ARG A 5 10.409 12.117 -0.006 1.00 0.00 H new ATOM 0 HG2 ARG A 5 10.397 9.170 -0.585 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.867 10.053 -0.948 1.00 0.00 H new ATOM 0 HD2 ARG A 5 10.514 10.057 1.784 1.00 0.00 H new ATOM 0 HD3 ARG A 5 11.818 8.974 1.337 1.00 0.00 H new ATOM 0 HE ARG A 5 12.013 11.830 1.981 1.00 0.00 H new ATOM 0 HH11 ARG A 5 13.745 9.175 0.401 1.00 0.00 H new ATOM 0 HH12 ARG A 5 15.301 9.983 0.614 1.00 0.00 H new ATOM 0 HH21 ARG A 5 14.020 12.749 2.211 1.00 0.00 H new ATOM 0 HH22 ARG A 5 15.449 11.916 1.592 1.00 0.00 H new ATOM 96 N GLU A 6 7.679 11.999 1.473 1.00 0.00 N ATOM 97 CA GLU A 6 7.006 11.956 2.775 1.00 0.00 C ATOM 98 C GLU A 6 5.644 11.250 2.677 1.00 0.00 C ATOM 99 O GLU A 6 5.346 10.379 3.494 1.00 0.00 O ATOM 100 CB GLU A 6 6.887 13.380 3.351 1.00 0.00 C ATOM 101 CG GLU A 6 6.555 13.351 4.849 1.00 0.00 C ATOM 102 CD GLU A 6 6.572 14.769 5.451 1.00 0.00 C ATOM 103 OE1 GLU A 6 7.649 15.220 5.914 1.00 0.00 O ATOM 104 OE2 GLU A 6 5.512 15.438 5.477 1.00 0.00 O ATOM 0 H GLU A 6 7.796 12.943 1.105 1.00 0.00 H new ATOM 0 HA GLU A 6 7.608 11.365 3.465 1.00 0.00 H new ATOM 0 HB2 GLU A 6 7.822 13.917 3.194 1.00 0.00 H new ATOM 0 HB3 GLU A 6 6.112 13.927 2.815 1.00 0.00 H new ATOM 0 HG2 GLU A 6 5.573 12.902 4.998 1.00 0.00 H new ATOM 0 HG3 GLU A 6 7.276 12.722 5.372 1.00 0.00 H new ATOM 111 N LEU A 7 4.862 11.543 1.630 1.00 0.00 N ATOM 112 CA LEU A 7 3.594 10.843 1.358 1.00 0.00 C ATOM 113 C LEU A 7 3.813 9.338 1.149 1.00 0.00 C ATOM 114 O LEU A 7 3.184 8.533 1.830 1.00 0.00 O ATOM 115 CB LEU A 7 2.858 11.420 0.134 1.00 0.00 C ATOM 116 CG LEU A 7 2.562 12.925 0.146 1.00 0.00 C ATOM 117 CD1 LEU A 7 1.644 13.251 -1.032 1.00 0.00 C ATOM 118 CD2 LEU A 7 1.884 13.401 1.430 1.00 0.00 C ATOM 0 H LEU A 7 5.087 12.268 0.949 1.00 0.00 H new ATOM 0 HA LEU A 7 2.973 10.998 2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 7 3.451 11.198 -0.753 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.912 10.889 0.026 1.00 0.00 H new ATOM 0 HG LEU A 7 3.521 13.439 0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 7 1.424 14.319 -1.037 1.00 0.00 H new ATOM 0 HD12 LEU A 7 2.138 12.978 -1.965 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.715 12.690 -0.935 1.00 0.00 H new ATOM 0 HD21 LEU A 7 1.704 14.474 1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 7 0.935 12.880 1.555 1.00 0.00 H new ATOM 0 HD23 LEU A 7 2.529 13.188 2.282 1.00 0.00 H new ATOM 130 N TYR A 8 4.743 8.978 0.256 1.00 0.00 N ATOM 131 CA TYR A 8 5.177 7.608 -0.080 1.00 0.00 C ATOM 132 C TYR A 8 5.476 6.770 1.162 1.00 0.00 C ATOM 133 O TYR A 8 5.087 5.607 1.235 1.00 0.00 O ATOM 134 CB TYR A 8 6.479 7.752 -0.899 1.00 0.00 C ATOM 135 CG TYR A 8 6.888 6.655 -1.870 1.00 0.00 C ATOM 136 CD1 TYR A 8 7.164 5.349 -1.417 1.00 0.00 C ATOM 137 CD2 TYR A 8 7.155 6.991 -3.212 1.00 0.00 C ATOM 138 CE1 TYR A 8 7.682 4.386 -2.304 1.00 0.00 C ATOM 139 CE2 TYR A 8 7.655 6.027 -4.108 1.00 0.00 C ATOM 140 CZ TYR A 8 7.932 4.722 -3.651 1.00 0.00 C ATOM 141 OH TYR A 8 8.470 3.806 -4.502 1.00 0.00 O ATOM 0 H TYR A 8 5.247 9.678 -0.288 1.00 0.00 H new ATOM 0 HA TYR A 8 4.381 7.102 -0.626 1.00 0.00 H new ATOM 0 HB2 TYR A 8 6.404 8.678 -1.468 1.00 0.00 H new ATOM 0 HB3 TYR A 8 7.297 7.879 -0.190 1.00 0.00 H new ATOM 0 HD1 TYR A 8 6.978 5.086 -0.386 1.00 0.00 H new ATOM 0 HD2 TYR A 8 6.974 7.998 -3.557 1.00 0.00 H new ATOM 0 HE1 TYR A 8 7.889 3.386 -1.952 1.00 0.00 H new ATOM 0 HE2 TYR A 8 7.826 6.286 -5.142 1.00 0.00 H new ATOM 0 HH TYR A 8 8.574 4.206 -5.391 1.00 0.00 H new ATOM 151 N LYS A 9 6.164 7.354 2.147 1.00 0.00 N ATOM 152 CA LYS A 9 6.546 6.643 3.375 1.00 0.00 C ATOM 153 C LYS A 9 5.351 6.220 4.226 1.00 0.00 C ATOM 154 O LYS A 9 5.226 5.039 4.538 1.00 0.00 O ATOM 155 CB LYS A 9 7.586 7.466 4.153 1.00 0.00 C ATOM 156 CG LYS A 9 8.281 6.623 5.232 1.00 0.00 C ATOM 157 CD LYS A 9 9.365 7.434 5.953 1.00 0.00 C ATOM 158 CE LYS A 9 10.107 6.542 6.957 1.00 0.00 C ATOM 159 NZ LYS A 9 11.153 7.299 7.694 1.00 0.00 N ATOM 0 H LYS A 9 6.471 8.326 2.119 1.00 0.00 H new ATOM 0 HA LYS A 9 7.011 5.701 3.086 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.331 7.859 3.461 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.099 8.323 4.618 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.544 6.272 5.954 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.727 5.739 4.776 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.069 7.842 5.227 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.914 8.281 6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.394 6.121 7.666 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.566 5.705 6.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.634 6.665 8.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.846 7.680 7.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.711 8.083 8.216 1.00 0.00 H new ATOM 173 N LEU A 10 4.434 7.131 4.543 1.00 0.00 N ATOM 174 CA LEU A 10 3.164 6.807 5.190 1.00 0.00 C ATOM 175 C LEU A 10 2.256 5.907 4.327 1.00 0.00 C ATOM 176 O LEU A 10 1.619 4.991 4.846 1.00 0.00 O ATOM 177 CB LEU A 10 2.463 8.096 5.650 1.00 0.00 C ATOM 178 CG LEU A 10 3.204 8.738 6.847 1.00 0.00 C ATOM 179 CD1 LEU A 10 4.003 9.981 6.459 1.00 0.00 C ATOM 180 CD2 LEU A 10 2.226 9.104 7.963 1.00 0.00 C ATOM 0 H LEU A 10 4.553 8.127 4.356 1.00 0.00 H new ATOM 0 HA LEU A 10 3.385 6.208 6.074 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.420 8.805 4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.434 7.873 5.933 1.00 0.00 H new ATOM 0 HG LEU A 10 3.908 7.984 7.198 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.499 10.385 7.342 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.751 9.714 5.712 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.330 10.732 6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.772 9.553 8.792 1.00 0.00 H new ATOM 0 HD22 LEU A 10 1.492 9.815 7.584 1.00 0.00 H new ATOM 0 HD23 LEU A 10 1.716 8.205 8.309 1.00 0.00 H new ATOM 192 N GLU A 11 2.275 6.087 3.006 1.00 0.00 N ATOM 193 CA GLU A 11 1.711 5.156 2.015 1.00 0.00 C ATOM 194 C GLU A 11 2.310 3.736 2.136 1.00 0.00 C ATOM 195 O GLU A 11 1.570 2.759 2.007 1.00 0.00 O ATOM 196 CB GLU A 11 1.884 5.786 0.607 1.00 0.00 C ATOM 197 CG GLU A 11 0.684 6.637 0.143 1.00 0.00 C ATOM 198 CD GLU A 11 -0.490 5.839 -0.440 1.00 0.00 C ATOM 199 OE1 GLU A 11 -1.149 4.962 0.142 1.00 0.00 O ATOM 200 OE2 GLU A 11 -1.035 6.040 -1.543 1.00 0.00 O ATOM 0 H GLU A 11 2.696 6.911 2.577 1.00 0.00 H new ATOM 0 HA GLU A 11 0.647 5.012 2.203 1.00 0.00 H new ATOM 0 HB2 GLU A 11 2.778 6.409 0.608 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.051 4.989 -0.117 1.00 0.00 H new ATOM 0 HG2 GLU A 11 0.322 7.220 0.990 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.030 7.347 -0.608 1.00 0.00 H new ATOM 207 N GLN A 12 3.599 3.582 2.481 1.00 0.00 N ATOM 208 CA GLN A 12 4.218 2.288 2.762 1.00 0.00 C ATOM 209 C GLN A 12 4.057 1.767 4.198 1.00 0.00 C ATOM 210 O GLN A 12 4.190 0.567 4.421 1.00 0.00 O ATOM 211 CB GLN A 12 5.698 2.331 2.393 1.00 0.00 C ATOM 212 CG GLN A 12 5.874 2.247 0.877 1.00 0.00 C ATOM 213 CD GLN A 12 7.347 2.117 0.490 1.00 0.00 C ATOM 214 OE1 GLN A 12 8.207 2.876 0.916 1.00 0.00 O ATOM 215 NE2 GLN A 12 7.706 1.138 -0.315 1.00 0.00 N ATOM 0 H GLN A 12 4.244 4.367 2.572 1.00 0.00 H new ATOM 0 HA GLN A 12 3.671 1.577 2.142 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.145 3.252 2.767 1.00 0.00 H new ATOM 0 HB3 GLN A 12 6.223 1.505 2.872 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.319 1.392 0.492 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.451 3.137 0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 12 7.004 0.495 -0.681 1.00 0.00 H new ATOM 0 HE22 GLN A 12 8.686 1.023 -0.573 1.00 0.00 H new ATOM 224 N GLN A 13 3.710 2.600 5.177 1.00 0.00 N ATOM 225 CA GLN A 13 3.384 2.121 6.533 1.00 0.00 C ATOM 226 C GLN A 13 2.109 1.274 6.542 1.00 0.00 C ATOM 227 O GLN A 13 2.059 0.258 7.238 1.00 0.00 O ATOM 228 CB GLN A 13 3.244 3.287 7.524 1.00 0.00 C ATOM 229 CG GLN A 13 4.578 3.973 7.853 1.00 0.00 C ATOM 230 CD GLN A 13 4.414 5.146 8.822 1.00 0.00 C ATOM 231 OE1 GLN A 13 3.400 5.829 8.870 1.00 0.00 O ATOM 232 NE2 GLN A 13 5.407 5.435 9.637 1.00 0.00 N ATOM 0 H GLN A 13 3.645 3.612 5.064 1.00 0.00 H new ATOM 0 HA GLN A 13 4.216 1.493 6.851 1.00 0.00 H new ATOM 0 HB2 GLN A 13 2.557 4.025 7.110 1.00 0.00 H new ATOM 0 HB3 GLN A 13 2.797 2.918 8.447 1.00 0.00 H new ATOM 0 HG2 GLN A 13 5.261 3.242 8.286 1.00 0.00 H new ATOM 0 HG3 GLN A 13 5.036 4.330 6.930 1.00 0.00 H new ATOM 0 HE21 GLN A 13 6.262 4.880 9.616 1.00 0.00 H new ATOM 0 HE22 GLN A 13 5.321 6.214 10.290 1.00 0.00 H new ATOM 241 N ALA A 14 1.123 1.611 5.704 1.00 0.00 N ATOM 242 CA ALA A 14 -0.025 0.741 5.464 1.00 0.00 C ATOM 243 C ALA A 14 0.385 -0.542 4.720 1.00 0.00 C ATOM 244 O ALA A 14 -0.229 -1.576 4.937 1.00 0.00 O ATOM 245 CB ALA A 14 -1.087 1.530 4.689 1.00 0.00 C ATOM 0 H ALA A 14 1.101 2.486 5.180 1.00 0.00 H new ATOM 0 HA ALA A 14 -0.442 0.421 6.419 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -1.951 0.892 4.503 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -1.396 2.396 5.274 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -0.671 1.864 3.738 1.00 0.00 H new ATOM 251 N MET A 15 1.444 -0.514 3.900 1.00 0.00 N ATOM 252 CA MET A 15 1.917 -1.663 3.109 1.00 0.00 C ATOM 253 C MET A 15 2.694 -2.657 3.989 1.00 0.00 C ATOM 254 O MET A 15 2.487 -3.867 3.889 1.00 0.00 O ATOM 255 CB MET A 15 2.773 -1.135 1.940 1.00 0.00 C ATOM 256 CG MET A 15 3.306 -2.164 0.937 1.00 0.00 C ATOM 257 SD MET A 15 2.089 -2.963 -0.142 1.00 0.00 S ATOM 258 CE MET A 15 1.628 -4.354 0.914 1.00 0.00 C ATOM 0 H MET A 15 2.009 0.324 3.764 1.00 0.00 H new ATOM 0 HA MET A 15 1.066 -2.211 2.705 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.179 -0.405 1.390 1.00 0.00 H new ATOM 0 HB3 MET A 15 3.625 -0.601 2.360 1.00 0.00 H new ATOM 0 HG2 MET A 15 4.047 -1.672 0.307 1.00 0.00 H new ATOM 0 HG3 MET A 15 3.828 -2.942 1.494 1.00 0.00 H new ATOM 0 HE1 MET A 15 1.374 -5.213 0.293 1.00 0.00 H new ATOM 0 HE2 MET A 15 2.465 -4.610 1.564 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.767 -4.079 1.523 1.00 0.00 H new ATOM 268 N LYS A 16 3.515 -2.160 4.924 1.00 0.00 N ATOM 269 CA LYS A 16 4.130 -2.959 5.995 1.00 0.00 C ATOM 270 C LYS A 16 3.087 -3.612 6.895 1.00 0.00 C ATOM 271 O LYS A 16 3.182 -4.806 7.173 1.00 0.00 O ATOM 272 CB LYS A 16 5.049 -2.056 6.832 1.00 0.00 C ATOM 273 CG LYS A 16 6.474 -1.934 6.268 1.00 0.00 C ATOM 274 CD LYS A 16 7.309 -3.194 6.558 1.00 0.00 C ATOM 275 CE LYS A 16 8.754 -3.014 6.075 1.00 0.00 C ATOM 276 NZ LYS A 16 9.599 -4.180 6.447 1.00 0.00 N ATOM 0 H LYS A 16 3.776 -1.174 4.959 1.00 0.00 H new ATOM 0 HA LYS A 16 4.705 -3.760 5.531 1.00 0.00 H new ATOM 0 HB2 LYS A 16 4.607 -1.062 6.896 1.00 0.00 H new ATOM 0 HB3 LYS A 16 5.102 -2.448 7.848 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.427 -1.768 5.192 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.965 -1.064 6.703 1.00 0.00 H new ATOM 0 HD2 LYS A 16 7.302 -3.402 7.628 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.860 -4.055 6.063 1.00 0.00 H new ATOM 0 HE2 LYS A 16 8.764 -2.886 4.993 1.00 0.00 H new ATOM 0 HE3 LYS A 16 9.174 -2.106 6.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.570 -4.028 6.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 9.608 -4.286 7.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 9.211 -5.042 6.014 1.00 0.00 H new ATOM 290 N LEU A 17 2.064 -2.854 7.296 1.00 0.00 N ATOM 291 CA LEU A 17 0.902 -3.392 8.003 1.00 0.00 C ATOM 292 C LEU A 17 0.180 -4.470 7.183 1.00 0.00 C ATOM 293 O LEU A 17 -0.065 -5.567 7.684 1.00 0.00 O ATOM 294 CB LEU A 17 -0.026 -2.219 8.373 1.00 0.00 C ATOM 295 CG LEU A 17 0.147 -1.779 9.834 1.00 0.00 C ATOM 296 CD1 LEU A 17 -0.617 -0.484 10.073 1.00 0.00 C ATOM 297 CD2 LEU A 17 -0.379 -2.818 10.828 1.00 0.00 C ATOM 0 H LEU A 17 2.019 -1.847 7.139 1.00 0.00 H new ATOM 0 HA LEU A 17 1.228 -3.892 8.915 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.179 -1.375 7.715 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.062 -2.511 8.204 1.00 0.00 H new ATOM 0 HG LEU A 17 1.217 -1.651 9.996 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.492 -0.174 11.111 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.231 0.293 9.413 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.675 -0.643 9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.232 -2.456 11.845 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -1.442 -2.984 10.652 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.161 -3.755 10.695 1.00 0.00 H new ATOM 309 N TYR A 18 -0.087 -4.203 5.904 1.00 0.00 N ATOM 310 CA TYR A 18 -0.722 -5.133 4.977 1.00 0.00 C ATOM 311 C TYR A 18 0.061 -6.436 4.749 1.00 0.00 C ATOM 312 O TYR A 18 -0.568 -7.484 4.584 1.00 0.00 O ATOM 313 CB TYR A 18 -1.043 -4.405 3.660 1.00 0.00 C ATOM 314 CG TYR A 18 -2.416 -3.744 3.607 1.00 0.00 C ATOM 315 CD1 TYR A 18 -3.560 -4.459 4.009 1.00 0.00 C ATOM 316 CD2 TYR A 18 -2.554 -2.407 3.178 1.00 0.00 C ATOM 317 CE1 TYR A 18 -4.816 -3.830 4.067 1.00 0.00 C ATOM 318 CE2 TYR A 18 -3.808 -1.766 3.240 1.00 0.00 C ATOM 319 CZ TYR A 18 -4.938 -2.471 3.711 1.00 0.00 C ATOM 320 OH TYR A 18 -6.140 -1.847 3.843 1.00 0.00 O ATOM 0 H TYR A 18 0.140 -3.306 5.474 1.00 0.00 H new ATOM 0 HA TYR A 18 -1.650 -5.465 5.442 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -0.283 -3.643 3.489 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -0.968 -5.119 2.840 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -3.472 -5.502 4.276 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -1.695 -1.872 2.800 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -5.686 -4.387 4.384 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -3.905 -0.737 2.928 1.00 0.00 H new ATOM 0 HH TYR A 18 -6.057 -0.913 3.557 1.00 0.00 H new ATOM 330 N ARG A 19 1.402 -6.418 4.827 1.00 0.00 N ATOM 331 CA ARG A 19 2.238 -7.637 4.800 1.00 0.00 C ATOM 332 C ARG A 19 1.928 -8.631 5.930 1.00 0.00 C ATOM 333 O ARG A 19 2.154 -9.828 5.760 1.00 0.00 O ATOM 334 CB ARG A 19 3.738 -7.263 4.792 1.00 0.00 C ATOM 335 CG ARG A 19 4.452 -7.764 3.527 1.00 0.00 C ATOM 336 CD ARG A 19 4.050 -6.946 2.291 1.00 0.00 C ATOM 337 NE ARG A 19 4.422 -7.618 1.028 1.00 0.00 N ATOM 338 CZ ARG A 19 5.619 -7.705 0.471 1.00 0.00 C ATOM 339 NH1 ARG A 19 6.683 -7.181 1.010 1.00 0.00 N ATOM 340 NH2 ARG A 19 5.767 -8.336 -0.658 1.00 0.00 N ATOM 0 H ARG A 19 1.942 -5.556 4.911 1.00 0.00 H new ATOM 0 HA ARG A 19 1.987 -8.156 3.875 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.842 -6.180 4.861 1.00 0.00 H new ATOM 0 HB3 ARG A 19 4.221 -7.686 5.672 1.00 0.00 H new ATOM 0 HG2 ARG A 19 5.531 -7.704 3.669 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.210 -8.814 3.364 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.974 -6.775 2.306 1.00 0.00 H new ATOM 0 HD3 ARG A 19 4.529 -5.968 2.334 1.00 0.00 H new ATOM 0 HE ARG A 19 3.661 -8.071 0.523 1.00 0.00 H new ATOM 0 HH11 ARG A 19 6.612 -6.680 1.896 1.00 0.00 H new ATOM 0 HH12 ARG A 19 7.587 -7.272 0.546 1.00 0.00 H new ATOM 0 HH21 ARG A 19 4.960 -8.763 -1.113 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.690 -8.403 -1.088 1.00 0.00 H new ATOM 354 N GLU A 20 1.377 -8.158 7.048 1.00 0.00 N ATOM 355 CA GLU A 20 1.000 -8.977 8.211 1.00 0.00 C ATOM 356 C GLU A 20 -0.515 -9.171 8.327 1.00 0.00 C ATOM 357 O GLU A 20 -0.986 -10.254 8.678 1.00 0.00 O ATOM 358 CB GLU A 20 1.523 -8.294 9.483 1.00 0.00 C ATOM 359 CG GLU A 20 2.035 -9.281 10.540 1.00 0.00 C ATOM 360 CD GLU A 20 3.387 -9.906 10.142 1.00 0.00 C ATOM 361 OE1 GLU A 20 4.446 -9.277 10.384 1.00 0.00 O ATOM 362 OE2 GLU A 20 3.402 -11.037 9.600 1.00 0.00 O ATOM 0 H GLU A 20 1.173 -7.167 7.178 1.00 0.00 H new ATOM 0 HA GLU A 20 1.443 -9.965 8.083 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.329 -7.611 9.214 1.00 0.00 H new ATOM 0 HB3 GLU A 20 0.725 -7.691 9.916 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.141 -8.766 11.495 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.299 -10.072 10.684 1.00 0.00 H new ATOM 369 N ALA A 21 -1.284 -8.145 7.966 1.00 0.00 N ATOM 370 CA ALA A 21 -2.739 -8.241 7.830 1.00 0.00 C ATOM 371 C ALA A 21 -3.144 -9.352 6.845 1.00 0.00 C ATOM 372 O ALA A 21 -4.061 -10.110 7.141 1.00 0.00 O ATOM 373 CB ALA A 21 -3.311 -6.882 7.412 1.00 0.00 C ATOM 0 H ALA A 21 -0.914 -7.217 7.758 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.161 -8.513 8.798 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -4.394 -6.958 7.312 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -3.068 -6.137 8.169 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -2.879 -6.583 6.457 1.00 0.00 H new ATOM 379 N SER A 22 -2.423 -9.515 5.727 1.00 0.00 N ATOM 380 CA SER A 22 -2.569 -10.645 4.792 1.00 0.00 C ATOM 381 C SER A 22 -2.345 -12.029 5.437 1.00 0.00 C ATOM 382 O SER A 22 -3.034 -12.989 5.090 1.00 0.00 O ATOM 383 CB SER A 22 -1.598 -10.447 3.620 1.00 0.00 C ATOM 384 OG SER A 22 -1.814 -11.401 2.593 1.00 0.00 O ATOM 0 H SER A 22 -1.705 -8.851 5.439 1.00 0.00 H new ATOM 0 HA SER A 22 -3.604 -10.644 4.451 1.00 0.00 H new ATOM 0 HB2 SER A 22 -1.717 -9.442 3.214 1.00 0.00 H new ATOM 0 HB3 SER A 22 -0.572 -10.526 3.980 1.00 0.00 H new ATOM 0 HG SER A 22 -1.180 -11.244 1.862 1.00 0.00 H new ATOM 390 N GLU A 23 -1.431 -12.148 6.410 1.00 0.00 N ATOM 391 CA GLU A 23 -1.181 -13.397 7.155 1.00 0.00 C ATOM 392 C GLU A 23 -2.363 -13.755 8.070 1.00 0.00 C ATOM 393 O GLU A 23 -2.827 -14.896 8.088 1.00 0.00 O ATOM 394 CB GLU A 23 0.102 -13.260 7.991 1.00 0.00 C ATOM 395 CG GLU A 23 0.683 -14.604 8.456 1.00 0.00 C ATOM 396 CD GLU A 23 1.288 -15.420 7.294 1.00 0.00 C ATOM 397 OE1 GLU A 23 2.492 -15.247 6.987 1.00 0.00 O ATOM 398 OE2 GLU A 23 0.570 -16.253 6.691 1.00 0.00 O ATOM 0 H GLU A 23 -0.837 -11.374 6.707 1.00 0.00 H new ATOM 0 HA GLU A 23 -1.062 -14.201 6.429 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.854 -12.733 7.403 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -0.109 -12.643 8.865 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.451 -14.423 9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.102 -15.189 8.936 1.00 0.00 H new ATOM 405 N LYS A 24 -2.887 -12.763 8.803 1.00 0.00 N ATOM 406 CA LYS A 24 -4.109 -12.917 9.617 1.00 0.00 C ATOM 407 C LYS A 24 -5.354 -13.166 8.747 1.00 0.00 C ATOM 408 O LYS A 24 -6.165 -14.037 9.062 1.00 0.00 O ATOM 409 CB LYS A 24 -4.294 -11.702 10.544 1.00 0.00 C ATOM 410 CG LYS A 24 -3.216 -11.658 11.641 1.00 0.00 C ATOM 411 CD LYS A 24 -3.530 -10.581 12.690 1.00 0.00 C ATOM 412 CE LYS A 24 -2.582 -10.648 13.899 1.00 0.00 C ATOM 413 NZ LYS A 24 -1.212 -10.158 13.586 1.00 0.00 N ATOM 0 H LYS A 24 -2.478 -11.830 8.851 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.986 -13.803 10.240 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.253 -10.785 9.956 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.281 -11.742 11.004 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.148 -12.632 12.126 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.244 -11.457 11.191 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -3.458 -9.596 12.229 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.559 -10.698 13.031 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.998 -10.055 14.714 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -2.523 -11.678 14.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.616 -10.226 14.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.800 -10.739 12.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.260 -9.167 13.275 1.00 0.00 H new ATOM 427 N ALA A 25 -5.454 -12.488 7.602 1.00 0.00 N ATOM 428 CA ALA A 25 -6.467 -12.655 6.559 1.00 0.00 C ATOM 429 C ALA A 25 -6.218 -13.877 5.646 1.00 0.00 C ATOM 430 O ALA A 25 -6.534 -13.830 4.455 1.00 0.00 O ATOM 431 CB ALA A 25 -6.541 -11.353 5.756 1.00 0.00 C ATOM 0 H ALA A 25 -4.783 -11.758 7.363 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.424 -12.861 7.038 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -7.290 -11.452 4.971 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.816 -10.532 6.418 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.570 -11.147 5.307 1.00 0.00 H new ATOM 437 N ARG A 26 -5.657 -14.990 6.158 1.00 0.00 N ATOM 438 CA ARG A 26 -5.427 -16.221 5.375 1.00 0.00 C ATOM 439 C ARG A 26 -6.714 -16.841 4.801 1.00 0.00 C ATOM 440 O ARG A 26 -6.646 -17.640 3.870 1.00 0.00 O ATOM 441 CB ARG A 26 -4.538 -17.202 6.171 1.00 0.00 C ATOM 442 CG ARG A 26 -5.040 -17.706 7.542 1.00 0.00 C ATOM 443 CD ARG A 26 -6.379 -18.449 7.464 1.00 0.00 C ATOM 444 NE ARG A 26 -6.496 -19.528 8.468 1.00 0.00 N ATOM 445 CZ ARG A 26 -7.228 -20.627 8.364 1.00 0.00 C ATOM 446 NH1 ARG A 26 -7.975 -20.875 7.323 1.00 0.00 N ATOM 447 NH2 ARG A 26 -7.225 -21.516 9.315 1.00 0.00 N ATOM 0 H ARG A 26 -5.350 -15.061 7.128 1.00 0.00 H new ATOM 0 HA ARG A 26 -4.872 -15.948 4.478 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -4.361 -18.074 5.542 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -3.572 -16.721 6.328 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -4.290 -18.368 7.974 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -5.143 -16.857 8.218 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -7.193 -17.738 7.606 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -6.496 -18.873 6.467 1.00 0.00 H new ATOM 0 HE ARG A 26 -5.959 -19.415 9.328 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -8.010 -20.210 6.550 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -8.524 -21.734 7.282 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -6.656 -21.369 10.149 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.792 -22.359 9.226 1.00 0.00 H new ATOM 461 N ASN A 27 -7.882 -16.472 5.343 1.00 0.00 N ATOM 462 CA ASN A 27 -9.204 -16.812 4.813 1.00 0.00 C ATOM 463 C ASN A 27 -9.421 -16.162 3.422 1.00 0.00 C ATOM 464 O ASN A 27 -9.291 -14.939 3.300 1.00 0.00 O ATOM 465 CB ASN A 27 -10.259 -16.347 5.836 1.00 0.00 C ATOM 466 CG ASN A 27 -11.676 -16.722 5.425 1.00 0.00 C ATOM 467 OD1 ASN A 27 -12.176 -16.305 4.391 1.00 0.00 O ATOM 468 ND2 ASN A 27 -12.362 -17.529 6.200 1.00 0.00 N ATOM 0 H ASN A 27 -7.931 -15.909 6.192 1.00 0.00 H new ATOM 0 HA ASN A 27 -9.293 -17.889 4.668 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -10.037 -16.789 6.808 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -10.193 -15.266 5.955 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -13.308 -17.805 5.938 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -11.949 -17.880 7.064 1.00 0.00 H new ATOM 475 N PRO A 28 -9.785 -16.933 2.376 1.00 0.00 N ATOM 476 CA PRO A 28 -9.815 -16.450 0.994 1.00 0.00 C ATOM 477 C PRO A 28 -10.899 -15.396 0.714 1.00 0.00 C ATOM 478 O PRO A 28 -10.794 -14.674 -0.278 1.00 0.00 O ATOM 479 CB PRO A 28 -10.009 -17.701 0.131 1.00 0.00 C ATOM 480 CG PRO A 28 -10.758 -18.657 1.057 1.00 0.00 C ATOM 481 CD PRO A 28 -10.164 -18.339 2.426 1.00 0.00 C ATOM 0 HA PRO A 28 -8.888 -15.923 0.767 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -10.582 -17.483 -0.770 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -9.055 -18.119 -0.191 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -11.834 -18.483 1.033 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -10.597 -19.698 0.779 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -10.889 -18.521 3.219 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -9.300 -18.970 2.634 1.00 0.00 H new ATOM 489 N GLU A 29 -11.918 -15.268 1.572 1.00 0.00 N ATOM 490 CA GLU A 29 -12.966 -14.244 1.431 1.00 0.00 C ATOM 491 C GLU A 29 -12.371 -12.839 1.603 1.00 0.00 C ATOM 492 O GLU A 29 -12.417 -12.008 0.691 1.00 0.00 O ATOM 493 CB GLU A 29 -14.106 -14.543 2.426 1.00 0.00 C ATOM 494 CG GLU A 29 -15.465 -13.931 2.052 1.00 0.00 C ATOM 495 CD GLU A 29 -15.523 -12.394 2.160 1.00 0.00 C ATOM 496 OE1 GLU A 29 -15.160 -11.840 3.225 1.00 0.00 O ATOM 497 OE2 GLU A 29 -15.977 -11.737 1.191 1.00 0.00 O ATOM 0 H GLU A 29 -12.041 -15.871 2.385 1.00 0.00 H new ATOM 0 HA GLU A 29 -13.390 -14.274 0.427 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.221 -15.624 2.511 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.816 -14.175 3.410 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -15.711 -14.221 1.031 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -16.232 -14.358 2.698 1.00 0.00 H new ATOM 504 N LYS A 30 -11.694 -12.624 2.733 1.00 0.00 N ATOM 505 CA LYS A 30 -10.906 -11.416 3.029 1.00 0.00 C ATOM 506 C LYS A 30 -9.719 -11.261 2.077 1.00 0.00 C ATOM 507 O LYS A 30 -9.460 -10.147 1.622 1.00 0.00 O ATOM 508 CB LYS A 30 -10.439 -11.430 4.499 1.00 0.00 C ATOM 509 CG LYS A 30 -10.773 -10.134 5.267 1.00 0.00 C ATOM 510 CD LYS A 30 -12.028 -10.261 6.146 1.00 0.00 C ATOM 511 CE LYS A 30 -11.742 -11.118 7.392 1.00 0.00 C ATOM 512 NZ LYS A 30 -12.949 -11.278 8.245 1.00 0.00 N ATOM 0 H LYS A 30 -11.676 -13.304 3.493 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.552 -10.551 2.875 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.901 -12.274 5.010 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.361 -11.591 4.527 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -9.924 -9.861 5.893 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.917 -9.323 4.554 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -12.365 -9.270 6.451 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.837 -10.709 5.569 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.384 -12.100 7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -10.945 -10.657 7.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -12.714 -11.861 9.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.277 -10.343 8.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.702 -11.742 7.698 1.00 0.00 H new ATOM 526 N LYS A 31 -9.047 -12.360 1.705 1.00 0.00 N ATOM 527 CA LYS A 31 -7.937 -12.375 0.727 1.00 0.00 C ATOM 528 C LYS A 31 -8.308 -12.045 -0.729 1.00 0.00 C ATOM 529 O LYS A 31 -7.425 -12.030 -1.586 1.00 0.00 O ATOM 530 CB LYS A 31 -7.085 -13.654 0.876 1.00 0.00 C ATOM 531 CG LYS A 31 -5.642 -13.262 1.234 1.00 0.00 C ATOM 532 CD LYS A 31 -4.763 -14.451 1.635 1.00 0.00 C ATOM 533 CE LYS A 31 -4.307 -15.273 0.424 1.00 0.00 C ATOM 534 NZ LYS A 31 -3.284 -16.280 0.812 1.00 0.00 N ATOM 0 H LYS A 31 -9.260 -13.284 2.080 1.00 0.00 H new ATOM 0 HA LYS A 31 -7.315 -11.521 0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.503 -14.296 1.652 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -7.100 -14.225 -0.052 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -5.189 -12.758 0.380 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.663 -12.544 2.054 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.888 -14.088 2.175 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.316 -15.094 2.320 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -5.165 -15.776 -0.022 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -3.897 -14.608 -0.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.994 -16.821 -0.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.456 -15.796 1.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.685 -16.928 1.520 1.00 0.00 H new ATOM 548 N SER A 32 -9.566 -11.684 -0.995 1.00 0.00 N ATOM 549 CA SER A 32 -10.030 -11.058 -2.247 1.00 0.00 C ATOM 550 C SER A 32 -10.706 -9.686 -2.021 1.00 0.00 C ATOM 551 O SER A 32 -11.246 -9.080 -2.948 1.00 0.00 O ATOM 552 CB SER A 32 -10.938 -12.051 -2.991 1.00 0.00 C ATOM 553 OG SER A 32 -11.003 -11.771 -4.382 1.00 0.00 O ATOM 0 H SER A 32 -10.321 -11.822 -0.323 1.00 0.00 H new ATOM 0 HA SER A 32 -9.163 -10.836 -2.869 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.566 -13.065 -2.842 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.941 -12.014 -2.566 1.00 0.00 H new ATOM 0 HG SER A 32 -11.108 -10.806 -4.517 1.00 0.00 H new ATOM 559 N VAL A 33 -10.615 -9.147 -0.796 1.00 0.00 N ATOM 560 CA VAL A 33 -11.090 -7.807 -0.400 1.00 0.00 C ATOM 561 C VAL A 33 -9.903 -6.892 -0.099 1.00 0.00 C ATOM 562 O VAL A 33 -9.777 -5.848 -0.743 1.00 0.00 O ATOM 563 CB VAL A 33 -12.050 -7.895 0.805 1.00 0.00 C ATOM 564 CG1 VAL A 33 -12.409 -6.520 1.381 1.00 0.00 C ATOM 565 CG2 VAL A 33 -13.360 -8.582 0.404 1.00 0.00 C ATOM 0 H VAL A 33 -10.190 -9.653 -0.019 1.00 0.00 H new ATOM 0 HA VAL A 33 -11.648 -7.377 -1.232 1.00 0.00 H new ATOM 0 HB VAL A 33 -11.519 -8.470 1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -13.086 -6.645 2.226 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -11.501 -6.017 1.715 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -12.895 -5.919 0.612 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -14.023 -8.634 1.268 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -13.842 -8.011 -0.390 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -13.148 -9.590 0.048 1.00 0.00 H new ATOM 575 N LEU A 34 -8.968 -7.289 0.782 1.00 0.00 N ATOM 576 CA LEU A 34 -7.740 -6.512 0.982 1.00 0.00 C ATOM 577 C LEU A 34 -6.837 -6.533 -0.272 1.00 0.00 C ATOM 578 O LEU A 34 -6.044 -5.618 -0.477 1.00 0.00 O ATOM 579 CB LEU A 34 -7.066 -6.893 2.320 1.00 0.00 C ATOM 580 CG LEU A 34 -5.956 -7.934 2.220 1.00 0.00 C ATOM 581 CD1 LEU A 34 -5.175 -8.041 3.528 1.00 0.00 C ATOM 582 CD2 LEU A 34 -6.430 -9.334 1.867 1.00 0.00 C ATOM 0 H LEU A 34 -9.039 -8.129 1.356 1.00 0.00 H new ATOM 0 HA LEU A 34 -7.985 -5.456 1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -6.654 -5.990 2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -7.832 -7.267 2.999 1.00 0.00 H new ATOM 0 HG LEU A 34 -5.331 -7.569 1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.391 -8.791 3.424 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.725 -7.076 3.763 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.851 -8.332 4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.574 -10.006 1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.125 -9.686 2.630 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.932 -9.315 0.900 1.00 0.00 H new ATOM 594 N GLN A 35 -6.997 -7.527 -1.158 1.00 0.00 N ATOM 595 CA GLN A 35 -6.273 -7.609 -2.431 1.00 0.00 C ATOM 596 C GLN A 35 -6.691 -6.502 -3.420 1.00 0.00 C ATOM 597 O GLN A 35 -5.859 -6.003 -4.177 1.00 0.00 O ATOM 598 CB GLN A 35 -6.501 -9.004 -3.038 1.00 0.00 C ATOM 599 CG GLN A 35 -5.350 -9.428 -3.964 1.00 0.00 C ATOM 600 CD GLN A 35 -5.647 -10.701 -4.761 1.00 0.00 C ATOM 601 OE1 GLN A 35 -5.436 -10.767 -5.966 1.00 0.00 O ATOM 602 NE2 GLN A 35 -6.138 -11.762 -4.154 1.00 0.00 N ATOM 0 H GLN A 35 -7.640 -8.304 -1.007 1.00 0.00 H new ATOM 0 HA GLN A 35 -5.212 -7.454 -2.236 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -6.608 -9.734 -2.236 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -7.436 -9.006 -3.598 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.134 -8.616 -4.658 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.452 -9.584 -3.367 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.324 -11.736 -3.151 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -6.333 -12.610 -4.687 1.00 0.00 H new ATOM 611 N LYS A 36 -7.965 -6.082 -3.395 1.00 0.00 N ATOM 612 CA LYS A 36 -8.503 -5.016 -4.261 1.00 0.00 C ATOM 613 C LYS A 36 -7.985 -3.635 -3.858 1.00 0.00 C ATOM 614 O LYS A 36 -7.581 -2.854 -4.719 1.00 0.00 O ATOM 615 CB LYS A 36 -10.041 -5.072 -4.214 1.00 0.00 C ATOM 616 CG LYS A 36 -10.703 -4.267 -5.341 1.00 0.00 C ATOM 617 CD LYS A 36 -12.231 -4.267 -5.172 1.00 0.00 C ATOM 618 CE LYS A 36 -12.952 -3.611 -6.358 1.00 0.00 C ATOM 619 NZ LYS A 36 -12.981 -4.494 -7.555 1.00 0.00 N ATOM 0 H LYS A 36 -8.662 -6.478 -2.764 1.00 0.00 H new ATOM 0 HA LYS A 36 -8.161 -5.183 -5.282 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -10.364 -6.111 -4.279 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -10.384 -4.691 -3.252 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -10.330 -3.243 -5.333 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.437 -4.696 -6.307 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -12.581 -5.293 -5.060 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -12.492 -3.739 -4.255 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.973 -3.361 -6.068 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.454 -2.675 -6.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -13.477 -4.011 -8.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -12.008 -4.712 -7.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -13.479 -5.377 -7.323 1.00 0.00 H new ATOM 633 N ILE A 37 -7.905 -3.382 -2.548 1.00 0.00 N ATOM 634 CA ILE A 37 -7.125 -2.275 -1.977 1.00 0.00 C ATOM 635 C ILE A 37 -5.682 -2.403 -2.449 1.00 0.00 C ATOM 636 O ILE A 37 -5.199 -1.477 -3.076 1.00 0.00 O ATOM 637 CB ILE A 37 -7.212 -2.296 -0.428 1.00 0.00 C ATOM 638 CG1 ILE A 37 -8.636 -2.007 0.080 1.00 0.00 C ATOM 639 CG2 ILE A 37 -6.152 -1.380 0.211 1.00 0.00 C ATOM 640 CD1 ILE A 37 -8.840 -2.092 1.600 1.00 0.00 C ATOM 0 H ILE A 37 -8.384 -3.945 -1.845 1.00 0.00 H new ATOM 0 HA ILE A 37 -7.529 -1.320 -2.314 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.982 -3.311 -0.105 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -8.922 -1.008 -0.249 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -9.320 -2.708 -0.398 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -6.243 -1.420 1.296 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -5.157 -1.715 -0.082 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.304 -0.355 -0.128 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.880 -1.870 1.841 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.595 -3.097 1.944 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -8.191 -1.370 2.095 1.00 0.00 H new ATOM 652 N LEU A 38 -4.996 -3.528 -2.231 1.00 0.00 N ATOM 653 CA LEU A 38 -3.581 -3.649 -2.593 1.00 0.00 C ATOM 654 C LEU A 38 -3.278 -3.420 -4.085 1.00 0.00 C ATOM 655 O LEU A 38 -2.226 -2.860 -4.397 1.00 0.00 O ATOM 656 CB LEU A 38 -3.021 -4.986 -2.079 1.00 0.00 C ATOM 657 CG LEU A 38 -2.774 -4.987 -0.558 1.00 0.00 C ATOM 658 CD1 LEU A 38 -2.390 -6.394 -0.097 1.00 0.00 C ATOM 659 CD2 LEU A 38 -1.647 -4.024 -0.177 1.00 0.00 C ATOM 0 H LEU A 38 -5.395 -4.365 -1.807 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.062 -2.830 -2.095 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.717 -5.786 -2.330 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -2.086 -5.205 -2.594 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.695 -4.664 -0.072 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.216 -6.390 0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.198 -7.087 -0.331 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.481 -6.710 -0.610 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.497 -4.048 0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -0.727 -4.325 -0.678 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.913 -3.013 -0.484 1.00 0.00 H new ATOM 671 N GLU A 39 -4.185 -3.758 -5.006 1.00 0.00 N ATOM 672 CA GLU A 39 -4.001 -3.444 -6.432 1.00 0.00 C ATOM 673 C GLU A 39 -4.124 -1.937 -6.737 1.00 0.00 C ATOM 674 O GLU A 39 -3.329 -1.387 -7.501 1.00 0.00 O ATOM 675 CB GLU A 39 -4.986 -4.275 -7.270 1.00 0.00 C ATOM 676 CG GLU A 39 -4.595 -4.292 -8.752 1.00 0.00 C ATOM 677 CD GLU A 39 -5.554 -5.176 -9.573 1.00 0.00 C ATOM 678 OE1 GLU A 39 -5.390 -6.420 -9.576 1.00 0.00 O ATOM 679 OE2 GLU A 39 -6.472 -4.632 -10.235 1.00 0.00 O ATOM 0 H GLU A 39 -5.054 -4.248 -4.793 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.981 -3.713 -6.705 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -5.016 -5.296 -6.890 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -5.990 -3.865 -7.163 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -4.607 -3.276 -9.145 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.575 -4.662 -8.857 1.00 0.00 H new ATOM 686 N ASP A 40 -5.063 -1.245 -6.087 1.00 0.00 N ATOM 687 CA ASP A 40 -5.169 0.217 -6.059 1.00 0.00 C ATOM 688 C ASP A 40 -3.959 0.876 -5.373 1.00 0.00 C ATOM 689 O ASP A 40 -3.507 1.952 -5.756 1.00 0.00 O ATOM 690 CB ASP A 40 -6.435 0.553 -5.246 1.00 0.00 C ATOM 691 CG ASP A 40 -7.726 0.768 -6.045 1.00 0.00 C ATOM 692 OD1 ASP A 40 -7.768 0.558 -7.281 1.00 0.00 O ATOM 693 OD2 ASP A 40 -8.723 1.140 -5.383 1.00 0.00 O ATOM 0 H ASP A 40 -5.797 -1.703 -5.546 1.00 0.00 H new ATOM 0 HA ASP A 40 -5.209 0.593 -7.081 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.606 -0.253 -4.533 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.239 1.455 -4.667 1.00 0.00 H new ATOM 698 N GLU A 41 -3.440 0.231 -4.335 1.00 0.00 N ATOM 699 CA GLU A 41 -2.469 0.799 -3.404 1.00 0.00 C ATOM 700 C GLU A 41 -1.044 0.745 -3.976 1.00 0.00 C ATOM 701 O GLU A 41 -0.275 1.694 -3.824 1.00 0.00 O ATOM 702 CB GLU A 41 -2.614 0.038 -2.072 1.00 0.00 C ATOM 703 CG GLU A 41 -2.216 0.791 -0.817 1.00 0.00 C ATOM 704 CD GLU A 41 -3.076 2.040 -0.595 1.00 0.00 C ATOM 705 OE1 GLU A 41 -2.689 3.107 -1.126 1.00 0.00 O ATOM 706 OE2 GLU A 41 -4.151 2.022 0.068 1.00 0.00 O ATOM 0 H GLU A 41 -3.690 -0.732 -4.110 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.663 1.858 -3.236 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.653 -0.273 -1.968 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -2.014 -0.870 -2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.308 0.131 0.045 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.168 1.081 -0.886 1.00 0.00 H new ATOM 713 N GLU A 42 -0.724 -0.304 -4.740 1.00 0.00 N ATOM 714 CA GLU A 42 0.441 -0.353 -5.638 1.00 0.00 C ATOM 715 C GLU A 42 0.365 0.731 -6.732 1.00 0.00 C ATOM 716 O GLU A 42 1.381 1.317 -7.112 1.00 0.00 O ATOM 717 CB GLU A 42 0.512 -1.749 -6.285 1.00 0.00 C ATOM 718 CG GLU A 42 1.842 -2.021 -6.998 1.00 0.00 C ATOM 719 CD GLU A 42 1.672 -3.081 -8.104 1.00 0.00 C ATOM 720 OE1 GLU A 42 1.802 -4.296 -7.818 1.00 0.00 O ATOM 721 OE2 GLU A 42 1.420 -2.703 -9.274 1.00 0.00 O ATOM 0 H GLU A 42 -1.277 -1.161 -4.754 1.00 0.00 H new ATOM 0 HA GLU A 42 1.339 -0.161 -5.051 1.00 0.00 H new ATOM 0 HB2 GLU A 42 0.359 -2.506 -5.516 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -0.304 -1.852 -7.001 1.00 0.00 H new ATOM 0 HG2 GLU A 42 2.221 -1.096 -7.432 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.583 -2.361 -6.275 1.00 0.00 H new ATOM 728 N LYS A 43 -0.842 1.040 -7.227 1.00 0.00 N ATOM 729 CA LYS A 43 -1.051 2.053 -8.273 1.00 0.00 C ATOM 730 C LYS A 43 -0.614 3.451 -7.826 1.00 0.00 C ATOM 731 O LYS A 43 -0.005 4.176 -8.609 1.00 0.00 O ATOM 732 CB LYS A 43 -2.517 2.033 -8.752 1.00 0.00 C ATOM 733 CG LYS A 43 -2.639 2.144 -10.279 1.00 0.00 C ATOM 734 CD LYS A 43 -2.251 0.831 -10.981 1.00 0.00 C ATOM 735 CE LYS A 43 -2.373 0.979 -12.502 1.00 0.00 C ATOM 736 NZ LYS A 43 -2.030 -0.289 -13.200 1.00 0.00 N ATOM 0 H LYS A 43 -1.704 0.594 -6.913 1.00 0.00 H new ATOM 0 HA LYS A 43 -0.413 1.795 -9.118 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -2.992 1.110 -8.419 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -3.059 2.856 -8.287 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.663 2.409 -10.543 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -1.999 2.950 -10.637 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.229 0.559 -10.717 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.896 0.023 -10.635 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -3.390 1.274 -12.760 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -1.713 1.775 -12.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -2.122 -0.156 -14.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -1.051 -0.557 -12.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -2.676 -1.042 -12.889 1.00 0.00 H new ATOM 750 N HIS A 44 -0.830 3.816 -6.559 1.00 0.00 N ATOM 751 CA HIS A 44 -0.390 5.070 -5.980 1.00 0.00 C ATOM 752 C HIS A 44 1.131 5.202 -5.982 1.00 0.00 C ATOM 753 O HIS A 44 1.648 6.252 -6.349 1.00 0.00 O ATOM 754 CB HIS A 44 -0.944 5.111 -4.556 1.00 0.00 C ATOM 755 CG HIS A 44 -2.446 5.063 -4.430 1.00 0.00 C ATOM 756 ND1 HIS A 44 -3.169 4.916 -3.231 1.00 0.00 N ATOM 757 CD2 HIS A 44 -3.318 5.135 -5.475 1.00 0.00 C ATOM 758 CE1 HIS A 44 -4.468 4.878 -3.624 1.00 0.00 C ATOM 759 NE2 HIS A 44 -4.571 4.993 -4.957 1.00 0.00 N ATOM 0 H HIS A 44 -1.331 3.224 -5.896 1.00 0.00 H new ATOM 0 HA HIS A 44 -0.758 5.908 -6.572 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -0.526 4.272 -4.000 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -0.588 6.022 -4.075 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -3.065 5.277 -6.515 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -5.307 4.770 -2.953 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -5.439 4.977 -5.492 1.00 0.00 H new ATOM 767 N ILE A 45 1.846 4.131 -5.627 1.00 0.00 N ATOM 768 CA ILE A 45 3.309 4.060 -5.645 1.00 0.00 C ATOM 769 C ILE A 45 3.883 4.293 -7.052 1.00 0.00 C ATOM 770 O ILE A 45 4.850 5.040 -7.192 1.00 0.00 O ATOM 771 CB ILE A 45 3.737 2.688 -5.076 1.00 0.00 C ATOM 772 CG1 ILE A 45 3.277 2.451 -3.620 1.00 0.00 C ATOM 773 CG2 ILE A 45 5.246 2.482 -5.191 1.00 0.00 C ATOM 774 CD1 ILE A 45 3.857 3.422 -2.587 1.00 0.00 C ATOM 0 H ILE A 45 1.410 3.265 -5.310 1.00 0.00 H new ATOM 0 HA ILE A 45 3.714 4.859 -5.024 1.00 0.00 H new ATOM 0 HB ILE A 45 3.226 1.948 -5.692 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.189 2.515 -3.584 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.546 1.435 -3.331 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.512 1.508 -4.782 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.541 2.528 -6.239 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.763 3.263 -4.634 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.474 3.172 -1.598 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.944 3.345 -2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.566 4.441 -2.842 1.00 0.00 H new ATOM 786 N GLU A 46 3.281 3.729 -8.105 1.00 0.00 N ATOM 787 CA GLU A 46 3.693 3.986 -9.490 1.00 0.00 C ATOM 788 C GLU A 46 3.613 5.477 -9.856 1.00 0.00 C ATOM 789 O GLU A 46 4.526 6.017 -10.486 1.00 0.00 O ATOM 790 CB GLU A 46 2.820 3.166 -10.451 1.00 0.00 C ATOM 791 CG GLU A 46 3.186 1.680 -10.520 1.00 0.00 C ATOM 792 CD GLU A 46 4.504 1.452 -11.286 1.00 0.00 C ATOM 793 OE1 GLU A 46 4.482 1.413 -12.541 1.00 0.00 O ATOM 794 OE2 GLU A 46 5.571 1.308 -10.644 1.00 0.00 O ATOM 0 H GLU A 46 2.496 3.083 -8.022 1.00 0.00 H new ATOM 0 HA GLU A 46 4.736 3.684 -9.582 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.778 3.258 -10.145 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.898 3.595 -11.450 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.278 1.281 -9.510 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.382 1.129 -11.008 1.00 0.00 H new ATOM 801 N TRP A 47 2.550 6.162 -9.429 1.00 0.00 N ATOM 802 CA TRP A 47 2.352 7.584 -9.683 1.00 0.00 C ATOM 803 C TRP A 47 3.281 8.447 -8.824 1.00 0.00 C ATOM 804 O TRP A 47 3.902 9.379 -9.324 1.00 0.00 O ATOM 805 CB TRP A 47 0.891 7.939 -9.385 1.00 0.00 C ATOM 806 CG TRP A 47 -0.196 7.106 -9.998 1.00 0.00 C ATOM 807 CD1 TRP A 47 -0.099 6.289 -11.074 1.00 0.00 C ATOM 808 CD2 TRP A 47 -1.575 6.981 -9.535 1.00 0.00 C ATOM 809 NE1 TRP A 47 -1.319 5.675 -11.302 1.00 0.00 N ATOM 810 CE2 TRP A 47 -2.265 6.060 -10.374 1.00 0.00 C ATOM 811 CE3 TRP A 47 -2.304 7.553 -8.472 1.00 0.00 C ATOM 812 CZ2 TRP A 47 -3.611 5.719 -10.162 1.00 0.00 C ATOM 813 CZ3 TRP A 47 -3.657 7.232 -8.251 1.00 0.00 C ATOM 814 CH2 TRP A 47 -4.309 6.310 -9.091 1.00 0.00 C ATOM 0 H TRP A 47 1.795 5.736 -8.891 1.00 0.00 H new ATOM 0 HA TRP A 47 2.589 7.787 -10.727 1.00 0.00 H new ATOM 0 HB2 TRP A 47 0.759 7.910 -8.303 1.00 0.00 H new ATOM 0 HB3 TRP A 47 0.732 8.971 -9.698 1.00 0.00 H new ATOM 0 HD1 TRP A 47 0.793 6.139 -11.664 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -1.497 5.019 -12.062 1.00 0.00 H new ATOM 0 HE3 TRP A 47 -1.813 8.253 -7.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 -4.105 5.012 -10.812 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 -4.195 7.694 -7.436 1.00 0.00 H new ATOM 0 HH2 TRP A 47 -5.344 6.056 -8.914 1.00 0.00 H new ATOM 825 N LEU A 48 3.433 8.107 -7.545 1.00 0.00 N ATOM 826 CA LEU A 48 4.373 8.727 -6.612 1.00 0.00 C ATOM 827 C LEU A 48 5.814 8.694 -7.139 1.00 0.00 C ATOM 828 O LEU A 48 6.531 9.691 -7.050 1.00 0.00 O ATOM 829 CB LEU A 48 4.234 7.983 -5.270 1.00 0.00 C ATOM 830 CG LEU A 48 3.058 8.475 -4.415 1.00 0.00 C ATOM 831 CD1 LEU A 48 2.741 7.461 -3.315 1.00 0.00 C ATOM 832 CD2 LEU A 48 3.376 9.807 -3.730 1.00 0.00 C ATOM 0 H LEU A 48 2.884 7.364 -7.114 1.00 0.00 H new ATOM 0 HA LEU A 48 4.139 9.784 -6.486 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.110 6.918 -5.466 1.00 0.00 H new ATOM 0 HB3 LEU A 48 5.158 8.097 -4.703 1.00 0.00 H new ATOM 0 HG LEU A 48 2.211 8.601 -5.089 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.905 7.823 -2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.477 6.505 -3.767 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.615 7.331 -2.677 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.520 10.123 -3.134 1.00 0.00 H new ATOM 0 HD22 LEU A 48 4.244 9.685 -3.082 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.591 10.563 -4.486 1.00 0.00 H new ATOM 844 N GLU A 49 6.220 7.584 -7.753 1.00 0.00 N ATOM 845 CA GLU A 49 7.517 7.467 -8.430 1.00 0.00 C ATOM 846 C GLU A 49 7.590 8.287 -9.724 1.00 0.00 C ATOM 847 O GLU A 49 8.582 8.978 -9.951 1.00 0.00 O ATOM 848 CB GLU A 49 7.827 5.995 -8.744 1.00 0.00 C ATOM 849 CG GLU A 49 9.339 5.738 -8.718 1.00 0.00 C ATOM 850 CD GLU A 49 9.683 4.306 -9.173 1.00 0.00 C ATOM 851 OE1 GLU A 49 9.877 4.086 -10.394 1.00 0.00 O ATOM 852 OE2 GLU A 49 9.791 3.395 -8.317 1.00 0.00 O ATOM 0 H GLU A 49 5.658 6.734 -7.797 1.00 0.00 H new ATOM 0 HA GLU A 49 8.261 7.870 -7.742 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.332 5.352 -8.017 1.00 0.00 H new ATOM 0 HB3 GLU A 49 7.426 5.736 -9.724 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.841 6.456 -9.366 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.718 5.900 -7.709 1.00 0.00 H new ATOM 859 N THR A 50 6.547 8.260 -10.563 1.00 0.00 N ATOM 860 CA THR A 50 6.535 9.070 -11.803 1.00 0.00 C ATOM 861 C THR A 50 6.512 10.587 -11.538 1.00 0.00 C ATOM 862 O THR A 50 6.977 11.377 -12.362 1.00 0.00 O ATOM 863 CB THR A 50 5.436 8.614 -12.786 1.00 0.00 C ATOM 864 OG1 THR A 50 5.953 8.646 -14.101 1.00 0.00 O ATOM 865 CG2 THR A 50 4.145 9.438 -12.800 1.00 0.00 C ATOM 0 H THR A 50 5.709 7.697 -10.416 1.00 0.00 H new ATOM 0 HA THR A 50 7.488 8.881 -12.297 1.00 0.00 H new ATOM 0 HB THR A 50 5.163 7.619 -12.434 1.00 0.00 H new ATOM 0 HG1 THR A 50 5.261 8.356 -14.732 1.00 0.00 H new ATOM 0 HG21 THR A 50 3.453 9.018 -13.530 1.00 0.00 H new ATOM 0 HG22 THR A 50 3.687 9.414 -11.811 1.00 0.00 H new ATOM 0 HG23 THR A 50 4.374 10.469 -13.069 1.00 0.00 H new ATOM 873 N ILE A 51 6.028 10.995 -10.359 1.00 0.00 N ATOM 874 CA ILE A 51 5.992 12.385 -9.871 1.00 0.00 C ATOM 875 C ILE A 51 7.294 12.820 -9.171 1.00 0.00 C ATOM 876 O ILE A 51 7.559 14.017 -9.033 1.00 0.00 O ATOM 877 CB ILE A 51 4.711 12.578 -9.013 1.00 0.00 C ATOM 878 CG1 ILE A 51 3.427 12.524 -9.881 1.00 0.00 C ATOM 879 CG2 ILE A 51 4.687 13.856 -8.158 1.00 0.00 C ATOM 880 CD1 ILE A 51 3.210 13.698 -10.849 1.00 0.00 C ATOM 0 H ILE A 51 5.632 10.338 -9.686 1.00 0.00 H new ATOM 0 HA ILE A 51 5.935 13.062 -10.723 1.00 0.00 H new ATOM 0 HB ILE A 51 4.735 11.738 -8.318 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.444 11.601 -10.461 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.566 12.466 -9.215 1.00 0.00 H new ATOM 0 HG21 ILE A 51 3.754 13.901 -7.596 1.00 0.00 H new ATOM 0 HG22 ILE A 51 5.528 13.846 -7.465 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.762 14.729 -8.806 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.281 13.548 -11.400 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.151 14.629 -10.285 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.043 13.751 -11.550 1.00 0.00 H new ATOM 892 N ASN A 52 8.151 11.871 -8.793 1.00 0.00 N ATOM 893 CA ASN A 52 9.491 12.147 -8.256 1.00 0.00 C ATOM 894 C ASN A 52 10.430 12.791 -9.309 1.00 0.00 C ATOM 895 O ASN A 52 10.293 12.552 -10.514 1.00 0.00 O ATOM 896 CB ASN A 52 10.086 10.845 -7.684 1.00 0.00 C ATOM 897 CG ASN A 52 11.393 11.061 -6.935 1.00 0.00 C ATOM 898 OD1 ASN A 52 11.594 12.052 -6.249 1.00 0.00 O ATOM 899 ND2 ASN A 52 12.339 10.158 -7.063 1.00 0.00 N ATOM 0 H ASN A 52 7.935 10.876 -8.850 1.00 0.00 H new ATOM 0 HA ASN A 52 9.396 12.881 -7.456 1.00 0.00 H new ATOM 0 HB2 ASN A 52 9.361 10.387 -7.011 1.00 0.00 H new ATOM 0 HB3 ASN A 52 10.254 10.141 -8.499 1.00 0.00 H new ATOM 0 HD21 ASN A 52 13.234 10.287 -6.591 1.00 0.00 H new ATOM 0 HD22 ASN A 52 12.178 9.328 -7.634 1.00 0.00 H new ATOM 906 N GLY A 53 11.425 13.561 -8.842 1.00 0.00 N ATOM 907 CA GLY A 53 12.454 14.232 -9.659 1.00 0.00 C ATOM 908 C GLY A 53 11.905 15.286 -10.625 1.00 0.00 C ATOM 909 O GLY A 53 11.219 16.223 -10.158 1.00 0.00 O ATOM 910 OXT GLY A 53 12.201 15.194 -11.838 1.00 0.00 O ATOM 0 H GLY A 53 11.541 13.742 -7.845 1.00 0.00 H new ATOM 0 HA2 GLY A 53 13.176 14.706 -8.994 1.00 0.00 H new ATOM 0 HA3 GLY A 53 12.995 13.478 -10.231 1.00 0.00 H new TER 914 GLY A 53 ATOM 915 N MET B 1 -5.916 -10.759 17.703 1.00 0.00 N ATOM 916 CA MET B 1 -7.155 -10.268 17.042 1.00 0.00 C ATOM 917 C MET B 1 -7.314 -8.755 17.267 1.00 0.00 C ATOM 918 O MET B 1 -8.082 -8.322 18.124 1.00 0.00 O ATOM 919 CB MET B 1 -8.372 -11.096 17.521 1.00 0.00 C ATOM 920 CG MET B 1 -9.693 -10.753 16.814 1.00 0.00 C ATOM 921 SD MET B 1 -11.078 -11.867 17.201 1.00 0.00 S ATOM 922 CE MET B 1 -11.269 -11.593 18.988 1.00 0.00 C ATOM 0 H1 MET B 1 -5.820 -11.782 17.544 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.091 -10.267 17.303 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.970 -10.571 18.724 1.00 0.00 H new ATOM 0 HA MET B 1 -7.087 -10.410 15.963 1.00 0.00 H new ATOM 0 HB2 MET B 1 -8.158 -12.154 17.370 1.00 0.00 H new ATOM 0 HB3 MET B 1 -8.499 -10.946 18.593 1.00 0.00 H new ATOM 0 HG2 MET B 1 -9.978 -9.735 17.081 1.00 0.00 H new ATOM 0 HG3 MET B 1 -9.526 -10.765 15.737 1.00 0.00 H new ATOM 0 HE1 MET B 1 -12.159 -12.113 19.343 1.00 0.00 H new ATOM 0 HE2 MET B 1 -10.392 -11.976 19.511 1.00 0.00 H new ATOM 0 HE3 MET B 1 -11.371 -10.526 19.184 1.00 0.00 H new ATOM 934 N ASP B 2 -6.547 -7.936 16.528 1.00 0.00 N ATOM 935 CA ASP B 2 -6.474 -6.470 16.711 1.00 0.00 C ATOM 936 C ASP B 2 -5.908 -5.755 15.456 1.00 0.00 C ATOM 937 O ASP B 2 -4.885 -5.070 15.515 1.00 0.00 O ATOM 938 CB ASP B 2 -5.653 -6.156 17.983 1.00 0.00 C ATOM 939 CG ASP B 2 -5.676 -4.667 18.379 1.00 0.00 C ATOM 940 OD1 ASP B 2 -6.699 -3.981 18.145 1.00 0.00 O ATOM 941 OD2 ASP B 2 -4.683 -4.189 18.981 1.00 0.00 O ATOM 0 H ASP B 2 -5.950 -8.276 15.774 1.00 0.00 H new ATOM 0 HA ASP B 2 -7.483 -6.080 16.842 1.00 0.00 H new ATOM 0 HB2 ASP B 2 -6.040 -6.750 18.811 1.00 0.00 H new ATOM 0 HB3 ASP B 2 -4.620 -6.465 17.824 1.00 0.00 H new ATOM 946 N TYR B 3 -6.526 -5.977 14.287 1.00 0.00 N ATOM 947 CA TYR B 3 -6.027 -5.514 12.977 1.00 0.00 C ATOM 948 C TYR B 3 -7.153 -4.993 12.060 1.00 0.00 C ATOM 949 O TYR B 3 -7.466 -5.531 11.001 1.00 0.00 O ATOM 950 CB TYR B 3 -5.071 -6.557 12.355 1.00 0.00 C ATOM 951 CG TYR B 3 -5.701 -7.736 11.628 1.00 0.00 C ATOM 952 CD1 TYR B 3 -6.493 -8.676 12.317 1.00 0.00 C ATOM 953 CD2 TYR B 3 -5.524 -7.859 10.236 1.00 0.00 C ATOM 954 CE1 TYR B 3 -7.142 -9.707 11.608 1.00 0.00 C ATOM 955 CE2 TYR B 3 -6.172 -8.883 9.523 1.00 0.00 C ATOM 956 CZ TYR B 3 -6.997 -9.802 10.207 1.00 0.00 C ATOM 957 OH TYR B 3 -7.656 -10.775 9.522 1.00 0.00 O ATOM 0 H TYR B 3 -7.403 -6.493 14.221 1.00 0.00 H new ATOM 0 HA TYR B 3 -5.414 -4.625 13.126 1.00 0.00 H new ATOM 0 HB2 TYR B 3 -4.417 -6.039 11.654 1.00 0.00 H new ATOM 0 HB3 TYR B 3 -4.438 -6.950 13.150 1.00 0.00 H new ATOM 0 HD1 TYR B 3 -6.603 -8.606 13.389 1.00 0.00 H new ATOM 0 HD2 TYR B 3 -4.886 -7.162 9.713 1.00 0.00 H new ATOM 0 HE1 TYR B 3 -7.751 -10.425 12.137 1.00 0.00 H new ATOM 0 HE2 TYR B 3 -6.039 -8.966 8.454 1.00 0.00 H new ATOM 0 HH TYR B 3 -7.449 -10.700 8.567 1.00 0.00 H new ATOM 967 N LEU B 4 -7.777 -3.900 12.506 1.00 0.00 N ATOM 968 CA LEU B 4 -8.811 -3.158 11.770 1.00 0.00 C ATOM 969 C LEU B 4 -8.665 -1.639 11.933 1.00 0.00 C ATOM 970 O LEU B 4 -8.389 -0.957 10.945 1.00 0.00 O ATOM 971 CB LEU B 4 -10.215 -3.721 12.095 1.00 0.00 C ATOM 972 CG LEU B 4 -10.553 -3.906 13.592 1.00 0.00 C ATOM 973 CD1 LEU B 4 -11.525 -2.848 14.114 1.00 0.00 C ATOM 974 CD2 LEU B 4 -11.188 -5.274 13.843 1.00 0.00 C ATOM 0 H LEU B 4 -7.572 -3.492 13.418 1.00 0.00 H new ATOM 0 HA LEU B 4 -8.668 -3.317 10.701 1.00 0.00 H new ATOM 0 HB2 LEU B 4 -10.959 -3.056 11.657 1.00 0.00 H new ATOM 0 HB3 LEU B 4 -10.319 -4.686 11.600 1.00 0.00 H new ATOM 0 HG LEU B 4 -9.604 -3.811 14.120 1.00 0.00 H new ATOM 0 HD11 LEU B 4 -11.726 -3.028 15.170 1.00 0.00 H new ATOM 0 HD12 LEU B 4 -11.085 -1.858 13.992 1.00 0.00 H new ATOM 0 HD13 LEU B 4 -12.458 -2.902 13.553 1.00 0.00 H new ATOM 0 HD21 LEU B 4 -11.417 -5.380 14.903 1.00 0.00 H new ATOM 0 HD22 LEU B 4 -12.107 -5.360 13.263 1.00 0.00 H new ATOM 0 HD23 LEU B 4 -10.494 -6.058 13.541 1.00 0.00 H new ATOM 986 N ARG B 5 -8.724 -1.101 13.159 1.00 0.00 N ATOM 987 CA ARG B 5 -8.520 0.338 13.418 1.00 0.00 C ATOM 988 C ARG B 5 -7.088 0.787 13.104 1.00 0.00 C ATOM 989 O ARG B 5 -6.883 1.861 12.542 1.00 0.00 O ATOM 990 CB ARG B 5 -8.954 0.657 14.860 1.00 0.00 C ATOM 991 CG ARG B 5 -8.955 2.167 15.171 1.00 0.00 C ATOM 992 CD ARG B 5 -10.146 2.586 16.046 1.00 0.00 C ATOM 993 NE ARG B 5 -10.159 1.916 17.365 1.00 0.00 N ATOM 994 CZ ARG B 5 -11.216 1.720 18.136 1.00 0.00 C ATOM 995 NH1 ARG B 5 -12.414 2.096 17.784 1.00 0.00 N ATOM 996 NH2 ARG B 5 -11.093 1.135 19.294 1.00 0.00 N ATOM 0 H ARG B 5 -8.914 -1.646 14.000 1.00 0.00 H new ATOM 0 HA ARG B 5 -9.147 0.917 12.739 1.00 0.00 H new ATOM 0 HB2 ARG B 5 -9.954 0.257 15.029 1.00 0.00 H new ATOM 0 HB3 ARG B 5 -8.285 0.149 15.555 1.00 0.00 H new ATOM 0 HG2 ARG B 5 -8.026 2.431 15.676 1.00 0.00 H new ATOM 0 HG3 ARG B 5 -8.980 2.727 14.236 1.00 0.00 H new ATOM 0 HD2 ARG B 5 -10.119 3.666 16.193 1.00 0.00 H new ATOM 0 HD3 ARG B 5 -11.073 2.359 15.520 1.00 0.00 H new ATOM 0 HE ARG B 5 -9.265 1.571 17.714 1.00 0.00 H new ATOM 0 HH11 ARG B 5 -12.560 2.559 16.887 1.00 0.00 H new ATOM 0 HH12 ARG B 5 -13.205 1.927 18.406 1.00 0.00 H new ATOM 0 HH21 ARG B 5 -10.176 0.824 19.613 1.00 0.00 H new ATOM 0 HH22 ARG B 5 -11.914 0.989 19.881 1.00 0.00 H new ATOM 1010 N GLU B 6 -6.111 -0.078 13.381 1.00 0.00 N ATOM 1011 CA GLU B 6 -4.697 0.129 13.034 1.00 0.00 C ATOM 1012 C GLU B 6 -4.472 0.266 11.518 1.00 0.00 C ATOM 1013 O GLU B 6 -3.684 1.102 11.079 1.00 0.00 O ATOM 1014 CB GLU B 6 -3.871 -1.037 13.609 1.00 0.00 C ATOM 1015 CG GLU B 6 -2.373 -0.703 13.667 1.00 0.00 C ATOM 1016 CD GLU B 6 -1.612 -1.675 14.591 1.00 0.00 C ATOM 1017 OE1 GLU B 6 -1.351 -2.834 14.190 1.00 0.00 O ATOM 1018 OE2 GLU B 6 -1.260 -1.277 15.730 1.00 0.00 O ATOM 0 H GLU B 6 -6.280 -0.961 13.863 1.00 0.00 H new ATOM 0 HA GLU B 6 -4.372 1.072 13.473 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -4.229 -1.276 14.610 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -4.021 -1.926 12.996 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -1.950 -0.747 12.663 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -2.241 0.318 14.024 1.00 0.00 H new ATOM 1025 N LEU B 7 -5.202 -0.517 10.717 1.00 0.00 N ATOM 1026 CA LEU B 7 -5.127 -0.485 9.247 1.00 0.00 C ATOM 1027 C LEU B 7 -5.672 0.840 8.695 1.00 0.00 C ATOM 1028 O LEU B 7 -4.990 1.563 7.968 1.00 0.00 O ATOM 1029 CB LEU B 7 -5.897 -1.688 8.652 1.00 0.00 C ATOM 1030 CG LEU B 7 -5.566 -3.081 9.220 1.00 0.00 C ATOM 1031 CD1 LEU B 7 -6.133 -4.154 8.292 1.00 0.00 C ATOM 1032 CD2 LEU B 7 -4.076 -3.356 9.398 1.00 0.00 C ATOM 0 H LEU B 7 -5.871 -1.200 11.073 1.00 0.00 H new ATOM 0 HA LEU B 7 -4.080 -0.559 8.952 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -6.963 -1.510 8.792 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -5.715 -1.708 7.577 1.00 0.00 H new ATOM 0 HG LEU B 7 -6.017 -3.106 10.212 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -5.900 -5.141 8.692 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -7.214 -4.038 8.219 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -5.690 -4.050 7.302 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -3.937 -4.359 9.802 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -3.574 -3.281 8.433 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -3.651 -2.625 10.086 1.00 0.00 H new ATOM 1044 N TYR B 8 -6.896 1.165 9.106 1.00 0.00 N ATOM 1045 CA TYR B 8 -7.699 2.333 8.725 1.00 0.00 C ATOM 1046 C TYR B 8 -7.027 3.662 9.066 1.00 0.00 C ATOM 1047 O TYR B 8 -7.077 4.592 8.264 1.00 0.00 O ATOM 1048 CB TYR B 8 -9.005 2.202 9.544 1.00 0.00 C ATOM 1049 CG TYR B 8 -10.325 2.629 8.939 1.00 0.00 C ATOM 1050 CD1 TYR B 8 -10.431 3.792 8.157 1.00 0.00 C ATOM 1051 CD2 TYR B 8 -11.488 1.906 9.282 1.00 0.00 C ATOM 1052 CE1 TYR B 8 -11.697 4.243 7.741 1.00 0.00 C ATOM 1053 CE2 TYR B 8 -12.754 2.352 8.863 1.00 0.00 C ATOM 1054 CZ TYR B 8 -12.860 3.534 8.099 1.00 0.00 C ATOM 1055 OH TYR B 8 -14.072 4.029 7.740 1.00 0.00 O ATOM 0 H TYR B 8 -7.396 0.572 9.768 1.00 0.00 H new ATOM 0 HA TYR B 8 -7.851 2.344 7.646 1.00 0.00 H new ATOM 0 HB2 TYR B 8 -9.104 1.155 9.831 1.00 0.00 H new ATOM 0 HB3 TYR B 8 -8.870 2.773 10.463 1.00 0.00 H new ATOM 0 HD1 TYR B 8 -9.543 4.338 7.876 1.00 0.00 H new ATOM 0 HD2 TYR B 8 -11.405 1.004 9.870 1.00 0.00 H new ATOM 0 HE1 TYR B 8 -11.778 5.139 7.143 1.00 0.00 H new ATOM 0 HE2 TYR B 8 -13.640 1.793 9.124 1.00 0.00 H new ATOM 0 HH TYR B 8 -13.975 4.966 7.469 1.00 0.00 H new ATOM 1065 N LYS B 9 -6.406 3.775 10.246 1.00 0.00 N ATOM 1066 CA LYS B 9 -5.843 5.049 10.716 1.00 0.00 C ATOM 1067 C LYS B 9 -4.719 5.551 9.826 1.00 0.00 C ATOM 1068 O LYS B 9 -4.809 6.665 9.324 1.00 0.00 O ATOM 1069 CB LYS B 9 -5.426 4.924 12.195 1.00 0.00 C ATOM 1070 CG LYS B 9 -4.996 6.266 12.812 1.00 0.00 C ATOM 1071 CD LYS B 9 -4.491 6.064 14.250 1.00 0.00 C ATOM 1072 CE LYS B 9 -4.088 7.385 14.924 1.00 0.00 C ATOM 1073 NZ LYS B 9 -5.267 8.201 15.322 1.00 0.00 N ATOM 0 H LYS B 9 -6.280 2.998 10.895 1.00 0.00 H new ATOM 0 HA LYS B 9 -6.619 5.812 10.650 1.00 0.00 H new ATOM 0 HB2 LYS B 9 -6.258 4.516 12.769 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -4.604 4.213 12.277 1.00 0.00 H new ATOM 0 HG2 LYS B 9 -4.211 6.716 12.205 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -5.837 6.959 12.810 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -5.270 5.581 14.841 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -3.635 5.389 14.239 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -3.484 7.171 15.805 1.00 0.00 H new ATOM 0 HE3 LYS B 9 -3.464 7.962 14.242 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 -4.944 9.081 15.772 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 -5.831 8.430 14.479 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -5.851 7.663 15.994 1.00 0.00 H new ATOM 1087 N LEU B 10 -3.713 4.727 9.558 1.00 0.00 N ATOM 1088 CA LEU B 10 -2.661 5.016 8.595 1.00 0.00 C ATOM 1089 C LEU B 10 -3.195 5.221 7.163 1.00 0.00 C ATOM 1090 O LEU B 10 -2.752 6.134 6.464 1.00 0.00 O ATOM 1091 CB LEU B 10 -1.569 3.939 8.717 1.00 0.00 C ATOM 1092 CG LEU B 10 -0.781 4.130 10.035 1.00 0.00 C ATOM 1093 CD1 LEU B 10 -1.279 3.262 11.190 1.00 0.00 C ATOM 1094 CD2 LEU B 10 0.708 3.854 9.828 1.00 0.00 C ATOM 0 H LEU B 10 -3.605 3.821 10.014 1.00 0.00 H new ATOM 0 HA LEU B 10 -2.209 5.979 8.831 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.021 2.947 8.694 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -0.890 4.000 7.866 1.00 0.00 H new ATOM 0 HG LEU B 10 -0.947 5.171 10.311 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -0.675 3.455 12.077 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -2.321 3.501 11.402 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.196 2.210 10.916 1.00 0.00 H new ATOM 0 HD21 LEU B 10 1.239 3.995 10.770 1.00 0.00 H new ATOM 0 HD22 LEU B 10 0.844 2.828 9.486 1.00 0.00 H new ATOM 0 HD23 LEU B 10 1.105 4.541 9.081 1.00 0.00 H new ATOM 1106 N GLU B 11 -4.218 4.463 6.761 1.00 0.00 N ATOM 1107 CA GLU B 11 -4.996 4.693 5.532 1.00 0.00 C ATOM 1108 C GLU B 11 -5.691 6.079 5.483 1.00 0.00 C ATOM 1109 O GLU B 11 -5.740 6.674 4.404 1.00 0.00 O ATOM 1110 CB GLU B 11 -5.960 3.492 5.343 1.00 0.00 C ATOM 1111 CG GLU B 11 -5.408 2.396 4.402 1.00 0.00 C ATOM 1112 CD GLU B 11 -5.438 2.691 2.887 1.00 0.00 C ATOM 1113 OE1 GLU B 11 -4.554 3.275 2.236 1.00 0.00 O ATOM 1114 OE2 GLU B 11 -6.211 2.195 2.043 1.00 0.00 O ATOM 0 H GLU B 11 -4.539 3.652 7.290 1.00 0.00 H new ATOM 0 HA GLU B 11 -4.319 4.739 4.679 1.00 0.00 H new ATOM 0 HB2 GLU B 11 -6.171 3.050 6.317 1.00 0.00 H new ATOM 0 HB3 GLU B 11 -6.907 3.857 4.946 1.00 0.00 H new ATOM 0 HG2 GLU B 11 -4.376 2.194 4.687 1.00 0.00 H new ATOM 0 HG3 GLU B 11 -5.973 1.481 4.580 1.00 0.00 H new ATOM 1121 N GLN B 12 -6.141 6.668 6.606 1.00 0.00 N ATOM 1122 CA GLN B 12 -6.700 8.029 6.656 1.00 0.00 C ATOM 1123 C GLN B 12 -5.695 9.138 6.999 1.00 0.00 C ATOM 1124 O GLN B 12 -5.934 10.319 6.752 1.00 0.00 O ATOM 1125 CB GLN B 12 -7.834 8.054 7.676 1.00 0.00 C ATOM 1126 CG GLN B 12 -9.050 7.348 7.088 1.00 0.00 C ATOM 1127 CD GLN B 12 -10.262 7.425 8.017 1.00 0.00 C ATOM 1128 OE1 GLN B 12 -10.200 7.127 9.202 1.00 0.00 O ATOM 1129 NE2 GLN B 12 -11.410 7.844 7.526 1.00 0.00 N ATOM 0 H GLN B 12 -6.126 6.205 7.515 1.00 0.00 H new ATOM 0 HA GLN B 12 -7.043 8.248 5.645 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -7.522 7.561 8.597 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -8.085 9.083 7.934 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -9.301 7.797 6.127 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -8.805 6.303 6.897 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -11.481 8.097 6.540 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -12.228 7.916 8.131 1.00 0.00 H new ATOM 1138 N GLN B 13 -4.547 8.775 7.538 1.00 0.00 N ATOM 1139 CA GLN B 13 -3.430 9.665 7.821 1.00 0.00 C ATOM 1140 C GLN B 13 -2.737 10.107 6.533 1.00 0.00 C ATOM 1141 O GLN B 13 -2.434 11.292 6.384 1.00 0.00 O ATOM 1142 CB GLN B 13 -2.483 8.915 8.766 1.00 0.00 C ATOM 1143 CG GLN B 13 -1.335 9.817 9.192 1.00 0.00 C ATOM 1144 CD GLN B 13 -0.386 9.190 10.216 1.00 0.00 C ATOM 1145 OE1 GLN B 13 -0.469 8.024 10.580 1.00 0.00 O ATOM 1146 NE2 GLN B 13 0.560 9.951 10.726 1.00 0.00 N ATOM 0 H GLN B 13 -4.356 7.809 7.804 1.00 0.00 H new ATOM 0 HA GLN B 13 -3.774 10.583 8.298 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -3.031 8.573 9.644 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -2.091 8.027 8.269 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -0.762 10.098 8.308 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -1.746 10.735 9.611 1.00 0.00 H new ATOM 0 HE21 GLN B 13 0.644 10.925 10.434 1.00 0.00 H new ATOM 0 HE22 GLN B 13 1.209 9.567 11.413 1.00 0.00 H new ATOM 1155 N ALA B 14 -2.584 9.198 5.563 1.00 0.00 N ATOM 1156 CA ALA B 14 -2.241 9.589 4.201 1.00 0.00 C ATOM 1157 C ALA B 14 -3.344 10.489 3.623 1.00 0.00 C ATOM 1158 O ALA B 14 -3.035 11.475 2.969 1.00 0.00 O ATOM 1159 CB ALA B 14 -2.017 8.326 3.362 1.00 0.00 C ATOM 0 H ALA B 14 -2.693 8.193 5.700 1.00 0.00 H new ATOM 0 HA ALA B 14 -1.318 10.168 4.189 1.00 0.00 H new ATOM 0 HB1 ALA B 14 -1.760 8.608 2.341 1.00 0.00 H new ATOM 0 HB2 ALA B 14 -1.204 7.742 3.793 1.00 0.00 H new ATOM 0 HB3 ALA B 14 -2.928 7.728 3.354 1.00 0.00 H new ATOM 1165 N MET B 15 -4.621 10.219 3.920 1.00 0.00 N ATOM 1166 CA MET B 15 -5.739 11.040 3.412 1.00 0.00 C ATOM 1167 C MET B 15 -5.742 12.487 3.931 1.00 0.00 C ATOM 1168 O MET B 15 -5.926 13.415 3.144 1.00 0.00 O ATOM 1169 CB MET B 15 -7.098 10.384 3.700 1.00 0.00 C ATOM 1170 CG MET B 15 -8.254 11.183 3.073 1.00 0.00 C ATOM 1171 SD MET B 15 -9.554 10.190 2.310 1.00 0.00 S ATOM 1172 CE MET B 15 -8.492 9.396 1.085 1.00 0.00 C ATOM 0 H MET B 15 -4.911 9.439 4.510 1.00 0.00 H new ATOM 0 HA MET B 15 -5.578 11.091 2.335 1.00 0.00 H new ATOM 0 HB2 MET B 15 -7.103 9.367 3.308 1.00 0.00 H new ATOM 0 HB3 MET B 15 -7.247 10.311 4.777 1.00 0.00 H new ATOM 0 HG2 MET B 15 -8.703 11.808 3.845 1.00 0.00 H new ATOM 0 HG3 MET B 15 -7.843 11.854 2.319 1.00 0.00 H new ATOM 0 HE1 MET B 15 -9.056 9.230 0.167 1.00 0.00 H new ATOM 0 HE2 MET B 15 -7.637 10.038 0.874 1.00 0.00 H new ATOM 0 HE3 MET B 15 -8.141 8.440 1.473 1.00 0.00 H new ATOM 1182 N LYS B 16 -5.506 12.711 5.227 1.00 0.00 N ATOM 1183 CA LYS B 16 -5.337 14.065 5.781 1.00 0.00 C ATOM 1184 C LYS B 16 -4.131 14.784 5.181 1.00 0.00 C ATOM 1185 O LYS B 16 -4.234 15.958 4.821 1.00 0.00 O ATOM 1186 CB LYS B 16 -5.215 14.009 7.306 1.00 0.00 C ATOM 1187 CG LYS B 16 -6.603 13.950 7.964 1.00 0.00 C ATOM 1188 CD LYS B 16 -6.521 14.204 9.474 1.00 0.00 C ATOM 1189 CE LYS B 16 -7.934 14.357 10.052 1.00 0.00 C ATOM 1190 NZ LYS B 16 -7.903 14.729 11.491 1.00 0.00 N ATOM 0 H LYS B 16 -5.426 11.967 5.920 1.00 0.00 H new ATOM 0 HA LYS B 16 -6.226 14.636 5.514 1.00 0.00 H new ATOM 0 HB2 LYS B 16 -4.633 13.135 7.597 1.00 0.00 H new ATOM 0 HB3 LYS B 16 -4.675 14.885 7.664 1.00 0.00 H new ATOM 0 HG2 LYS B 16 -7.256 14.692 7.504 1.00 0.00 H new ATOM 0 HG3 LYS B 16 -7.052 12.973 7.782 1.00 0.00 H new ATOM 0 HD2 LYS B 16 -6.005 13.378 9.964 1.00 0.00 H new ATOM 0 HD3 LYS B 16 -5.939 15.104 9.670 1.00 0.00 H new ATOM 0 HE2 LYS B 16 -8.476 15.118 9.491 1.00 0.00 H new ATOM 0 HE3 LYS B 16 -8.480 13.422 9.930 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 -8.876 14.823 11.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 -7.408 13.990 12.030 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 -7.404 15.634 11.605 1.00 0.00 H new ATOM 1204 N LEU B 17 -3.023 14.066 5.001 1.00 0.00 N ATOM 1205 CA LEU B 17 -1.884 14.547 4.219 1.00 0.00 C ATOM 1206 C LEU B 17 -2.287 14.948 2.785 1.00 0.00 C ATOM 1207 O LEU B 17 -1.955 16.045 2.344 1.00 0.00 O ATOM 1208 CB LEU B 17 -0.797 13.456 4.244 1.00 0.00 C ATOM 1209 CG LEU B 17 0.281 13.697 5.310 1.00 0.00 C ATOM 1210 CD1 LEU B 17 1.161 12.455 5.403 1.00 0.00 C ATOM 1211 CD2 LEU B 17 1.178 14.893 4.982 1.00 0.00 C ATOM 0 H LEU B 17 -2.889 13.134 5.393 1.00 0.00 H new ATOM 0 HA LEU B 17 -1.491 15.461 4.665 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -1.267 12.489 4.424 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -0.323 13.402 3.264 1.00 0.00 H new ATOM 0 HG LEU B 17 -0.230 13.908 6.250 1.00 0.00 H new ATOM 0 HD11 LEU B 17 1.932 12.611 6.157 1.00 0.00 H new ATOM 0 HD12 LEU B 17 0.550 11.596 5.681 1.00 0.00 H new ATOM 0 HD13 LEU B 17 1.630 12.268 4.437 1.00 0.00 H new ATOM 0 HD21 LEU B 17 1.922 15.017 5.769 1.00 0.00 H new ATOM 0 HD22 LEU B 17 1.682 14.720 4.031 1.00 0.00 H new ATOM 0 HD23 LEU B 17 0.570 15.795 4.912 1.00 0.00 H new ATOM 1223 N TYR B 18 -3.063 14.114 2.093 1.00 0.00 N ATOM 1224 CA TYR B 18 -3.613 14.353 0.755 1.00 0.00 C ATOM 1225 C TYR B 18 -4.569 15.564 0.678 1.00 0.00 C ATOM 1226 O TYR B 18 -4.510 16.311 -0.302 1.00 0.00 O ATOM 1227 CB TYR B 18 -4.247 13.042 0.235 1.00 0.00 C ATOM 1228 CG TYR B 18 -3.284 12.158 -0.547 1.00 0.00 C ATOM 1229 CD1 TYR B 18 -2.743 12.632 -1.755 1.00 0.00 C ATOM 1230 CD2 TYR B 18 -2.882 10.896 -0.059 1.00 0.00 C ATOM 1231 CE1 TYR B 18 -1.746 11.899 -2.425 1.00 0.00 C ATOM 1232 CE2 TYR B 18 -1.853 10.174 -0.698 1.00 0.00 C ATOM 1233 CZ TYR B 18 -1.271 10.686 -1.877 1.00 0.00 C ATOM 1234 OH TYR B 18 -0.260 10.012 -2.489 1.00 0.00 O ATOM 0 H TYR B 18 -3.340 13.207 2.468 1.00 0.00 H new ATOM 0 HA TYR B 18 -2.793 14.637 0.095 1.00 0.00 H new ATOM 0 HB2 TYR B 18 -4.636 12.477 1.082 1.00 0.00 H new ATOM 0 HB3 TYR B 18 -5.097 13.288 -0.402 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -3.095 13.564 -2.171 1.00 0.00 H new ATOM 0 HD2 TYR B 18 -3.367 10.480 0.812 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -1.344 12.264 -3.359 1.00 0.00 H new ATOM 0 HE2 TYR B 18 -1.512 9.235 -0.287 1.00 0.00 H new ATOM 0 HH TYR B 18 -0.055 9.199 -1.982 1.00 0.00 H new ATOM 1244 N ARG B 19 -5.387 15.837 1.710 1.00 0.00 N ATOM 1245 CA ARG B 19 -6.189 17.078 1.814 1.00 0.00 C ATOM 1246 C ARG B 19 -5.327 18.342 1.863 1.00 0.00 C ATOM 1247 O ARG B 19 -5.626 19.313 1.174 1.00 0.00 O ATOM 1248 CB ARG B 19 -7.113 17.059 3.049 1.00 0.00 C ATOM 1249 CG ARG B 19 -8.491 16.431 2.778 1.00 0.00 C ATOM 1250 CD ARG B 19 -9.484 16.748 3.910 1.00 0.00 C ATOM 1251 NE ARG B 19 -9.809 18.192 3.969 1.00 0.00 N ATOM 1252 CZ ARG B 19 -10.219 18.886 5.018 1.00 0.00 C ATOM 1253 NH1 ARG B 19 -10.466 18.330 6.170 1.00 0.00 N ATOM 1254 NH2 ARG B 19 -10.390 20.175 4.929 1.00 0.00 N ATOM 0 H ARG B 19 -5.514 15.204 2.500 1.00 0.00 H new ATOM 0 HA ARG B 19 -6.791 17.107 0.906 1.00 0.00 H new ATOM 0 HB2 ARG B 19 -6.623 16.507 3.851 1.00 0.00 H new ATOM 0 HB3 ARG B 19 -7.252 18.080 3.404 1.00 0.00 H new ATOM 0 HG2 ARG B 19 -8.883 16.805 1.832 1.00 0.00 H new ATOM 0 HG3 ARG B 19 -8.387 15.351 2.675 1.00 0.00 H new ATOM 0 HD2 ARG B 19 -10.399 16.175 3.761 1.00 0.00 H new ATOM 0 HD3 ARG B 19 -9.061 16.431 4.863 1.00 0.00 H new ATOM 0 HE ARG B 19 -9.704 18.713 3.098 1.00 0.00 H new ATOM 0 HH11 ARG B 19 -10.345 17.324 6.287 1.00 0.00 H new ATOM 0 HH12 ARG B 19 -10.781 18.901 6.955 1.00 0.00 H new ATOM 0 HH21 ARG B 19 -10.208 20.654 4.047 1.00 0.00 H new ATOM 0 HH22 ARG B 19 -10.706 20.705 5.741 1.00 0.00 H new ATOM 1268 N GLU B 20 -4.261 18.351 2.659 1.00 0.00 N ATOM 1269 CA GLU B 20 -3.389 19.530 2.808 1.00 0.00 C ATOM 1270 C GLU B 20 -2.439 19.705 1.623 1.00 0.00 C ATOM 1271 O GLU B 20 -2.212 20.821 1.152 1.00 0.00 O ATOM 1272 CB GLU B 20 -2.598 19.401 4.112 1.00 0.00 C ATOM 1273 CG GLU B 20 -2.448 20.762 4.803 1.00 0.00 C ATOM 1274 CD GLU B 20 -1.707 20.636 6.146 1.00 0.00 C ATOM 1275 OE1 GLU B 20 -2.366 20.412 7.192 1.00 0.00 O ATOM 1276 OE2 GLU B 20 -0.459 20.778 6.168 1.00 0.00 O ATOM 0 H GLU B 20 -3.972 17.549 3.220 1.00 0.00 H new ATOM 0 HA GLU B 20 -4.020 20.418 2.836 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -3.104 18.704 4.780 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -1.612 18.985 3.904 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -1.905 21.445 4.150 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -3.434 21.197 4.970 1.00 0.00 H new ATOM 1283 N ALA B 21 -1.958 18.586 1.085 1.00 0.00 N ATOM 1284 CA ALA B 21 -1.286 18.531 -0.211 1.00 0.00 C ATOM 1285 C ALA B 21 -2.149 19.153 -1.324 1.00 0.00 C ATOM 1286 O ALA B 21 -1.615 19.891 -2.144 1.00 0.00 O ATOM 1287 CB ALA B 21 -0.909 17.082 -0.534 1.00 0.00 C ATOM 0 H ALA B 21 -2.025 17.678 1.545 1.00 0.00 H new ATOM 0 HA ALA B 21 -0.374 19.125 -0.156 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -0.408 17.043 -1.501 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -0.240 16.700 0.237 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -1.811 16.470 -0.568 1.00 0.00 H new ATOM 1293 N SER B 22 -3.474 18.949 -1.321 1.00 0.00 N ATOM 1294 CA SER B 22 -4.403 19.589 -2.272 1.00 0.00 C ATOM 1295 C SER B 22 -4.360 21.130 -2.249 1.00 0.00 C ATOM 1296 O SER B 22 -4.498 21.762 -3.297 1.00 0.00 O ATOM 1297 CB SER B 22 -5.840 19.102 -2.042 1.00 0.00 C ATOM 1298 OG SER B 22 -6.654 19.370 -3.173 1.00 0.00 O ATOM 0 H SER B 22 -3.938 18.331 -0.655 1.00 0.00 H new ATOM 0 HA SER B 22 -4.062 19.285 -3.262 1.00 0.00 H new ATOM 0 HB2 SER B 22 -5.837 18.031 -1.837 1.00 0.00 H new ATOM 0 HB3 SER B 22 -6.258 19.593 -1.164 1.00 0.00 H new ATOM 0 HG SER B 22 -7.565 19.050 -3.004 1.00 0.00 H new ATOM 1304 N GLU B 23 -4.108 21.759 -1.091 1.00 0.00 N ATOM 1305 CA GLU B 23 -3.975 23.226 -0.984 1.00 0.00 C ATOM 1306 C GLU B 23 -2.715 23.757 -1.697 1.00 0.00 C ATOM 1307 O GLU B 23 -2.756 24.816 -2.329 1.00 0.00 O ATOM 1308 CB GLU B 23 -3.905 23.605 0.502 1.00 0.00 C ATOM 1309 CG GLU B 23 -4.267 25.067 0.801 1.00 0.00 C ATOM 1310 CD GLU B 23 -5.756 25.365 0.538 1.00 0.00 C ATOM 1311 OE1 GLU B 23 -6.605 25.052 1.408 1.00 0.00 O ATOM 1312 OE2 GLU B 23 -6.085 25.927 -0.535 1.00 0.00 O ATOM 0 H GLU B 23 -3.990 21.270 -0.204 1.00 0.00 H new ATOM 0 HA GLU B 23 -4.841 23.677 -1.469 1.00 0.00 H new ATOM 0 HB2 GLU B 23 -4.577 22.955 1.062 1.00 0.00 H new ATOM 0 HB3 GLU B 23 -2.896 23.411 0.867 1.00 0.00 H new ATOM 0 HG2 GLU B 23 -4.032 25.292 1.841 1.00 0.00 H new ATOM 0 HG3 GLU B 23 -3.653 25.724 0.186 1.00 0.00 H new ATOM 1319 N LYS B 24 -1.604 23.007 -1.623 1.00 0.00 N ATOM 1320 CA LYS B 24 -0.381 23.237 -2.426 1.00 0.00 C ATOM 1321 C LYS B 24 -0.606 22.898 -3.909 1.00 0.00 C ATOM 1322 O LYS B 24 -0.278 23.692 -4.788 1.00 0.00 O ATOM 1323 CB LYS B 24 0.808 22.411 -1.886 1.00 0.00 C ATOM 1324 CG LYS B 24 1.597 23.061 -0.737 1.00 0.00 C ATOM 1325 CD LYS B 24 0.923 22.976 0.640 1.00 0.00 C ATOM 1326 CE LYS B 24 1.875 23.566 1.692 1.00 0.00 C ATOM 1327 NZ LYS B 24 1.349 23.418 3.073 1.00 0.00 N ATOM 0 H LYS B 24 -1.524 22.208 -0.994 1.00 0.00 H new ATOM 0 HA LYS B 24 -0.145 24.298 -2.341 1.00 0.00 H new ATOM 0 HB2 LYS B 24 0.433 21.446 -1.546 1.00 0.00 H new ATOM 0 HB3 LYS B 24 1.495 22.214 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS B 24 2.577 22.588 -0.675 1.00 0.00 H new ATOM 0 HG3 LYS B 24 1.765 24.110 -0.979 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -0.019 23.524 0.634 1.00 0.00 H new ATOM 0 HD3 LYS B 24 0.688 21.940 0.882 1.00 0.00 H new ATOM 0 HE2 LYS B 24 2.844 23.072 1.620 1.00 0.00 H new ATOM 0 HE3 LYS B 24 2.039 24.622 1.479 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 2.025 23.830 3.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 0.437 23.911 3.152 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 1.217 22.409 3.288 1.00 0.00 H new ATOM 1341 N ALA B 25 -1.212 21.745 -4.184 1.00 0.00 N ATOM 1342 CA ALA B 25 -1.526 21.182 -5.502 1.00 0.00 C ATOM 1343 C ALA B 25 -2.732 21.840 -6.217 1.00 0.00 C ATOM 1344 O ALA B 25 -3.327 21.245 -7.112 1.00 0.00 O ATOM 1345 CB ALA B 25 -1.719 19.670 -5.323 1.00 0.00 C ATOM 0 H ALA B 25 -1.522 21.128 -3.433 1.00 0.00 H new ATOM 0 HA ALA B 25 -0.692 21.395 -6.170 1.00 0.00 H new ATOM 0 HB1 ALA B 25 -1.955 19.217 -6.286 1.00 0.00 H new ATOM 0 HB2 ALA B 25 -0.803 19.230 -4.930 1.00 0.00 H new ATOM 0 HB3 ALA B 25 -2.537 19.488 -4.626 1.00 0.00 H new ATOM 1351 N ARG B 26 -3.078 23.080 -5.851 1.00 0.00 N ATOM 1352 CA ARG B 26 -4.054 23.989 -6.494 1.00 0.00 C ATOM 1353 C ARG B 26 -3.937 24.102 -8.026 1.00 0.00 C ATOM 1354 O ARG B 26 -4.934 24.380 -8.690 1.00 0.00 O ATOM 1355 CB ARG B 26 -3.880 25.353 -5.795 1.00 0.00 C ATOM 1356 CG ARG B 26 -2.548 26.028 -6.200 1.00 0.00 C ATOM 1357 CD ARG B 26 -1.830 26.704 -5.041 1.00 0.00 C ATOM 1358 NE ARG B 26 -2.333 28.064 -4.776 1.00 0.00 N ATOM 1359 CZ ARG B 26 -2.964 28.494 -3.699 1.00 0.00 C ATOM 1360 NH1 ARG B 26 -3.285 27.708 -2.708 1.00 0.00 N ATOM 1361 NH2 ARG B 26 -3.283 29.753 -3.602 1.00 0.00 N ATOM 0 H ARG B 26 -2.653 23.515 -5.033 1.00 0.00 H new ATOM 0 HA ARG B 26 -5.057 23.582 -6.367 1.00 0.00 H new ATOM 0 HB2 ARG B 26 -4.714 26.005 -6.054 1.00 0.00 H new ATOM 0 HB3 ARG B 26 -3.906 25.216 -4.714 1.00 0.00 H new ATOM 0 HG2 ARG B 26 -1.889 25.278 -6.637 1.00 0.00 H new ATOM 0 HG3 ARG B 26 -2.747 26.768 -6.975 1.00 0.00 H new ATOM 0 HD2 ARG B 26 -1.946 26.097 -4.143 1.00 0.00 H new ATOM 0 HD3 ARG B 26 -0.763 26.752 -5.258 1.00 0.00 H new ATOM 0 HE ARG B 26 -2.175 28.754 -5.511 1.00 0.00 H new ATOM 0 HH11 ARG B 26 -3.048 26.717 -2.746 1.00 0.00 H new ATOM 0 HH12 ARG B 26 -3.773 28.085 -1.895 1.00 0.00 H new ATOM 0 HH21 ARG B 26 -3.045 30.399 -4.355 1.00 0.00 H new ATOM 0 HH22 ARG B 26 -3.771 30.093 -2.773 1.00 0.00 H new ATOM 1375 N ASN B 27 -2.742 23.887 -8.590 1.00 0.00 N ATOM 1376 CA ASN B 27 -2.500 23.868 -10.034 1.00 0.00 C ATOM 1377 C ASN B 27 -3.154 22.612 -10.659 1.00 0.00 C ATOM 1378 O ASN B 27 -2.886 21.501 -10.189 1.00 0.00 O ATOM 1379 CB ASN B 27 -0.977 23.915 -10.266 1.00 0.00 C ATOM 1380 CG ASN B 27 -0.633 24.170 -11.724 1.00 0.00 C ATOM 1381 OD1 ASN B 27 -0.881 25.238 -12.264 1.00 0.00 O ATOM 1382 ND2 ASN B 27 -0.073 23.205 -12.416 1.00 0.00 N ATOM 0 H ASN B 27 -1.899 23.718 -8.041 1.00 0.00 H new ATOM 0 HA ASN B 27 -2.951 24.733 -10.520 1.00 0.00 H new ATOM 0 HB2 ASN B 27 -0.540 24.699 -9.647 1.00 0.00 H new ATOM 0 HB3 ASN B 27 -0.532 22.972 -9.948 1.00 0.00 H new ATOM 0 HD21 ASN B 27 0.153 23.348 -13.400 1.00 0.00 H new ATOM 0 HD22 ASN B 27 0.136 22.312 -11.969 1.00 0.00 H new ATOM 1389 N PRO B 28 -3.994 22.738 -11.707 1.00 0.00 N ATOM 1390 CA PRO B 28 -4.919 21.675 -12.116 1.00 0.00 C ATOM 1391 C PRO B 28 -4.226 20.396 -12.608 1.00 0.00 C ATOM 1392 O PRO B 28 -4.779 19.306 -12.463 1.00 0.00 O ATOM 1393 CB PRO B 28 -5.825 22.299 -13.185 1.00 0.00 C ATOM 1394 CG PRO B 28 -5.002 23.461 -13.735 1.00 0.00 C ATOM 1395 CD PRO B 28 -4.204 23.926 -12.519 1.00 0.00 C ATOM 0 HA PRO B 28 -5.491 21.327 -11.256 1.00 0.00 H new ATOM 0 HB2 PRO B 28 -6.073 21.581 -13.966 1.00 0.00 H new ATOM 0 HB3 PRO B 28 -6.767 22.644 -12.758 1.00 0.00 H new ATOM 0 HG2 PRO B 28 -4.349 23.143 -14.548 1.00 0.00 H new ATOM 0 HG3 PRO B 28 -5.637 24.255 -14.128 1.00 0.00 H new ATOM 0 HD2 PRO B 28 -3.254 24.367 -12.820 1.00 0.00 H new ATOM 0 HD3 PRO B 28 -4.748 24.689 -11.963 1.00 0.00 H new ATOM 1403 N GLU B 29 -3.000 20.510 -13.127 1.00 0.00 N ATOM 1404 CA GLU B 29 -2.163 19.375 -13.543 1.00 0.00 C ATOM 1405 C GLU B 29 -1.915 18.372 -12.405 1.00 0.00 C ATOM 1406 O GLU B 29 -2.163 17.175 -12.544 1.00 0.00 O ATOM 1407 CB GLU B 29 -0.829 19.920 -14.085 1.00 0.00 C ATOM 1408 CG GLU B 29 -0.047 18.918 -14.944 1.00 0.00 C ATOM 1409 CD GLU B 29 -0.680 18.741 -16.339 1.00 0.00 C ATOM 1410 OE1 GLU B 29 -0.330 19.508 -17.270 1.00 0.00 O ATOM 1411 OE2 GLU B 29 -1.528 17.833 -16.518 1.00 0.00 O ATOM 0 H GLU B 29 -2.549 21.413 -13.274 1.00 0.00 H new ATOM 0 HA GLU B 29 -2.694 18.826 -14.321 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -1.027 20.813 -14.677 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -0.206 20.227 -13.245 1.00 0.00 H new ATOM 0 HG2 GLU B 29 0.983 19.259 -15.053 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -0.012 17.954 -14.436 1.00 0.00 H new ATOM 1418 N LYS B 30 -1.476 18.887 -11.252 1.00 0.00 N ATOM 1419 CA LYS B 30 -1.320 18.127 -10.000 1.00 0.00 C ATOM 1420 C LYS B 30 -2.665 17.816 -9.350 1.00 0.00 C ATOM 1421 O LYS B 30 -2.849 16.683 -8.902 1.00 0.00 O ATOM 1422 CB LYS B 30 -0.380 18.848 -9.008 1.00 0.00 C ATOM 1423 CG LYS B 30 1.045 18.262 -8.921 1.00 0.00 C ATOM 1424 CD LYS B 30 2.154 19.161 -9.484 1.00 0.00 C ATOM 1425 CE LYS B 30 2.085 19.305 -11.009 1.00 0.00 C ATOM 1426 NZ LYS B 30 3.229 20.107 -11.524 1.00 0.00 N ATOM 0 H LYS B 30 -1.212 19.868 -11.157 1.00 0.00 H new ATOM 0 HA LYS B 30 -0.857 17.177 -10.266 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -0.309 19.897 -9.295 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -0.831 18.818 -8.016 1.00 0.00 H new ATOM 0 HG2 LYS B 30 1.269 18.046 -7.876 1.00 0.00 H new ATOM 0 HG3 LYS B 30 1.063 17.311 -9.454 1.00 0.00 H new ATOM 0 HD2 LYS B 30 2.083 20.148 -9.027 1.00 0.00 H new ATOM 0 HD3 LYS B 30 3.125 18.750 -9.206 1.00 0.00 H new ATOM 0 HE2 LYS B 30 2.092 18.318 -11.471 1.00 0.00 H new ATOM 0 HE3 LYS B 30 1.146 19.782 -11.290 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 3.158 20.189 -12.558 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 3.207 21.056 -11.099 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 4.123 19.637 -11.275 1.00 0.00 H new ATOM 1440 N LYS B 31 -3.624 18.753 -9.350 1.00 0.00 N ATOM 1441 CA LYS B 31 -4.967 18.521 -8.780 1.00 0.00 C ATOM 1442 C LYS B 31 -5.681 17.316 -9.393 1.00 0.00 C ATOM 1443 O LYS B 31 -6.357 16.577 -8.686 1.00 0.00 O ATOM 1444 CB LYS B 31 -5.831 19.794 -8.822 1.00 0.00 C ATOM 1445 CG LYS B 31 -6.961 19.723 -7.778 1.00 0.00 C ATOM 1446 CD LYS B 31 -7.474 21.112 -7.375 1.00 0.00 C ATOM 1447 CE LYS B 31 -8.614 20.958 -6.359 1.00 0.00 C ATOM 1448 NZ LYS B 31 -9.030 22.267 -5.789 1.00 0.00 N ATOM 0 H LYS B 31 -3.497 19.687 -9.741 1.00 0.00 H new ATOM 0 HA LYS B 31 -4.813 18.268 -7.731 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -5.208 20.668 -8.631 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -6.257 19.917 -9.818 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -7.787 19.136 -8.180 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -6.601 19.201 -6.892 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -6.664 21.700 -6.943 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -7.826 21.651 -8.254 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -9.469 20.484 -6.842 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -8.295 20.296 -5.554 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -9.802 22.119 -5.108 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -8.221 22.708 -5.306 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -9.358 22.890 -6.554 1.00 0.00 H new ATOM 1462 N SER B 32 -5.443 17.056 -10.676 1.00 0.00 N ATOM 1463 CA SER B 32 -6.003 15.912 -11.416 1.00 0.00 C ATOM 1464 C SER B 32 -5.148 14.636 -11.376 1.00 0.00 C ATOM 1465 O SER B 32 -5.526 13.624 -11.969 1.00 0.00 O ATOM 1466 CB SER B 32 -6.279 16.304 -12.876 1.00 0.00 C ATOM 1467 OG SER B 32 -7.051 17.493 -12.960 1.00 0.00 O ATOM 0 H SER B 32 -4.841 17.646 -11.251 1.00 0.00 H new ATOM 0 HA SER B 32 -6.931 15.665 -10.899 1.00 0.00 H new ATOM 0 HB2 SER B 32 -5.334 16.445 -13.401 1.00 0.00 H new ATOM 0 HB3 SER B 32 -6.804 15.492 -13.379 1.00 0.00 H new ATOM 0 HG SER B 32 -6.471 18.270 -12.817 1.00 0.00 H new ATOM 1473 N VAL B 33 -4.031 14.655 -10.645 1.00 0.00 N ATOM 1474 CA VAL B 33 -3.160 13.490 -10.398 1.00 0.00 C ATOM 1475 C VAL B 33 -3.335 12.995 -8.965 1.00 0.00 C ATOM 1476 O VAL B 33 -3.635 11.814 -8.779 1.00 0.00 O ATOM 1477 CB VAL B 33 -1.685 13.814 -10.723 1.00 0.00 C ATOM 1478 CG1 VAL B 33 -0.697 12.761 -10.203 1.00 0.00 C ATOM 1479 CG2 VAL B 33 -1.494 13.897 -12.242 1.00 0.00 C ATOM 0 H VAL B 33 -3.692 15.504 -10.193 1.00 0.00 H new ATOM 0 HA VAL B 33 -3.458 12.684 -11.068 1.00 0.00 H new ATOM 0 HB VAL B 33 -1.475 14.761 -10.226 1.00 0.00 H new ATOM 0 HG11 VAL B 33 0.319 13.054 -10.467 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -0.783 12.686 -9.119 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -0.925 11.795 -10.653 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -0.452 14.126 -12.466 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -1.761 12.942 -12.695 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -2.133 14.682 -12.647 1.00 0.00 H new ATOM 1489 N LEU B 34 -3.257 13.866 -7.946 1.00 0.00 N ATOM 1490 CA LEU B 34 -3.510 13.431 -6.572 1.00 0.00 C ATOM 1491 C LEU B 34 -5.001 13.106 -6.316 1.00 0.00 C ATOM 1492 O LEU B 34 -5.300 12.332 -5.406 1.00 0.00 O ATOM 1493 CB LEU B 34 -2.812 14.378 -5.570 1.00 0.00 C ATOM 1494 CG LEU B 34 -3.699 15.465 -4.972 1.00 0.00 C ATOM 1495 CD1 LEU B 34 -3.014 16.184 -3.806 1.00 0.00 C ATOM 1496 CD2 LEU B 34 -4.110 16.536 -5.968 1.00 0.00 C ATOM 0 H LEU B 34 -3.026 14.854 -8.048 1.00 0.00 H new ATOM 0 HA LEU B 34 -3.041 12.462 -6.399 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -2.401 13.780 -4.757 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -1.970 14.855 -6.072 1.00 0.00 H new ATOM 0 HG LEU B 34 -4.585 14.926 -4.637 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -3.680 16.950 -3.409 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -2.781 15.464 -3.021 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -2.093 16.650 -4.156 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -4.739 17.274 -5.470 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -3.220 17.026 -6.364 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -4.666 16.078 -6.786 1.00 0.00 H new ATOM 1508 N GLN B 35 -5.937 13.606 -7.146 1.00 0.00 N ATOM 1509 CA GLN B 35 -7.355 13.231 -7.053 1.00 0.00 C ATOM 1510 C GLN B 35 -7.595 11.731 -7.320 1.00 0.00 C ATOM 1511 O GLN B 35 -8.461 11.132 -6.687 1.00 0.00 O ATOM 1512 CB GLN B 35 -8.210 14.108 -7.986 1.00 0.00 C ATOM 1513 CG GLN B 35 -9.709 13.767 -7.918 1.00 0.00 C ATOM 1514 CD GLN B 35 -10.587 14.647 -8.809 1.00 0.00 C ATOM 1515 OE1 GLN B 35 -10.333 15.821 -9.052 1.00 0.00 O ATOM 1516 NE2 GLN B 35 -11.667 14.107 -9.334 1.00 0.00 N ATOM 0 H GLN B 35 -5.732 14.273 -7.890 1.00 0.00 H new ATOM 0 HA GLN B 35 -7.665 13.412 -6.024 1.00 0.00 H new ATOM 0 HB2 GLN B 35 -8.068 15.156 -7.722 1.00 0.00 H new ATOM 0 HB3 GLN B 35 -7.861 13.987 -9.011 1.00 0.00 H new ATOM 0 HG2 GLN B 35 -9.848 12.725 -8.205 1.00 0.00 H new ATOM 0 HG3 GLN B 35 -10.046 13.861 -6.886 1.00 0.00 H new ATOM 0 HE21 GLN B 35 -11.894 13.131 -9.142 1.00 0.00 H new ATOM 0 HE22 GLN B 35 -12.277 14.664 -9.932 1.00 0.00 H new ATOM 1525 N LYS B 36 -6.827 11.095 -8.217 1.00 0.00 N ATOM 1526 CA LYS B 36 -6.980 9.658 -8.525 1.00 0.00 C ATOM 1527 C LYS B 36 -6.670 8.777 -7.317 1.00 0.00 C ATOM 1528 O LYS B 36 -7.438 7.871 -7.000 1.00 0.00 O ATOM 1529 CB LYS B 36 -6.047 9.264 -9.690 1.00 0.00 C ATOM 1530 CG LYS B 36 -6.395 9.865 -11.061 1.00 0.00 C ATOM 1531 CD LYS B 36 -7.559 9.130 -11.742 1.00 0.00 C ATOM 1532 CE LYS B 36 -7.704 9.616 -13.190 1.00 0.00 C ATOM 1533 NZ LYS B 36 -8.719 8.825 -13.935 1.00 0.00 N ATOM 0 H LYS B 36 -6.087 11.554 -8.748 1.00 0.00 H new ATOM 0 HA LYS B 36 -8.021 9.498 -8.805 1.00 0.00 H new ATOM 0 HB2 LYS B 36 -5.030 9.561 -9.432 1.00 0.00 H new ATOM 0 HB3 LYS B 36 -6.049 8.178 -9.780 1.00 0.00 H new ATOM 0 HG2 LYS B 36 -6.654 10.917 -10.939 1.00 0.00 H new ATOM 0 HG3 LYS B 36 -5.517 9.826 -11.706 1.00 0.00 H new ATOM 0 HD2 LYS B 36 -7.382 8.055 -11.726 1.00 0.00 H new ATOM 0 HD3 LYS B 36 -8.484 9.309 -11.194 1.00 0.00 H new ATOM 0 HE2 LYS B 36 -7.988 10.668 -13.194 1.00 0.00 H new ATOM 0 HE3 LYS B 36 -6.742 9.543 -13.697 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 -8.790 9.181 -14.909 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 -8.435 7.825 -13.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 -9.642 8.915 -13.465 1.00 0.00 H new ATOM 1547 N ILE B 37 -5.582 9.090 -6.612 1.00 0.00 N ATOM 1548 CA ILE B 37 -5.235 8.457 -5.334 1.00 0.00 C ATOM 1549 C ILE B 37 -6.321 8.782 -4.303 1.00 0.00 C ATOM 1550 O ILE B 37 -6.827 7.859 -3.680 1.00 0.00 O ATOM 1551 CB ILE B 37 -3.841 8.938 -4.863 1.00 0.00 C ATOM 1552 CG1 ILE B 37 -2.723 8.578 -5.860 1.00 0.00 C ATOM 1553 CG2 ILE B 37 -3.545 8.406 -3.452 1.00 0.00 C ATOM 1554 CD1 ILE B 37 -1.316 9.072 -5.495 1.00 0.00 C ATOM 0 H ILE B 37 -4.910 9.796 -6.913 1.00 0.00 H new ATOM 0 HA ILE B 37 -5.184 7.375 -5.455 1.00 0.00 H new ATOM 0 HB ILE B 37 -3.863 10.027 -4.822 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -2.691 7.493 -5.964 1.00 0.00 H new ATOM 0 HG13 ILE B 37 -2.988 8.984 -6.836 1.00 0.00 H new ATOM 0 HG21 ILE B 37 -2.562 8.751 -3.132 1.00 0.00 H new ATOM 0 HG22 ILE B 37 -4.302 8.773 -2.759 1.00 0.00 H new ATOM 0 HG23 ILE B 37 -3.561 7.316 -3.463 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -0.610 8.762 -6.266 1.00 0.00 H new ATOM 0 HD12 ILE B 37 -1.320 10.160 -5.422 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -1.018 8.646 -4.537 1.00 0.00 H new ATOM 1566 N LEU B 38 -6.756 10.040 -4.160 1.00 0.00 N ATOM 1567 CA LEU B 38 -7.864 10.393 -3.261 1.00 0.00 C ATOM 1568 C LEU B 38 -9.134 9.558 -3.510 1.00 0.00 C ATOM 1569 O LEU B 38 -9.734 9.091 -2.539 1.00 0.00 O ATOM 1570 CB LEU B 38 -8.164 11.902 -3.352 1.00 0.00 C ATOM 1571 CG LEU B 38 -7.353 12.757 -2.363 1.00 0.00 C ATOM 1572 CD1 LEU B 38 -7.330 14.221 -2.802 1.00 0.00 C ATOM 1573 CD2 LEU B 38 -7.980 12.701 -0.967 1.00 0.00 C ATOM 0 H LEU B 38 -6.356 10.835 -4.658 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.541 10.153 -2.248 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.958 12.243 -4.367 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -9.227 12.063 -3.171 1.00 0.00 H new ATOM 0 HG LEU B 38 -6.340 12.355 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.751 14.806 -2.088 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.873 14.298 -3.789 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.349 14.605 -2.843 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.394 13.311 -0.280 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -9.000 13.082 -1.011 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.993 11.669 -0.615 1.00 0.00 H new ATOM 1585 N GLU B 39 -9.532 9.309 -4.764 1.00 0.00 N ATOM 1586 CA GLU B 39 -10.732 8.508 -5.040 1.00 0.00 C ATOM 1587 C GLU B 39 -10.538 7.010 -4.781 1.00 0.00 C ATOM 1588 O GLU B 39 -11.434 6.359 -4.244 1.00 0.00 O ATOM 1589 CB GLU B 39 -11.227 8.751 -6.476 1.00 0.00 C ATOM 1590 CG GLU B 39 -11.918 10.115 -6.631 1.00 0.00 C ATOM 1591 CD GLU B 39 -12.454 10.343 -8.060 1.00 0.00 C ATOM 1592 OE1 GLU B 39 -13.205 9.485 -8.586 1.00 0.00 O ATOM 1593 OE2 GLU B 39 -12.163 11.409 -8.657 1.00 0.00 O ATOM 0 H GLU B 39 -9.047 9.646 -5.596 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.492 8.843 -4.335 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -10.383 8.693 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -11.922 7.960 -6.757 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -12.742 10.185 -5.921 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.213 10.907 -6.379 1.00 0.00 H new ATOM 1600 N ASP B 40 -9.360 6.469 -5.084 1.00 0.00 N ATOM 1601 CA ASP B 40 -8.954 5.116 -4.729 1.00 0.00 C ATOM 1602 C ASP B 40 -8.878 4.913 -3.208 1.00 0.00 C ATOM 1603 O ASP B 40 -9.337 3.896 -2.692 1.00 0.00 O ATOM 1604 CB ASP B 40 -7.563 4.920 -5.343 1.00 0.00 C ATOM 1605 CG ASP B 40 -7.543 4.448 -6.805 1.00 0.00 C ATOM 1606 OD1 ASP B 40 -8.597 4.365 -7.481 1.00 0.00 O ATOM 1607 OD2 ASP B 40 -6.417 4.153 -7.269 1.00 0.00 O ATOM 0 H ASP B 40 -8.642 6.978 -5.599 1.00 0.00 H new ATOM 0 HA ASP B 40 -9.683 4.396 -5.101 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -7.020 5.863 -5.277 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -7.018 4.195 -4.739 1.00 0.00 H new ATOM 1612 N GLU B 41 -8.331 5.882 -2.470 1.00 0.00 N ATOM 1613 CA GLU B 41 -8.160 5.763 -1.020 1.00 0.00 C ATOM 1614 C GLU B 41 -9.520 5.902 -0.313 1.00 0.00 C ATOM 1615 O GLU B 41 -9.806 5.160 0.624 1.00 0.00 O ATOM 1616 CB GLU B 41 -7.149 6.782 -0.453 1.00 0.00 C ATOM 1617 CG GLU B 41 -5.658 6.712 -0.839 1.00 0.00 C ATOM 1618 CD GLU B 41 -4.925 5.405 -0.563 1.00 0.00 C ATOM 1619 OE1 GLU B 41 -5.488 4.388 -0.082 1.00 0.00 O ATOM 1620 OE2 GLU B 41 -3.718 5.344 -0.901 1.00 0.00 O ATOM 0 H GLU B 41 -7.997 6.765 -2.857 1.00 0.00 H new ATOM 0 HA GLU B 41 -7.749 4.772 -0.826 1.00 0.00 H new ATOM 0 HB2 GLU B 41 -7.505 7.774 -0.729 1.00 0.00 H new ATOM 0 HB3 GLU B 41 -7.202 6.715 0.634 1.00 0.00 H new ATOM 0 HG2 GLU B 41 -5.575 6.927 -1.904 1.00 0.00 H new ATOM 0 HG3 GLU B 41 -5.135 7.510 -0.311 1.00 0.00 H new ATOM 1627 N GLU B 42 -10.411 6.774 -0.797 1.00 0.00 N ATOM 1628 CA GLU B 42 -11.803 6.834 -0.324 1.00 0.00 C ATOM 1629 C GLU B 42 -12.533 5.494 -0.539 1.00 0.00 C ATOM 1630 O GLU B 42 -13.283 5.050 0.333 1.00 0.00 O ATOM 1631 CB GLU B 42 -12.549 7.993 -1.009 1.00 0.00 C ATOM 1632 CG GLU B 42 -13.879 8.305 -0.312 1.00 0.00 C ATOM 1633 CD GLU B 42 -14.659 9.402 -1.063 1.00 0.00 C ATOM 1634 OE1 GLU B 42 -14.363 10.606 -0.876 1.00 0.00 O ATOM 1635 OE2 GLU B 42 -15.594 9.068 -1.832 1.00 0.00 O ATOM 0 H GLU B 42 -10.192 7.455 -1.524 1.00 0.00 H new ATOM 0 HA GLU B 42 -11.788 7.020 0.750 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -11.919 8.883 -1.006 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -12.736 7.739 -2.052 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -14.484 7.400 -0.255 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -13.689 8.627 0.712 1.00 0.00 H new ATOM 1642 N LYS B 43 -12.264 4.806 -1.659 1.00 0.00 N ATOM 1643 CA LYS B 43 -12.758 3.447 -1.931 1.00 0.00 C ATOM 1644 C LYS B 43 -12.255 2.432 -0.898 1.00 0.00 C ATOM 1645 O LYS B 43 -13.050 1.645 -0.392 1.00 0.00 O ATOM 1646 CB LYS B 43 -12.396 3.026 -3.372 1.00 0.00 C ATOM 1647 CG LYS B 43 -13.583 2.475 -4.174 1.00 0.00 C ATOM 1648 CD LYS B 43 -14.612 3.570 -4.515 1.00 0.00 C ATOM 1649 CE LYS B 43 -15.683 3.085 -5.503 1.00 0.00 C ATOM 1650 NZ LYS B 43 -15.160 2.963 -6.891 1.00 0.00 N ATOM 0 H LYS B 43 -11.689 5.183 -2.412 1.00 0.00 H new ATOM 0 HA LYS B 43 -13.844 3.460 -1.841 1.00 0.00 H new ATOM 0 HB2 LYS B 43 -11.982 3.886 -3.898 1.00 0.00 H new ATOM 0 HB3 LYS B 43 -11.613 2.269 -3.333 1.00 0.00 H new ATOM 0 HG2 LYS B 43 -13.218 2.022 -5.096 1.00 0.00 H new ATOM 0 HG3 LYS B 43 -14.071 1.686 -3.602 1.00 0.00 H new ATOM 0 HD2 LYS B 43 -15.095 3.908 -3.598 1.00 0.00 H new ATOM 0 HD3 LYS B 43 -14.095 4.431 -4.939 1.00 0.00 H new ATOM 0 HE2 LYS B 43 -16.065 2.118 -5.175 1.00 0.00 H new ATOM 0 HE3 LYS B 43 -16.523 3.779 -5.494 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 -15.919 2.633 -7.520 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 -14.819 3.890 -7.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 -14.375 2.281 -6.908 1.00 0.00 H new ATOM 1664 N HIS B 44 -10.977 2.477 -0.505 1.00 0.00 N ATOM 1665 CA HIS B 44 -10.418 1.637 0.533 1.00 0.00 C ATOM 1666 C HIS B 44 -11.090 1.892 1.883 1.00 0.00 C ATOM 1667 O HIS B 44 -11.458 0.940 2.564 1.00 0.00 O ATOM 1668 CB HIS B 44 -8.913 1.924 0.598 1.00 0.00 C ATOM 1669 CG HIS B 44 -8.108 1.654 -0.653 1.00 0.00 C ATOM 1670 ND1 HIS B 44 -6.734 1.934 -0.834 1.00 0.00 N ATOM 1671 CD2 HIS B 44 -8.611 1.095 -1.789 1.00 0.00 C ATOM 1672 CE1 HIS B 44 -6.486 1.543 -2.113 1.00 0.00 C ATOM 1673 NE2 HIS B 44 -7.597 1.072 -2.700 1.00 0.00 N ATOM 0 H HIS B 44 -10.297 3.116 -0.916 1.00 0.00 H new ATOM 0 HA HIS B 44 -10.593 0.587 0.299 1.00 0.00 H new ATOM 0 HB2 HIS B 44 -8.779 2.972 0.867 1.00 0.00 H new ATOM 0 HB3 HIS B 44 -8.490 1.330 1.408 1.00 0.00 H new ATOM 0 HD2 HIS B 44 -9.619 0.739 -1.939 1.00 0.00 H new ATOM 0 HE1 HIS B 44 -5.521 1.604 -2.593 1.00 0.00 H new ATOM 0 HE2 HIS B 44 -7.670 0.751 -3.665 1.00 0.00 H new ATOM 1681 N ILE B 45 -11.312 3.162 2.241 1.00 0.00 N ATOM 1682 CA ILE B 45 -12.023 3.572 3.461 1.00 0.00 C ATOM 1683 C ILE B 45 -13.480 3.074 3.467 1.00 0.00 C ATOM 1684 O ILE B 45 -13.935 2.554 4.486 1.00 0.00 O ATOM 1685 CB ILE B 45 -11.891 5.110 3.638 1.00 0.00 C ATOM 1686 CG1 ILE B 45 -10.627 5.480 4.452 1.00 0.00 C ATOM 1687 CG2 ILE B 45 -13.105 5.745 4.337 1.00 0.00 C ATOM 1688 CD1 ILE B 45 -9.296 5.381 3.705 1.00 0.00 C ATOM 0 H ILE B 45 -10.996 3.952 1.679 1.00 0.00 H new ATOM 0 HA ILE B 45 -11.563 3.100 4.329 1.00 0.00 H new ATOM 0 HB ILE B 45 -11.823 5.505 2.625 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -10.741 6.500 4.818 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -10.579 4.831 5.327 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -12.950 6.820 4.430 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -14.003 5.557 3.748 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -13.223 5.308 5.329 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -8.482 5.663 4.373 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -9.146 4.357 3.363 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -9.310 6.052 2.846 1.00 0.00 H new ATOM 1700 N GLU B 46 -14.200 3.155 2.341 1.00 0.00 N ATOM 1701 CA GLU B 46 -15.553 2.595 2.202 1.00 0.00 C ATOM 1702 C GLU B 46 -15.601 1.105 2.564 1.00 0.00 C ATOM 1703 O GLU B 46 -16.480 0.673 3.310 1.00 0.00 O ATOM 1704 CB GLU B 46 -16.071 2.795 0.765 1.00 0.00 C ATOM 1705 CG GLU B 46 -16.890 4.073 0.567 1.00 0.00 C ATOM 1706 CD GLU B 46 -18.286 3.963 1.210 1.00 0.00 C ATOM 1707 OE1 GLU B 46 -19.199 3.360 0.594 1.00 0.00 O ATOM 1708 OE2 GLU B 46 -18.488 4.492 2.331 1.00 0.00 O ATOM 0 H GLU B 46 -13.860 3.613 1.496 1.00 0.00 H new ATOM 0 HA GLU B 46 -16.195 3.130 2.902 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -15.221 2.812 0.083 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -16.684 1.937 0.489 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -16.356 4.918 1.001 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -16.996 4.276 -0.499 1.00 0.00 H new ATOM 1715 N TRP B 47 -14.639 0.323 2.073 1.00 0.00 N ATOM 1716 CA TRP B 47 -14.569 -1.113 2.307 1.00 0.00 C ATOM 1717 C TRP B 47 -14.065 -1.450 3.719 1.00 0.00 C ATOM 1718 O TRP B 47 -14.587 -2.353 4.366 1.00 0.00 O ATOM 1719 CB TRP B 47 -13.639 -1.725 1.259 1.00 0.00 C ATOM 1720 CG TRP B 47 -13.859 -1.397 -0.194 1.00 0.00 C ATOM 1721 CD1 TRP B 47 -15.003 -0.986 -0.796 1.00 0.00 C ATOM 1722 CD2 TRP B 47 -12.851 -1.421 -1.251 1.00 0.00 C ATOM 1723 NE1 TRP B 47 -14.755 -0.730 -2.136 1.00 0.00 N ATOM 1724 CE2 TRP B 47 -13.444 -1.002 -2.475 1.00 0.00 C ATOM 1725 CE3 TRP B 47 -11.481 -1.744 -1.280 1.00 0.00 C ATOM 1726 CZ2 TRP B 47 -12.710 -0.916 -3.670 1.00 0.00 C ATOM 1727 CZ3 TRP B 47 -10.730 -1.673 -2.469 1.00 0.00 C ATOM 1728 CH2 TRP B 47 -11.341 -1.251 -3.664 1.00 0.00 C ATOM 0 H TRP B 47 -13.878 0.678 1.494 1.00 0.00 H new ATOM 0 HA TRP B 47 -15.574 -1.527 2.225 1.00 0.00 H new ATOM 0 HB2 TRP B 47 -12.620 -1.431 1.512 1.00 0.00 H new ATOM 0 HB3 TRP B 47 -13.694 -2.809 1.363 1.00 0.00 H new ATOM 0 HD1 TRP B 47 -15.960 -0.875 -0.307 1.00 0.00 H new ATOM 0 HE1 TRP B 47 -15.455 -0.383 -2.791 1.00 0.00 H new ATOM 0 HE3 TRP B 47 -10.994 -2.054 -0.367 1.00 0.00 H new ATOM 0 HZ2 TRP B 47 -13.190 -0.597 -4.583 1.00 0.00 H new ATOM 0 HZ3 TRP B 47 -9.684 -1.943 -2.464 1.00 0.00 H new ATOM 0 HH2 TRP B 47 -10.763 -1.184 -4.574 1.00 0.00 H new ATOM 1739 N LEU B 48 -13.095 -0.695 4.234 1.00 0.00 N ATOM 1740 CA LEU B 48 -12.590 -0.783 5.608 1.00 0.00 C ATOM 1741 C LEU B 48 -13.702 -0.615 6.650 1.00 0.00 C ATOM 1742 O LEU B 48 -13.798 -1.408 7.582 1.00 0.00 O ATOM 1743 CB LEU B 48 -11.504 0.297 5.782 1.00 0.00 C ATOM 1744 CG LEU B 48 -10.116 -0.158 5.311 1.00 0.00 C ATOM 1745 CD1 LEU B 48 -9.193 1.052 5.175 1.00 0.00 C ATOM 1746 CD2 LEU B 48 -9.471 -1.136 6.299 1.00 0.00 C ATOM 0 H LEU B 48 -12.620 0.023 3.687 1.00 0.00 H new ATOM 0 HA LEU B 48 -12.173 -1.777 5.773 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -11.795 1.188 5.226 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -11.449 0.581 6.833 1.00 0.00 H new ATOM 0 HG LEU B 48 -10.250 -0.659 4.352 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -8.209 0.723 4.840 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -9.610 1.748 4.447 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -9.100 1.549 6.140 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -8.490 -1.434 5.928 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -9.361 -0.653 7.270 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -10.103 -2.018 6.402 1.00 0.00 H new ATOM 1758 N GLU B 49 -14.598 0.350 6.453 1.00 0.00 N ATOM 1759 CA GLU B 49 -15.803 0.527 7.288 1.00 0.00 C ATOM 1760 C GLU B 49 -16.793 -0.634 7.192 1.00 0.00 C ATOM 1761 O GLU B 49 -17.558 -0.908 8.116 1.00 0.00 O ATOM 1762 CB GLU B 49 -16.553 1.794 6.854 1.00 0.00 C ATOM 1763 CG GLU B 49 -17.256 2.470 8.040 1.00 0.00 C ATOM 1764 CD GLU B 49 -18.102 3.679 7.596 1.00 0.00 C ATOM 1765 OE1 GLU B 49 -19.261 3.483 7.154 1.00 0.00 O ATOM 1766 OE2 GLU B 49 -17.633 4.837 7.717 1.00 0.00 O ATOM 0 H GLU B 49 -14.515 1.040 5.707 1.00 0.00 H new ATOM 0 HA GLU B 49 -15.442 0.588 8.315 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -15.852 2.494 6.399 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -17.289 1.538 6.092 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -17.896 1.745 8.544 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -16.511 2.796 8.766 1.00 0.00 H new ATOM 1773 N THR B 50 -16.766 -1.315 6.054 1.00 0.00 N ATOM 1774 CA THR B 50 -17.647 -2.452 5.764 1.00 0.00 C ATOM 1775 C THR B 50 -17.097 -3.755 6.358 1.00 0.00 C ATOM 1776 O THR B 50 -17.866 -4.647 6.726 1.00 0.00 O ATOM 1777 CB THR B 50 -17.889 -2.518 4.246 1.00 0.00 C ATOM 1778 OG1 THR B 50 -18.799 -1.507 3.859 1.00 0.00 O ATOM 1779 CG2 THR B 50 -18.469 -3.828 3.752 1.00 0.00 C ATOM 0 H THR B 50 -16.125 -1.095 5.292 1.00 0.00 H new ATOM 0 HA THR B 50 -18.613 -2.310 6.248 1.00 0.00 H new ATOM 0 HB THR B 50 -16.899 -2.397 3.805 1.00 0.00 H new ATOM 0 HG1 THR B 50 -18.304 -0.697 3.615 1.00 0.00 H new ATOM 0 HG21 THR B 50 -18.605 -3.781 2.672 1.00 0.00 H new ATOM 0 HG22 THR B 50 -17.788 -4.643 3.997 1.00 0.00 H new ATOM 0 HG23 THR B 50 -19.432 -4.003 4.231 1.00 0.00 H new ATOM 1787 N ILE B 51 -15.776 -3.836 6.532 1.00 0.00 N ATOM 1788 CA ILE B 51 -15.071 -4.928 7.221 1.00 0.00 C ATOM 1789 C ILE B 51 -14.985 -4.699 8.744 1.00 0.00 C ATOM 1790 O ILE B 51 -14.886 -5.652 9.523 1.00 0.00 O ATOM 1791 CB ILE B 51 -13.711 -5.199 6.512 1.00 0.00 C ATOM 1792 CG1 ILE B 51 -13.875 -6.168 5.315 1.00 0.00 C ATOM 1793 CG2 ILE B 51 -12.655 -5.846 7.418 1.00 0.00 C ATOM 1794 CD1 ILE B 51 -14.583 -5.583 4.095 1.00 0.00 C ATOM 0 H ILE B 51 -15.141 -3.117 6.185 1.00 0.00 H new ATOM 0 HA ILE B 51 -15.649 -5.849 7.139 1.00 0.00 H new ATOM 0 HB ILE B 51 -13.381 -4.207 6.202 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -12.887 -6.514 5.010 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -14.430 -7.044 5.651 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -11.737 -6.003 6.852 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -12.452 -5.191 8.265 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -13.025 -6.805 7.781 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -14.647 -6.340 3.314 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -15.587 -5.265 4.375 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -14.021 -4.726 3.724 1.00 0.00 H new ATOM 1806 N ASN B 52 -15.107 -3.447 9.179 1.00 0.00 N ATOM 1807 CA ASN B 52 -15.246 -3.045 10.583 1.00 0.00 C ATOM 1808 C ASN B 52 -16.581 -3.539 11.199 1.00 0.00 C ATOM 1809 O ASN B 52 -17.594 -3.664 10.503 1.00 0.00 O ATOM 1810 CB ASN B 52 -15.106 -1.512 10.645 1.00 0.00 C ATOM 1811 CG ASN B 52 -15.205 -0.953 12.053 1.00 0.00 C ATOM 1812 OD1 ASN B 52 -16.249 -0.506 12.502 1.00 0.00 O ATOM 1813 ND2 ASN B 52 -14.123 -0.969 12.796 1.00 0.00 N ATOM 0 H ASN B 52 -15.112 -2.651 8.541 1.00 0.00 H new ATOM 0 HA ASN B 52 -14.465 -3.511 11.184 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -14.147 -1.225 10.215 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -15.881 -1.059 10.027 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -14.154 -0.608 13.749 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -13.252 -1.343 12.420 1.00 0.00 H new ATOM 1820 N GLY B 53 -16.588 -3.792 12.515 1.00 0.00 N ATOM 1821 CA GLY B 53 -17.775 -4.193 13.291 1.00 0.00 C ATOM 1822 C GLY B 53 -17.451 -4.550 14.741 1.00 0.00 C ATOM 1823 O GLY B 53 -17.672 -5.719 15.127 1.00 0.00 O ATOM 1824 OXT GLY B 53 -16.976 -3.660 15.480 1.00 0.00 O ATOM 0 H GLY B 53 -15.746 -3.722 13.087 1.00 0.00 H new ATOM 0 HA2 GLY B 53 -18.502 -3.381 13.277 1.00 0.00 H new ATOM 0 HA3 GLY B 53 -18.245 -5.050 12.808 1.00 0.00 H new TER 1828 GLY B 53 HETATM 1829 ZN ZN A 54 -2.404 4.858 -1.263 1.00 0.00 ZN HETATM 1830 ZN ZN B 154 -5.344 2.727 0.585 1.00 0.00 ZN