USER MOD reduce.3.24.130724 H: found=0, std=0, add=1287, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1279 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: B 569 HIS HD1 : B 569 HIS ND1 : B 701 ZNZN :(H bumps) USER MOD NoAdj-H: B 572 HIS HD1 : B 572 HIS ND1 : B 701 ZNZN :(H bumps) USER MOD Set 1.1: B 562 THR OG1 : rot 180:sc= 0.0243 USER MOD Set 1.2: B 567 LYS NZ :NH3+ 142:sc= 0.0139 (180deg=0) USER MOD Set 1.3: B 584 LYS NZ :NH3+ 148:sc= -6.19! (180deg=-7.48!) USER MOD Set 2.1: A 25 THR OG1 : rot 130:sc= -1.05 USER MOD Set 2.2: A 93 THR OG1 : rot 146:sc= -0.257 USER MOD Set 3.1: A 74 LYS NZ :NH3+ 172:sc= -3.14! (180deg=-3.3!) USER MOD Set 3.2: A 82 TYR OH : rot 180:sc= 0.163 USER MOD Single : A 1 MET CE :methyl -152:sc= -0.213 (180deg=-1.52!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 CYS SG : rot -14:sc= 0.579 USER MOD Single : A 13 TYR OH : rot -29:sc= 0.432 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0636 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -5.16! C(o=-5.2!,f=-5!) USER MOD Single : A 28 ASN : amide:sc= -2.96! K(o=-3!,f=-1.5) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= -0.65 USER MOD Single : A 40 HIS : no HD1:sc= 0.512 K(o=0.51,f=-2.5!) USER MOD Single : A 45 MET CE :methyl 146:sc= -1.43 (180deg=-4.2!) USER MOD Single : A 47 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.175) USER MOD Single : A 51 LYS NZ :NH3+ -133:sc= -0.75 (180deg=-1.54) USER MOD Single : A 55 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.0895) USER MOD Single : A 56 LYS NZ :NH3+ -105:sc= 1.27 (180deg=-1.75!) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -6.39! C(o=-6.4!,f=-18!) USER MOD Single : A 67 LYS NZ :NH3+ 159:sc= -0.182 (180deg=-0.973) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0645 USER MOD Single : A 75 THR OG1 : rot 120:sc= -0.368 USER MOD Single : A 76 HIS : no HD1:sc= -0.512 X(o=-0.51,f=-0.089) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.71 USER MOD Single : A 81 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.501) USER MOD Single : A 85 GLN : amide:sc= -3.19! K(o=-3.2!,f=-2.3) USER MOD Single : A 89 LYS NZ :NH3+ 162:sc= -0.0322 (180deg=-0.388) USER MOD Single : A 91 GLN : amide:sc= -9.48! C(o=-9.5!,f=-18!) USER MOD Single : B 541 TYR OH : rot 180:sc= 0 USER MOD Single : B 542 HIS : no HD1:sc= 0 X(o=0,f=-0.087) USER MOD Single : B 547 SER OG : rot 36:sc= 1.21 USER MOD Single : B 550 SER OG : rot 130:sc= 0 USER MOD Single : B 553 GLN : amide:sc= -3.36! K(o=-3.4!,f=-1.2) USER MOD Single : B 554 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 557 THR OG1 : rot 65:sc= 1.18 USER MOD Single : B 560 CYS SG : rot 30:sc= 0.363 USER MOD Single : B 564 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 566 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 580 LYS NZ :NH3+ 158:sc= -0.0321 (180deg=-0.758) USER MOD Single : B 581 GLN : amide:sc= -4.94! K(o=-4.9!,f=-2.2) USER MOD Single : B 583 ASN : amide:sc= -1.99! C(o=-2!,f=-3.9!) USER MOD Single : B 586 THR OG1 : rot 180:sc= -0.0241 USER MOD Single : B 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 590 GLN : amide:sc= -1.34! K(o=-1.3!,f=-3.3) USER MOD Single : B 591 ASN : amide:sc= -12.7! C(o=-13!,f=-6.5!) USER MOD Single : B 593 LYS NZ :NH3+ -162:sc= -0.0141 (180deg=-0.282) USER MOD Single : B 595 TYR OH : rot 180:sc= 0 USER MOD Single : B 597 GLN : amide:sc= -4.57! K(o=-4.6!,f=-0.088) USER MOD Single : B 598 ASN : amide:sc= -0.596 X(o=-0.6,f=-0.55) USER MOD Single : B 602 LYS NZ :NH3+ -149:sc= -0.354 (180deg=-1.56!) USER MOD Single : B 605 CYS SG : rot -57:sc= 0.173 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 97.222 -31.343 17.563 1.00 0.00 N ATOM 2 CA MET A 1 96.361 -31.484 16.354 1.00 0.00 C ATOM 3 C MET A 1 96.924 -30.613 15.223 1.00 0.00 C ATOM 4 O MET A 1 98.028 -30.829 14.764 1.00 0.00 O ATOM 5 CB MET A 1 94.931 -31.057 16.699 1.00 0.00 C ATOM 6 CG MET A 1 93.979 -31.557 15.613 1.00 0.00 C ATOM 7 SD MET A 1 92.312 -30.932 15.935 1.00 0.00 S ATOM 8 CE MET A 1 92.061 -31.768 17.521 1.00 0.00 C ATOM 0 H1 MET A 1 96.842 -31.933 18.331 1.00 0.00 H new ATOM 0 H2 MET A 1 98.190 -31.650 17.338 1.00 0.00 H new ATOM 0 H3 MET A 1 97.236 -30.348 17.865 1.00 0.00 H new ATOM 0 HA MET A 1 96.349 -32.523 16.024 1.00 0.00 H new ATOM 0 HB2 MET A 1 94.641 -31.464 17.668 1.00 0.00 H new ATOM 0 HB3 MET A 1 94.872 -29.971 16.779 1.00 0.00 H new ATOM 0 HG2 MET A 1 94.321 -31.223 14.633 1.00 0.00 H new ATOM 0 HG3 MET A 1 93.973 -32.647 15.594 1.00 0.00 H new ATOM 0 HE1 MET A 1 90.997 -31.948 17.673 1.00 0.00 H new ATOM 0 HE2 MET A 1 92.594 -32.719 17.519 1.00 0.00 H new ATOM 0 HE3 MET A 1 92.441 -31.141 18.327 1.00 0.00 H new ATOM 18 N ALA A 2 96.187 -29.631 14.763 1.00 0.00 N ATOM 19 CA ALA A 2 96.701 -28.759 13.663 1.00 0.00 C ATOM 20 C ALA A 2 96.198 -27.339 13.902 1.00 0.00 C ATOM 21 O ALA A 2 96.934 -26.377 13.808 1.00 0.00 O ATOM 22 CB ALA A 2 96.181 -29.279 12.316 1.00 0.00 C ATOM 0 H ALA A 2 95.254 -29.397 15.102 1.00 0.00 H new ATOM 0 HA ALA A 2 97.791 -28.768 13.647 1.00 0.00 H new ATOM 0 HB1 ALA A 2 96.555 -28.645 11.512 1.00 0.00 H new ATOM 0 HB2 ALA A 2 96.527 -30.301 12.162 1.00 0.00 H new ATOM 0 HB3 ALA A 2 95.091 -29.261 12.315 1.00 0.00 H new ATOM 28 N LEU A 3 94.949 -27.211 14.227 1.00 0.00 N ATOM 29 CA LEU A 3 94.371 -25.881 14.497 1.00 0.00 C ATOM 30 C LEU A 3 95.046 -25.282 15.707 1.00 0.00 C ATOM 31 O LEU A 3 95.768 -24.310 15.628 1.00 0.00 O ATOM 32 CB LEU A 3 92.913 -26.067 14.826 1.00 0.00 C ATOM 33 CG LEU A 3 92.191 -26.685 13.614 1.00 0.00 C ATOM 34 CD1 LEU A 3 92.429 -28.209 13.532 1.00 0.00 C ATOM 35 CD2 LEU A 3 90.705 -26.402 13.743 1.00 0.00 C ATOM 0 H LEU A 3 94.295 -27.988 14.318 1.00 0.00 H new ATOM 0 HA LEU A 3 94.504 -25.232 13.632 1.00 0.00 H new ATOM 0 HB2 LEU A 3 92.805 -26.714 15.697 1.00 0.00 H new ATOM 0 HB3 LEU A 3 92.461 -25.109 15.083 1.00 0.00 H new ATOM 0 HG LEU A 3 92.588 -26.240 12.701 1.00 0.00 H new ATOM 0 HD11 LEU A 3 91.905 -28.613 12.665 1.00 0.00 H new ATOM 0 HD12 LEU A 3 93.497 -28.406 13.435 1.00 0.00 H new ATOM 0 HD13 LEU A 3 92.053 -28.685 14.438 1.00 0.00 H new ATOM 0 HD21 LEU A 3 90.177 -26.833 12.892 1.00 0.00 H new ATOM 0 HD22 LEU A 3 90.329 -26.845 14.665 1.00 0.00 H new ATOM 0 HD23 LEU A 3 90.540 -25.325 13.764 1.00 0.00 H new ATOM 47 N ASP A 4 94.801 -25.865 16.838 1.00 0.00 N ATOM 48 CA ASP A 4 95.411 -25.351 18.079 1.00 0.00 C ATOM 49 C ASP A 4 96.877 -25.769 18.113 1.00 0.00 C ATOM 50 O ASP A 4 97.525 -25.738 19.141 1.00 0.00 O ATOM 51 CB ASP A 4 94.684 -25.937 19.284 1.00 0.00 C ATOM 52 CG ASP A 4 95.306 -25.393 20.572 1.00 0.00 C ATOM 53 OD1 ASP A 4 95.009 -25.932 21.625 1.00 0.00 O ATOM 54 OD2 ASP A 4 96.069 -24.444 20.482 1.00 0.00 O ATOM 0 H ASP A 4 94.200 -26.681 16.955 1.00 0.00 H new ATOM 0 HA ASP A 4 95.334 -24.264 18.110 1.00 0.00 H new ATOM 0 HB2 ASP A 4 93.625 -25.681 19.243 1.00 0.00 H new ATOM 0 HB3 ASP A 4 94.750 -27.025 19.268 1.00 0.00 H new ATOM 59 N GLY A 5 97.403 -26.152 16.987 1.00 0.00 N ATOM 60 CA GLY A 5 98.832 -26.566 16.935 1.00 0.00 C ATOM 61 C GLY A 5 99.673 -25.375 17.344 1.00 0.00 C ATOM 62 O GLY A 5 100.854 -25.475 17.615 1.00 0.00 O ATOM 0 H GLY A 5 96.905 -26.197 16.098 1.00 0.00 H new ATOM 0 HA2 GLY A 5 99.011 -27.408 17.604 1.00 0.00 H new ATOM 0 HA3 GLY A 5 99.098 -26.895 15.931 1.00 0.00 H new ATOM 66 N ILE A 6 99.047 -24.240 17.369 1.00 0.00 N ATOM 67 CA ILE A 6 99.734 -22.970 17.734 1.00 0.00 C ATOM 68 C ILE A 6 99.186 -22.497 19.090 1.00 0.00 C ATOM 69 O ILE A 6 99.646 -22.917 20.133 1.00 0.00 O ATOM 70 CB ILE A 6 99.457 -21.914 16.625 1.00 0.00 C ATOM 71 CG1 ILE A 6 98.287 -22.378 15.735 1.00 0.00 C ATOM 72 CG2 ILE A 6 100.699 -21.708 15.759 1.00 0.00 C ATOM 73 CD1 ILE A 6 98.706 -23.528 14.796 1.00 0.00 C ATOM 0 H ILE A 6 98.058 -24.132 17.145 1.00 0.00 H new ATOM 0 HA ILE A 6 100.811 -23.114 17.816 1.00 0.00 H new ATOM 0 HB ILE A 6 99.198 -20.971 17.107 1.00 0.00 H new ATOM 0 HG12 ILE A 6 97.459 -22.705 16.364 1.00 0.00 H new ATOM 0 HG13 ILE A 6 97.925 -21.538 15.142 1.00 0.00 H new ATOM 0 HG21 ILE A 6 100.487 -20.966 14.989 1.00 0.00 H new ATOM 0 HG22 ILE A 6 101.523 -21.359 16.382 1.00 0.00 H new ATOM 0 HG23 ILE A 6 100.975 -22.651 15.288 1.00 0.00 H new ATOM 0 HD11 ILE A 6 97.854 -23.827 14.185 1.00 0.00 H new ATOM 0 HD12 ILE A 6 99.517 -23.193 14.149 1.00 0.00 H new ATOM 0 HD13 ILE A 6 99.043 -24.378 15.389 1.00 0.00 H new ATOM 85 N ARG A 7 98.212 -21.626 19.084 1.00 0.00 N ATOM 86 CA ARG A 7 97.644 -21.129 20.364 1.00 0.00 C ATOM 87 C ARG A 7 96.184 -20.727 20.158 1.00 0.00 C ATOM 88 O ARG A 7 95.300 -21.561 20.181 1.00 0.00 O ATOM 89 CB ARG A 7 98.453 -19.922 20.839 1.00 0.00 C ATOM 90 CG ARG A 7 98.711 -18.933 19.674 1.00 0.00 C ATOM 91 CD ARG A 7 100.128 -19.116 19.117 1.00 0.00 C ATOM 92 NE ARG A 7 100.248 -18.391 17.821 1.00 0.00 N ATOM 93 CZ ARG A 7 101.425 -18.151 17.310 1.00 0.00 C ATOM 94 NH1 ARG A 7 101.525 -17.510 16.178 1.00 0.00 N ATOM 95 NH2 ARG A 7 102.500 -18.554 17.929 1.00 0.00 N ATOM 0 H ARG A 7 97.786 -21.238 18.242 1.00 0.00 H new ATOM 0 HA ARG A 7 97.692 -21.917 21.116 1.00 0.00 H new ATOM 0 HB2 ARG A 7 97.917 -19.413 21.641 1.00 0.00 H new ATOM 0 HB3 ARG A 7 99.404 -20.257 21.253 1.00 0.00 H new ATOM 0 HG2 ARG A 7 97.979 -19.095 18.883 1.00 0.00 H new ATOM 0 HG3 ARG A 7 98.581 -17.909 20.023 1.00 0.00 H new ATOM 0 HD2 ARG A 7 100.862 -18.736 19.828 1.00 0.00 H new ATOM 0 HD3 ARG A 7 100.341 -20.176 18.975 1.00 0.00 H new ATOM 0 HE ARG A 7 99.408 -18.081 17.332 1.00 0.00 H new ATOM 0 HH11 ARG A 7 100.684 -17.197 15.693 1.00 0.00 H new ATOM 0 HH12 ARG A 7 102.444 -17.322 15.778 1.00 0.00 H new ATOM 0 HH21 ARG A 7 102.421 -19.057 18.813 1.00 0.00 H new ATOM 0 HH22 ARG A 7 103.419 -18.366 17.529 1.00 0.00 H new ATOM 109 N MET A 8 95.910 -19.457 19.973 1.00 0.00 N ATOM 110 CA MET A 8 94.487 -19.022 19.785 1.00 0.00 C ATOM 111 C MET A 8 94.402 -17.823 18.804 1.00 0.00 C ATOM 112 O MET A 8 93.821 -17.966 17.749 1.00 0.00 O ATOM 113 CB MET A 8 93.845 -18.711 21.163 1.00 0.00 C ATOM 114 CG MET A 8 94.902 -18.845 22.279 1.00 0.00 C ATOM 115 SD MET A 8 94.217 -18.226 23.836 1.00 0.00 S ATOM 116 CE MET A 8 95.621 -18.660 24.892 1.00 0.00 C ATOM 0 H MET A 8 96.602 -18.708 19.944 1.00 0.00 H new ATOM 0 HA MET A 8 93.917 -19.833 19.332 1.00 0.00 H new ATOM 0 HB2 MET A 8 93.431 -17.703 21.162 1.00 0.00 H new ATOM 0 HB3 MET A 8 93.017 -19.395 21.351 1.00 0.00 H new ATOM 0 HG2 MET A 8 95.200 -19.888 22.389 1.00 0.00 H new ATOM 0 HG3 MET A 8 95.798 -18.284 22.015 1.00 0.00 H new ATOM 0 HE1 MET A 8 95.410 -18.362 25.919 1.00 0.00 H new ATOM 0 HE2 MET A 8 95.786 -19.737 24.854 1.00 0.00 H new ATOM 0 HE3 MET A 8 96.514 -18.143 24.540 1.00 0.00 H new ATOM 126 N PRO A 9 94.970 -16.659 19.090 1.00 0.00 N ATOM 127 CA PRO A 9 94.908 -15.518 18.130 1.00 0.00 C ATOM 128 C PRO A 9 95.207 -16.004 16.723 1.00 0.00 C ATOM 129 O PRO A 9 94.648 -15.550 15.744 1.00 0.00 O ATOM 130 CB PRO A 9 96.013 -14.586 18.622 1.00 0.00 C ATOM 131 CG PRO A 9 96.020 -14.792 20.088 1.00 0.00 C ATOM 132 CD PRO A 9 95.717 -16.278 20.303 1.00 0.00 C ATOM 0 HA PRO A 9 93.931 -15.036 18.091 1.00 0.00 H new ATOM 0 HB2 PRO A 9 96.976 -14.838 18.178 1.00 0.00 H new ATOM 0 HB3 PRO A 9 95.805 -13.547 18.365 1.00 0.00 H new ATOM 0 HG2 PRO A 9 96.986 -14.524 20.516 1.00 0.00 H new ATOM 0 HG3 PRO A 9 95.272 -14.166 20.574 1.00 0.00 H new ATOM 0 HD2 PRO A 9 96.631 -16.862 20.411 1.00 0.00 H new ATOM 0 HD3 PRO A 9 95.127 -16.440 21.205 1.00 0.00 H new ATOM 140 N ASP A 10 96.097 -16.948 16.647 1.00 0.00 N ATOM 141 CA ASP A 10 96.493 -17.541 15.334 1.00 0.00 C ATOM 142 C ASP A 10 95.993 -18.979 15.283 1.00 0.00 C ATOM 143 O ASP A 10 95.753 -19.534 14.229 1.00 0.00 O ATOM 144 CB ASP A 10 98.019 -17.522 15.211 1.00 0.00 C ATOM 145 CG ASP A 10 98.419 -17.748 13.751 1.00 0.00 C ATOM 146 OD1 ASP A 10 99.427 -17.197 13.341 1.00 0.00 O ATOM 147 OD2 ASP A 10 97.710 -18.470 13.069 1.00 0.00 O ATOM 0 H ASP A 10 96.579 -17.345 17.453 1.00 0.00 H new ATOM 0 HA ASP A 10 96.061 -16.968 14.514 1.00 0.00 H new ATOM 0 HB2 ASP A 10 98.410 -16.567 15.562 1.00 0.00 H new ATOM 0 HB3 ASP A 10 98.455 -18.297 15.842 1.00 0.00 H new ATOM 152 N GLY A 11 95.835 -19.581 16.425 1.00 0.00 N ATOM 153 CA GLY A 11 95.349 -20.987 16.477 1.00 0.00 C ATOM 154 C GLY A 11 93.824 -21.002 16.550 1.00 0.00 C ATOM 155 O GLY A 11 93.212 -22.033 16.744 1.00 0.00 O ATOM 0 H GLY A 11 96.023 -19.157 17.333 1.00 0.00 H new ATOM 0 HA2 GLY A 11 95.686 -21.531 15.595 1.00 0.00 H new ATOM 0 HA3 GLY A 11 95.769 -21.495 17.345 1.00 0.00 H new ATOM 159 N CYS A 12 93.204 -19.866 16.400 1.00 0.00 N ATOM 160 CA CYS A 12 91.718 -19.820 16.467 1.00 0.00 C ATOM 161 C CYS A 12 91.202 -18.484 15.924 1.00 0.00 C ATOM 162 O CYS A 12 90.097 -18.400 15.425 1.00 0.00 O ATOM 163 CB CYS A 12 91.278 -19.976 17.922 1.00 0.00 C ATOM 164 SG CYS A 12 89.501 -19.659 18.052 1.00 0.00 S ATOM 0 H CYS A 12 93.661 -18.969 16.234 1.00 0.00 H new ATOM 0 HA CYS A 12 91.309 -20.629 15.862 1.00 0.00 H new ATOM 0 HB2 CYS A 12 91.506 -20.981 18.276 1.00 0.00 H new ATOM 0 HB3 CYS A 12 91.829 -19.282 18.556 1.00 0.00 H new ATOM 0 HG CYS A 12 89.081 -19.088 16.962 1.00 0.00 H new ATOM 170 N TYR A 13 91.974 -17.433 16.038 1.00 0.00 N ATOM 171 CA TYR A 13 91.510 -16.113 15.551 1.00 0.00 C ATOM 172 C TYR A 13 90.153 -15.832 16.179 1.00 0.00 C ATOM 173 O TYR A 13 90.061 -15.521 17.348 1.00 0.00 O ATOM 174 CB TYR A 13 91.377 -16.124 14.026 1.00 0.00 C ATOM 175 CG TYR A 13 92.743 -16.169 13.381 1.00 0.00 C ATOM 176 CD1 TYR A 13 93.312 -17.400 13.032 1.00 0.00 C ATOM 177 CD2 TYR A 13 93.433 -14.980 13.120 1.00 0.00 C ATOM 178 CE1 TYR A 13 94.572 -17.441 12.423 1.00 0.00 C ATOM 179 CE2 TYR A 13 94.694 -15.021 12.512 1.00 0.00 C ATOM 180 CZ TYR A 13 95.263 -16.252 12.162 1.00 0.00 C ATOM 181 OH TYR A 13 96.504 -16.293 11.561 1.00 0.00 O ATOM 0 H TYR A 13 92.907 -17.439 16.450 1.00 0.00 H new ATOM 0 HA TYR A 13 92.229 -15.342 15.826 1.00 0.00 H new ATOM 0 HB2 TYR A 13 90.790 -16.987 13.712 1.00 0.00 H new ATOM 0 HB3 TYR A 13 90.840 -15.235 13.695 1.00 0.00 H new ATOM 0 HD1 TYR A 13 92.779 -18.318 13.233 1.00 0.00 H new ATOM 0 HD2 TYR A 13 92.993 -14.031 13.387 1.00 0.00 H new ATOM 0 HE1 TYR A 13 95.011 -18.390 12.154 1.00 0.00 H new ATOM 0 HE2 TYR A 13 95.228 -14.103 12.313 1.00 0.00 H new ATOM 0 HH TYR A 13 96.952 -17.133 11.793 1.00 0.00 H new ATOM 191 N ALA A 14 89.102 -15.957 15.409 1.00 0.00 N ATOM 192 CA ALA A 14 87.727 -15.715 15.935 1.00 0.00 C ATOM 193 C ALA A 14 86.811 -15.424 14.753 1.00 0.00 C ATOM 194 O ALA A 14 85.684 -15.876 14.695 1.00 0.00 O ATOM 195 CB ALA A 14 87.737 -14.521 16.908 1.00 0.00 C ATOM 0 H ALA A 14 89.141 -16.220 14.424 1.00 0.00 H new ATOM 0 HA ALA A 14 87.371 -16.591 16.476 1.00 0.00 H new ATOM 0 HB1 ALA A 14 86.729 -14.352 17.287 1.00 0.00 H new ATOM 0 HB2 ALA A 14 88.406 -14.736 17.741 1.00 0.00 H new ATOM 0 HB3 ALA A 14 88.083 -13.629 16.386 1.00 0.00 H new ATOM 201 N ASP A 15 87.292 -14.675 13.808 1.00 0.00 N ATOM 202 CA ASP A 15 86.456 -14.354 12.625 1.00 0.00 C ATOM 203 C ASP A 15 87.332 -13.793 11.504 1.00 0.00 C ATOM 204 O ASP A 15 86.842 -13.269 10.524 1.00 0.00 O ATOM 205 CB ASP A 15 85.424 -13.307 13.024 1.00 0.00 C ATOM 206 CG ASP A 15 84.352 -13.198 11.938 1.00 0.00 C ATOM 207 OD1 ASP A 15 83.771 -12.133 11.812 1.00 0.00 O ATOM 208 OD2 ASP A 15 84.129 -14.182 11.251 1.00 0.00 O ATOM 0 H ASP A 15 88.228 -14.271 13.803 1.00 0.00 H new ATOM 0 HA ASP A 15 85.961 -15.259 12.273 1.00 0.00 H new ATOM 0 HB2 ASP A 15 84.965 -13.579 13.975 1.00 0.00 H new ATOM 0 HB3 ASP A 15 85.909 -12.341 13.168 1.00 0.00 H new ATOM 213 N GLY A 16 88.621 -13.874 11.652 1.00 0.00 N ATOM 214 CA GLY A 16 89.523 -13.318 10.607 1.00 0.00 C ATOM 215 C GLY A 16 89.522 -11.804 10.758 1.00 0.00 C ATOM 216 O GLY A 16 89.382 -11.066 9.805 1.00 0.00 O ATOM 0 H GLY A 16 89.091 -14.301 12.451 1.00 0.00 H new ATOM 0 HA2 GLY A 16 90.532 -13.714 10.722 1.00 0.00 H new ATOM 0 HA3 GLY A 16 89.180 -13.604 9.613 1.00 0.00 H new ATOM 220 N THR A 17 89.645 -11.341 11.969 1.00 0.00 N ATOM 221 CA THR A 17 89.620 -9.878 12.219 1.00 0.00 C ATOM 222 C THR A 17 90.945 -9.235 11.804 1.00 0.00 C ATOM 223 O THR A 17 92.005 -9.568 12.297 1.00 0.00 O ATOM 224 CB THR A 17 89.372 -9.629 13.718 1.00 0.00 C ATOM 225 OG1 THR A 17 90.015 -10.645 14.475 1.00 0.00 O ATOM 226 CG2 THR A 17 87.869 -9.652 14.011 1.00 0.00 C ATOM 0 H THR A 17 89.763 -11.919 12.801 1.00 0.00 H new ATOM 0 HA THR A 17 88.821 -9.431 11.628 1.00 0.00 H new ATOM 0 HB THR A 17 89.774 -8.653 13.991 1.00 0.00 H new ATOM 0 HG1 THR A 17 89.861 -10.489 15.430 1.00 0.00 H new ATOM 0 HG21 THR A 17 87.703 -9.475 15.074 1.00 0.00 H new ATOM 0 HG22 THR A 17 87.373 -8.873 13.431 1.00 0.00 H new ATOM 0 HG23 THR A 17 87.460 -10.624 13.737 1.00 0.00 H new ATOM 234 N TRP A 18 90.867 -8.291 10.910 1.00 0.00 N ATOM 235 CA TRP A 18 92.072 -7.560 10.436 1.00 0.00 C ATOM 236 C TRP A 18 91.680 -6.087 10.254 1.00 0.00 C ATOM 237 O TRP A 18 90.744 -5.771 9.549 1.00 0.00 O ATOM 238 CB TRP A 18 92.556 -8.157 9.098 1.00 0.00 C ATOM 239 CG TRP A 18 91.477 -8.971 8.447 1.00 0.00 C ATOM 240 CD1 TRP A 18 90.205 -8.562 8.221 1.00 0.00 C ATOM 241 CD2 TRP A 18 91.567 -10.329 7.926 1.00 0.00 C ATOM 242 NE1 TRP A 18 89.512 -9.584 7.598 1.00 0.00 N ATOM 243 CE2 TRP A 18 90.308 -10.693 7.394 1.00 0.00 C ATOM 244 CE3 TRP A 18 92.611 -11.270 7.865 1.00 0.00 C ATOM 245 CZ2 TRP A 18 90.092 -11.948 6.823 1.00 0.00 C ATOM 246 CZ3 TRP A 18 92.397 -12.533 7.290 1.00 0.00 C ATOM 247 CH2 TRP A 18 91.139 -12.871 6.770 1.00 0.00 C ATOM 0 H TRP A 18 89.994 -7.988 10.477 1.00 0.00 H new ATOM 0 HA TRP A 18 92.885 -7.648 11.157 1.00 0.00 H new ATOM 0 HB2 TRP A 18 92.864 -7.354 8.428 1.00 0.00 H new ATOM 0 HB3 TRP A 18 93.432 -8.781 9.271 1.00 0.00 H new ATOM 0 HD1 TRP A 18 89.799 -7.596 8.484 1.00 0.00 H new ATOM 0 HE1 TRP A 18 88.532 -9.525 7.323 1.00 0.00 H new ATOM 0 HE3 TRP A 18 93.583 -11.019 8.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 89.121 -12.204 6.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 93.205 -13.248 7.248 1.00 0.00 H new ATOM 0 HH2 TRP A 18 90.980 -13.844 6.329 1.00 0.00 H new ATOM 258 N GLU A 19 92.368 -5.179 10.891 1.00 0.00 N ATOM 259 CA GLU A 19 91.986 -3.743 10.738 1.00 0.00 C ATOM 260 C GLU A 19 92.408 -3.238 9.362 1.00 0.00 C ATOM 261 O GLU A 19 93.533 -3.408 8.936 1.00 0.00 O ATOM 262 CB GLU A 19 92.614 -2.857 11.849 1.00 0.00 C ATOM 263 CG GLU A 19 93.637 -3.647 12.654 1.00 0.00 C ATOM 264 CD GLU A 19 94.716 -4.203 11.722 1.00 0.00 C ATOM 265 OE1 GLU A 19 95.078 -5.356 11.889 1.00 0.00 O ATOM 266 OE2 GLU A 19 95.160 -3.467 10.856 1.00 0.00 O ATOM 0 H GLU A 19 93.165 -5.362 11.501 1.00 0.00 H new ATOM 0 HA GLU A 19 90.903 -3.674 10.836 1.00 0.00 H new ATOM 0 HB2 GLU A 19 93.091 -1.986 11.400 1.00 0.00 H new ATOM 0 HB3 GLU A 19 91.831 -2.486 12.511 1.00 0.00 H new ATOM 0 HG2 GLU A 19 94.092 -3.006 13.409 1.00 0.00 H new ATOM 0 HG3 GLU A 19 93.145 -4.463 13.183 1.00 0.00 H new ATOM 273 N LEU A 20 91.503 -2.597 8.674 1.00 0.00 N ATOM 274 CA LEU A 20 91.832 -2.053 7.333 1.00 0.00 C ATOM 275 C LEU A 20 92.483 -0.687 7.535 1.00 0.00 C ATOM 276 O LEU A 20 91.979 0.145 8.256 1.00 0.00 O ATOM 277 CB LEU A 20 90.529 -1.915 6.505 1.00 0.00 C ATOM 278 CG LEU A 20 90.670 -2.550 5.106 1.00 0.00 C ATOM 279 CD1 LEU A 20 91.960 -2.084 4.405 1.00 0.00 C ATOM 280 CD2 LEU A 20 90.646 -4.086 5.232 1.00 0.00 C ATOM 0 H LEU A 20 90.547 -2.428 8.987 1.00 0.00 H new ATOM 0 HA LEU A 20 92.513 -2.714 6.796 1.00 0.00 H new ATOM 0 HB2 LEU A 20 89.707 -2.391 7.039 1.00 0.00 H new ATOM 0 HB3 LEU A 20 90.274 -0.860 6.402 1.00 0.00 H new ATOM 0 HG LEU A 20 89.830 -2.225 4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 20 92.029 -2.550 3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 20 91.942 -1.000 4.292 1.00 0.00 H new ATOM 0 HD13 LEU A 20 92.824 -2.372 5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 20 90.746 -4.534 4.243 1.00 0.00 H new ATOM 0 HD22 LEU A 20 91.473 -4.412 5.863 1.00 0.00 H new ATOM 0 HD23 LEU A 20 89.703 -4.400 5.679 1.00 0.00 H new ATOM 292 N SER A 21 93.594 -0.454 6.912 1.00 0.00 N ATOM 293 CA SER A 21 94.277 0.853 7.083 1.00 0.00 C ATOM 294 C SER A 21 93.596 1.904 6.230 1.00 0.00 C ATOM 295 O SER A 21 93.126 1.627 5.144 1.00 0.00 O ATOM 296 CB SER A 21 95.734 0.726 6.642 1.00 0.00 C ATOM 297 OG SER A 21 96.525 1.664 7.358 1.00 0.00 O ATOM 0 H SER A 21 94.063 -1.112 6.289 1.00 0.00 H new ATOM 0 HA SER A 21 94.229 1.146 8.132 1.00 0.00 H new ATOM 0 HB2 SER A 21 96.095 -0.286 6.826 1.00 0.00 H new ATOM 0 HB3 SER A 21 95.818 0.905 5.570 1.00 0.00 H new ATOM 0 HG SER A 21 97.461 1.584 7.078 1.00 0.00 H new ATOM 303 N VAL A 22 93.565 3.117 6.707 1.00 0.00 N ATOM 304 CA VAL A 22 92.943 4.215 5.917 1.00 0.00 C ATOM 305 C VAL A 22 93.859 5.419 5.892 1.00 0.00 C ATOM 306 O VAL A 22 94.665 5.640 6.770 1.00 0.00 O ATOM 307 CB VAL A 22 91.579 4.638 6.511 1.00 0.00 C ATOM 308 CG1 VAL A 22 91.139 6.002 5.946 1.00 0.00 C ATOM 309 CG2 VAL A 22 90.538 3.609 6.116 1.00 0.00 C ATOM 0 H VAL A 22 93.945 3.396 7.612 1.00 0.00 H new ATOM 0 HA VAL A 22 92.784 3.841 4.905 1.00 0.00 H new ATOM 0 HB VAL A 22 91.676 4.710 7.594 1.00 0.00 H new ATOM 0 HG11 VAL A 22 90.177 6.281 6.377 1.00 0.00 H new ATOM 0 HG12 VAL A 22 91.883 6.758 6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 22 91.045 5.934 4.862 1.00 0.00 H new ATOM 0 HG21 VAL A 22 89.570 3.894 6.528 1.00 0.00 H new ATOM 0 HG22 VAL A 22 90.469 3.559 5.029 1.00 0.00 H new ATOM 0 HG23 VAL A 22 90.825 2.633 6.506 1.00 0.00 H new ATOM 319 N HIS A 23 93.670 6.223 4.896 1.00 0.00 N ATOM 320 CA HIS A 23 94.420 7.481 4.754 1.00 0.00 C ATOM 321 C HIS A 23 93.348 8.531 4.544 1.00 0.00 C ATOM 322 O HIS A 23 92.817 8.686 3.462 1.00 0.00 O ATOM 323 CB HIS A 23 95.318 7.386 3.519 1.00 0.00 C ATOM 324 CG HIS A 23 96.644 6.775 3.891 1.00 0.00 C ATOM 325 ND1 HIS A 23 96.762 5.452 4.285 1.00 0.00 N ATOM 326 CD2 HIS A 23 97.914 7.292 3.930 1.00 0.00 C ATOM 327 CE1 HIS A 23 98.061 5.219 4.541 1.00 0.00 C ATOM 328 NE2 HIS A 23 98.808 6.308 4.341 1.00 0.00 N ATOM 0 H HIS A 23 92.999 6.049 4.147 1.00 0.00 H new ATOM 0 HA HIS A 23 95.055 7.707 5.610 1.00 0.00 H new ATOM 0 HB2 HIS A 23 94.833 6.782 2.752 1.00 0.00 H new ATOM 0 HB3 HIS A 23 95.472 8.378 3.094 1.00 0.00 H new ATOM 0 HD2 HIS A 23 98.180 8.308 3.680 1.00 0.00 H new ATOM 0 HE1 HIS A 23 98.453 4.267 4.868 1.00 0.00 H new ATOM 0 HE2 HIS A 23 99.817 6.399 4.463 1.00 0.00 H new ATOM 336 N VAL A 24 92.994 9.230 5.573 1.00 0.00 N ATOM 337 CA VAL A 24 91.923 10.236 5.422 1.00 0.00 C ATOM 338 C VAL A 24 92.464 11.429 4.644 1.00 0.00 C ATOM 339 O VAL A 24 93.047 12.330 5.204 1.00 0.00 O ATOM 340 CB VAL A 24 91.445 10.665 6.803 1.00 0.00 C ATOM 341 CG1 VAL A 24 90.142 11.448 6.666 1.00 0.00 C ATOM 342 CG2 VAL A 24 91.201 9.421 7.661 1.00 0.00 C ATOM 0 H VAL A 24 93.396 9.150 6.507 1.00 0.00 H new ATOM 0 HA VAL A 24 91.080 9.814 4.874 1.00 0.00 H new ATOM 0 HB VAL A 24 92.201 11.293 7.274 1.00 0.00 H new ATOM 0 HG11 VAL A 24 89.797 11.756 7.653 1.00 0.00 H new ATOM 0 HG12 VAL A 24 90.311 12.330 6.049 1.00 0.00 H new ATOM 0 HG13 VAL A 24 89.386 10.817 6.198 1.00 0.00 H new ATOM 0 HG21 VAL A 24 90.859 9.723 8.651 1.00 0.00 H new ATOM 0 HG22 VAL A 24 90.442 8.797 7.189 1.00 0.00 H new ATOM 0 HG23 VAL A 24 92.128 8.856 7.755 1.00 0.00 H new ATOM 352 N THR A 25 92.272 11.443 3.351 1.00 0.00 N ATOM 353 CA THR A 25 92.782 12.589 2.550 1.00 0.00 C ATOM 354 C THR A 25 92.020 13.839 2.988 1.00 0.00 C ATOM 355 O THR A 25 91.065 13.749 3.731 1.00 0.00 O ATOM 356 CB THR A 25 92.589 12.331 1.045 1.00 0.00 C ATOM 357 OG1 THR A 25 91.392 12.952 0.604 1.00 0.00 O ATOM 358 CG2 THR A 25 92.526 10.821 0.772 1.00 0.00 C ATOM 0 H THR A 25 91.789 10.717 2.821 1.00 0.00 H new ATOM 0 HA THR A 25 93.851 12.721 2.719 1.00 0.00 H new ATOM 0 HB THR A 25 93.434 12.752 0.500 1.00 0.00 H new ATOM 0 HG1 THR A 25 91.577 13.488 -0.195 1.00 0.00 H new ATOM 0 HG21 THR A 25 92.389 10.650 -0.296 1.00 0.00 H new ATOM 0 HG22 THR A 25 93.455 10.353 1.099 1.00 0.00 H new ATOM 0 HG23 THR A 25 91.689 10.387 1.319 1.00 0.00 H new ATOM 366 N ASP A 26 92.450 15.001 2.575 1.00 0.00 N ATOM 367 CA ASP A 26 91.767 16.252 3.022 1.00 0.00 C ATOM 368 C ASP A 26 92.149 16.464 4.491 1.00 0.00 C ATOM 369 O ASP A 26 92.535 17.540 4.903 1.00 0.00 O ATOM 370 CB ASP A 26 90.238 16.127 2.868 1.00 0.00 C ATOM 371 CG ASP A 26 89.912 15.243 1.662 1.00 0.00 C ATOM 372 OD1 ASP A 26 90.196 15.660 0.552 1.00 0.00 O ATOM 373 OD2 ASP A 26 89.384 14.163 1.870 1.00 0.00 O ATOM 0 H ASP A 26 93.243 15.139 1.949 1.00 0.00 H new ATOM 0 HA ASP A 26 92.077 17.101 2.413 1.00 0.00 H new ATOM 0 HB2 ASP A 26 89.805 15.699 3.772 1.00 0.00 H new ATOM 0 HB3 ASP A 26 89.794 17.114 2.738 1.00 0.00 H new ATOM 378 N LEU A 27 92.083 15.412 5.268 1.00 0.00 N ATOM 379 CA LEU A 27 92.480 15.485 6.701 1.00 0.00 C ATOM 380 C LEU A 27 93.951 15.101 6.764 1.00 0.00 C ATOM 381 O LEU A 27 94.700 15.568 7.595 1.00 0.00 O ATOM 382 CB LEU A 27 91.649 14.461 7.506 1.00 0.00 C ATOM 383 CG LEU A 27 91.365 14.933 8.947 1.00 0.00 C ATOM 384 CD1 LEU A 27 90.694 16.315 8.966 1.00 0.00 C ATOM 385 CD2 LEU A 27 90.439 13.907 9.615 1.00 0.00 C ATOM 0 H LEU A 27 91.765 14.493 4.962 1.00 0.00 H new ATOM 0 HA LEU A 27 92.313 16.480 7.114 1.00 0.00 H new ATOM 0 HB2 LEU A 27 90.704 14.281 6.993 1.00 0.00 H new ATOM 0 HB3 LEU A 27 92.181 13.510 7.537 1.00 0.00 H new ATOM 0 HG LEU A 27 92.310 15.016 9.484 1.00 0.00 H new ATOM 0 HD11 LEU A 27 90.509 16.615 9.997 1.00 0.00 H new ATOM 0 HD12 LEU A 27 91.348 17.044 8.488 1.00 0.00 H new ATOM 0 HD13 LEU A 27 89.748 16.268 8.427 1.00 0.00 H new ATOM 0 HD21 LEU A 27 90.225 14.221 10.637 1.00 0.00 H new ATOM 0 HD22 LEU A 27 89.507 13.838 9.054 1.00 0.00 H new ATOM 0 HD23 LEU A 27 90.927 12.932 9.630 1.00 0.00 H new ATOM 397 N ASN A 28 94.338 14.223 5.876 1.00 0.00 N ATOM 398 CA ASN A 28 95.739 13.741 5.825 1.00 0.00 C ATOM 399 C ASN A 28 95.996 12.807 6.997 1.00 0.00 C ATOM 400 O ASN A 28 97.121 12.429 7.254 1.00 0.00 O ATOM 401 CB ASN A 28 96.725 14.917 5.877 1.00 0.00 C ATOM 402 CG ASN A 28 98.082 14.458 5.354 1.00 0.00 C ATOM 403 OD1 ASN A 28 98.915 15.261 4.985 1.00 0.00 O ATOM 404 ND2 ASN A 28 98.333 13.184 5.312 1.00 0.00 N ATOM 0 H ASN A 28 93.724 13.815 5.171 1.00 0.00 H new ATOM 0 HA ASN A 28 95.889 13.208 4.886 1.00 0.00 H new ATOM 0 HB2 ASN A 28 96.352 15.746 5.276 1.00 0.00 H new ATOM 0 HB3 ASN A 28 96.821 15.282 6.900 1.00 0.00 H new ATOM 0 HD21 ASN A 28 99.234 12.853 4.968 1.00 0.00 H new ATOM 0 HD22 ASN A 28 97.629 12.515 5.623 1.00 0.00 H new ATOM 411 N ARG A 29 94.977 12.410 7.723 1.00 0.00 N ATOM 412 CA ARG A 29 95.227 11.498 8.853 1.00 0.00 C ATOM 413 C ARG A 29 95.203 10.072 8.348 1.00 0.00 C ATOM 414 O ARG A 29 94.985 9.807 7.182 1.00 0.00 O ATOM 415 CB ARG A 29 94.143 11.669 9.900 1.00 0.00 C ATOM 416 CG ARG A 29 94.291 13.043 10.543 1.00 0.00 C ATOM 417 CD ARG A 29 93.158 13.270 11.548 1.00 0.00 C ATOM 418 NE ARG A 29 93.552 12.714 12.873 1.00 0.00 N ATOM 419 CZ ARG A 29 92.642 12.475 13.777 1.00 0.00 C ATOM 420 NH1 ARG A 29 92.987 11.988 14.938 1.00 0.00 N ATOM 421 NH2 ARG A 29 91.387 12.725 13.519 1.00 0.00 N ATOM 0 H ARG A 29 94.004 12.679 7.576 1.00 0.00 H new ATOM 0 HA ARG A 29 96.197 11.725 9.295 1.00 0.00 H new ATOM 0 HB2 ARG A 29 93.158 11.571 9.443 1.00 0.00 H new ATOM 0 HB3 ARG A 29 94.223 10.888 10.656 1.00 0.00 H new ATOM 0 HG2 ARG A 29 95.255 13.118 11.045 1.00 0.00 H new ATOM 0 HG3 ARG A 29 94.270 13.818 9.776 1.00 0.00 H new ATOM 0 HD2 ARG A 29 92.944 14.335 11.637 1.00 0.00 H new ATOM 0 HD3 ARG A 29 92.244 12.790 11.197 1.00 0.00 H new ATOM 0 HE ARG A 29 94.533 12.520 13.073 1.00 0.00 H new ATOM 0 HH11 ARG A 29 93.968 11.794 15.139 1.00 0.00 H new ATOM 0 HH12 ARG A 29 92.275 11.801 15.645 1.00 0.00 H new ATOM 0 HH21 ARG A 29 91.119 13.107 12.612 1.00 0.00 H new ATOM 0 HH22 ARG A 29 90.674 12.539 14.225 1.00 0.00 H new ATOM 435 N ASP A 30 95.404 9.153 9.231 1.00 0.00 N ATOM 436 CA ASP A 30 95.378 7.721 8.855 1.00 0.00 C ATOM 437 C ASP A 30 94.739 6.953 9.997 1.00 0.00 C ATOM 438 O ASP A 30 95.173 7.035 11.129 1.00 0.00 O ATOM 439 CB ASP A 30 96.797 7.207 8.618 1.00 0.00 C ATOM 440 CG ASP A 30 97.307 7.706 7.265 1.00 0.00 C ATOM 441 OD1 ASP A 30 97.152 8.884 6.992 1.00 0.00 O ATOM 442 OD2 ASP A 30 97.847 6.901 6.525 1.00 0.00 O ATOM 0 H ASP A 30 95.589 9.333 10.218 1.00 0.00 H new ATOM 0 HA ASP A 30 94.810 7.586 7.934 1.00 0.00 H new ATOM 0 HB2 ASP A 30 97.456 7.550 9.415 1.00 0.00 H new ATOM 0 HB3 ASP A 30 96.808 6.117 8.642 1.00 0.00 H new ATOM 447 N VAL A 31 93.689 6.236 9.715 1.00 0.00 N ATOM 448 CA VAL A 31 92.975 5.481 10.794 1.00 0.00 C ATOM 449 C VAL A 31 92.807 4.010 10.407 1.00 0.00 C ATOM 450 O VAL A 31 92.863 3.650 9.249 1.00 0.00 O ATOM 451 CB VAL A 31 91.607 6.122 10.994 1.00 0.00 C ATOM 452 CG1 VAL A 31 90.989 5.610 12.294 1.00 0.00 C ATOM 453 CG2 VAL A 31 91.764 7.653 11.058 1.00 0.00 C ATOM 0 H VAL A 31 93.289 6.137 8.782 1.00 0.00 H new ATOM 0 HA VAL A 31 93.556 5.521 11.715 1.00 0.00 H new ATOM 0 HB VAL A 31 90.955 5.861 10.160 1.00 0.00 H new ATOM 0 HG11 VAL A 31 90.011 6.069 12.437 1.00 0.00 H new ATOM 0 HG12 VAL A 31 90.878 4.527 12.242 1.00 0.00 H new ATOM 0 HG13 VAL A 31 91.637 5.869 13.131 1.00 0.00 H new ATOM 0 HG21 VAL A 31 90.786 8.113 11.201 1.00 0.00 H new ATOM 0 HG22 VAL A 31 92.415 7.917 11.891 1.00 0.00 H new ATOM 0 HG23 VAL A 31 92.202 8.013 10.127 1.00 0.00 H new ATOM 463 N THR A 32 92.605 3.156 11.386 1.00 0.00 N ATOM 464 CA THR A 32 92.428 1.690 11.116 1.00 0.00 C ATOM 465 C THR A 32 91.082 1.238 11.707 1.00 0.00 C ATOM 466 O THR A 32 90.691 1.663 12.776 1.00 0.00 O ATOM 467 CB THR A 32 93.595 0.909 11.778 1.00 0.00 C ATOM 468 OG1 THR A 32 94.432 1.829 12.462 1.00 0.00 O ATOM 469 CG2 THR A 32 94.430 0.166 10.725 1.00 0.00 C ATOM 0 H THR A 32 92.555 3.416 12.371 1.00 0.00 H new ATOM 0 HA THR A 32 92.434 1.496 10.044 1.00 0.00 H new ATOM 0 HB THR A 32 93.176 0.177 12.469 1.00 0.00 H new ATOM 0 HG1 THR A 32 95.172 1.346 12.886 1.00 0.00 H new ATOM 0 HG21 THR A 32 95.240 -0.372 11.217 1.00 0.00 H new ATOM 0 HG22 THR A 32 93.796 -0.542 10.191 1.00 0.00 H new ATOM 0 HG23 THR A 32 94.847 0.884 10.019 1.00 0.00 H new ATOM 477 N LEU A 33 90.369 0.390 11.003 1.00 0.00 N ATOM 478 CA LEU A 33 89.036 -0.092 11.481 1.00 0.00 C ATOM 479 C LEU A 33 89.061 -1.610 11.646 1.00 0.00 C ATOM 480 O LEU A 33 89.136 -2.342 10.686 1.00 0.00 O ATOM 481 CB LEU A 33 87.981 0.282 10.418 1.00 0.00 C ATOM 482 CG LEU A 33 87.306 1.630 10.723 1.00 0.00 C ATOM 483 CD1 LEU A 33 86.239 1.459 11.806 1.00 0.00 C ATOM 484 CD2 LEU A 33 88.344 2.669 11.167 1.00 0.00 C ATOM 0 H LEU A 33 90.660 0.007 10.104 1.00 0.00 H new ATOM 0 HA LEU A 33 88.797 0.366 12.441 1.00 0.00 H new ATOM 0 HB2 LEU A 33 88.455 0.328 9.438 1.00 0.00 H new ATOM 0 HB3 LEU A 33 87.223 -0.500 10.369 1.00 0.00 H new ATOM 0 HG LEU A 33 86.828 1.985 9.810 1.00 0.00 H new ATOM 0 HD11 LEU A 33 85.771 2.422 12.011 1.00 0.00 H new ATOM 0 HD12 LEU A 33 85.483 0.753 11.463 1.00 0.00 H new ATOM 0 HD13 LEU A 33 86.703 1.080 12.717 1.00 0.00 H new ATOM 0 HD21 LEU A 33 87.845 3.615 11.378 1.00 0.00 H new ATOM 0 HD22 LEU A 33 88.849 2.317 12.066 1.00 0.00 H new ATOM 0 HD23 LEU A 33 89.076 2.814 10.373 1.00 0.00 H new ATOM 496 N ARG A 34 88.953 -2.075 12.858 1.00 0.00 N ATOM 497 CA ARG A 34 88.939 -3.538 13.105 1.00 0.00 C ATOM 498 C ARG A 34 87.745 -4.131 12.367 1.00 0.00 C ATOM 499 O ARG A 34 86.610 -3.973 12.771 1.00 0.00 O ATOM 500 CB ARG A 34 88.796 -3.792 14.608 1.00 0.00 C ATOM 501 CG ARG A 34 88.986 -5.284 14.900 1.00 0.00 C ATOM 502 CD ARG A 34 90.446 -5.702 14.665 1.00 0.00 C ATOM 503 NE ARG A 34 90.764 -6.873 15.528 1.00 0.00 N ATOM 504 CZ ARG A 34 90.897 -6.717 16.817 1.00 0.00 C ATOM 505 NH1 ARG A 34 91.174 -7.743 17.573 1.00 0.00 N ATOM 506 NH2 ARG A 34 90.752 -5.534 17.349 1.00 0.00 N ATOM 0 H ARG A 34 88.873 -1.497 13.694 1.00 0.00 H new ATOM 0 HA ARG A 34 89.863 -3.997 12.753 1.00 0.00 H new ATOM 0 HB2 ARG A 34 89.534 -3.207 15.157 1.00 0.00 H new ATOM 0 HB3 ARG A 34 87.813 -3.467 14.950 1.00 0.00 H new ATOM 0 HG2 ARG A 34 88.703 -5.497 15.931 1.00 0.00 H new ATOM 0 HG3 ARG A 34 88.327 -5.872 14.261 1.00 0.00 H new ATOM 0 HD2 ARG A 34 90.600 -5.955 13.616 1.00 0.00 H new ATOM 0 HD3 ARG A 34 91.116 -4.873 14.894 1.00 0.00 H new ATOM 0 HE ARG A 34 90.878 -7.797 15.112 1.00 0.00 H new ATOM 0 HH11 ARG A 34 91.287 -8.667 17.157 1.00 0.00 H new ATOM 0 HH12 ARG A 34 91.278 -7.621 18.580 1.00 0.00 H new ATOM 0 HH21 ARG A 34 90.535 -4.732 16.757 1.00 0.00 H new ATOM 0 HH22 ARG A 34 90.856 -5.412 18.356 1.00 0.00 H new ATOM 520 N VAL A 35 87.999 -4.785 11.262 1.00 0.00 N ATOM 521 CA VAL A 35 86.893 -5.370 10.445 1.00 0.00 C ATOM 522 C VAL A 35 87.173 -6.832 10.136 1.00 0.00 C ATOM 523 O VAL A 35 88.076 -7.441 10.671 1.00 0.00 O ATOM 524 CB VAL A 35 86.801 -4.614 9.122 1.00 0.00 C ATOM 525 CG1 VAL A 35 86.319 -3.189 9.385 1.00 0.00 C ATOM 526 CG2 VAL A 35 88.182 -4.572 8.463 1.00 0.00 C ATOM 0 H VAL A 35 88.935 -4.940 10.887 1.00 0.00 H new ATOM 0 HA VAL A 35 85.963 -5.289 11.008 1.00 0.00 H new ATOM 0 HB VAL A 35 86.098 -5.120 8.461 1.00 0.00 H new ATOM 0 HG11 VAL A 35 86.253 -2.647 8.441 1.00 0.00 H new ATOM 0 HG12 VAL A 35 85.337 -3.218 9.856 1.00 0.00 H new ATOM 0 HG13 VAL A 35 87.023 -2.683 10.045 1.00 0.00 H new ATOM 0 HG21 VAL A 35 88.118 -4.032 7.518 1.00 0.00 H new ATOM 0 HG22 VAL A 35 88.885 -4.065 9.124 1.00 0.00 H new ATOM 0 HG23 VAL A 35 88.528 -5.589 8.277 1.00 0.00 H new ATOM 536 N THR A 36 86.395 -7.384 9.250 1.00 0.00 N ATOM 537 CA THR A 36 86.572 -8.800 8.845 1.00 0.00 C ATOM 538 C THR A 36 86.266 -8.884 7.353 1.00 0.00 C ATOM 539 O THR A 36 85.723 -7.966 6.775 1.00 0.00 O ATOM 540 CB THR A 36 85.595 -9.683 9.629 1.00 0.00 C ATOM 541 OG1 THR A 36 84.358 -9.001 9.770 1.00 0.00 O ATOM 542 CG2 THR A 36 86.163 -9.982 11.013 1.00 0.00 C ATOM 0 H THR A 36 85.629 -6.901 8.781 1.00 0.00 H new ATOM 0 HA THR A 36 87.586 -9.143 9.050 1.00 0.00 H new ATOM 0 HB THR A 36 85.445 -10.619 9.091 1.00 0.00 H new ATOM 0 HG1 THR A 36 83.730 -9.563 10.269 1.00 0.00 H new ATOM 0 HG21 THR A 36 85.464 -10.610 11.565 1.00 0.00 H new ATOM 0 HG22 THR A 36 87.115 -10.502 10.911 1.00 0.00 H new ATOM 0 HG23 THR A 36 86.316 -9.048 11.553 1.00 0.00 H new ATOM 550 N GLY A 37 86.609 -9.957 6.715 1.00 0.00 N ATOM 551 CA GLY A 37 86.328 -10.054 5.260 1.00 0.00 C ATOM 552 C GLY A 37 84.853 -10.353 5.045 1.00 0.00 C ATOM 553 O GLY A 37 84.481 -11.227 4.288 1.00 0.00 O ATOM 0 H GLY A 37 87.068 -10.767 7.130 1.00 0.00 H new ATOM 0 HA2 GLY A 37 86.596 -9.121 4.764 1.00 0.00 H new ATOM 0 HA3 GLY A 37 86.938 -10.839 4.813 1.00 0.00 H new ATOM 557 N GLU A 38 84.009 -9.620 5.707 1.00 0.00 N ATOM 558 CA GLU A 38 82.550 -9.829 5.557 1.00 0.00 C ATOM 559 C GLU A 38 81.821 -8.521 5.866 1.00 0.00 C ATOM 560 O GLU A 38 80.608 -8.463 5.842 1.00 0.00 O ATOM 561 CB GLU A 38 82.092 -10.917 6.531 1.00 0.00 C ATOM 562 CG GLU A 38 82.126 -10.383 7.976 1.00 0.00 C ATOM 563 CD GLU A 38 80.789 -9.717 8.323 1.00 0.00 C ATOM 564 OE1 GLU A 38 80.811 -8.572 8.741 1.00 0.00 O ATOM 565 OE2 GLU A 38 79.768 -10.366 8.163 1.00 0.00 O ATOM 0 H GLU A 38 84.272 -8.876 6.353 1.00 0.00 H new ATOM 0 HA GLU A 38 82.323 -10.139 4.537 1.00 0.00 H new ATOM 0 HB2 GLU A 38 81.082 -11.240 6.278 1.00 0.00 H new ATOM 0 HB3 GLU A 38 82.738 -11.790 6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 38 82.325 -11.200 8.669 1.00 0.00 H new ATOM 0 HG3 GLU A 38 82.939 -9.665 8.088 1.00 0.00 H new ATOM 572 N VAL A 39 82.540 -7.462 6.149 1.00 0.00 N ATOM 573 CA VAL A 39 81.854 -6.178 6.444 1.00 0.00 C ATOM 574 C VAL A 39 81.473 -5.501 5.133 1.00 0.00 C ATOM 575 O VAL A 39 82.228 -5.494 4.185 1.00 0.00 O ATOM 576 CB VAL A 39 82.767 -5.254 7.258 1.00 0.00 C ATOM 577 CG1 VAL A 39 83.414 -6.054 8.379 1.00 0.00 C ATOM 578 CG2 VAL A 39 83.856 -4.637 6.368 1.00 0.00 C ATOM 0 H VAL A 39 83.559 -7.436 6.187 1.00 0.00 H new ATOM 0 HA VAL A 39 80.958 -6.381 7.030 1.00 0.00 H new ATOM 0 HB VAL A 39 82.167 -4.445 7.674 1.00 0.00 H new ATOM 0 HG11 VAL A 39 84.065 -5.403 8.962 1.00 0.00 H new ATOM 0 HG12 VAL A 39 82.639 -6.466 9.026 1.00 0.00 H new ATOM 0 HG13 VAL A 39 84.002 -6.867 7.953 1.00 0.00 H new ATOM 0 HG21 VAL A 39 84.491 -3.985 6.969 1.00 0.00 H new ATOM 0 HG22 VAL A 39 84.461 -5.431 5.931 1.00 0.00 H new ATOM 0 HG23 VAL A 39 83.390 -4.056 5.572 1.00 0.00 H new ATOM 588 N HIS A 40 80.317 -4.923 5.075 1.00 0.00 N ATOM 589 CA HIS A 40 79.902 -4.235 3.824 1.00 0.00 C ATOM 590 C HIS A 40 80.587 -2.866 3.770 1.00 0.00 C ATOM 591 O HIS A 40 80.721 -2.192 4.771 1.00 0.00 O ATOM 592 CB HIS A 40 78.372 -4.073 3.801 1.00 0.00 C ATOM 593 CG HIS A 40 77.729 -5.212 4.546 1.00 0.00 C ATOM 594 ND1 HIS A 40 77.583 -5.207 5.924 1.00 0.00 N ATOM 595 CD2 HIS A 40 77.185 -6.397 4.117 1.00 0.00 C ATOM 596 CE1 HIS A 40 76.975 -6.355 6.273 1.00 0.00 C ATOM 597 NE2 HIS A 40 76.710 -7.118 5.209 1.00 0.00 N ATOM 0 H HIS A 40 79.638 -4.894 5.836 1.00 0.00 H new ATOM 0 HA HIS A 40 80.196 -4.824 2.955 1.00 0.00 H new ATOM 0 HB2 HIS A 40 78.091 -3.123 4.256 1.00 0.00 H new ATOM 0 HB3 HIS A 40 78.015 -4.051 2.772 1.00 0.00 H new ATOM 0 HD2 HIS A 40 77.133 -6.721 3.088 1.00 0.00 H new ATOM 0 HE1 HIS A 40 76.731 -6.627 7.289 1.00 0.00 H new ATOM 0 HE2 HIS A 40 76.257 -8.032 5.199 1.00 0.00 H new ATOM 605 N ILE A 41 81.029 -2.452 2.612 1.00 0.00 N ATOM 606 CA ILE A 41 81.708 -1.127 2.501 1.00 0.00 C ATOM 607 C ILE A 41 80.889 -0.073 3.237 1.00 0.00 C ATOM 608 O ILE A 41 81.364 0.587 4.133 1.00 0.00 O ATOM 609 CB ILE A 41 81.808 -0.728 1.030 1.00 0.00 C ATOM 610 CG1 ILE A 41 82.573 -1.803 0.262 1.00 0.00 C ATOM 611 CG2 ILE A 41 82.540 0.606 0.900 1.00 0.00 C ATOM 612 CD1 ILE A 41 82.430 -1.564 -1.243 1.00 0.00 C ATOM 0 H ILE A 41 80.949 -2.973 1.739 1.00 0.00 H new ATOM 0 HA ILE A 41 82.704 -1.197 2.937 1.00 0.00 H new ATOM 0 HB ILE A 41 80.804 -0.627 0.619 1.00 0.00 H new ATOM 0 HG12 ILE A 41 83.626 -1.785 0.544 1.00 0.00 H new ATOM 0 HG13 ILE A 41 82.190 -2.790 0.521 1.00 0.00 H new ATOM 0 HG21 ILE A 41 82.607 0.883 -0.152 1.00 0.00 H new ATOM 0 HG22 ILE A 41 81.993 1.376 1.444 1.00 0.00 H new ATOM 0 HG23 ILE A 41 83.543 0.512 1.315 1.00 0.00 H new ATOM 0 HD11 ILE A 41 82.978 -2.333 -1.787 1.00 0.00 H new ATOM 0 HD12 ILE A 41 81.376 -1.604 -1.519 1.00 0.00 H new ATOM 0 HD13 ILE A 41 82.834 -0.584 -1.496 1.00 0.00 H new ATOM 624 N GLY A 42 79.657 0.088 2.864 1.00 0.00 N ATOM 625 CA GLY A 42 78.814 1.103 3.539 1.00 0.00 C ATOM 626 C GLY A 42 78.741 0.791 5.027 1.00 0.00 C ATOM 627 O GLY A 42 78.290 1.593 5.829 1.00 0.00 O ATOM 0 H GLY A 42 79.197 -0.439 2.121 1.00 0.00 H new ATOM 0 HA2 GLY A 42 79.231 2.098 3.385 1.00 0.00 H new ATOM 0 HA3 GLY A 42 77.813 1.106 3.107 1.00 0.00 H new ATOM 631 N GLY A 43 79.214 -0.356 5.410 1.00 0.00 N ATOM 632 CA GLY A 43 79.194 -0.714 6.847 1.00 0.00 C ATOM 633 C GLY A 43 80.379 -0.025 7.477 1.00 0.00 C ATOM 634 O GLY A 43 80.418 0.258 8.654 1.00 0.00 O ATOM 0 H GLY A 43 79.613 -1.060 4.790 1.00 0.00 H new ATOM 0 HA2 GLY A 43 78.264 -0.391 7.314 1.00 0.00 H new ATOM 0 HA3 GLY A 43 79.258 -1.794 6.979 1.00 0.00 H new ATOM 638 N VAL A 44 81.341 0.250 6.659 1.00 0.00 N ATOM 639 CA VAL A 44 82.571 0.928 7.109 1.00 0.00 C ATOM 640 C VAL A 44 82.259 2.410 7.378 1.00 0.00 C ATOM 641 O VAL A 44 82.503 2.914 8.457 1.00 0.00 O ATOM 642 CB VAL A 44 83.622 0.728 5.979 1.00 0.00 C ATOM 643 CG1 VAL A 44 83.837 1.992 5.127 1.00 0.00 C ATOM 644 CG2 VAL A 44 84.949 0.280 6.575 1.00 0.00 C ATOM 0 H VAL A 44 81.324 0.025 5.664 1.00 0.00 H new ATOM 0 HA VAL A 44 82.964 0.520 8.040 1.00 0.00 H new ATOM 0 HB VAL A 44 83.227 -0.042 5.316 1.00 0.00 H new ATOM 0 HG11 VAL A 44 84.581 1.789 4.356 1.00 0.00 H new ATOM 0 HG12 VAL A 44 82.896 2.278 4.657 1.00 0.00 H new ATOM 0 HG13 VAL A 44 84.186 2.805 5.764 1.00 0.00 H new ATOM 0 HG21 VAL A 44 85.678 0.143 5.777 1.00 0.00 H new ATOM 0 HG22 VAL A 44 85.310 1.038 7.270 1.00 0.00 H new ATOM 0 HG23 VAL A 44 84.810 -0.662 7.106 1.00 0.00 H new ATOM 654 N MET A 45 81.727 3.111 6.403 1.00 0.00 N ATOM 655 CA MET A 45 81.408 4.557 6.611 1.00 0.00 C ATOM 656 C MET A 45 80.694 4.719 7.949 1.00 0.00 C ATOM 657 O MET A 45 80.814 5.728 8.620 1.00 0.00 O ATOM 658 CB MET A 45 80.476 5.066 5.500 1.00 0.00 C ATOM 659 CG MET A 45 80.997 4.643 4.124 1.00 0.00 C ATOM 660 SD MET A 45 80.137 5.588 2.828 1.00 0.00 S ATOM 661 CE MET A 45 78.599 4.620 2.720 1.00 0.00 C ATOM 0 H MET A 45 81.502 2.745 5.478 1.00 0.00 H new ATOM 0 HA MET A 45 82.336 5.128 6.595 1.00 0.00 H new ATOM 0 HB2 MET A 45 79.471 4.671 5.652 1.00 0.00 H new ATOM 0 HB3 MET A 45 80.402 6.152 5.549 1.00 0.00 H new ATOM 0 HG2 MET A 45 82.071 4.816 4.062 1.00 0.00 H new ATOM 0 HG3 MET A 45 80.837 3.575 3.976 1.00 0.00 H new ATOM 0 HE1 MET A 45 77.766 5.285 2.494 1.00 0.00 H new ATOM 0 HE2 MET A 45 78.693 3.874 1.930 1.00 0.00 H new ATOM 0 HE3 MET A 45 78.416 4.120 3.671 1.00 0.00 H new ATOM 671 N LEU A 46 79.941 3.728 8.331 1.00 0.00 N ATOM 672 CA LEU A 46 79.196 3.813 9.614 1.00 0.00 C ATOM 673 C LEU A 46 80.146 3.703 10.813 1.00 0.00 C ATOM 674 O LEU A 46 79.865 4.222 11.863 1.00 0.00 O ATOM 675 CB LEU A 46 78.163 2.677 9.664 1.00 0.00 C ATOM 676 CG LEU A 46 77.174 2.881 10.856 1.00 0.00 C ATOM 677 CD1 LEU A 46 75.723 2.660 10.393 1.00 0.00 C ATOM 678 CD2 LEU A 46 77.499 1.888 11.984 1.00 0.00 C ATOM 0 H LEU A 46 79.809 2.862 7.809 1.00 0.00 H new ATOM 0 HA LEU A 46 78.697 4.780 9.669 1.00 0.00 H new ATOM 0 HB2 LEU A 46 77.608 2.642 8.727 1.00 0.00 H new ATOM 0 HB3 LEU A 46 78.673 1.719 9.768 1.00 0.00 H new ATOM 0 HG LEU A 46 77.283 3.902 11.222 1.00 0.00 H new ATOM 0 HD11 LEU A 46 75.046 2.806 11.235 1.00 0.00 H new ATOM 0 HD12 LEU A 46 75.480 3.372 9.605 1.00 0.00 H new ATOM 0 HD13 LEU A 46 75.614 1.645 10.011 1.00 0.00 H new ATOM 0 HD21 LEU A 46 76.805 2.037 12.811 1.00 0.00 H new ATOM 0 HD22 LEU A 46 77.404 0.869 11.610 1.00 0.00 H new ATOM 0 HD23 LEU A 46 78.519 2.053 12.332 1.00 0.00 H new ATOM 690 N LYS A 47 81.255 3.022 10.694 1.00 0.00 N ATOM 691 CA LYS A 47 82.167 2.896 11.883 1.00 0.00 C ATOM 692 C LYS A 47 83.177 4.048 11.949 1.00 0.00 C ATOM 693 O LYS A 47 83.238 4.763 12.927 1.00 0.00 O ATOM 694 CB LYS A 47 82.937 1.580 11.805 1.00 0.00 C ATOM 695 CG LYS A 47 81.959 0.418 11.621 1.00 0.00 C ATOM 696 CD LYS A 47 82.704 -0.937 11.729 1.00 0.00 C ATOM 697 CE LYS A 47 82.118 -1.949 10.734 1.00 0.00 C ATOM 698 NZ LYS A 47 80.663 -2.130 11.002 1.00 0.00 N ATOM 0 H LYS A 47 81.570 2.553 9.845 1.00 0.00 H new ATOM 0 HA LYS A 47 81.544 2.926 12.777 1.00 0.00 H new ATOM 0 HB2 LYS A 47 83.642 1.609 10.974 1.00 0.00 H new ATOM 0 HB3 LYS A 47 83.521 1.435 12.714 1.00 0.00 H new ATOM 0 HG2 LYS A 47 81.175 0.471 12.377 1.00 0.00 H new ATOM 0 HG3 LYS A 47 81.471 0.495 10.650 1.00 0.00 H new ATOM 0 HD2 LYS A 47 83.766 -0.793 11.529 1.00 0.00 H new ATOM 0 HD3 LYS A 47 82.621 -1.325 12.744 1.00 0.00 H new ATOM 0 HE2 LYS A 47 82.269 -1.599 9.713 1.00 0.00 H new ATOM 0 HE3 LYS A 47 82.636 -2.904 10.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 80.312 -2.953 10.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 80.514 -2.284 12.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 80.146 -1.279 10.701 1.00 0.00 H new ATOM 712 N LEU A 48 83.995 4.220 10.942 1.00 0.00 N ATOM 713 CA LEU A 48 85.016 5.321 10.994 1.00 0.00 C ATOM 714 C LEU A 48 84.341 6.604 11.487 1.00 0.00 C ATOM 715 O LEU A 48 84.748 7.205 12.461 1.00 0.00 O ATOM 716 CB LEU A 48 85.620 5.538 9.580 1.00 0.00 C ATOM 717 CG LEU A 48 87.158 5.883 9.643 1.00 0.00 C ATOM 718 CD1 LEU A 48 87.978 4.910 8.769 1.00 0.00 C ATOM 719 CD2 LEU A 48 87.425 7.311 9.139 1.00 0.00 C ATOM 0 H LEU A 48 84.004 3.655 10.093 1.00 0.00 H new ATOM 0 HA LEU A 48 85.820 5.052 11.679 1.00 0.00 H new ATOM 0 HB2 LEU A 48 85.474 4.639 8.981 1.00 0.00 H new ATOM 0 HB3 LEU A 48 85.087 6.346 9.078 1.00 0.00 H new ATOM 0 HG LEU A 48 87.460 5.794 10.687 1.00 0.00 H new ATOM 0 HD11 LEU A 48 89.035 5.169 8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 48 87.833 3.890 9.126 1.00 0.00 H new ATOM 0 HD13 LEU A 48 87.645 4.983 7.734 1.00 0.00 H new ATOM 0 HD21 LEU A 48 88.493 7.522 9.193 1.00 0.00 H new ATOM 0 HD22 LEU A 48 87.089 7.401 8.106 1.00 0.00 H new ATOM 0 HD23 LEU A 48 86.882 8.023 9.760 1.00 0.00 H new ATOM 731 N VAL A 49 83.306 7.013 10.818 1.00 0.00 N ATOM 732 CA VAL A 49 82.587 8.247 11.242 1.00 0.00 C ATOM 733 C VAL A 49 82.232 8.158 12.733 1.00 0.00 C ATOM 734 O VAL A 49 82.505 9.066 13.493 1.00 0.00 O ATOM 735 CB VAL A 49 81.307 8.396 10.420 1.00 0.00 C ATOM 736 CG1 VAL A 49 80.477 9.563 10.962 1.00 0.00 C ATOM 737 CG2 VAL A 49 81.674 8.672 8.962 1.00 0.00 C ATOM 0 H VAL A 49 82.924 6.548 9.995 1.00 0.00 H new ATOM 0 HA VAL A 49 83.230 9.112 11.079 1.00 0.00 H new ATOM 0 HB VAL A 49 80.725 7.477 10.487 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.566 9.666 10.373 1.00 0.00 H new ATOM 0 HG12 VAL A 49 80.217 9.372 12.003 1.00 0.00 H new ATOM 0 HG13 VAL A 49 81.057 10.484 10.896 1.00 0.00 H new ATOM 0 HG21 VAL A 49 80.764 8.779 8.372 1.00 0.00 H new ATOM 0 HG22 VAL A 49 82.256 9.591 8.901 1.00 0.00 H new ATOM 0 HG23 VAL A 49 82.264 7.843 8.572 1.00 0.00 H new ATOM 747 N GLU A 50 81.620 7.080 13.163 1.00 0.00 N ATOM 748 CA GLU A 50 81.254 6.967 14.610 1.00 0.00 C ATOM 749 C GLU A 50 82.457 7.349 15.474 1.00 0.00 C ATOM 750 O GLU A 50 82.325 8.021 16.477 1.00 0.00 O ATOM 751 CB GLU A 50 80.833 5.528 14.939 1.00 0.00 C ATOM 752 CG GLU A 50 79.420 5.269 14.413 1.00 0.00 C ATOM 753 CD GLU A 50 78.395 5.933 15.335 1.00 0.00 C ATOM 754 OE1 GLU A 50 77.524 6.617 14.824 1.00 0.00 O ATOM 755 OE2 GLU A 50 78.497 5.744 16.536 1.00 0.00 O ATOM 0 H GLU A 50 81.361 6.283 12.582 1.00 0.00 H new ATOM 0 HA GLU A 50 80.422 7.640 14.816 1.00 0.00 H new ATOM 0 HB2 GLU A 50 81.533 4.823 14.491 1.00 0.00 H new ATOM 0 HB3 GLU A 50 80.865 5.367 16.017 1.00 0.00 H new ATOM 0 HG2 GLU A 50 79.321 5.662 13.401 1.00 0.00 H new ATOM 0 HG3 GLU A 50 79.233 4.197 14.358 1.00 0.00 H new ATOM 762 N LYS A 51 83.627 6.921 15.096 1.00 0.00 N ATOM 763 CA LYS A 51 84.834 7.252 15.896 1.00 0.00 C ATOM 764 C LYS A 51 85.125 8.752 15.802 1.00 0.00 C ATOM 765 O LYS A 51 85.520 9.377 16.766 1.00 0.00 O ATOM 766 CB LYS A 51 86.020 6.462 15.352 1.00 0.00 C ATOM 767 CG LYS A 51 85.772 4.967 15.562 1.00 0.00 C ATOM 768 CD LYS A 51 86.853 4.160 14.838 1.00 0.00 C ATOM 769 CE LYS A 51 86.896 2.737 15.400 1.00 0.00 C ATOM 770 NZ LYS A 51 88.008 1.982 14.759 1.00 0.00 N ATOM 0 H LYS A 51 83.799 6.355 14.265 1.00 0.00 H new ATOM 0 HA LYS A 51 84.665 6.991 16.941 1.00 0.00 H new ATOM 0 HB2 LYS A 51 86.157 6.674 14.292 1.00 0.00 H new ATOM 0 HB3 LYS A 51 86.936 6.765 15.859 1.00 0.00 H new ATOM 0 HG2 LYS A 51 85.781 4.733 16.626 1.00 0.00 H new ATOM 0 HG3 LYS A 51 84.787 4.695 15.184 1.00 0.00 H new ATOM 0 HD2 LYS A 51 86.645 4.133 13.768 1.00 0.00 H new ATOM 0 HD3 LYS A 51 87.824 4.640 14.962 1.00 0.00 H new ATOM 0 HE2 LYS A 51 87.037 2.766 16.480 1.00 0.00 H new ATOM 0 HE3 LYS A 51 85.947 2.233 15.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 87.664 1.049 14.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 88.355 2.510 13.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 88.783 1.859 15.441 1.00 0.00 H new ATOM 784 N LEU A 52 84.934 9.336 14.650 1.00 0.00 N ATOM 785 CA LEU A 52 85.196 10.779 14.490 1.00 0.00 C ATOM 786 C LEU A 52 84.185 11.562 15.335 1.00 0.00 C ATOM 787 O LEU A 52 84.532 12.157 16.333 1.00 0.00 O ATOM 788 CB LEU A 52 85.050 11.112 12.989 1.00 0.00 C ATOM 789 CG LEU A 52 86.313 11.803 12.446 1.00 0.00 C ATOM 790 CD1 LEU A 52 86.648 13.048 13.292 1.00 0.00 C ATOM 791 CD2 LEU A 52 87.506 10.821 12.447 1.00 0.00 C ATOM 0 H LEU A 52 84.604 8.862 13.809 1.00 0.00 H new ATOM 0 HA LEU A 52 86.197 11.049 14.825 1.00 0.00 H new ATOM 0 HB2 LEU A 52 84.863 10.197 12.427 1.00 0.00 H new ATOM 0 HB3 LEU A 52 84.186 11.759 12.840 1.00 0.00 H new ATOM 0 HG LEU A 52 86.121 12.118 11.420 1.00 0.00 H new ATOM 0 HD11 LEU A 52 87.544 13.527 12.896 1.00 0.00 H new ATOM 0 HD12 LEU A 52 85.815 13.749 13.253 1.00 0.00 H new ATOM 0 HD13 LEU A 52 86.823 12.749 14.326 1.00 0.00 H new ATOM 0 HD21 LEU A 52 88.392 11.324 12.060 1.00 0.00 H new ATOM 0 HD22 LEU A 52 87.697 10.482 13.465 1.00 0.00 H new ATOM 0 HD23 LEU A 52 87.272 9.963 11.816 1.00 0.00 H new ATOM 803 N ASP A 53 82.940 11.544 14.938 1.00 0.00 N ATOM 804 CA ASP A 53 81.874 12.255 15.694 1.00 0.00 C ATOM 805 C ASP A 53 81.975 13.750 15.451 1.00 0.00 C ATOM 806 O ASP A 53 82.557 14.489 16.220 1.00 0.00 O ATOM 807 CB ASP A 53 82.029 11.946 17.175 1.00 0.00 C ATOM 808 CG ASP A 53 80.677 12.058 17.891 1.00 0.00 C ATOM 809 OD1 ASP A 53 80.632 12.692 18.932 1.00 0.00 O ATOM 810 OD2 ASP A 53 79.713 11.509 17.384 1.00 0.00 O ATOM 0 H ASP A 53 82.613 11.056 14.104 1.00 0.00 H new ATOM 0 HA ASP A 53 80.894 11.919 15.356 1.00 0.00 H new ATOM 0 HB2 ASP A 53 82.433 10.942 17.303 1.00 0.00 H new ATOM 0 HB3 ASP A 53 82.743 12.636 17.624 1.00 0.00 H new ATOM 815 N VAL A 54 81.416 14.195 14.380 1.00 0.00 N ATOM 816 CA VAL A 54 81.480 15.640 14.075 1.00 0.00 C ATOM 817 C VAL A 54 80.528 15.974 12.927 1.00 0.00 C ATOM 818 O VAL A 54 80.244 15.154 12.076 1.00 0.00 O ATOM 819 CB VAL A 54 82.926 15.982 13.722 1.00 0.00 C ATOM 820 CG1 VAL A 54 83.477 14.929 12.762 1.00 0.00 C ATOM 821 CG2 VAL A 54 83.006 17.371 13.078 1.00 0.00 C ATOM 0 H VAL A 54 80.916 13.624 13.699 1.00 0.00 H new ATOM 0 HA VAL A 54 81.169 16.233 14.935 1.00 0.00 H new ATOM 0 HB VAL A 54 83.522 15.990 14.634 1.00 0.00 H new ATOM 0 HG11 VAL A 54 84.509 15.172 12.509 1.00 0.00 H new ATOM 0 HG12 VAL A 54 83.441 13.949 13.237 1.00 0.00 H new ATOM 0 HG13 VAL A 54 82.875 14.914 11.854 1.00 0.00 H new ATOM 0 HG21 VAL A 54 84.043 17.599 12.833 1.00 0.00 H new ATOM 0 HG22 VAL A 54 82.406 17.385 12.168 1.00 0.00 H new ATOM 0 HG23 VAL A 54 82.625 18.118 13.775 1.00 0.00 H new ATOM 831 N LYS A 55 80.023 17.176 12.911 1.00 0.00 N ATOM 832 CA LYS A 55 79.074 17.585 11.837 1.00 0.00 C ATOM 833 C LYS A 55 79.824 17.671 10.496 1.00 0.00 C ATOM 834 O LYS A 55 79.444 18.419 9.617 1.00 0.00 O ATOM 835 CB LYS A 55 78.473 18.970 12.212 1.00 0.00 C ATOM 836 CG LYS A 55 76.917 18.968 12.194 1.00 0.00 C ATOM 837 CD LYS A 55 76.384 19.492 10.847 1.00 0.00 C ATOM 838 CE LYS A 55 74.873 19.722 10.945 1.00 0.00 C ATOM 839 NZ LYS A 55 74.616 20.994 11.678 1.00 0.00 N ATOM 0 H LYS A 55 80.228 17.898 13.601 1.00 0.00 H new ATOM 0 HA LYS A 55 78.271 16.854 11.739 1.00 0.00 H new ATOM 0 HB2 LYS A 55 78.821 19.257 13.204 1.00 0.00 H new ATOM 0 HB3 LYS A 55 78.840 19.723 11.515 1.00 0.00 H new ATOM 0 HG2 LYS A 55 76.548 17.957 12.367 1.00 0.00 H new ATOM 0 HG3 LYS A 55 76.539 19.589 13.006 1.00 0.00 H new ATOM 0 HD2 LYS A 55 76.887 20.422 10.583 1.00 0.00 H new ATOM 0 HD3 LYS A 55 76.602 18.776 10.055 1.00 0.00 H new ATOM 0 HE2 LYS A 55 74.435 19.768 9.948 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.399 18.888 11.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 73.836 20.855 12.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 75.474 21.277 12.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 74.358 21.739 11.000 1.00 0.00 H new ATOM 853 N LYS A 56 80.884 16.921 10.329 1.00 0.00 N ATOM 854 CA LYS A 56 81.633 16.989 9.039 1.00 0.00 C ATOM 855 C LYS A 56 80.898 16.175 7.975 1.00 0.00 C ATOM 856 O LYS A 56 80.269 15.176 8.261 1.00 0.00 O ATOM 857 CB LYS A 56 83.054 16.432 9.226 1.00 0.00 C ATOM 858 CG LYS A 56 83.837 16.481 7.879 1.00 0.00 C ATOM 859 CD LYS A 56 85.264 17.035 8.081 1.00 0.00 C ATOM 860 CE LYS A 56 86.158 15.980 8.747 1.00 0.00 C ATOM 861 NZ LYS A 56 86.691 15.055 7.707 1.00 0.00 N ATOM 0 H LYS A 56 81.259 16.272 11.021 1.00 0.00 H new ATOM 0 HA LYS A 56 81.698 18.029 8.719 1.00 0.00 H new ATOM 0 HB2 LYS A 56 83.582 17.012 9.983 1.00 0.00 H new ATOM 0 HB3 LYS A 56 83.004 15.405 9.588 1.00 0.00 H new ATOM 0 HG2 LYS A 56 83.890 15.480 7.450 1.00 0.00 H new ATOM 0 HG3 LYS A 56 83.299 17.106 7.166 1.00 0.00 H new ATOM 0 HD2 LYS A 56 85.688 17.325 7.120 1.00 0.00 H new ATOM 0 HD3 LYS A 56 85.228 17.933 8.698 1.00 0.00 H new ATOM 0 HE2 LYS A 56 86.980 16.464 9.274 1.00 0.00 H new ATOM 0 HE3 LYS A 56 85.588 15.421 9.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 86.188 14.146 7.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 86.551 15.474 6.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 87.706 14.899 7.869 1.00 0.00 H new ATOM 875 N ASP A 57 80.976 16.603 6.747 1.00 0.00 N ATOM 876 CA ASP A 57 80.289 15.872 5.647 1.00 0.00 C ATOM 877 C ASP A 57 80.991 14.533 5.416 1.00 0.00 C ATOM 878 O ASP A 57 82.127 14.488 4.986 1.00 0.00 O ATOM 879 CB ASP A 57 80.349 16.715 4.370 1.00 0.00 C ATOM 880 CG ASP A 57 80.059 18.179 4.708 1.00 0.00 C ATOM 881 OD1 ASP A 57 78.933 18.602 4.506 1.00 0.00 O ATOM 882 OD2 ASP A 57 80.969 18.853 5.162 1.00 0.00 O ATOM 0 H ASP A 57 81.490 17.434 6.456 1.00 0.00 H new ATOM 0 HA ASP A 57 79.248 15.692 5.914 1.00 0.00 H new ATOM 0 HB2 ASP A 57 81.333 16.626 3.909 1.00 0.00 H new ATOM 0 HB3 ASP A 57 79.623 16.348 3.645 1.00 0.00 H new ATOM 887 N TRP A 58 80.329 13.442 5.715 1.00 0.00 N ATOM 888 CA TRP A 58 80.952 12.097 5.536 1.00 0.00 C ATOM 889 C TRP A 58 80.316 11.362 4.355 1.00 0.00 C ATOM 890 O TRP A 58 80.995 10.737 3.565 1.00 0.00 O ATOM 891 CB TRP A 58 80.725 11.289 6.808 1.00 0.00 C ATOM 892 CG TRP A 58 81.447 11.937 7.943 1.00 0.00 C ATOM 893 CD1 TRP A 58 80.853 12.468 9.036 1.00 0.00 C ATOM 894 CD2 TRP A 58 82.880 12.136 8.117 1.00 0.00 C ATOM 895 NE1 TRP A 58 81.829 12.983 9.869 1.00 0.00 N ATOM 896 CE2 TRP A 58 83.094 12.803 9.345 1.00 0.00 C ATOM 897 CE3 TRP A 58 84.006 11.807 7.336 1.00 0.00 C ATOM 898 CZ2 TRP A 58 84.375 13.134 9.783 1.00 0.00 C ATOM 899 CZ3 TRP A 58 85.297 12.140 7.776 1.00 0.00 C ATOM 900 CH2 TRP A 58 85.481 12.802 8.996 1.00 0.00 C ATOM 0 H TRP A 58 79.376 13.428 6.078 1.00 0.00 H new ATOM 0 HA TRP A 58 82.017 12.216 5.338 1.00 0.00 H new ATOM 0 HB2 TRP A 58 79.659 11.228 7.028 1.00 0.00 H new ATOM 0 HB3 TRP A 58 81.081 10.268 6.672 1.00 0.00 H new ATOM 0 HD1 TRP A 58 79.790 12.487 9.227 1.00 0.00 H new ATOM 0 HE1 TRP A 58 81.638 13.440 10.761 1.00 0.00 H new ATOM 0 HE3 TRP A 58 83.875 11.296 6.394 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 84.512 13.644 10.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 86.153 11.884 7.170 1.00 0.00 H new ATOM 0 HH2 TRP A 58 86.477 13.056 9.328 1.00 0.00 H new ATOM 911 N SER A 59 79.018 11.422 4.232 1.00 0.00 N ATOM 912 CA SER A 59 78.337 10.715 3.105 1.00 0.00 C ATOM 913 C SER A 59 79.090 10.979 1.804 1.00 0.00 C ATOM 914 O SER A 59 79.505 10.064 1.121 1.00 0.00 O ATOM 915 CB SER A 59 76.904 11.216 2.976 1.00 0.00 C ATOM 916 OG SER A 59 76.277 10.568 1.877 1.00 0.00 O ATOM 0 H SER A 59 78.398 11.930 4.863 1.00 0.00 H new ATOM 0 HA SER A 59 78.328 9.644 3.306 1.00 0.00 H new ATOM 0 HB2 SER A 59 76.352 11.015 3.894 1.00 0.00 H new ATOM 0 HB3 SER A 59 76.896 12.296 2.829 1.00 0.00 H new ATOM 0 HG SER A 59 75.354 10.887 1.792 1.00 0.00 H new ATOM 922 N ASP A 60 79.288 12.221 1.461 1.00 0.00 N ATOM 923 CA ASP A 60 80.036 12.527 0.213 1.00 0.00 C ATOM 924 C ASP A 60 81.345 11.737 0.237 1.00 0.00 C ATOM 925 O ASP A 60 81.835 11.289 -0.779 1.00 0.00 O ATOM 926 CB ASP A 60 80.335 14.027 0.155 1.00 0.00 C ATOM 927 CG ASP A 60 81.288 14.319 -1.007 1.00 0.00 C ATOM 928 OD1 ASP A 60 81.465 13.442 -1.837 1.00 0.00 O ATOM 929 OD2 ASP A 60 81.824 15.414 -1.047 1.00 0.00 O ATOM 0 H ASP A 60 78.966 13.033 1.988 1.00 0.00 H new ATOM 0 HA ASP A 60 79.448 12.251 -0.663 1.00 0.00 H new ATOM 0 HB2 ASP A 60 79.409 14.588 0.028 1.00 0.00 H new ATOM 0 HB3 ASP A 60 80.780 14.355 1.094 1.00 0.00 H new ATOM 934 N HIS A 61 81.902 11.559 1.405 1.00 0.00 N ATOM 935 CA HIS A 61 83.172 10.799 1.530 1.00 0.00 C ATOM 936 C HIS A 61 82.899 9.316 1.279 1.00 0.00 C ATOM 937 O HIS A 61 82.204 8.655 2.025 1.00 0.00 O ATOM 938 CB HIS A 61 83.780 11.047 2.942 1.00 0.00 C ATOM 939 CG HIS A 61 83.675 9.823 3.824 1.00 0.00 C ATOM 940 ND1 HIS A 61 82.764 9.734 4.865 1.00 0.00 N ATOM 941 CD2 HIS A 61 84.352 8.629 3.816 1.00 0.00 C ATOM 942 CE1 HIS A 61 82.916 8.524 5.434 1.00 0.00 C ATOM 943 NE2 HIS A 61 83.871 7.810 4.833 1.00 0.00 N ATOM 0 H HIS A 61 81.525 11.913 2.284 1.00 0.00 H new ATOM 0 HA HIS A 61 83.896 11.136 0.788 1.00 0.00 H new ATOM 0 HB2 HIS A 61 84.827 11.333 2.841 1.00 0.00 H new ATOM 0 HB3 HIS A 61 83.266 11.882 3.417 1.00 0.00 H new ATOM 0 HD2 HIS A 61 85.139 8.365 3.125 1.00 0.00 H new ATOM 0 HE1 HIS A 61 82.336 8.173 6.275 1.00 0.00 H new ATOM 0 HE2 HIS A 61 84.181 6.867 5.069 1.00 0.00 H new ATOM 951 N ALA A 62 83.469 8.800 0.229 1.00 0.00 N ATOM 952 CA ALA A 62 83.305 7.363 -0.117 1.00 0.00 C ATOM 953 C ALA A 62 84.703 6.759 -0.141 1.00 0.00 C ATOM 954 O ALA A 62 85.684 7.476 -0.150 1.00 0.00 O ATOM 955 CB ALA A 62 82.636 7.247 -1.488 1.00 0.00 C ATOM 0 H ALA A 62 84.055 9.326 -0.419 1.00 0.00 H new ATOM 0 HA ALA A 62 82.678 6.839 0.604 1.00 0.00 H new ATOM 0 HB1 ALA A 62 82.514 6.195 -1.745 1.00 0.00 H new ATOM 0 HB2 ALA A 62 81.659 7.729 -1.458 1.00 0.00 H new ATOM 0 HB3 ALA A 62 83.258 7.734 -2.239 1.00 0.00 H new ATOM 961 N LEU A 63 84.823 5.461 -0.112 1.00 0.00 N ATOM 962 CA LEU A 63 86.189 4.852 -0.087 1.00 0.00 C ATOM 963 C LEU A 63 86.657 4.514 -1.486 1.00 0.00 C ATOM 964 O LEU A 63 85.904 4.069 -2.329 1.00 0.00 O ATOM 965 CB LEU A 63 86.182 3.583 0.765 1.00 0.00 C ATOM 966 CG LEU A 63 85.372 3.807 2.046 1.00 0.00 C ATOM 967 CD1 LEU A 63 85.795 5.127 2.697 1.00 0.00 C ATOM 968 CD2 LEU A 63 83.847 3.819 1.754 1.00 0.00 C ATOM 0 H LEU A 63 84.047 4.799 -0.105 1.00 0.00 H new ATOM 0 HA LEU A 63 86.875 5.581 0.345 1.00 0.00 H new ATOM 0 HB2 LEU A 63 85.755 2.757 0.196 1.00 0.00 H new ATOM 0 HB3 LEU A 63 87.204 3.301 1.018 1.00 0.00 H new ATOM 0 HG LEU A 63 85.574 2.982 2.729 1.00 0.00 H new ATOM 0 HD11 LEU A 63 85.218 5.285 3.608 1.00 0.00 H new ATOM 0 HD12 LEU A 63 86.856 5.088 2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 63 85.612 5.949 2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 63 83.300 3.980 2.683 1.00 0.00 H new ATOM 0 HD22 LEU A 63 83.617 4.622 1.054 1.00 0.00 H new ATOM 0 HD23 LEU A 63 83.552 2.864 1.320 1.00 0.00 H new ATOM 980 N TRP A 64 87.919 4.739 -1.725 1.00 0.00 N ATOM 981 CA TRP A 64 88.513 4.455 -3.067 1.00 0.00 C ATOM 982 C TRP A 64 89.766 3.585 -2.872 1.00 0.00 C ATOM 983 O TRP A 64 90.513 3.746 -1.924 1.00 0.00 O ATOM 984 CB TRP A 64 88.798 5.824 -3.761 1.00 0.00 C ATOM 985 CG TRP A 64 90.248 6.055 -4.091 1.00 0.00 C ATOM 986 CD1 TRP A 64 91.277 6.039 -3.211 1.00 0.00 C ATOM 987 CD2 TRP A 64 90.826 6.397 -5.386 1.00 0.00 C ATOM 988 NE1 TRP A 64 92.451 6.307 -3.892 1.00 0.00 N ATOM 989 CE2 TRP A 64 92.224 6.540 -5.234 1.00 0.00 C ATOM 990 CE3 TRP A 64 90.277 6.580 -6.668 1.00 0.00 C ATOM 991 CZ2 TRP A 64 93.050 6.858 -6.314 1.00 0.00 C ATOM 992 CZ3 TRP A 64 91.104 6.903 -7.758 1.00 0.00 C ATOM 993 CH2 TRP A 64 92.488 7.042 -7.581 1.00 0.00 C ATOM 0 H TRP A 64 88.575 5.113 -1.039 1.00 0.00 H new ATOM 0 HA TRP A 64 87.841 3.894 -3.716 1.00 0.00 H new ATOM 0 HB2 TRP A 64 88.214 5.882 -4.679 1.00 0.00 H new ATOM 0 HB3 TRP A 64 88.452 6.628 -3.111 1.00 0.00 H new ATOM 0 HD1 TRP A 64 91.195 5.848 -2.151 1.00 0.00 H new ATOM 0 HE1 TRP A 64 93.373 6.330 -3.456 1.00 0.00 H new ATOM 0 HE3 TRP A 64 89.213 6.472 -6.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 94.116 6.961 -6.172 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 90.671 7.045 -8.737 1.00 0.00 H new ATOM 0 HH2 TRP A 64 93.119 7.291 -8.422 1.00 0.00 H new ATOM 1004 N TRP A 65 89.974 2.632 -3.746 1.00 0.00 N ATOM 1005 CA TRP A 65 91.155 1.722 -3.622 1.00 0.00 C ATOM 1006 C TRP A 65 92.217 2.183 -4.621 1.00 0.00 C ATOM 1007 O TRP A 65 92.201 1.789 -5.763 1.00 0.00 O ATOM 1008 CB TRP A 65 90.712 0.290 -3.954 1.00 0.00 C ATOM 1009 CG TRP A 65 91.727 -0.714 -3.488 1.00 0.00 C ATOM 1010 CD1 TRP A 65 92.965 -0.435 -3.007 1.00 0.00 C ATOM 1011 CD2 TRP A 65 91.602 -2.167 -3.460 1.00 0.00 C ATOM 1012 NE1 TRP A 65 93.603 -1.626 -2.699 1.00 0.00 N ATOM 1013 CE2 TRP A 65 92.804 -2.718 -2.960 1.00 0.00 C ATOM 1014 CE3 TRP A 65 90.570 -3.050 -3.823 1.00 0.00 C ATOM 1015 CZ2 TRP A 65 92.978 -4.096 -2.825 1.00 0.00 C ATOM 1016 CZ3 TRP A 65 90.742 -4.437 -3.688 1.00 0.00 C ATOM 1017 CH2 TRP A 65 91.943 -4.959 -3.191 1.00 0.00 C ATOM 0 H TRP A 65 89.371 2.444 -4.547 1.00 0.00 H new ATOM 0 HA TRP A 65 91.562 1.746 -2.611 1.00 0.00 H new ATOM 0 HB2 TRP A 65 89.751 0.085 -3.482 1.00 0.00 H new ATOM 0 HB3 TRP A 65 90.567 0.192 -5.030 1.00 0.00 H new ATOM 0 HD1 TRP A 65 93.384 0.553 -2.884 1.00 0.00 H new ATOM 0 HE1 TRP A 65 94.550 -1.687 -2.324 1.00 0.00 H new ATOM 0 HE3 TRP A 65 89.640 -2.659 -4.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 93.906 -4.492 -2.440 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 89.942 -5.106 -3.969 1.00 0.00 H new ATOM 0 HH2 TRP A 65 92.068 -6.027 -3.091 1.00 0.00 H new ATOM 1028 N GLU A 66 93.120 3.037 -4.213 1.00 0.00 N ATOM 1029 CA GLU A 66 94.153 3.540 -5.171 1.00 0.00 C ATOM 1030 C GLU A 66 94.916 2.383 -5.810 1.00 0.00 C ATOM 1031 O GLU A 66 95.472 2.530 -6.875 1.00 0.00 O ATOM 1032 CB GLU A 66 95.130 4.474 -4.469 1.00 0.00 C ATOM 1033 CG GLU A 66 95.630 3.832 -3.184 1.00 0.00 C ATOM 1034 CD GLU A 66 96.456 4.846 -2.391 1.00 0.00 C ATOM 1035 OE1 GLU A 66 96.616 5.956 -2.873 1.00 0.00 O ATOM 1036 OE2 GLU A 66 96.914 4.496 -1.316 1.00 0.00 O ATOM 0 H GLU A 66 93.188 3.407 -3.265 1.00 0.00 H new ATOM 0 HA GLU A 66 93.635 4.093 -5.955 1.00 0.00 H new ATOM 0 HB2 GLU A 66 95.971 4.695 -5.126 1.00 0.00 H new ATOM 0 HB3 GLU A 66 94.642 5.423 -4.246 1.00 0.00 H new ATOM 0 HG2 GLU A 66 94.787 3.488 -2.586 1.00 0.00 H new ATOM 0 HG3 GLU A 66 96.236 2.956 -3.415 1.00 0.00 H new ATOM 1043 N LYS A 67 94.944 1.228 -5.210 1.00 0.00 N ATOM 1044 CA LYS A 67 95.659 0.112 -5.877 1.00 0.00 C ATOM 1045 C LYS A 67 94.869 -0.182 -7.146 1.00 0.00 C ATOM 1046 O LYS A 67 95.335 -0.811 -8.075 1.00 0.00 O ATOM 1047 CB LYS A 67 95.655 -1.150 -5.021 1.00 0.00 C ATOM 1048 CG LYS A 67 96.584 -1.036 -3.791 1.00 0.00 C ATOM 1049 CD LYS A 67 96.681 0.391 -3.248 1.00 0.00 C ATOM 1050 CE LYS A 67 97.495 0.381 -1.953 1.00 0.00 C ATOM 1051 NZ LYS A 67 98.717 -0.451 -2.142 1.00 0.00 N ATOM 0 H LYS A 67 94.515 1.012 -4.310 1.00 0.00 H new ATOM 0 HA LYS A 67 96.697 0.390 -6.061 1.00 0.00 H new ATOM 0 HB2 LYS A 67 94.638 -1.354 -4.686 1.00 0.00 H new ATOM 0 HB3 LYS A 67 95.967 -1.999 -5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 67 96.218 -1.695 -3.003 1.00 0.00 H new ATOM 0 HG3 LYS A 67 97.581 -1.385 -4.061 1.00 0.00 H new ATOM 0 HD2 LYS A 67 97.153 1.042 -3.984 1.00 0.00 H new ATOM 0 HD3 LYS A 67 95.684 0.791 -3.062 1.00 0.00 H new ATOM 0 HE2 LYS A 67 97.773 1.398 -1.678 1.00 0.00 H new ATOM 0 HE3 LYS A 67 96.894 -0.017 -1.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 99.430 -0.187 -1.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 98.473 -1.456 -2.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 99.102 -0.291 -3.095 1.00 0.00 H new ATOM 1065 N LYS A 68 93.637 0.267 -7.146 1.00 0.00 N ATOM 1066 CA LYS A 68 92.709 0.038 -8.290 1.00 0.00 C ATOM 1067 C LYS A 68 92.198 1.386 -8.810 1.00 0.00 C ATOM 1068 O LYS A 68 91.578 1.461 -9.852 1.00 0.00 O ATOM 1069 CB LYS A 68 91.499 -0.796 -7.807 1.00 0.00 C ATOM 1070 CG LYS A 68 91.916 -1.812 -6.730 1.00 0.00 C ATOM 1071 CD LYS A 68 92.628 -2.997 -7.390 1.00 0.00 C ATOM 1072 CE LYS A 68 93.335 -3.844 -6.322 1.00 0.00 C ATOM 1073 NZ LYS A 68 93.447 -5.249 -6.801 1.00 0.00 N ATOM 0 H LYS A 68 93.228 0.797 -6.377 1.00 0.00 H new ATOM 0 HA LYS A 68 93.237 -0.491 -9.083 1.00 0.00 H new ATOM 0 HB2 LYS A 68 90.733 -0.132 -7.407 1.00 0.00 H new ATOM 0 HB3 LYS A 68 91.055 -1.321 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 68 92.576 -1.337 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 68 91.039 -2.160 -6.185 1.00 0.00 H new ATOM 0 HD2 LYS A 68 91.907 -3.609 -7.933 1.00 0.00 H new ATOM 0 HD3 LYS A 68 93.353 -2.636 -8.119 1.00 0.00 H new ATOM 0 HE2 LYS A 68 94.325 -3.438 -6.117 1.00 0.00 H new ATOM 0 HE3 LYS A 68 92.776 -3.810 -5.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 93.926 -5.825 -6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 92.496 -5.633 -6.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 93.997 -5.272 -7.683 1.00 0.00 H new ATOM 1087 N ARG A 69 92.413 2.443 -8.070 1.00 0.00 N ATOM 1088 CA ARG A 69 91.902 3.772 -8.499 1.00 0.00 C ATOM 1089 C ARG A 69 90.408 3.621 -8.757 1.00 0.00 C ATOM 1090 O ARG A 69 89.887 4.067 -9.761 1.00 0.00 O ATOM 1091 CB ARG A 69 92.604 4.242 -9.785 1.00 0.00 C ATOM 1092 CG ARG A 69 94.046 4.705 -9.487 1.00 0.00 C ATOM 1093 CD ARG A 69 94.993 3.506 -9.528 1.00 0.00 C ATOM 1094 NE ARG A 69 95.174 3.065 -10.941 1.00 0.00 N ATOM 1095 CZ ARG A 69 95.506 1.829 -11.208 1.00 0.00 C ATOM 1096 NH1 ARG A 69 95.655 1.447 -12.447 1.00 0.00 N ATOM 1097 NH2 ARG A 69 95.691 0.976 -10.237 1.00 0.00 N ATOM 0 H ARG A 69 92.922 2.439 -7.186 1.00 0.00 H new ATOM 0 HA ARG A 69 92.097 4.514 -7.725 1.00 0.00 H new ATOM 0 HB2 ARG A 69 92.621 3.430 -10.512 1.00 0.00 H new ATOM 0 HB3 ARG A 69 92.040 5.060 -10.234 1.00 0.00 H new ATOM 0 HG2 ARG A 69 94.357 5.451 -10.219 1.00 0.00 H new ATOM 0 HG3 ARG A 69 94.090 5.181 -8.508 1.00 0.00 H new ATOM 0 HD2 ARG A 69 95.956 3.774 -9.093 1.00 0.00 H new ATOM 0 HD3 ARG A 69 94.589 2.689 -8.930 1.00 0.00 H new ATOM 0 HE ARG A 69 95.038 3.730 -11.702 1.00 0.00 H new ATOM 0 HH11 ARG A 69 95.512 2.113 -13.207 1.00 0.00 H new ATOM 0 HH12 ARG A 69 95.914 0.483 -12.656 1.00 0.00 H new ATOM 0 HH21 ARG A 69 95.577 1.274 -9.268 1.00 0.00 H new ATOM 0 HH22 ARG A 69 95.950 0.012 -10.447 1.00 0.00 H new ATOM 1111 N THR A 70 89.721 2.963 -7.856 1.00 0.00 N ATOM 1112 CA THR A 70 88.256 2.732 -8.026 1.00 0.00 C ATOM 1113 C THR A 70 87.482 3.508 -6.976 1.00 0.00 C ATOM 1114 O THR A 70 88.039 4.241 -6.196 1.00 0.00 O ATOM 1115 CB THR A 70 87.978 1.235 -7.836 1.00 0.00 C ATOM 1116 OG1 THR A 70 86.690 0.922 -8.346 1.00 0.00 O ATOM 1117 CG2 THR A 70 88.049 0.852 -6.347 1.00 0.00 C ATOM 0 H THR A 70 90.119 2.573 -7.002 1.00 0.00 H new ATOM 0 HA THR A 70 87.946 3.062 -9.018 1.00 0.00 H new ATOM 0 HB THR A 70 88.737 0.670 -8.377 1.00 0.00 H new ATOM 0 HG1 THR A 70 86.514 -0.035 -8.226 1.00 0.00 H new ATOM 0 HG21 THR A 70 87.849 -0.214 -6.235 1.00 0.00 H new ATOM 0 HG22 THR A 70 89.043 1.077 -5.960 1.00 0.00 H new ATOM 0 HG23 THR A 70 87.306 1.421 -5.789 1.00 0.00 H new ATOM 1125 N TRP A 71 86.199 3.298 -6.935 1.00 0.00 N ATOM 1126 CA TRP A 71 85.336 3.954 -5.921 1.00 0.00 C ATOM 1127 C TRP A 71 84.552 2.824 -5.255 1.00 0.00 C ATOM 1128 O TRP A 71 83.607 2.303 -5.785 1.00 0.00 O ATOM 1129 CB TRP A 71 84.404 4.968 -6.608 1.00 0.00 C ATOM 1130 CG TRP A 71 84.185 4.578 -8.040 1.00 0.00 C ATOM 1131 CD1 TRP A 71 83.576 3.445 -8.461 1.00 0.00 C ATOM 1132 CD2 TRP A 71 84.571 5.298 -9.247 1.00 0.00 C ATOM 1133 NE1 TRP A 71 83.564 3.422 -9.829 1.00 0.00 N ATOM 1134 CE2 TRP A 71 84.164 4.541 -10.371 1.00 0.00 C ATOM 1135 CE3 TRP A 71 85.227 6.521 -9.474 1.00 0.00 C ATOM 1136 CZ2 TRP A 71 84.400 4.980 -11.674 1.00 0.00 C ATOM 1137 CZ3 TRP A 71 85.466 6.967 -10.785 1.00 0.00 C ATOM 1138 CH2 TRP A 71 85.054 6.197 -11.883 1.00 0.00 C ATOM 0 H TRP A 71 85.701 2.683 -7.579 1.00 0.00 H new ATOM 0 HA TRP A 71 85.909 4.512 -5.181 1.00 0.00 H new ATOM 0 HB2 TRP A 71 83.449 5.009 -6.084 1.00 0.00 H new ATOM 0 HB3 TRP A 71 84.839 5.966 -6.557 1.00 0.00 H new ATOM 0 HD1 TRP A 71 83.165 2.680 -7.819 1.00 0.00 H new ATOM 0 HE1 TRP A 71 83.159 2.667 -10.383 1.00 0.00 H new ATOM 0 HE3 TRP A 71 85.549 7.121 -8.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 84.079 4.383 -12.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 85.970 7.908 -10.948 1.00 0.00 H new ATOM 0 HH2 TRP A 71 85.242 6.544 -12.888 1.00 0.00 H new ATOM 1149 N LEU A 72 84.977 2.393 -4.119 1.00 0.00 N ATOM 1150 CA LEU A 72 84.287 1.246 -3.481 1.00 0.00 C ATOM 1151 C LEU A 72 82.836 1.605 -3.176 1.00 0.00 C ATOM 1152 O LEU A 72 82.478 1.989 -2.081 1.00 0.00 O ATOM 1153 CB LEU A 72 85.035 0.859 -2.212 1.00 0.00 C ATOM 1154 CG LEU A 72 86.517 0.619 -2.549 1.00 0.00 C ATOM 1155 CD1 LEU A 72 87.358 0.703 -1.277 1.00 0.00 C ATOM 1156 CD2 LEU A 72 86.702 -0.759 -3.206 1.00 0.00 C ATOM 0 H LEU A 72 85.767 2.777 -3.601 1.00 0.00 H new ATOM 0 HA LEU A 72 84.281 0.394 -4.161 1.00 0.00 H new ATOM 0 HB2 LEU A 72 84.943 1.649 -1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 72 84.598 -0.041 -1.779 1.00 0.00 H new ATOM 0 HG LEU A 72 86.845 1.387 -3.249 1.00 0.00 H new ATOM 0 HD11 LEU A 72 88.406 0.532 -1.522 1.00 0.00 H new ATOM 0 HD12 LEU A 72 87.246 1.691 -0.831 1.00 0.00 H new ATOM 0 HD13 LEU A 72 87.023 -0.055 -0.569 1.00 0.00 H new ATOM 0 HD21 LEU A 72 87.756 -0.913 -3.438 1.00 0.00 H new ATOM 0 HD22 LEU A 72 86.364 -1.537 -2.521 1.00 0.00 H new ATOM 0 HD23 LEU A 72 86.118 -0.805 -4.125 1.00 0.00 H new ATOM 1168 N LEU A 73 82.001 1.452 -4.167 1.00 0.00 N ATOM 1169 CA LEU A 73 80.537 1.734 -4.020 1.00 0.00 C ATOM 1170 C LEU A 73 79.776 0.414 -4.160 1.00 0.00 C ATOM 1171 O LEU A 73 78.573 0.389 -4.330 1.00 0.00 O ATOM 1172 CB LEU A 73 80.056 2.740 -5.098 1.00 0.00 C ATOM 1173 CG LEU A 73 80.530 2.345 -6.527 1.00 0.00 C ATOM 1174 CD1 LEU A 73 79.471 1.499 -7.255 1.00 0.00 C ATOM 1175 CD2 LEU A 73 80.764 3.613 -7.360 1.00 0.00 C ATOM 0 H LEU A 73 82.276 1.136 -5.097 1.00 0.00 H new ATOM 0 HA LEU A 73 80.349 2.178 -3.043 1.00 0.00 H new ATOM 0 HB2 LEU A 73 78.968 2.795 -5.081 1.00 0.00 H new ATOM 0 HB3 LEU A 73 80.429 3.735 -4.856 1.00 0.00 H new ATOM 0 HG LEU A 73 81.448 1.766 -6.420 1.00 0.00 H new ATOM 0 HD11 LEU A 73 79.833 1.240 -8.250 1.00 0.00 H new ATOM 0 HD12 LEU A 73 79.282 0.587 -6.689 1.00 0.00 H new ATOM 0 HD13 LEU A 73 78.547 2.070 -7.343 1.00 0.00 H new ATOM 0 HD21 LEU A 73 81.096 3.335 -8.360 1.00 0.00 H new ATOM 0 HD22 LEU A 73 79.835 4.179 -7.430 1.00 0.00 H new ATOM 0 HD23 LEU A 73 81.527 4.227 -6.882 1.00 0.00 H new ATOM 1187 N LYS A 74 80.478 -0.689 -4.087 1.00 0.00 N ATOM 1188 CA LYS A 74 79.813 -2.019 -4.218 1.00 0.00 C ATOM 1189 C LYS A 74 79.281 -2.453 -2.848 1.00 0.00 C ATOM 1190 O LYS A 74 79.745 -3.413 -2.265 1.00 0.00 O ATOM 1191 CB LYS A 74 80.832 -3.053 -4.735 1.00 0.00 C ATOM 1192 CG LYS A 74 80.864 -3.049 -6.273 1.00 0.00 C ATOM 1193 CD LYS A 74 81.274 -1.668 -6.801 1.00 0.00 C ATOM 1194 CE LYS A 74 82.667 -1.287 -6.284 1.00 0.00 C ATOM 1195 NZ LYS A 74 83.531 -2.499 -6.209 1.00 0.00 N ATOM 0 H LYS A 74 81.487 -0.724 -3.942 1.00 0.00 H new ATOM 0 HA LYS A 74 78.985 -1.950 -4.923 1.00 0.00 H new ATOM 0 HB2 LYS A 74 81.823 -2.824 -4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 74 80.568 -4.046 -4.373 1.00 0.00 H new ATOM 0 HG2 LYS A 74 81.565 -3.803 -6.629 1.00 0.00 H new ATOM 0 HG3 LYS A 74 79.882 -3.317 -6.663 1.00 0.00 H new ATOM 0 HD2 LYS A 74 81.273 -1.674 -7.891 1.00 0.00 H new ATOM 0 HD3 LYS A 74 80.546 -0.921 -6.486 1.00 0.00 H new ATOM 0 HE2 LYS A 74 83.120 -0.548 -6.945 1.00 0.00 H new ATOM 0 HE3 LYS A 74 82.585 -0.827 -5.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 84.507 -2.216 -5.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 83.178 -3.132 -5.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 83.512 -2.996 -7.122 1.00 0.00 H new ATOM 1209 N THR A 75 78.314 -1.752 -2.331 1.00 0.00 N ATOM 1210 CA THR A 75 77.755 -2.118 -1.000 1.00 0.00 C ATOM 1211 C THR A 75 77.076 -3.491 -1.082 1.00 0.00 C ATOM 1212 O THR A 75 76.647 -4.040 -0.087 1.00 0.00 O ATOM 1213 CB THR A 75 76.729 -1.054 -0.575 1.00 0.00 C ATOM 1214 OG1 THR A 75 77.185 0.223 -0.998 1.00 0.00 O ATOM 1215 CG2 THR A 75 76.559 -1.052 0.953 1.00 0.00 C ATOM 0 H THR A 75 77.885 -0.939 -2.773 1.00 0.00 H new ATOM 0 HA THR A 75 78.559 -2.165 -0.266 1.00 0.00 H new ATOM 0 HB THR A 75 75.768 -1.282 -1.035 1.00 0.00 H new ATOM 0 HG1 THR A 75 76.529 0.618 -1.610 1.00 0.00 H new ATOM 0 HG21 THR A 75 75.830 -0.293 1.237 1.00 0.00 H new ATOM 0 HG22 THR A 75 76.211 -2.031 1.282 1.00 0.00 H new ATOM 0 HG23 THR A 75 77.516 -0.830 1.425 1.00 0.00 H new ATOM 1223 N HIS A 76 76.966 -4.045 -2.261 1.00 0.00 N ATOM 1224 CA HIS A 76 76.304 -5.377 -2.404 1.00 0.00 C ATOM 1225 C HIS A 76 77.312 -6.497 -2.130 1.00 0.00 C ATOM 1226 O HIS A 76 76.975 -7.522 -1.571 1.00 0.00 O ATOM 1227 CB HIS A 76 75.757 -5.519 -3.827 1.00 0.00 C ATOM 1228 CG HIS A 76 74.594 -4.582 -4.011 1.00 0.00 C ATOM 1229 ND1 HIS A 76 73.514 -4.892 -4.822 1.00 0.00 N ATOM 1230 CD2 HIS A 76 74.328 -3.339 -3.491 1.00 0.00 C ATOM 1231 CE1 HIS A 76 72.655 -3.857 -4.767 1.00 0.00 C ATOM 1232 NE2 HIS A 76 73.103 -2.884 -3.970 1.00 0.00 N ATOM 0 H HIS A 76 77.305 -3.634 -3.131 1.00 0.00 H new ATOM 0 HA HIS A 76 75.488 -5.451 -1.685 1.00 0.00 H new ATOM 0 HB2 HIS A 76 76.538 -5.294 -4.553 1.00 0.00 H new ATOM 0 HB3 HIS A 76 75.442 -6.547 -4.007 1.00 0.00 H new ATOM 0 HD2 HIS A 76 74.971 -2.797 -2.814 1.00 0.00 H new ATOM 0 HE1 HIS A 76 71.718 -3.818 -5.302 1.00 0.00 H new ATOM 0 HE2 HIS A 76 72.646 -1.997 -3.758 1.00 0.00 H new ATOM 1240 N TRP A 77 78.545 -6.315 -2.520 1.00 0.00 N ATOM 1241 CA TRP A 77 79.574 -7.369 -2.287 1.00 0.00 C ATOM 1242 C TRP A 77 80.269 -7.116 -0.954 1.00 0.00 C ATOM 1243 O TRP A 77 79.764 -6.413 -0.102 1.00 0.00 O ATOM 1244 CB TRP A 77 80.616 -7.303 -3.400 1.00 0.00 C ATOM 1245 CG TRP A 77 80.021 -7.747 -4.687 1.00 0.00 C ATOM 1246 CD1 TRP A 77 79.927 -6.973 -5.782 1.00 0.00 C ATOM 1247 CD2 TRP A 77 79.449 -9.044 -5.047 1.00 0.00 C ATOM 1248 NE1 TRP A 77 79.340 -7.698 -6.789 1.00 0.00 N ATOM 1249 CE2 TRP A 77 79.022 -8.978 -6.391 1.00 0.00 C ATOM 1250 CE3 TRP A 77 79.258 -10.255 -4.353 1.00 0.00 C ATOM 1251 CZ2 TRP A 77 78.429 -10.068 -7.028 1.00 0.00 C ATOM 1252 CZ3 TRP A 77 78.661 -11.355 -4.991 1.00 0.00 C ATOM 1253 CH2 TRP A 77 78.246 -11.260 -6.325 1.00 0.00 C ATOM 0 H TRP A 77 78.885 -5.477 -2.992 1.00 0.00 H new ATOM 0 HA TRP A 77 79.095 -8.348 -2.275 1.00 0.00 H new ATOM 0 HB2 TRP A 77 80.991 -6.284 -3.497 1.00 0.00 H new ATOM 0 HB3 TRP A 77 81.468 -7.934 -3.148 1.00 0.00 H new ATOM 0 HD1 TRP A 77 80.259 -5.948 -5.857 1.00 0.00 H new ATOM 0 HE1 TRP A 77 79.160 -7.331 -7.724 1.00 0.00 H new ATOM 0 HE3 TRP A 77 79.573 -10.338 -3.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 78.114 -9.990 -8.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 78.521 -12.279 -4.450 1.00 0.00 H new ATOM 0 HH2 TRP A 77 77.785 -12.108 -6.809 1.00 0.00 H new ATOM 1264 N THR A 78 81.436 -7.679 -0.767 1.00 0.00 N ATOM 1265 CA THR A 78 82.170 -7.462 0.511 1.00 0.00 C ATOM 1266 C THR A 78 83.679 -7.536 0.246 1.00 0.00 C ATOM 1267 O THR A 78 84.130 -7.939 -0.807 1.00 0.00 O ATOM 1268 CB THR A 78 81.744 -8.547 1.538 1.00 0.00 C ATOM 1269 OG1 THR A 78 80.540 -9.150 1.091 1.00 0.00 O ATOM 1270 CG2 THR A 78 81.504 -7.949 2.933 1.00 0.00 C ATOM 0 H THR A 78 81.909 -8.278 -1.444 1.00 0.00 H new ATOM 0 HA THR A 78 81.931 -6.479 0.918 1.00 0.00 H new ATOM 0 HB THR A 78 82.549 -9.278 1.613 1.00 0.00 H new ATOM 0 HG1 THR A 78 80.262 -9.838 1.731 1.00 0.00 H new ATOM 0 HG21 THR A 78 81.208 -8.740 3.622 1.00 0.00 H new ATOM 0 HG22 THR A 78 82.421 -7.481 3.291 1.00 0.00 H new ATOM 0 HG23 THR A 78 80.713 -7.201 2.877 1.00 0.00 H new ATOM 1278 N LEU A 79 84.444 -7.152 1.219 1.00 0.00 N ATOM 1279 CA LEU A 79 85.930 -7.182 1.107 1.00 0.00 C ATOM 1280 C LEU A 79 86.360 -8.497 0.459 1.00 0.00 C ATOM 1281 O LEU A 79 86.927 -8.530 -0.611 1.00 0.00 O ATOM 1282 CB LEU A 79 86.521 -7.134 2.518 1.00 0.00 C ATOM 1283 CG LEU A 79 86.517 -5.714 3.087 1.00 0.00 C ATOM 1284 CD1 LEU A 79 85.101 -5.146 3.070 1.00 0.00 C ATOM 1285 CD2 LEU A 79 87.010 -5.772 4.534 1.00 0.00 C ATOM 0 H LEU A 79 84.096 -6.808 2.114 1.00 0.00 H new ATOM 0 HA LEU A 79 86.274 -6.338 0.509 1.00 0.00 H new ATOM 0 HB2 LEU A 79 85.949 -7.790 3.174 1.00 0.00 H new ATOM 0 HB3 LEU A 79 87.542 -7.515 2.498 1.00 0.00 H new ATOM 0 HG LEU A 79 87.164 -5.077 2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 79 85.110 -4.135 3.477 1.00 0.00 H new ATOM 0 HD12 LEU A 79 84.731 -5.121 2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 79 84.449 -5.775 3.676 1.00 0.00 H new ATOM 0 HD21 LEU A 79 87.014 -4.768 4.957 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.347 -6.410 5.119 1.00 0.00 H new ATOM 0 HD23 LEU A 79 88.020 -6.180 4.558 1.00 0.00 H new ATOM 1297 N ASP A 80 86.087 -9.577 1.132 1.00 0.00 N ATOM 1298 CA ASP A 80 86.462 -10.925 0.620 1.00 0.00 C ATOM 1299 C ASP A 80 86.152 -11.024 -0.860 1.00 0.00 C ATOM 1300 O ASP A 80 86.975 -11.416 -1.663 1.00 0.00 O ATOM 1301 CB ASP A 80 85.627 -11.959 1.356 1.00 0.00 C ATOM 1302 CG ASP A 80 86.058 -13.366 0.937 1.00 0.00 C ATOM 1303 OD1 ASP A 80 86.535 -14.097 1.790 1.00 0.00 O ATOM 1304 OD2 ASP A 80 85.904 -13.690 -0.229 1.00 0.00 O ATOM 0 H ASP A 80 85.610 -9.584 2.034 1.00 0.00 H new ATOM 0 HA ASP A 80 87.527 -11.093 0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 80 85.747 -11.837 2.433 1.00 0.00 H new ATOM 0 HB3 ASP A 80 84.570 -11.811 1.134 1.00 0.00 H new ATOM 1309 N LYS A 81 84.954 -10.685 -1.215 1.00 0.00 N ATOM 1310 CA LYS A 81 84.540 -10.762 -2.635 1.00 0.00 C ATOM 1311 C LYS A 81 85.624 -10.165 -3.521 1.00 0.00 C ATOM 1312 O LYS A 81 86.099 -10.785 -4.452 1.00 0.00 O ATOM 1313 CB LYS A 81 83.244 -9.977 -2.825 1.00 0.00 C ATOM 1314 CG LYS A 81 82.289 -10.254 -1.661 1.00 0.00 C ATOM 1315 CD LYS A 81 82.164 -11.760 -1.433 1.00 0.00 C ATOM 1316 CE LYS A 81 80.968 -12.050 -0.521 1.00 0.00 C ATOM 1317 NZ LYS A 81 79.717 -12.061 -1.331 1.00 0.00 N ATOM 0 H LYS A 81 84.233 -10.353 -0.574 1.00 0.00 H new ATOM 0 HA LYS A 81 84.384 -11.805 -2.910 1.00 0.00 H new ATOM 0 HB2 LYS A 81 83.460 -8.910 -2.883 1.00 0.00 H new ATOM 0 HB3 LYS A 81 82.773 -10.258 -3.767 1.00 0.00 H new ATOM 0 HG2 LYS A 81 82.656 -9.770 -0.756 1.00 0.00 H new ATOM 0 HG3 LYS A 81 81.309 -9.828 -1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 81 82.038 -12.272 -2.387 1.00 0.00 H new ATOM 0 HD3 LYS A 81 83.078 -12.146 -0.982 1.00 0.00 H new ATOM 0 HE2 LYS A 81 81.101 -13.011 -0.024 1.00 0.00 H new ATOM 0 HE3 LYS A 81 80.901 -11.293 0.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 78.979 -12.589 -0.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 79.397 -11.084 -1.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 79.901 -12.517 -2.247 1.00 0.00 H new ATOM 1331 N TYR A 82 86.014 -8.960 -3.237 1.00 0.00 N ATOM 1332 CA TYR A 82 87.068 -8.314 -4.069 1.00 0.00 C ATOM 1333 C TYR A 82 88.442 -8.875 -3.682 1.00 0.00 C ATOM 1334 O TYR A 82 89.275 -9.119 -4.532 1.00 0.00 O ATOM 1335 CB TYR A 82 87.023 -6.789 -3.857 1.00 0.00 C ATOM 1336 CG TYR A 82 86.094 -6.162 -4.875 1.00 0.00 C ATOM 1337 CD1 TYR A 82 84.759 -5.909 -4.545 1.00 0.00 C ATOM 1338 CD2 TYR A 82 86.573 -5.846 -6.153 1.00 0.00 C ATOM 1339 CE1 TYR A 82 83.901 -5.340 -5.493 1.00 0.00 C ATOM 1340 CE2 TYR A 82 85.716 -5.276 -7.100 1.00 0.00 C ATOM 1341 CZ TYR A 82 84.380 -5.023 -6.772 1.00 0.00 C ATOM 1342 OH TYR A 82 83.535 -4.464 -7.709 1.00 0.00 O ATOM 0 H TYR A 82 85.653 -8.393 -2.470 1.00 0.00 H new ATOM 0 HA TYR A 82 86.891 -8.526 -5.123 1.00 0.00 H new ATOM 0 HB2 TYR A 82 86.679 -6.562 -2.848 1.00 0.00 H new ATOM 0 HB3 TYR A 82 88.024 -6.368 -3.955 1.00 0.00 H new ATOM 0 HD1 TYR A 82 84.390 -6.152 -3.559 1.00 0.00 H new ATOM 0 HD2 TYR A 82 87.604 -6.043 -6.407 1.00 0.00 H new ATOM 0 HE1 TYR A 82 82.869 -5.145 -5.239 1.00 0.00 H new ATOM 0 HE2 TYR A 82 86.086 -5.031 -8.085 1.00 0.00 H new ATOM 0 HH TYR A 82 84.028 -4.306 -8.541 1.00 0.00 H new ATOM 1352 N GLY A 83 88.685 -9.083 -2.410 1.00 0.00 N ATOM 1353 CA GLY A 83 90.008 -9.633 -1.965 1.00 0.00 C ATOM 1354 C GLY A 83 90.712 -8.591 -1.105 1.00 0.00 C ATOM 1355 O GLY A 83 91.875 -8.719 -0.774 1.00 0.00 O ATOM 0 H GLY A 83 88.023 -8.895 -1.657 1.00 0.00 H new ATOM 0 HA2 GLY A 83 89.862 -10.553 -1.399 1.00 0.00 H new ATOM 0 HA3 GLY A 83 90.622 -9.885 -2.830 1.00 0.00 H new ATOM 1359 N ILE A 84 90.010 -7.560 -0.738 1.00 0.00 N ATOM 1360 CA ILE A 84 90.622 -6.501 0.104 1.00 0.00 C ATOM 1361 C ILE A 84 91.067 -7.117 1.430 1.00 0.00 C ATOM 1362 O ILE A 84 90.616 -8.176 1.814 1.00 0.00 O ATOM 1363 CB ILE A 84 89.579 -5.407 0.348 1.00 0.00 C ATOM 1364 CG1 ILE A 84 89.201 -4.753 -0.990 1.00 0.00 C ATOM 1365 CG2 ILE A 84 90.153 -4.340 1.281 1.00 0.00 C ATOM 1366 CD1 ILE A 84 87.829 -4.076 -0.875 1.00 0.00 C ATOM 0 H ILE A 84 89.033 -7.405 -0.987 1.00 0.00 H new ATOM 0 HA ILE A 84 91.489 -6.067 -0.393 1.00 0.00 H new ATOM 0 HB ILE A 84 88.696 -5.853 0.806 1.00 0.00 H new ATOM 0 HG12 ILE A 84 89.956 -4.018 -1.271 1.00 0.00 H new ATOM 0 HG13 ILE A 84 89.179 -5.505 -1.778 1.00 0.00 H new ATOM 0 HG21 ILE A 84 89.406 -3.565 1.450 1.00 0.00 H new ATOM 0 HG22 ILE A 84 90.424 -4.797 2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 84 91.039 -3.897 0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 84 87.570 -3.615 -1.828 1.00 0.00 H new ATOM 0 HD12 ILE A 84 87.077 -4.821 -0.615 1.00 0.00 H new ATOM 0 HD13 ILE A 84 87.865 -3.311 -0.100 1.00 0.00 H new ATOM 1378 N GLN A 85 91.958 -6.468 2.124 1.00 0.00 N ATOM 1379 CA GLN A 85 92.446 -7.019 3.419 1.00 0.00 C ATOM 1380 C GLN A 85 93.324 -5.972 4.119 1.00 0.00 C ATOM 1381 O GLN A 85 93.360 -4.821 3.742 1.00 0.00 O ATOM 1382 CB GLN A 85 93.271 -8.295 3.146 1.00 0.00 C ATOM 1383 CG GLN A 85 93.131 -9.298 4.313 1.00 0.00 C ATOM 1384 CD GLN A 85 91.921 -10.203 4.083 1.00 0.00 C ATOM 1385 OE1 GLN A 85 91.998 -11.402 4.256 1.00 0.00 O ATOM 1386 NE2 GLN A 85 90.802 -9.669 3.697 1.00 0.00 N ATOM 0 H GLN A 85 92.371 -5.577 1.850 1.00 0.00 H new ATOM 0 HA GLN A 85 91.600 -7.264 4.061 1.00 0.00 H new ATOM 0 HB2 GLN A 85 92.935 -8.759 2.219 1.00 0.00 H new ATOM 0 HB3 GLN A 85 94.320 -8.033 3.009 1.00 0.00 H new ATOM 0 HG2 GLN A 85 94.036 -9.901 4.396 1.00 0.00 H new ATOM 0 HG3 GLN A 85 93.019 -8.760 5.254 1.00 0.00 H new ATOM 0 HE21 GLN A 85 90.741 -8.661 3.553 1.00 0.00 H new ATOM 0 HE22 GLN A 85 89.984 -10.257 3.538 1.00 0.00 H new ATOM 1395 N ALA A 86 94.037 -6.374 5.130 1.00 0.00 N ATOM 1396 CA ALA A 86 94.918 -5.424 5.863 1.00 0.00 C ATOM 1397 C ALA A 86 96.059 -4.959 4.959 1.00 0.00 C ATOM 1398 O ALA A 86 96.638 -3.911 5.164 1.00 0.00 O ATOM 1399 CB ALA A 86 95.508 -6.142 7.074 1.00 0.00 C ATOM 0 H ALA A 86 94.048 -7.330 5.485 1.00 0.00 H new ATOM 0 HA ALA A 86 94.335 -4.558 6.176 1.00 0.00 H new ATOM 0 HB1 ALA A 86 96.157 -5.458 7.622 1.00 0.00 H new ATOM 0 HB2 ALA A 86 94.702 -6.478 7.726 1.00 0.00 H new ATOM 0 HB3 ALA A 86 96.088 -7.003 6.740 1.00 0.00 H new ATOM 1405 N ASP A 87 96.393 -5.731 3.968 1.00 0.00 N ATOM 1406 CA ASP A 87 97.502 -5.330 3.065 1.00 0.00 C ATOM 1407 C ASP A 87 96.981 -4.286 2.087 1.00 0.00 C ATOM 1408 O ASP A 87 97.725 -3.690 1.332 1.00 0.00 O ATOM 1409 CB ASP A 87 97.995 -6.555 2.299 1.00 0.00 C ATOM 1410 CG ASP A 87 96.797 -7.326 1.742 1.00 0.00 C ATOM 1411 OD1 ASP A 87 95.810 -6.690 1.413 1.00 0.00 O ATOM 1412 OD2 ASP A 87 96.888 -8.540 1.655 1.00 0.00 O ATOM 0 H ASP A 87 95.947 -6.621 3.744 1.00 0.00 H new ATOM 0 HA ASP A 87 98.327 -4.913 3.643 1.00 0.00 H new ATOM 0 HB2 ASP A 87 98.653 -6.248 1.486 1.00 0.00 H new ATOM 0 HB3 ASP A 87 98.580 -7.197 2.957 1.00 0.00 H new ATOM 1417 N ALA A 88 95.696 -4.066 2.099 1.00 0.00 N ATOM 1418 CA ALA A 88 95.085 -3.069 1.183 1.00 0.00 C ATOM 1419 C ALA A 88 94.845 -1.764 1.948 1.00 0.00 C ATOM 1420 O ALA A 88 94.038 -1.708 2.852 1.00 0.00 O ATOM 1421 CB ALA A 88 93.754 -3.641 0.695 1.00 0.00 C ATOM 0 H ALA A 88 95.036 -4.542 2.714 1.00 0.00 H new ATOM 0 HA ALA A 88 95.740 -2.864 0.336 1.00 0.00 H new ATOM 0 HB1 ALA A 88 93.279 -2.931 0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 88 93.932 -4.579 0.170 1.00 0.00 H new ATOM 0 HB3 ALA A 88 93.101 -3.822 1.549 1.00 0.00 H new ATOM 1427 N LYS A 89 95.536 -0.711 1.596 1.00 0.00 N ATOM 1428 CA LYS A 89 95.335 0.589 2.307 1.00 0.00 C ATOM 1429 C LYS A 89 94.298 1.413 1.554 1.00 0.00 C ATOM 1430 O LYS A 89 94.459 1.741 0.395 1.00 0.00 O ATOM 1431 CB LYS A 89 96.659 1.361 2.392 1.00 0.00 C ATOM 1432 CG LYS A 89 97.828 0.397 2.626 1.00 0.00 C ATOM 1433 CD LYS A 89 97.703 -0.293 3.990 1.00 0.00 C ATOM 1434 CE LYS A 89 98.689 -1.457 4.054 1.00 0.00 C ATOM 1435 NZ LYS A 89 100.074 -0.949 3.844 1.00 0.00 N ATOM 0 H LYS A 89 96.230 -0.694 0.849 1.00 0.00 H new ATOM 0 HA LYS A 89 94.984 0.396 3.321 1.00 0.00 H new ATOM 0 HB2 LYS A 89 96.820 1.921 1.471 1.00 0.00 H new ATOM 0 HB3 LYS A 89 96.612 2.088 3.203 1.00 0.00 H new ATOM 0 HG2 LYS A 89 97.850 -0.353 1.835 1.00 0.00 H new ATOM 0 HG3 LYS A 89 98.770 0.942 2.575 1.00 0.00 H new ATOM 0 HD2 LYS A 89 97.908 0.418 4.791 1.00 0.00 H new ATOM 0 HD3 LYS A 89 96.685 -0.654 4.137 1.00 0.00 H new ATOM 0 HE2 LYS A 89 98.616 -1.956 5.020 1.00 0.00 H new ATOM 0 HE3 LYS A 89 98.443 -2.198 3.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 100.758 -1.656 4.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 100.229 -0.773 2.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 100.203 -0.063 4.373 1.00 0.00 H new ATOM 1449 N LEU A 90 93.226 1.734 2.215 1.00 0.00 N ATOM 1450 CA LEU A 90 92.133 2.530 1.572 1.00 0.00 C ATOM 1451 C LEU A 90 92.241 3.999 1.964 1.00 0.00 C ATOM 1452 O LEU A 90 93.068 4.388 2.756 1.00 0.00 O ATOM 1453 CB LEU A 90 90.770 1.992 2.011 1.00 0.00 C ATOM 1454 CG LEU A 90 90.798 0.469 1.987 1.00 0.00 C ATOM 1455 CD1 LEU A 90 89.407 -0.072 2.320 1.00 0.00 C ATOM 1456 CD2 LEU A 90 91.221 -0.020 0.596 1.00 0.00 C ATOM 0 H LEU A 90 93.052 1.478 3.187 1.00 0.00 H new ATOM 0 HA LEU A 90 92.233 2.441 0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 90 90.532 2.347 3.014 1.00 0.00 H new ATOM 0 HB3 LEU A 90 89.989 2.363 1.348 1.00 0.00 H new ATOM 0 HG LEU A 90 91.514 0.110 2.726 1.00 0.00 H new ATOM 0 HD11 LEU A 90 89.427 -1.162 2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 90 89.111 0.270 3.312 1.00 0.00 H new ATOM 0 HD13 LEU A 90 88.690 0.290 1.583 1.00 0.00 H new ATOM 0 HD21 LEU A 90 91.240 -1.110 0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 90 90.510 0.339 -0.148 1.00 0.00 H new ATOM 0 HD23 LEU A 90 92.215 0.363 0.362 1.00 0.00 H new ATOM 1468 N GLN A 91 91.393 4.814 1.405 1.00 0.00 N ATOM 1469 CA GLN A 91 91.387 6.265 1.734 1.00 0.00 C ATOM 1470 C GLN A 91 89.937 6.661 1.973 1.00 0.00 C ATOM 1471 O GLN A 91 89.029 6.125 1.363 1.00 0.00 O ATOM 1472 CB GLN A 91 91.935 7.109 0.579 1.00 0.00 C ATOM 1473 CG GLN A 91 93.263 6.534 0.050 1.00 0.00 C ATOM 1474 CD GLN A 91 93.460 6.977 -1.390 1.00 0.00 C ATOM 1475 OE1 GLN A 91 94.271 6.429 -2.110 1.00 0.00 O ATOM 1476 NE2 GLN A 91 92.743 7.959 -1.834 1.00 0.00 N ATOM 0 H GLN A 91 90.691 4.530 0.721 1.00 0.00 H new ATOM 0 HA GLN A 91 92.017 6.440 2.606 1.00 0.00 H new ATOM 0 HB2 GLN A 91 91.204 7.144 -0.228 1.00 0.00 H new ATOM 0 HB3 GLN A 91 92.088 8.135 0.915 1.00 0.00 H new ATOM 0 HG2 GLN A 91 94.094 6.879 0.666 1.00 0.00 H new ATOM 0 HG3 GLN A 91 93.252 5.446 0.110 1.00 0.00 H new ATOM 0 HE21 GLN A 91 92.065 8.413 -1.222 1.00 0.00 H new ATOM 0 HE22 GLN A 91 92.856 8.279 -2.796 1.00 0.00 H new ATOM 1485 N PHE A 92 89.717 7.593 2.847 1.00 0.00 N ATOM 1486 CA PHE A 92 88.328 8.054 3.150 1.00 0.00 C ATOM 1487 C PHE A 92 88.201 9.501 2.664 1.00 0.00 C ATOM 1488 O PHE A 92 88.627 10.428 3.324 1.00 0.00 O ATOM 1489 CB PHE A 92 88.112 7.968 4.673 1.00 0.00 C ATOM 1490 CG PHE A 92 87.531 6.625 5.081 1.00 0.00 C ATOM 1491 CD1 PHE A 92 86.363 6.571 5.858 1.00 0.00 C ATOM 1492 CD2 PHE A 92 88.177 5.437 4.720 1.00 0.00 C ATOM 1493 CE1 PHE A 92 85.853 5.337 6.276 1.00 0.00 C ATOM 1494 CE2 PHE A 92 87.655 4.204 5.127 1.00 0.00 C ATOM 1495 CZ PHE A 92 86.503 4.154 5.906 1.00 0.00 C ATOM 0 H PHE A 92 90.448 8.067 3.377 1.00 0.00 H new ATOM 0 HA PHE A 92 87.579 7.438 2.653 1.00 0.00 H new ATOM 0 HB2 PHE A 92 89.061 8.125 5.185 1.00 0.00 H new ATOM 0 HB3 PHE A 92 87.442 8.767 4.992 1.00 0.00 H new ATOM 0 HD1 PHE A 92 85.857 7.484 6.134 1.00 0.00 H new ATOM 0 HD2 PHE A 92 89.079 5.472 4.127 1.00 0.00 H new ATOM 0 HE1 PHE A 92 84.960 5.297 6.882 1.00 0.00 H new ATOM 0 HE2 PHE A 92 88.148 3.288 4.836 1.00 0.00 H new ATOM 0 HZ PHE A 92 86.110 3.200 6.226 1.00 0.00 H new ATOM 1505 N THR A 93 87.655 9.696 1.492 1.00 0.00 N ATOM 1506 CA THR A 93 87.551 11.083 0.946 1.00 0.00 C ATOM 1507 C THR A 93 86.496 11.165 -0.178 1.00 0.00 C ATOM 1508 O THR A 93 86.256 10.198 -0.873 1.00 0.00 O ATOM 1509 CB THR A 93 88.923 11.443 0.376 1.00 0.00 C ATOM 1510 OG1 THR A 93 88.817 12.578 -0.470 1.00 0.00 O ATOM 1511 CG2 THR A 93 89.467 10.257 -0.432 1.00 0.00 C ATOM 0 H THR A 93 87.279 8.961 0.893 1.00 0.00 H new ATOM 0 HA THR A 93 87.246 11.770 1.736 1.00 0.00 H new ATOM 0 HB THR A 93 89.601 11.672 1.198 1.00 0.00 H new ATOM 0 HG1 THR A 93 89.633 13.116 -0.399 1.00 0.00 H new ATOM 0 HG21 THR A 93 90.445 10.512 -0.839 1.00 0.00 H new ATOM 0 HG22 THR A 93 89.560 9.386 0.217 1.00 0.00 H new ATOM 0 HG23 THR A 93 88.782 10.029 -1.249 1.00 0.00 H new ATOM 1519 N PRO A 94 85.890 12.325 -0.377 1.00 0.00 N ATOM 1520 CA PRO A 94 84.878 12.537 -1.454 1.00 0.00 C ATOM 1521 C PRO A 94 85.196 11.736 -2.722 1.00 0.00 C ATOM 1522 O PRO A 94 84.439 10.833 -3.034 1.00 0.00 O ATOM 1523 CB PRO A 94 84.985 14.037 -1.716 1.00 0.00 C ATOM 1524 CG PRO A 94 85.284 14.628 -0.373 1.00 0.00 C ATOM 1525 CD PRO A 94 86.089 13.566 0.403 1.00 0.00 C ATOM 0 HA PRO A 94 83.881 12.205 -1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 94 85.775 14.260 -2.433 1.00 0.00 H new ATOM 0 HB3 PRO A 94 84.058 14.436 -2.128 1.00 0.00 H new ATOM 0 HG2 PRO A 94 85.855 15.551 -0.474 1.00 0.00 H new ATOM 0 HG3 PRO A 94 84.364 14.879 0.154 1.00 0.00 H new ATOM 0 HD2 PRO A 94 87.144 13.833 0.466 1.00 0.00 H new ATOM 0 HD3 PRO A 94 85.726 13.458 1.425 1.00 0.00 H new TER 1533 PRO A 94 ATOM 1534 N TYR B 541 54.087 38.130 16.393 1.00 0.00 N ATOM 1535 CA TYR B 541 52.630 38.438 16.402 1.00 0.00 C ATOM 1536 C TYR B 541 52.007 38.001 15.074 1.00 0.00 C ATOM 1537 O TYR B 541 51.503 36.904 14.943 1.00 0.00 O ATOM 1538 CB TYR B 541 52.430 39.944 16.585 1.00 0.00 C ATOM 1539 CG TYR B 541 52.950 40.363 17.940 1.00 0.00 C ATOM 1540 CD1 TYR B 541 54.289 40.743 18.089 1.00 0.00 C ATOM 1541 CD2 TYR B 541 52.092 40.371 19.046 1.00 0.00 C ATOM 1542 CE1 TYR B 541 54.770 41.132 19.345 1.00 0.00 C ATOM 1543 CE2 TYR B 541 52.573 40.759 20.302 1.00 0.00 C ATOM 1544 CZ TYR B 541 53.913 41.139 20.451 1.00 0.00 C ATOM 1545 OH TYR B 541 54.387 41.523 21.689 1.00 0.00 O ATOM 0 HA TYR B 541 52.151 37.903 17.222 1.00 0.00 H new ATOM 0 HB2 TYR B 541 52.953 40.489 15.799 1.00 0.00 H new ATOM 0 HB3 TYR B 541 51.373 40.194 16.497 1.00 0.00 H new ATOM 0 HD1 TYR B 541 54.951 40.736 17.235 1.00 0.00 H new ATOM 0 HD2 TYR B 541 51.059 40.078 18.930 1.00 0.00 H new ATOM 0 HE1 TYR B 541 55.803 41.427 19.460 1.00 0.00 H new ATOM 0 HE2 TYR B 541 51.911 40.765 21.156 1.00 0.00 H new ATOM 0 HH TYR B 541 53.662 41.472 22.347 1.00 0.00 H new ATOM 1555 N HIS B 542 52.038 38.855 14.088 1.00 0.00 N ATOM 1556 CA HIS B 542 51.450 38.501 12.767 1.00 0.00 C ATOM 1557 C HIS B 542 52.415 37.579 12.010 1.00 0.00 C ATOM 1558 O HIS B 542 52.051 36.504 11.577 1.00 0.00 O ATOM 1559 CB HIS B 542 51.232 39.796 11.965 1.00 0.00 C ATOM 1560 CG HIS B 542 49.886 40.392 12.292 1.00 0.00 C ATOM 1561 ND1 HIS B 542 49.435 40.532 13.595 1.00 0.00 N ATOM 1562 CD2 HIS B 542 48.885 40.889 11.494 1.00 0.00 C ATOM 1563 CE1 HIS B 542 48.213 41.093 13.544 1.00 0.00 C ATOM 1564 NE2 HIS B 542 47.830 41.331 12.286 1.00 0.00 N ATOM 0 H HIS B 542 52.448 39.788 14.142 1.00 0.00 H new ATOM 0 HA HIS B 542 50.499 37.985 12.904 1.00 0.00 H new ATOM 0 HB2 HIS B 542 52.021 40.512 12.196 1.00 0.00 H new ATOM 0 HB3 HIS B 542 51.295 39.586 10.897 1.00 0.00 H new ATOM 0 HD2 HIS B 542 48.913 40.930 10.415 1.00 0.00 H new ATOM 0 HE1 HIS B 542 47.615 41.323 14.413 1.00 0.00 H new ATOM 0 HE2 HIS B 542 46.953 41.747 11.974 1.00 0.00 H new ATOM 1572 N GLU B 543 53.636 38.007 11.839 1.00 0.00 N ATOM 1573 CA GLU B 543 54.637 37.178 11.101 1.00 0.00 C ATOM 1574 C GLU B 543 54.541 35.710 11.536 1.00 0.00 C ATOM 1575 O GLU B 543 55.019 34.825 10.858 1.00 0.00 O ATOM 1576 CB GLU B 543 56.046 37.711 11.388 1.00 0.00 C ATOM 1577 CG GLU B 543 56.158 38.089 12.867 1.00 0.00 C ATOM 1578 CD GLU B 543 57.632 38.253 13.244 1.00 0.00 C ATOM 1579 OE1 GLU B 543 58.114 37.455 14.030 1.00 0.00 O ATOM 1580 OE2 GLU B 543 58.253 39.176 12.741 1.00 0.00 O ATOM 0 H GLU B 543 53.987 38.902 12.181 1.00 0.00 H new ATOM 0 HA GLU B 543 54.430 37.239 10.032 1.00 0.00 H new ATOM 0 HB2 GLU B 543 56.790 36.955 11.138 1.00 0.00 H new ATOM 0 HB3 GLU B 543 56.252 38.580 10.763 1.00 0.00 H new ATOM 0 HG2 GLU B 543 55.618 39.016 13.058 1.00 0.00 H new ATOM 0 HG3 GLU B 543 55.697 37.319 13.486 1.00 0.00 H new ATOM 1587 N ARG B 544 53.933 35.444 12.658 1.00 0.00 N ATOM 1588 CA ARG B 544 53.814 34.032 13.123 1.00 0.00 C ATOM 1589 C ARG B 544 52.689 33.334 12.350 1.00 0.00 C ATOM 1590 O ARG B 544 51.554 33.311 12.784 1.00 0.00 O ATOM 1591 CB ARG B 544 53.495 34.017 14.622 1.00 0.00 C ATOM 1592 CG ARG B 544 54.321 35.091 15.337 1.00 0.00 C ATOM 1593 CD ARG B 544 55.811 34.822 15.121 1.00 0.00 C ATOM 1594 NE ARG B 544 56.606 35.645 16.076 1.00 0.00 N ATOM 1595 CZ ARG B 544 57.865 35.371 16.282 1.00 0.00 C ATOM 1596 NH1 ARG B 544 58.560 36.087 17.123 1.00 0.00 N ATOM 1597 NH2 ARG B 544 58.430 34.384 15.643 1.00 0.00 N ATOM 0 H ARG B 544 53.514 36.141 13.273 1.00 0.00 H new ATOM 0 HA ARG B 544 54.753 33.507 12.947 1.00 0.00 H new ATOM 0 HB2 ARG B 544 52.432 34.198 14.779 1.00 0.00 H new ATOM 0 HB3 ARG B 544 53.717 33.035 15.041 1.00 0.00 H new ATOM 0 HG2 ARG B 544 54.060 36.078 14.955 1.00 0.00 H new ATOM 0 HG3 ARG B 544 54.092 35.091 16.403 1.00 0.00 H new ATOM 0 HD2 ARG B 544 56.026 33.764 15.269 1.00 0.00 H new ATOM 0 HD3 ARG B 544 56.091 35.063 14.095 1.00 0.00 H new ATOM 0 HE ARG B 544 56.166 36.422 16.568 1.00 0.00 H new ATOM 0 HH11 ARG B 544 58.119 36.861 17.620 1.00 0.00 H new ATOM 0 HH12 ARG B 544 59.544 35.872 17.284 1.00 0.00 H new ATOM 0 HH21 ARG B 544 57.888 33.827 14.983 1.00 0.00 H new ATOM 0 HH22 ARG B 544 59.414 34.169 15.804 1.00 0.00 H new ATOM 1611 N ARG B 545 52.993 32.776 11.201 1.00 0.00 N ATOM 1612 CA ARG B 545 51.950 32.090 10.381 1.00 0.00 C ATOM 1613 C ARG B 545 52.448 30.697 9.967 1.00 0.00 C ATOM 1614 O ARG B 545 51.706 29.737 9.978 1.00 0.00 O ATOM 1615 CB ARG B 545 51.644 32.937 9.118 1.00 0.00 C ATOM 1616 CG ARG B 545 52.750 33.980 8.847 1.00 0.00 C ATOM 1617 CD ARG B 545 54.066 33.293 8.429 1.00 0.00 C ATOM 1618 NE ARG B 545 54.853 34.198 7.521 1.00 0.00 N ATOM 1619 CZ ARG B 545 54.373 34.620 6.380 1.00 0.00 C ATOM 1620 NH1 ARG B 545 55.055 35.474 5.666 1.00 0.00 N ATOM 1621 NH2 ARG B 545 53.235 34.165 5.931 1.00 0.00 N ATOM 0 H ARG B 545 53.929 32.768 10.795 1.00 0.00 H new ATOM 0 HA ARG B 545 51.040 31.981 10.971 1.00 0.00 H new ATOM 0 HB2 ARG B 545 51.545 32.279 8.254 1.00 0.00 H new ATOM 0 HB3 ARG B 545 50.688 33.445 9.244 1.00 0.00 H new ATOM 0 HG2 ARG B 545 52.426 34.663 8.061 1.00 0.00 H new ATOM 0 HG3 ARG B 545 52.917 34.580 9.742 1.00 0.00 H new ATOM 0 HD2 ARG B 545 54.655 33.049 9.313 1.00 0.00 H new ATOM 0 HD3 ARG B 545 53.850 32.353 7.921 1.00 0.00 H new ATOM 0 HE ARG B 545 55.788 34.491 7.803 1.00 0.00 H new ATOM 0 HH11 ARG B 545 55.959 35.810 5.999 1.00 0.00 H new ATOM 0 HH12 ARG B 545 54.684 35.805 4.776 1.00 0.00 H new ATOM 0 HH21 ARG B 545 52.713 33.475 6.471 1.00 0.00 H new ATOM 0 HH22 ARG B 545 52.868 34.500 5.040 1.00 0.00 H new ATOM 1635 N GLY B 546 53.686 30.595 9.584 1.00 0.00 N ATOM 1636 CA GLY B 546 54.242 29.280 9.143 1.00 0.00 C ATOM 1637 C GLY B 546 53.949 28.191 10.180 1.00 0.00 C ATOM 1638 O GLY B 546 52.836 27.722 10.309 1.00 0.00 O ATOM 0 H GLY B 546 54.347 31.371 9.556 1.00 0.00 H new ATOM 0 HA2 GLY B 546 53.809 29.000 8.183 1.00 0.00 H new ATOM 0 HA3 GLY B 546 55.318 29.367 8.994 1.00 0.00 H new ATOM 1642 N SER B 547 54.946 27.774 10.909 1.00 0.00 N ATOM 1643 CA SER B 547 54.735 26.709 11.926 1.00 0.00 C ATOM 1644 C SER B 547 55.946 26.690 12.850 1.00 0.00 C ATOM 1645 O SER B 547 57.048 26.463 12.419 1.00 0.00 O ATOM 1646 CB SER B 547 54.596 25.356 11.220 1.00 0.00 C ATOM 1647 OG SER B 547 53.230 25.136 10.892 1.00 0.00 O ATOM 0 H SER B 547 55.901 28.127 10.843 1.00 0.00 H new ATOM 0 HA SER B 547 53.829 26.901 12.502 1.00 0.00 H new ATOM 0 HB2 SER B 547 55.206 25.340 10.317 1.00 0.00 H new ATOM 0 HB3 SER B 547 54.960 24.557 11.865 1.00 0.00 H new ATOM 0 HG SER B 547 52.813 25.987 10.641 1.00 0.00 H new ATOM 1653 N LEU B 548 55.763 26.946 14.108 1.00 0.00 N ATOM 1654 CA LEU B 548 56.927 26.960 15.029 1.00 0.00 C ATOM 1655 C LEU B 548 57.604 25.593 15.046 1.00 0.00 C ATOM 1656 O LEU B 548 56.956 24.578 15.155 1.00 0.00 O ATOM 1657 CB LEU B 548 56.445 27.331 16.451 1.00 0.00 C ATOM 1658 CG LEU B 548 56.714 28.821 16.732 1.00 0.00 C ATOM 1659 CD1 LEU B 548 55.783 29.691 15.883 1.00 0.00 C ATOM 1660 CD2 LEU B 548 56.482 29.126 18.209 1.00 0.00 C ATOM 0 H LEU B 548 54.861 27.146 14.540 1.00 0.00 H new ATOM 0 HA LEU B 548 57.651 27.699 14.685 1.00 0.00 H new ATOM 0 HB2 LEU B 548 55.380 27.122 16.548 1.00 0.00 H new ATOM 0 HB3 LEU B 548 56.959 26.716 17.189 1.00 0.00 H new ATOM 0 HG LEU B 548 57.750 29.042 16.476 1.00 0.00 H new ATOM 0 HD11 LEU B 548 55.980 30.743 16.088 1.00 0.00 H new ATOM 0 HD12 LEU B 548 55.959 29.488 14.827 1.00 0.00 H new ATOM 0 HD13 LEU B 548 54.746 29.462 16.129 1.00 0.00 H new ATOM 0 HD21 LEU B 548 56.675 30.182 18.397 1.00 0.00 H new ATOM 0 HD22 LEU B 548 55.450 28.893 18.471 1.00 0.00 H new ATOM 0 HD23 LEU B 548 57.155 28.521 18.816 1.00 0.00 H new ATOM 1672 N CYS B 549 58.913 25.566 14.987 1.00 0.00 N ATOM 1673 CA CYS B 549 59.620 24.263 15.041 1.00 0.00 C ATOM 1674 C CYS B 549 59.742 23.919 16.516 1.00 0.00 C ATOM 1675 O CYS B 549 60.529 24.489 17.245 1.00 0.00 O ATOM 1676 CB CYS B 549 61.014 24.425 14.408 1.00 0.00 C ATOM 1677 SG CYS B 549 62.172 23.161 15.024 1.00 0.00 S ATOM 0 H CYS B 549 59.513 26.387 14.904 1.00 0.00 H new ATOM 0 HA CYS B 549 59.092 23.478 14.499 1.00 0.00 H new ATOM 0 HB2 CYS B 549 60.934 24.350 13.323 1.00 0.00 H new ATOM 0 HB3 CYS B 549 61.404 25.418 14.631 1.00 0.00 H new ATOM 1682 N SER B 550 58.929 23.011 16.964 1.00 0.00 N ATOM 1683 CA SER B 550 58.942 22.644 18.401 1.00 0.00 C ATOM 1684 C SER B 550 60.361 22.342 18.839 1.00 0.00 C ATOM 1685 O SER B 550 61.076 21.572 18.228 1.00 0.00 O ATOM 1686 CB SER B 550 58.020 21.458 18.655 1.00 0.00 C ATOM 1687 OG SER B 550 58.264 20.942 19.957 1.00 0.00 O ATOM 0 H SER B 550 58.252 22.504 16.393 1.00 0.00 H new ATOM 0 HA SER B 550 58.572 23.483 18.990 1.00 0.00 H new ATOM 0 HB2 SER B 550 56.979 21.766 18.563 1.00 0.00 H new ATOM 0 HB3 SER B 550 58.190 20.684 17.907 1.00 0.00 H new ATOM 0 HG SER B 550 57.414 20.848 20.436 1.00 0.00 H new ATOM 1693 N GLY B 551 60.776 22.998 19.879 1.00 0.00 N ATOM 1694 CA GLY B 551 62.167 22.844 20.390 1.00 0.00 C ATOM 1695 C GLY B 551 62.877 24.148 20.084 1.00 0.00 C ATOM 1696 O GLY B 551 63.696 24.634 20.838 1.00 0.00 O ATOM 0 H GLY B 551 60.199 23.650 20.411 1.00 0.00 H new ATOM 0 HA2 GLY B 551 62.168 22.642 21.461 1.00 0.00 H new ATOM 0 HA3 GLY B 551 62.668 22.005 19.907 1.00 0.00 H new ATOM 1700 N CYS B 552 62.524 24.728 18.973 1.00 0.00 N ATOM 1701 CA CYS B 552 63.104 26.023 18.559 1.00 0.00 C ATOM 1702 C CYS B 552 62.043 27.091 18.791 1.00 0.00 C ATOM 1703 O CYS B 552 62.327 28.216 19.147 1.00 0.00 O ATOM 1704 CB CYS B 552 63.405 25.951 17.064 1.00 0.00 C ATOM 1705 SG CYS B 552 65.016 25.183 16.789 1.00 0.00 S ATOM 0 H CYS B 552 61.839 24.344 18.321 1.00 0.00 H new ATOM 0 HA CYS B 552 64.013 26.249 19.116 1.00 0.00 H new ATOM 0 HB2 CYS B 552 62.629 25.378 16.557 1.00 0.00 H new ATOM 0 HB3 CYS B 552 63.393 26.953 16.635 1.00 0.00 H new ATOM 1710 N GLN B 553 60.818 26.724 18.564 1.00 0.00 N ATOM 1711 CA GLN B 553 59.692 27.669 18.722 1.00 0.00 C ATOM 1712 C GLN B 553 59.921 28.901 17.869 1.00 0.00 C ATOM 1713 O GLN B 553 59.894 30.026 18.323 1.00 0.00 O ATOM 1714 CB GLN B 553 59.487 28.037 20.176 1.00 0.00 C ATOM 1715 CG GLN B 553 59.058 26.780 20.932 1.00 0.00 C ATOM 1716 CD GLN B 553 57.669 26.319 20.480 1.00 0.00 C ATOM 1717 OE1 GLN B 553 56.673 26.637 21.100 1.00 0.00 O ATOM 1718 NE2 GLN B 553 57.570 25.574 19.414 1.00 0.00 N ATOM 0 H GLN B 553 60.547 25.786 18.269 1.00 0.00 H new ATOM 0 HA GLN B 553 58.780 27.180 18.381 1.00 0.00 H new ATOM 0 HB2 GLN B 553 60.407 28.439 20.599 1.00 0.00 H new ATOM 0 HB3 GLN B 553 58.728 28.813 20.268 1.00 0.00 H new ATOM 0 HG2 GLN B 553 59.783 25.984 20.763 1.00 0.00 H new ATOM 0 HG3 GLN B 553 59.049 26.980 22.003 1.00 0.00 H new ATOM 0 HE21 GLN B 553 58.409 25.310 18.897 1.00 0.00 H new ATOM 0 HE22 GLN B 553 56.654 25.256 19.097 1.00 0.00 H new ATOM 1727 N LYS B 554 60.100 28.656 16.612 1.00 0.00 N ATOM 1728 CA LYS B 554 60.293 29.745 15.606 1.00 0.00 C ATOM 1729 C LYS B 554 59.517 29.332 14.336 1.00 0.00 C ATOM 1730 O LYS B 554 59.750 28.258 13.818 1.00 0.00 O ATOM 1731 CB LYS B 554 61.778 29.888 15.254 1.00 0.00 C ATOM 1732 CG LYS B 554 62.586 30.292 16.493 1.00 0.00 C ATOM 1733 CD LYS B 554 62.219 31.719 16.930 1.00 0.00 C ATOM 1734 CE LYS B 554 63.352 32.310 17.775 1.00 0.00 C ATOM 1735 NZ LYS B 554 62.882 33.564 18.430 1.00 0.00 N ATOM 0 H LYS B 554 60.123 27.716 16.218 1.00 0.00 H new ATOM 0 HA LYS B 554 59.938 30.695 16.005 1.00 0.00 H new ATOM 0 HB2 LYS B 554 62.156 28.946 14.857 1.00 0.00 H new ATOM 0 HB3 LYS B 554 61.902 30.637 14.471 1.00 0.00 H new ATOM 0 HG2 LYS B 554 62.390 29.594 17.307 1.00 0.00 H new ATOM 0 HG3 LYS B 554 63.652 30.235 16.274 1.00 0.00 H new ATOM 0 HD2 LYS B 554 62.042 32.343 16.054 1.00 0.00 H new ATOM 0 HD3 LYS B 554 61.293 31.706 17.505 1.00 0.00 H new ATOM 0 HE2 LYS B 554 63.671 31.591 18.529 1.00 0.00 H new ATOM 0 HE3 LYS B 554 64.218 32.518 17.147 1.00 0.00 H new ATOM 0 HZ1 LYS B 554 63.651 33.965 19.004 1.00 0.00 H new ATOM 0 HZ2 LYS B 554 62.598 34.251 17.702 1.00 0.00 H new ATOM 0 HZ3 LYS B 554 62.068 33.352 19.042 1.00 0.00 H new ATOM 1749 N PRO B 555 58.589 30.122 13.831 1.00 0.00 N ATOM 1750 CA PRO B 555 57.814 29.710 12.625 1.00 0.00 C ATOM 1751 C PRO B 555 58.658 29.097 11.509 1.00 0.00 C ATOM 1752 O PRO B 555 59.706 29.589 11.139 1.00 0.00 O ATOM 1753 CB PRO B 555 57.183 31.028 12.181 1.00 0.00 C ATOM 1754 CG PRO B 555 57.153 31.951 13.409 1.00 0.00 C ATOM 1755 CD PRO B 555 58.222 31.448 14.403 1.00 0.00 C ATOM 0 HA PRO B 555 57.104 28.915 12.854 1.00 0.00 H new ATOM 0 HB2 PRO B 555 57.761 31.479 11.374 1.00 0.00 H new ATOM 0 HB3 PRO B 555 56.176 30.863 11.798 1.00 0.00 H new ATOM 0 HG2 PRO B 555 57.357 32.981 13.118 1.00 0.00 H new ATOM 0 HG3 PRO B 555 56.166 31.940 13.871 1.00 0.00 H new ATOM 0 HD2 PRO B 555 59.079 32.120 14.453 1.00 0.00 H new ATOM 0 HD3 PRO B 555 57.827 31.359 15.415 1.00 0.00 H new ATOM 1763 N ILE B 556 58.167 28.019 10.973 1.00 0.00 N ATOM 1764 CA ILE B 556 58.854 27.314 9.866 1.00 0.00 C ATOM 1765 C ILE B 556 58.272 27.835 8.551 1.00 0.00 C ATOM 1766 O ILE B 556 57.207 27.425 8.132 1.00 0.00 O ATOM 1767 CB ILE B 556 58.562 25.821 10.006 1.00 0.00 C ATOM 1768 CG1 ILE B 556 59.243 25.260 11.278 1.00 0.00 C ATOM 1769 CG2 ILE B 556 59.090 25.085 8.781 1.00 0.00 C ATOM 1770 CD1 ILE B 556 58.500 24.004 11.785 1.00 0.00 C ATOM 0 H ILE B 556 57.291 27.586 11.267 1.00 0.00 H new ATOM 0 HA ILE B 556 59.931 27.481 9.888 1.00 0.00 H new ATOM 0 HB ILE B 556 57.485 25.676 10.088 1.00 0.00 H new ATOM 0 HG12 ILE B 556 60.282 25.012 11.061 1.00 0.00 H new ATOM 0 HG13 ILE B 556 59.254 26.022 12.057 1.00 0.00 H new ATOM 0 HG21 ILE B 556 58.882 24.019 8.879 1.00 0.00 H new ATOM 0 HG22 ILE B 556 58.600 25.469 7.886 1.00 0.00 H new ATOM 0 HG23 ILE B 556 60.166 25.239 8.700 1.00 0.00 H new ATOM 0 HD11 ILE B 556 58.994 23.625 12.680 1.00 0.00 H new ATOM 0 HD12 ILE B 556 57.468 24.263 12.023 1.00 0.00 H new ATOM 0 HD13 ILE B 556 58.513 23.237 11.011 1.00 0.00 H new ATOM 1782 N THR B 557 58.939 28.764 7.915 1.00 0.00 N ATOM 1783 CA THR B 557 58.401 29.350 6.646 1.00 0.00 C ATOM 1784 C THR B 557 59.070 28.729 5.419 1.00 0.00 C ATOM 1785 O THR B 557 60.087 29.189 4.939 1.00 0.00 O ATOM 1786 CB THR B 557 58.647 30.853 6.676 1.00 0.00 C ATOM 1787 OG1 THR B 557 60.033 31.113 6.499 1.00 0.00 O ATOM 1788 CG2 THR B 557 58.186 31.387 8.031 1.00 0.00 C ATOM 0 H THR B 557 59.835 29.144 8.219 1.00 0.00 H new ATOM 0 HA THR B 557 57.334 29.139 6.574 1.00 0.00 H new ATOM 0 HB THR B 557 58.094 31.343 5.874 1.00 0.00 H new ATOM 0 HG1 THR B 557 60.308 30.824 5.604 1.00 0.00 H new ATOM 0 HG21 THR B 557 58.353 32.463 8.074 1.00 0.00 H new ATOM 0 HG22 THR B 557 57.124 31.179 8.162 1.00 0.00 H new ATOM 0 HG23 THR B 557 58.751 30.900 8.826 1.00 0.00 H new ATOM 1796 N GLY B 558 58.482 27.684 4.915 1.00 0.00 N ATOM 1797 CA GLY B 558 59.022 26.991 3.716 1.00 0.00 C ATOM 1798 C GLY B 558 58.504 25.560 3.756 1.00 0.00 C ATOM 1799 O GLY B 558 57.383 25.280 3.380 1.00 0.00 O ATOM 0 H GLY B 558 57.629 27.271 5.293 1.00 0.00 H new ATOM 0 HA2 GLY B 558 58.699 27.492 2.803 1.00 0.00 H new ATOM 0 HA3 GLY B 558 60.112 27.007 3.720 1.00 0.00 H new ATOM 1803 N ARG B 559 59.305 24.664 4.253 1.00 0.00 N ATOM 1804 CA ARG B 559 58.891 23.245 4.386 1.00 0.00 C ATOM 1805 C ARG B 559 58.772 22.955 5.872 1.00 0.00 C ATOM 1806 O ARG B 559 59.456 23.554 6.678 1.00 0.00 O ATOM 1807 CB ARG B 559 59.968 22.352 3.764 1.00 0.00 C ATOM 1808 CG ARG B 559 59.684 22.190 2.268 1.00 0.00 C ATOM 1809 CD ARG B 559 58.444 21.298 2.036 1.00 0.00 C ATOM 1810 NE ARG B 559 57.284 22.158 1.670 1.00 0.00 N ATOM 1811 CZ ARG B 559 56.215 21.624 1.143 1.00 0.00 C ATOM 1812 NH1 ARG B 559 55.198 22.377 0.824 1.00 0.00 N ATOM 1813 NH2 ARG B 559 56.164 20.336 0.936 1.00 0.00 N ATOM 0 H ARG B 559 60.251 24.861 4.580 1.00 0.00 H new ATOM 0 HA ARG B 559 57.944 23.054 3.881 1.00 0.00 H new ATOM 0 HB2 ARG B 559 60.954 22.792 3.914 1.00 0.00 H new ATOM 0 HB3 ARG B 559 59.976 21.378 4.253 1.00 0.00 H new ATOM 0 HG2 ARG B 559 59.523 23.169 1.816 1.00 0.00 H new ATOM 0 HG3 ARG B 559 60.551 21.750 1.775 1.00 0.00 H new ATOM 0 HD2 ARG B 559 58.643 20.578 1.243 1.00 0.00 H new ATOM 0 HD3 ARG B 559 58.219 20.726 2.936 1.00 0.00 H new ATOM 0 HE ARG B 559 57.325 23.164 1.831 1.00 0.00 H new ATOM 0 HH11 ARG B 559 55.238 23.383 0.986 1.00 0.00 H new ATOM 0 HH12 ARG B 559 54.363 21.959 0.412 1.00 0.00 H new ATOM 0 HH21 ARG B 559 56.959 19.747 1.186 1.00 0.00 H new ATOM 0 HH22 ARG B 559 55.329 19.918 0.524 1.00 0.00 H new ATOM 1827 N CYS B 560 57.916 22.053 6.254 1.00 0.00 N ATOM 1828 CA CYS B 560 57.777 21.751 7.708 1.00 0.00 C ATOM 1829 C CYS B 560 57.503 20.283 7.943 1.00 0.00 C ATOM 1830 O CYS B 560 56.568 19.707 7.423 1.00 0.00 O ATOM 1831 CB CYS B 560 56.646 22.577 8.316 1.00 0.00 C ATOM 1832 SG CYS B 560 55.103 22.237 7.432 1.00 0.00 S ATOM 0 H CYS B 560 57.311 21.515 5.633 1.00 0.00 H new ATOM 0 HA CYS B 560 58.721 22.010 8.188 1.00 0.00 H new ATOM 0 HB2 CYS B 560 56.533 22.335 9.373 1.00 0.00 H new ATOM 0 HB3 CYS B 560 56.885 23.639 8.256 1.00 0.00 H new ATOM 0 HG CYS B 560 55.122 21.019 6.978 1.00 0.00 H new ATOM 1838 N ILE B 561 58.315 19.685 8.760 1.00 0.00 N ATOM 1839 CA ILE B 561 58.134 18.263 9.097 1.00 0.00 C ATOM 1840 C ILE B 561 57.260 18.180 10.323 1.00 0.00 C ATOM 1841 O ILE B 561 57.293 19.033 11.184 1.00 0.00 O ATOM 1842 CB ILE B 561 59.487 17.642 9.393 1.00 0.00 C ATOM 1843 CG1 ILE B 561 60.298 17.711 8.110 1.00 0.00 C ATOM 1844 CG2 ILE B 561 59.313 16.181 9.835 1.00 0.00 C ATOM 1845 CD1 ILE B 561 61.643 17.025 8.305 1.00 0.00 C ATOM 0 H ILE B 561 59.110 20.135 9.214 1.00 0.00 H new ATOM 0 HA ILE B 561 57.671 17.729 8.267 1.00 0.00 H new ATOM 0 HB ILE B 561 59.992 18.174 10.199 1.00 0.00 H new ATOM 0 HG12 ILE B 561 59.751 17.232 7.298 1.00 0.00 H new ATOM 0 HG13 ILE B 561 60.450 18.751 7.822 1.00 0.00 H new ATOM 0 HG21 ILE B 561 60.290 15.745 10.045 1.00 0.00 H new ATOM 0 HG22 ILE B 561 58.698 16.144 10.734 1.00 0.00 H new ATOM 0 HG23 ILE B 561 58.827 15.616 9.040 1.00 0.00 H new ATOM 0 HD11 ILE B 561 62.217 17.080 7.380 1.00 0.00 H new ATOM 0 HD12 ILE B 561 62.193 17.523 9.103 1.00 0.00 H new ATOM 0 HD13 ILE B 561 61.483 15.980 8.572 1.00 0.00 H new ATOM 1857 N THR B 562 56.481 17.150 10.396 1.00 0.00 N ATOM 1858 CA THR B 562 55.570 16.956 11.560 1.00 0.00 C ATOM 1859 C THR B 562 55.946 15.677 12.274 1.00 0.00 C ATOM 1860 O THR B 562 56.404 14.722 11.678 1.00 0.00 O ATOM 1861 CB THR B 562 54.112 16.877 11.112 1.00 0.00 C ATOM 1862 OG1 THR B 562 53.843 17.920 10.186 1.00 0.00 O ATOM 1863 CG2 THR B 562 53.205 17.025 12.339 1.00 0.00 C ATOM 0 H THR B 562 56.431 16.417 9.689 1.00 0.00 H new ATOM 0 HA THR B 562 55.676 17.810 12.230 1.00 0.00 H new ATOM 0 HB THR B 562 53.923 15.917 10.631 1.00 0.00 H new ATOM 0 HG1 THR B 562 52.908 17.868 9.897 1.00 0.00 H new ATOM 0 HG21 THR B 562 52.162 16.970 12.029 1.00 0.00 H new ATOM 0 HG22 THR B 562 53.416 16.223 13.046 1.00 0.00 H new ATOM 0 HG23 THR B 562 53.392 17.987 12.815 1.00 0.00 H new ATOM 1871 N ALA B 563 55.775 15.672 13.558 1.00 0.00 N ATOM 1872 CA ALA B 563 56.129 14.492 14.381 1.00 0.00 C ATOM 1873 C ALA B 563 54.903 14.033 15.159 1.00 0.00 C ATOM 1874 O ALA B 563 53.836 13.840 14.610 1.00 0.00 O ATOM 1875 CB ALA B 563 57.241 14.896 15.336 1.00 0.00 C ATOM 0 H ALA B 563 55.395 16.457 14.086 1.00 0.00 H new ATOM 0 HA ALA B 563 56.467 13.670 13.750 1.00 0.00 H new ATOM 0 HB1 ALA B 563 57.519 14.042 15.953 1.00 0.00 H new ATOM 0 HB2 ALA B 563 58.108 15.228 14.765 1.00 0.00 H new ATOM 0 HB3 ALA B 563 56.895 15.708 15.975 1.00 0.00 H new ATOM 1881 N MET B 564 55.055 13.860 16.435 1.00 0.00 N ATOM 1882 CA MET B 564 53.924 13.418 17.297 1.00 0.00 C ATOM 1883 C MET B 564 52.856 14.507 17.322 1.00 0.00 C ATOM 1884 O MET B 564 52.124 14.643 18.278 1.00 0.00 O ATOM 1885 CB MET B 564 54.458 13.205 18.709 1.00 0.00 C ATOM 1886 CG MET B 564 55.866 12.609 18.638 1.00 0.00 C ATOM 1887 SD MET B 564 56.311 11.915 20.249 1.00 0.00 S ATOM 1888 CE MET B 564 57.975 11.361 19.804 1.00 0.00 C ATOM 0 H MET B 564 55.933 14.009 16.932 1.00 0.00 H new ATOM 0 HA MET B 564 53.490 12.495 16.912 1.00 0.00 H new ATOM 0 HB2 MET B 564 54.479 14.152 19.248 1.00 0.00 H new ATOM 0 HB3 MET B 564 53.797 12.538 19.263 1.00 0.00 H new ATOM 0 HG2 MET B 564 55.906 11.834 17.873 1.00 0.00 H new ATOM 0 HG3 MET B 564 56.584 13.378 18.351 1.00 0.00 H new ATOM 0 HE1 MET B 564 58.446 10.892 20.668 1.00 0.00 H new ATOM 0 HE2 MET B 564 57.913 10.640 18.989 1.00 0.00 H new ATOM 0 HE3 MET B 564 58.571 12.217 19.487 1.00 0.00 H new ATOM 1898 N ALA B 565 52.829 15.280 16.276 1.00 0.00 N ATOM 1899 CA ALA B 565 51.896 16.435 16.104 1.00 0.00 C ATOM 1900 C ALA B 565 52.737 17.692 16.216 1.00 0.00 C ATOM 1901 O ALA B 565 52.292 18.788 15.939 1.00 0.00 O ATOM 1902 CB ALA B 565 50.782 16.478 17.153 1.00 0.00 C ATOM 0 H ALA B 565 53.456 15.150 15.482 1.00 0.00 H new ATOM 0 HA ALA B 565 51.398 16.342 15.139 1.00 0.00 H new ATOM 0 HB1 ALA B 565 50.142 17.341 16.969 1.00 0.00 H new ATOM 0 HB2 ALA B 565 50.188 15.566 17.091 1.00 0.00 H new ATOM 0 HB3 ALA B 565 51.221 16.558 18.147 1.00 0.00 H new ATOM 1908 N LYS B 566 53.973 17.531 16.607 1.00 0.00 N ATOM 1909 CA LYS B 566 54.872 18.704 16.722 1.00 0.00 C ATOM 1910 C LYS B 566 55.424 19.018 15.339 1.00 0.00 C ATOM 1911 O LYS B 566 55.401 18.188 14.461 1.00 0.00 O ATOM 1912 CB LYS B 566 56.034 18.356 17.663 1.00 0.00 C ATOM 1913 CG LYS B 566 55.713 18.806 19.090 1.00 0.00 C ATOM 1914 CD LYS B 566 56.671 18.114 20.074 1.00 0.00 C ATOM 1915 CE LYS B 566 56.092 16.755 20.498 1.00 0.00 C ATOM 1916 NZ LYS B 566 57.198 15.866 20.953 1.00 0.00 N ATOM 0 H LYS B 566 54.395 16.635 16.851 1.00 0.00 H new ATOM 0 HA LYS B 566 54.329 19.563 17.117 1.00 0.00 H new ATOM 0 HB2 LYS B 566 56.216 17.281 17.645 1.00 0.00 H new ATOM 0 HB3 LYS B 566 56.948 18.840 17.318 1.00 0.00 H new ATOM 0 HG2 LYS B 566 55.810 19.889 19.172 1.00 0.00 H new ATOM 0 HG3 LYS B 566 54.680 18.559 19.337 1.00 0.00 H new ATOM 0 HD2 LYS B 566 57.646 17.974 19.608 1.00 0.00 H new ATOM 0 HD3 LYS B 566 56.824 18.744 20.951 1.00 0.00 H new ATOM 0 HE2 LYS B 566 55.366 16.891 21.300 1.00 0.00 H new ATOM 0 HE3 LYS B 566 55.562 16.297 19.663 1.00 0.00 H new ATOM 0 HZ1 LYS B 566 56.808 14.946 21.240 1.00 0.00 H new ATOM 0 HZ2 LYS B 566 57.874 15.728 20.175 1.00 0.00 H new ATOM 0 HZ3 LYS B 566 57.685 16.303 21.761 1.00 0.00 H new ATOM 1930 N LYS B 567 55.940 20.201 15.151 1.00 0.00 N ATOM 1931 CA LYS B 567 56.524 20.577 13.834 1.00 0.00 C ATOM 1932 C LYS B 567 58.039 20.526 13.978 1.00 0.00 C ATOM 1933 O LYS B 567 58.549 20.305 15.058 1.00 0.00 O ATOM 1934 CB LYS B 567 56.059 21.985 13.454 1.00 0.00 C ATOM 1935 CG LYS B 567 54.609 22.202 13.921 1.00 0.00 C ATOM 1936 CD LYS B 567 53.662 21.169 13.278 1.00 0.00 C ATOM 1937 CE LYS B 567 53.646 21.353 11.759 1.00 0.00 C ATOM 1938 NZ LYS B 567 52.412 20.732 11.198 1.00 0.00 N ATOM 0 H LYS B 567 55.982 20.931 15.862 1.00 0.00 H new ATOM 0 HA LYS B 567 56.202 19.895 13.047 1.00 0.00 H new ATOM 0 HB2 LYS B 567 56.712 22.729 13.910 1.00 0.00 H new ATOM 0 HB3 LYS B 567 56.127 22.121 12.375 1.00 0.00 H new ATOM 0 HG2 LYS B 567 54.557 22.122 15.007 1.00 0.00 H new ATOM 0 HG3 LYS B 567 54.286 23.210 13.660 1.00 0.00 H new ATOM 0 HD2 LYS B 567 53.988 20.159 13.527 1.00 0.00 H new ATOM 0 HD3 LYS B 567 52.655 21.287 13.678 1.00 0.00 H new ATOM 0 HE2 LYS B 567 53.678 22.414 11.510 1.00 0.00 H new ATOM 0 HE3 LYS B 567 54.530 20.895 11.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 567 52.048 21.322 10.423 1.00 0.00 H new ATOM 0 HZ2 LYS B 567 52.635 19.783 10.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 567 51.691 20.657 11.944 1.00 0.00 H new ATOM 1952 N PHE B 568 58.778 20.708 12.923 1.00 0.00 N ATOM 1953 CA PHE B 568 60.258 20.637 13.079 1.00 0.00 C ATOM 1954 C PHE B 568 60.933 21.344 11.919 1.00 0.00 C ATOM 1955 O PHE B 568 60.561 21.179 10.775 1.00 0.00 O ATOM 1956 CB PHE B 568 60.698 19.145 13.100 1.00 0.00 C ATOM 1957 CG PHE B 568 61.430 18.817 14.390 1.00 0.00 C ATOM 1958 CD1 PHE B 568 62.530 19.588 14.783 1.00 0.00 C ATOM 1959 CD2 PHE B 568 61.008 17.743 15.188 1.00 0.00 C ATOM 1960 CE1 PHE B 568 63.209 19.288 15.971 1.00 0.00 C ATOM 1961 CE2 PHE B 568 61.687 17.444 16.376 1.00 0.00 C ATOM 1962 CZ PHE B 568 62.787 18.217 16.767 1.00 0.00 C ATOM 0 H PHE B 568 58.435 20.898 11.981 1.00 0.00 H new ATOM 0 HA PHE B 568 60.547 21.122 14.011 1.00 0.00 H new ATOM 0 HB2 PHE B 568 59.824 18.502 12.999 1.00 0.00 H new ATOM 0 HB3 PHE B 568 61.345 18.940 12.247 1.00 0.00 H new ATOM 0 HD1 PHE B 568 62.856 20.415 14.170 1.00 0.00 H new ATOM 0 HD2 PHE B 568 60.160 17.147 14.886 1.00 0.00 H new ATOM 0 HE1 PHE B 568 64.058 19.883 16.273 1.00 0.00 H new ATOM 0 HE2 PHE B 568 61.362 16.617 16.990 1.00 0.00 H new ATOM 0 HZ PHE B 568 63.310 17.987 17.683 1.00 0.00 H new ATOM 1972 N HIS B 569 61.962 22.086 12.196 1.00 0.00 N ATOM 1973 CA HIS B 569 62.689 22.739 11.089 1.00 0.00 C ATOM 1974 C HIS B 569 63.140 21.596 10.167 1.00 0.00 C ATOM 1975 O HIS B 569 63.894 20.748 10.601 1.00 0.00 O ATOM 1976 CB HIS B 569 63.932 23.451 11.638 1.00 0.00 C ATOM 1977 CG HIS B 569 63.602 24.849 12.076 1.00 0.00 C ATOM 1978 ND1 HIS B 569 63.738 25.241 13.395 1.00 0.00 N ATOM 1979 CD2 HIS B 569 63.185 25.960 11.389 1.00 0.00 C ATOM 1980 CE1 HIS B 569 63.416 26.544 13.463 1.00 0.00 C ATOM 1981 NE2 HIS B 569 63.069 27.033 12.268 1.00 0.00 N ATOM 0 H HIS B 569 62.326 22.266 13.132 1.00 0.00 H new ATOM 0 HA HIS B 569 62.068 23.472 10.574 1.00 0.00 H new ATOM 0 HB2 HIS B 569 64.336 22.888 12.480 1.00 0.00 H new ATOM 0 HB3 HIS B 569 64.707 23.479 10.872 1.00 0.00 H new ATOM 0 HD2 HIS B 569 62.978 25.997 10.330 1.00 0.00 H new ATOM 0 HE1 HIS B 569 63.435 27.126 14.373 1.00 0.00 H new ATOM 0 HE2 HIS B 569 62.781 27.987 12.048 1.00 0.00 H new ATOM 1988 N PRO B 570 62.694 21.523 8.936 1.00 0.00 N ATOM 1989 CA PRO B 570 63.122 20.404 8.059 1.00 0.00 C ATOM 1990 C PRO B 570 64.639 20.156 8.148 1.00 0.00 C ATOM 1991 O PRO B 570 65.148 19.172 7.653 1.00 0.00 O ATOM 1992 CB PRO B 570 62.682 20.909 6.680 1.00 0.00 C ATOM 1993 CG PRO B 570 61.556 21.926 6.920 1.00 0.00 C ATOM 1994 CD PRO B 570 61.758 22.507 8.324 1.00 0.00 C ATOM 0 HA PRO B 570 62.692 19.437 8.322 1.00 0.00 H new ATOM 0 HB2 PRO B 570 63.516 21.373 6.154 1.00 0.00 H new ATOM 0 HB3 PRO B 570 62.332 20.084 6.059 1.00 0.00 H new ATOM 0 HG2 PRO B 570 61.585 22.716 6.169 1.00 0.00 H new ATOM 0 HG3 PRO B 570 60.581 21.446 6.840 1.00 0.00 H new ATOM 0 HD2 PRO B 570 62.184 23.510 8.293 1.00 0.00 H new ATOM 0 HD3 PRO B 570 60.820 22.576 8.876 1.00 0.00 H new ATOM 2002 N GLU B 571 65.359 21.045 8.796 1.00 0.00 N ATOM 2003 CA GLU B 571 66.835 20.880 8.944 1.00 0.00 C ATOM 2004 C GLU B 571 67.163 20.319 10.334 1.00 0.00 C ATOM 2005 O GLU B 571 67.862 19.344 10.486 1.00 0.00 O ATOM 2006 CB GLU B 571 67.493 22.256 8.800 1.00 0.00 C ATOM 2007 CG GLU B 571 66.751 23.046 7.732 1.00 0.00 C ATOM 2008 CD GLU B 571 67.565 24.281 7.342 1.00 0.00 C ATOM 2009 OE1 GLU B 571 68.145 24.269 6.268 1.00 0.00 O ATOM 2010 OE2 GLU B 571 67.595 25.217 8.123 1.00 0.00 O ATOM 0 H GLU B 571 64.978 21.885 9.232 1.00 0.00 H new ATOM 0 HA GLU B 571 67.204 20.193 8.183 1.00 0.00 H new ATOM 0 HB2 GLU B 571 67.465 22.789 9.751 1.00 0.00 H new ATOM 0 HB3 GLU B 571 68.542 22.146 8.527 1.00 0.00 H new ATOM 0 HG2 GLU B 571 66.581 22.420 6.856 1.00 0.00 H new ATOM 0 HG3 GLU B 571 65.772 23.347 8.104 1.00 0.00 H new ATOM 2017 N HIS B 572 66.666 20.940 11.353 1.00 0.00 N ATOM 2018 CA HIS B 572 66.965 20.449 12.733 1.00 0.00 C ATOM 2019 C HIS B 572 66.503 18.999 12.881 1.00 0.00 C ATOM 2020 O HIS B 572 66.732 18.365 13.892 1.00 0.00 O ATOM 2021 CB HIS B 572 66.285 21.365 13.758 1.00 0.00 C ATOM 2022 CG HIS B 572 66.704 22.786 13.447 1.00 0.00 C ATOM 2023 ND1 HIS B 572 65.996 23.930 13.844 1.00 0.00 N ATOM 2024 CD2 HIS B 572 67.793 23.259 12.749 1.00 0.00 C ATOM 2025 CE1 HIS B 572 66.675 24.997 13.379 1.00 0.00 C ATOM 2026 NE2 HIS B 572 67.769 24.645 12.710 1.00 0.00 N ATOM 0 H HIS B 572 66.067 21.764 11.302 1.00 0.00 H new ATOM 0 HA HIS B 572 68.040 20.475 12.913 1.00 0.00 H new ATOM 0 HB2 HIS B 572 65.201 21.264 13.703 1.00 0.00 H new ATOM 0 HB3 HIS B 572 66.579 21.092 14.771 1.00 0.00 H new ATOM 0 HD2 HIS B 572 68.555 22.641 12.298 1.00 0.00 H new ATOM 0 HE1 HIS B 572 66.366 26.021 13.532 1.00 0.00 H new ATOM 0 HE2 HIS B 572 68.446 25.263 12.263 1.00 0.00 H new ATOM 2033 N PHE B 573 65.887 18.460 11.860 1.00 0.00 N ATOM 2034 CA PHE B 573 65.436 17.033 11.894 1.00 0.00 C ATOM 2035 C PHE B 573 65.983 16.339 10.641 1.00 0.00 C ATOM 2036 O PHE B 573 65.249 15.822 9.822 1.00 0.00 O ATOM 2037 CB PHE B 573 63.912 16.986 11.894 1.00 0.00 C ATOM 2038 CG PHE B 573 63.435 15.620 12.334 1.00 0.00 C ATOM 2039 CD1 PHE B 573 63.410 15.290 13.695 1.00 0.00 C ATOM 2040 CD2 PHE B 573 63.014 14.684 11.380 1.00 0.00 C ATOM 2041 CE1 PHE B 573 62.967 14.026 14.101 1.00 0.00 C ATOM 2042 CE2 PHE B 573 62.571 13.420 11.787 1.00 0.00 C ATOM 2043 CZ PHE B 573 62.547 13.091 13.148 1.00 0.00 C ATOM 0 H PHE B 573 65.674 18.953 10.993 1.00 0.00 H new ATOM 0 HA PHE B 573 65.801 16.532 12.791 1.00 0.00 H new ATOM 0 HB2 PHE B 573 63.517 17.751 12.563 1.00 0.00 H new ATOM 0 HB3 PHE B 573 63.533 17.208 10.896 1.00 0.00 H new ATOM 0 HD1 PHE B 573 63.733 16.011 14.431 1.00 0.00 H new ATOM 0 HD2 PHE B 573 63.031 14.938 10.330 1.00 0.00 H new ATOM 0 HE1 PHE B 573 62.949 13.772 15.151 1.00 0.00 H new ATOM 0 HE2 PHE B 573 62.248 12.698 11.051 1.00 0.00 H new ATOM 0 HZ PHE B 573 62.205 12.116 13.462 1.00 0.00 H new ATOM 2053 N VAL B 574 67.277 16.368 10.483 1.00 0.00 N ATOM 2054 CA VAL B 574 67.933 15.764 9.283 1.00 0.00 C ATOM 2055 C VAL B 574 68.393 14.317 9.561 1.00 0.00 C ATOM 2056 O VAL B 574 68.272 13.808 10.657 1.00 0.00 O ATOM 2057 CB VAL B 574 69.174 16.585 8.935 1.00 0.00 C ATOM 2058 CG1 VAL B 574 68.764 17.969 8.383 1.00 0.00 C ATOM 2059 CG2 VAL B 574 70.034 16.739 10.199 1.00 0.00 C ATOM 0 H VAL B 574 67.923 16.793 11.148 1.00 0.00 H new ATOM 0 HA VAL B 574 67.209 15.760 8.468 1.00 0.00 H new ATOM 0 HB VAL B 574 69.750 16.075 8.163 1.00 0.00 H new ATOM 0 HG11 VAL B 574 69.658 18.543 8.139 1.00 0.00 H new ATOM 0 HG12 VAL B 574 68.161 17.838 7.485 1.00 0.00 H new ATOM 0 HG13 VAL B 574 68.184 18.503 9.135 1.00 0.00 H new ATOM 0 HG21 VAL B 574 70.924 17.323 9.965 1.00 0.00 H new ATOM 0 HG22 VAL B 574 69.458 17.249 10.971 1.00 0.00 H new ATOM 0 HG23 VAL B 574 70.331 15.754 10.559 1.00 0.00 H new ATOM 2069 N CYS B 575 68.944 13.671 8.557 1.00 0.00 N ATOM 2070 CA CYS B 575 69.456 12.265 8.712 1.00 0.00 C ATOM 2071 C CYS B 575 70.791 12.330 9.421 1.00 0.00 C ATOM 2072 O CYS B 575 71.541 13.263 9.214 1.00 0.00 O ATOM 2073 CB CYS B 575 69.620 11.635 7.307 1.00 0.00 C ATOM 2074 SG CYS B 575 71.256 10.862 7.082 1.00 0.00 S ATOM 0 H CYS B 575 69.063 14.063 7.623 1.00 0.00 H new ATOM 0 HA CYS B 575 68.763 11.655 9.291 1.00 0.00 H new ATOM 0 HB2 CYS B 575 68.843 10.886 7.154 1.00 0.00 H new ATOM 0 HB3 CYS B 575 69.476 12.404 6.548 1.00 0.00 H new ATOM 2079 N ALA B 576 71.131 11.361 10.247 1.00 0.00 N ATOM 2080 CA ALA B 576 72.467 11.479 10.903 1.00 0.00 C ATOM 2081 C ALA B 576 73.515 10.684 10.107 1.00 0.00 C ATOM 2082 O ALA B 576 74.054 9.693 10.551 1.00 0.00 O ATOM 2083 CB ALA B 576 72.353 10.892 12.319 1.00 0.00 C ATOM 0 H ALA B 576 70.574 10.540 10.483 1.00 0.00 H new ATOM 0 HA ALA B 576 72.774 12.524 10.941 1.00 0.00 H new ATOM 0 HB1 ALA B 576 73.317 10.966 12.822 1.00 0.00 H new ATOM 0 HB2 ALA B 576 71.605 11.448 12.884 1.00 0.00 H new ATOM 0 HB3 ALA B 576 72.055 9.845 12.256 1.00 0.00 H new ATOM 2089 N PHE B 577 73.890 11.247 8.993 1.00 0.00 N ATOM 2090 CA PHE B 577 75.005 10.748 8.131 1.00 0.00 C ATOM 2091 C PHE B 577 75.452 12.018 7.428 1.00 0.00 C ATOM 2092 O PHE B 577 76.531 12.546 7.609 1.00 0.00 O ATOM 2093 CB PHE B 577 74.554 9.686 7.104 1.00 0.00 C ATOM 2094 CG PHE B 577 75.752 9.026 6.386 1.00 0.00 C ATOM 2095 CD1 PHE B 577 75.524 7.894 5.576 1.00 0.00 C ATOM 2096 CD2 PHE B 577 77.080 9.521 6.500 1.00 0.00 C ATOM 2097 CE1 PHE B 577 76.584 7.276 4.902 1.00 0.00 C ATOM 2098 CE2 PHE B 577 78.127 8.888 5.820 1.00 0.00 C ATOM 2099 CZ PHE B 577 77.879 7.771 5.025 1.00 0.00 C ATOM 0 H PHE B 577 73.441 12.085 8.623 1.00 0.00 H new ATOM 0 HA PHE B 577 75.781 10.244 8.707 1.00 0.00 H new ATOM 0 HB2 PHE B 577 73.968 8.919 7.610 1.00 0.00 H new ATOM 0 HB3 PHE B 577 73.901 10.151 6.366 1.00 0.00 H new ATOM 0 HD1 PHE B 577 74.523 7.501 5.475 1.00 0.00 H new ATOM 0 HD2 PHE B 577 77.281 10.387 7.113 1.00 0.00 H new ATOM 0 HE1 PHE B 577 76.396 6.411 4.284 1.00 0.00 H new ATOM 0 HE2 PHE B 577 79.134 9.268 5.912 1.00 0.00 H new ATOM 0 HZ PHE B 577 78.693 7.289 4.504 1.00 0.00 H new ATOM 2109 N CYS B 578 74.513 12.520 6.658 1.00 0.00 N ATOM 2110 CA CYS B 578 74.656 13.793 5.912 1.00 0.00 C ATOM 2111 C CYS B 578 73.633 14.740 6.540 1.00 0.00 C ATOM 2112 O CYS B 578 72.528 14.897 6.072 1.00 0.00 O ATOM 2113 CB CYS B 578 74.324 13.569 4.435 1.00 0.00 C ATOM 2114 SG CYS B 578 72.634 12.928 4.273 1.00 0.00 S ATOM 0 H CYS B 578 73.611 12.066 6.517 1.00 0.00 H new ATOM 0 HA CYS B 578 75.669 14.191 5.965 1.00 0.00 H new ATOM 0 HB2 CYS B 578 74.422 14.505 3.885 1.00 0.00 H new ATOM 0 HB3 CYS B 578 75.033 12.866 3.996 1.00 0.00 H new ATOM 2119 N LEU B 579 73.988 15.302 7.645 1.00 0.00 N ATOM 2120 CA LEU B 579 73.067 16.187 8.407 1.00 0.00 C ATOM 2121 C LEU B 579 72.466 17.327 7.564 1.00 0.00 C ATOM 2122 O LEU B 579 71.983 18.289 8.128 1.00 0.00 O ATOM 2123 CB LEU B 579 73.853 16.777 9.586 1.00 0.00 C ATOM 2124 CG LEU B 579 74.412 15.626 10.483 1.00 0.00 C ATOM 2125 CD1 LEU B 579 75.940 15.552 10.372 1.00 0.00 C ATOM 2126 CD2 LEU B 579 74.038 15.861 11.954 1.00 0.00 C ATOM 0 H LEU B 579 74.907 15.185 8.072 1.00 0.00 H new ATOM 0 HA LEU B 579 72.222 15.583 8.739 1.00 0.00 H new ATOM 0 HB2 LEU B 579 74.673 17.392 9.216 1.00 0.00 H new ATOM 0 HB3 LEU B 579 73.207 17.428 10.175 1.00 0.00 H new ATOM 0 HG LEU B 579 73.973 14.690 10.137 1.00 0.00 H new ATOM 0 HD11 LEU B 579 76.312 14.745 11.003 1.00 0.00 H new ATOM 0 HD12 LEU B 579 76.221 15.361 9.336 1.00 0.00 H new ATOM 0 HD13 LEU B 579 76.375 16.497 10.698 1.00 0.00 H new ATOM 0 HD21 LEU B 579 74.435 15.050 12.564 1.00 0.00 H new ATOM 0 HD22 LEU B 579 74.460 16.808 12.290 1.00 0.00 H new ATOM 0 HD23 LEU B 579 72.953 15.892 12.053 1.00 0.00 H new ATOM 2138 N LYS B 580 72.491 17.287 6.242 1.00 0.00 N ATOM 2139 CA LYS B 580 71.909 18.460 5.498 1.00 0.00 C ATOM 2140 C LYS B 580 70.394 18.310 5.241 1.00 0.00 C ATOM 2141 O LYS B 580 69.679 19.291 5.309 1.00 0.00 O ATOM 2142 CB LYS B 580 72.677 18.650 4.156 1.00 0.00 C ATOM 2143 CG LYS B 580 72.029 17.900 2.966 1.00 0.00 C ATOM 2144 CD LYS B 580 72.188 16.387 3.147 1.00 0.00 C ATOM 2145 CE LYS B 580 71.121 15.652 2.336 1.00 0.00 C ATOM 2146 NZ LYS B 580 70.924 16.343 1.030 1.00 0.00 N ATOM 0 H LYS B 580 72.870 16.531 5.671 1.00 0.00 H new ATOM 0 HA LYS B 580 72.028 19.344 6.124 1.00 0.00 H new ATOM 0 HB2 LYS B 580 72.727 19.713 3.922 1.00 0.00 H new ATOM 0 HB3 LYS B 580 73.703 18.302 4.280 1.00 0.00 H new ATOM 0 HG2 LYS B 580 70.972 18.157 2.897 1.00 0.00 H new ATOM 0 HG3 LYS B 580 72.495 18.213 2.032 1.00 0.00 H new ATOM 0 HD2 LYS B 580 73.181 16.076 2.824 1.00 0.00 H new ATOM 0 HD3 LYS B 580 72.099 16.127 4.202 1.00 0.00 H new ATOM 0 HE2 LYS B 580 71.423 14.618 2.170 1.00 0.00 H new ATOM 0 HE3 LYS B 580 70.183 15.625 2.890 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 70.507 15.680 0.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 70.286 17.154 1.159 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 71.841 16.678 0.673 1.00 0.00 H new ATOM 2160 N GLN B 581 69.855 17.135 4.971 1.00 0.00 N ATOM 2161 CA GLN B 581 68.363 17.084 4.763 1.00 0.00 C ATOM 2162 C GLN B 581 67.727 15.700 4.943 1.00 0.00 C ATOM 2163 O GLN B 581 68.219 14.695 4.470 1.00 0.00 O ATOM 2164 CB GLN B 581 68.000 17.644 3.393 1.00 0.00 C ATOM 2165 CG GLN B 581 66.491 17.909 3.328 1.00 0.00 C ATOM 2166 CD GLN B 581 66.142 19.147 4.148 1.00 0.00 C ATOM 2167 OE1 GLN B 581 65.957 20.219 3.606 1.00 0.00 O ATOM 2168 NE2 GLN B 581 66.045 19.046 5.441 1.00 0.00 N ATOM 0 H GLN B 581 70.355 16.250 4.889 1.00 0.00 H new ATOM 0 HA GLN B 581 67.947 17.703 5.558 1.00 0.00 H new ATOM 0 HB2 GLN B 581 68.550 18.567 3.209 1.00 0.00 H new ATOM 0 HB3 GLN B 581 68.290 16.940 2.613 1.00 0.00 H new ATOM 0 HG2 GLN B 581 66.183 18.050 2.292 1.00 0.00 H new ATOM 0 HG3 GLN B 581 65.945 17.045 3.708 1.00 0.00 H new ATOM 0 HE21 GLN B 581 66.200 18.146 5.895 1.00 0.00 H new ATOM 0 HE22 GLN B 581 65.814 19.867 6.001 1.00 0.00 H new ATOM 2177 N LEU B 582 66.575 15.686 5.567 1.00 0.00 N ATOM 2178 CA LEU B 582 65.781 14.434 5.746 1.00 0.00 C ATOM 2179 C LEU B 582 64.290 14.764 5.573 1.00 0.00 C ATOM 2180 O LEU B 582 63.902 15.915 5.540 1.00 0.00 O ATOM 2181 CB LEU B 582 66.019 13.898 7.144 1.00 0.00 C ATOM 2182 CG LEU B 582 65.553 12.443 7.281 1.00 0.00 C ATOM 2183 CD1 LEU B 582 66.342 11.529 6.315 1.00 0.00 C ATOM 2184 CD2 LEU B 582 65.767 12.006 8.738 1.00 0.00 C ATOM 0 H LEU B 582 66.141 16.516 5.971 1.00 0.00 H new ATOM 0 HA LEU B 582 66.081 13.688 5.010 1.00 0.00 H new ATOM 0 HB2 LEU B 582 67.080 13.964 7.383 1.00 0.00 H new ATOM 0 HB3 LEU B 582 65.490 14.519 7.867 1.00 0.00 H new ATOM 0 HG LEU B 582 64.497 12.362 7.021 1.00 0.00 H new ATOM 0 HD11 LEU B 582 65.999 10.500 6.425 1.00 0.00 H new ATOM 0 HD12 LEU B 582 66.179 11.858 5.289 1.00 0.00 H new ATOM 0 HD13 LEU B 582 67.405 11.584 6.549 1.00 0.00 H new ATOM 0 HD21 LEU B 582 65.442 10.973 8.859 1.00 0.00 H new ATOM 0 HD22 LEU B 582 66.824 12.086 8.990 1.00 0.00 H new ATOM 0 HD23 LEU B 582 65.187 12.649 9.400 1.00 0.00 H new ATOM 2196 N ASN B 583 63.453 13.765 5.472 1.00 0.00 N ATOM 2197 CA ASN B 583 61.986 14.011 5.309 1.00 0.00 C ATOM 2198 C ASN B 583 61.209 12.873 5.981 1.00 0.00 C ATOM 2199 O ASN B 583 61.581 11.720 5.895 1.00 0.00 O ATOM 2200 CB ASN B 583 61.637 14.057 3.812 1.00 0.00 C ATOM 2201 CG ASN B 583 61.915 15.447 3.246 1.00 0.00 C ATOM 2202 OD1 ASN B 583 62.199 16.374 3.977 1.00 0.00 O ATOM 2203 ND2 ASN B 583 61.839 15.629 1.961 1.00 0.00 N ATOM 0 H ASN B 583 63.723 12.782 5.495 1.00 0.00 H new ATOM 0 HA ASN B 583 61.719 14.961 5.771 1.00 0.00 H new ATOM 0 HB2 ASN B 583 62.223 13.313 3.272 1.00 0.00 H new ATOM 0 HB3 ASN B 583 60.587 13.802 3.668 1.00 0.00 H new ATOM 0 HD21 ASN B 583 62.018 16.552 1.565 1.00 0.00 H new ATOM 0 HD22 ASN B 583 61.600 14.849 1.349 1.00 0.00 H new ATOM 2210 N LYS B 584 60.129 13.192 6.643 1.00 0.00 N ATOM 2211 CA LYS B 584 59.318 12.144 7.318 1.00 0.00 C ATOM 2212 C LYS B 584 58.871 11.106 6.297 1.00 0.00 C ATOM 2213 O LYS B 584 58.497 10.000 6.634 1.00 0.00 O ATOM 2214 CB LYS B 584 58.082 12.803 7.920 1.00 0.00 C ATOM 2215 CG LYS B 584 57.412 13.709 6.857 1.00 0.00 C ATOM 2216 CD LYS B 584 55.905 13.820 7.114 1.00 0.00 C ATOM 2217 CE LYS B 584 55.653 14.724 8.320 1.00 0.00 C ATOM 2218 NZ LYS B 584 55.905 16.139 7.931 1.00 0.00 N ATOM 0 H LYS B 584 59.773 14.143 6.744 1.00 0.00 H new ATOM 0 HA LYS B 584 59.912 11.660 8.093 1.00 0.00 H new ATOM 0 HB2 LYS B 584 57.380 12.042 8.260 1.00 0.00 H new ATOM 0 HB3 LYS B 584 58.360 13.393 8.793 1.00 0.00 H new ATOM 0 HG2 LYS B 584 57.864 14.701 6.880 1.00 0.00 H new ATOM 0 HG3 LYS B 584 57.587 13.301 5.861 1.00 0.00 H new ATOM 0 HD2 LYS B 584 55.405 14.224 6.234 1.00 0.00 H new ATOM 0 HD3 LYS B 584 55.483 12.831 7.294 1.00 0.00 H new ATOM 0 HE2 LYS B 584 54.627 14.607 8.669 1.00 0.00 H new ATOM 0 HE3 LYS B 584 56.305 14.439 9.146 1.00 0.00 H new ATOM 0 HZ1 LYS B 584 55.272 16.765 8.469 1.00 0.00 H new ATOM 0 HZ2 LYS B 584 56.894 16.385 8.138 1.00 0.00 H new ATOM 0 HZ3 LYS B 584 55.725 16.257 6.913 1.00 0.00 H new ATOM 2232 N GLY B 585 58.894 11.467 5.048 1.00 0.00 N ATOM 2233 CA GLY B 585 58.460 10.528 3.982 1.00 0.00 C ATOM 2234 C GLY B 585 59.645 9.696 3.537 1.00 0.00 C ATOM 2235 O GLY B 585 59.498 8.666 2.910 1.00 0.00 O ATOM 0 H GLY B 585 59.198 12.382 4.717 1.00 0.00 H new ATOM 0 HA2 GLY B 585 57.665 9.881 4.353 1.00 0.00 H new ATOM 0 HA3 GLY B 585 58.052 11.082 3.137 1.00 0.00 H new ATOM 2239 N THR B 586 60.823 10.144 3.858 1.00 0.00 N ATOM 2240 CA THR B 586 62.054 9.401 3.465 1.00 0.00 C ATOM 2241 C THR B 586 62.985 9.293 4.665 1.00 0.00 C ATOM 2242 O THR B 586 64.183 9.154 4.519 1.00 0.00 O ATOM 2243 CB THR B 586 62.752 10.156 2.335 1.00 0.00 C ATOM 2244 OG1 THR B 586 63.572 11.177 2.887 1.00 0.00 O ATOM 2245 CG2 THR B 586 61.694 10.781 1.425 1.00 0.00 C ATOM 0 H THR B 586 60.990 11.003 4.382 1.00 0.00 H new ATOM 0 HA THR B 586 61.790 8.399 3.126 1.00 0.00 H new ATOM 0 HB THR B 586 63.372 9.470 1.757 1.00 0.00 H new ATOM 0 HG1 THR B 586 64.022 11.662 2.164 1.00 0.00 H new ATOM 0 HG21 THR B 586 62.184 11.322 0.615 1.00 0.00 H new ATOM 0 HG22 THR B 586 61.064 9.996 1.007 1.00 0.00 H new ATOM 0 HG23 THR B 586 61.079 11.471 2.003 1.00 0.00 H new ATOM 2253 N PHE B 587 62.449 9.350 5.859 1.00 0.00 N ATOM 2254 CA PHE B 587 63.329 9.242 7.066 1.00 0.00 C ATOM 2255 C PHE B 587 63.458 7.776 7.470 1.00 0.00 C ATOM 2256 O PHE B 587 62.516 7.133 7.889 1.00 0.00 O ATOM 2257 CB PHE B 587 62.750 10.089 8.224 1.00 0.00 C ATOM 2258 CG PHE B 587 62.467 9.259 9.465 1.00 0.00 C ATOM 2259 CD1 PHE B 587 61.227 8.627 9.619 1.00 0.00 C ATOM 2260 CD2 PHE B 587 63.447 9.129 10.455 1.00 0.00 C ATOM 2261 CE1 PHE B 587 60.968 7.864 10.764 1.00 0.00 C ATOM 2262 CE2 PHE B 587 63.189 8.366 11.600 1.00 0.00 C ATOM 2263 CZ PHE B 587 61.949 7.733 11.755 1.00 0.00 C ATOM 0 H PHE B 587 61.454 9.465 6.050 1.00 0.00 H new ATOM 0 HA PHE B 587 64.321 9.628 6.832 1.00 0.00 H new ATOM 0 HB2 PHE B 587 63.452 10.884 8.475 1.00 0.00 H new ATOM 0 HB3 PHE B 587 61.829 10.569 7.894 1.00 0.00 H new ATOM 0 HD1 PHE B 587 60.471 8.728 8.855 1.00 0.00 H new ATOM 0 HD2 PHE B 587 64.403 9.617 10.336 1.00 0.00 H new ATOM 0 HE1 PHE B 587 60.012 7.376 10.883 1.00 0.00 H new ATOM 0 HE2 PHE B 587 63.946 8.265 12.364 1.00 0.00 H new ATOM 0 HZ PHE B 587 61.750 7.144 12.638 1.00 0.00 H new ATOM 2273 N LYS B 588 64.641 7.274 7.355 1.00 0.00 N ATOM 2274 CA LYS B 588 64.939 5.866 7.726 1.00 0.00 C ATOM 2275 C LYS B 588 65.720 5.911 9.044 1.00 0.00 C ATOM 2276 O LYS B 588 66.149 6.962 9.473 1.00 0.00 O ATOM 2277 CB LYS B 588 65.774 5.249 6.578 1.00 0.00 C ATOM 2278 CG LYS B 588 65.272 3.850 6.131 1.00 0.00 C ATOM 2279 CD LYS B 588 63.744 3.758 5.880 1.00 0.00 C ATOM 2280 CE LYS B 588 63.163 5.047 5.278 1.00 0.00 C ATOM 2281 NZ LYS B 588 62.023 4.699 4.383 1.00 0.00 N ATOM 0 H LYS B 588 65.446 7.795 7.008 1.00 0.00 H new ATOM 0 HA LYS B 588 64.045 5.257 7.864 1.00 0.00 H new ATOM 0 HB2 LYS B 588 65.755 5.924 5.722 1.00 0.00 H new ATOM 0 HB3 LYS B 588 66.813 5.169 6.898 1.00 0.00 H new ATOM 0 HG2 LYS B 588 65.794 3.567 5.217 1.00 0.00 H new ATOM 0 HG3 LYS B 588 65.546 3.120 6.893 1.00 0.00 H new ATOM 0 HD2 LYS B 588 63.540 2.924 5.208 1.00 0.00 H new ATOM 0 HD3 LYS B 588 63.238 3.541 6.821 1.00 0.00 H new ATOM 0 HE2 LYS B 588 62.827 5.714 6.072 1.00 0.00 H new ATOM 0 HE3 LYS B 588 63.931 5.580 4.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 588 61.626 5.568 3.973 1.00 0.00 H new ATOM 0 HZ2 LYS B 588 62.358 4.078 3.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 588 61.288 4.208 4.932 1.00 0.00 H new ATOM 2295 N GLU B 589 65.882 4.805 9.714 1.00 0.00 N ATOM 2296 CA GLU B 589 66.609 4.848 11.019 1.00 0.00 C ATOM 2297 C GLU B 589 67.265 3.507 11.333 1.00 0.00 C ATOM 2298 O GLU B 589 66.868 2.457 10.868 1.00 0.00 O ATOM 2299 CB GLU B 589 65.613 5.229 12.130 1.00 0.00 C ATOM 2300 CG GLU B 589 66.127 4.807 13.515 1.00 0.00 C ATOM 2301 CD GLU B 589 65.270 5.473 14.593 1.00 0.00 C ATOM 2302 OE1 GLU B 589 65.722 6.456 15.157 1.00 0.00 O ATOM 2303 OE2 GLU B 589 64.177 4.990 14.836 1.00 0.00 O ATOM 0 H GLU B 589 65.550 3.885 9.423 1.00 0.00 H new ATOM 0 HA GLU B 589 67.402 5.593 10.958 1.00 0.00 H new ATOM 0 HB2 GLU B 589 65.445 6.306 12.116 1.00 0.00 H new ATOM 0 HB3 GLU B 589 64.651 4.753 11.937 1.00 0.00 H new ATOM 0 HG2 GLU B 589 66.084 3.723 13.617 1.00 0.00 H new ATOM 0 HG3 GLU B 589 67.171 5.097 13.633 1.00 0.00 H new ATOM 2310 N GLN B 590 68.256 3.572 12.164 1.00 0.00 N ATOM 2311 CA GLN B 590 68.986 2.369 12.612 1.00 0.00 C ATOM 2312 C GLN B 590 69.631 2.728 13.947 1.00 0.00 C ATOM 2313 O GLN B 590 70.026 3.856 14.164 1.00 0.00 O ATOM 2314 CB GLN B 590 70.071 1.975 11.592 1.00 0.00 C ATOM 2315 CG GLN B 590 70.420 0.475 11.742 1.00 0.00 C ATOM 2316 CD GLN B 590 69.588 -0.366 10.766 1.00 0.00 C ATOM 2317 OE1 GLN B 590 68.393 -0.510 10.934 1.00 0.00 O ATOM 2318 NE2 GLN B 590 70.180 -0.933 9.749 1.00 0.00 N ATOM 0 H GLN B 590 68.602 4.444 12.565 1.00 0.00 H new ATOM 0 HA GLN B 590 68.309 1.520 12.709 1.00 0.00 H new ATOM 0 HB2 GLN B 590 69.720 2.175 10.580 1.00 0.00 H new ATOM 0 HB3 GLN B 590 70.964 2.581 11.746 1.00 0.00 H new ATOM 0 HG2 GLN B 590 71.482 0.321 11.551 1.00 0.00 H new ATOM 0 HG3 GLN B 590 70.230 0.151 12.765 1.00 0.00 H new ATOM 0 HE21 GLN B 590 71.183 -0.811 9.610 1.00 0.00 H new ATOM 0 HE22 GLN B 590 69.639 -1.498 9.094 1.00 0.00 H new ATOM 2327 N ASN B 591 69.742 1.798 14.845 1.00 0.00 N ATOM 2328 CA ASN B 591 70.358 2.108 16.167 1.00 0.00 C ATOM 2329 C ASN B 591 69.753 3.411 16.727 1.00 0.00 C ATOM 2330 O ASN B 591 70.352 4.066 17.552 1.00 0.00 O ATOM 2331 CB ASN B 591 71.904 2.229 16.037 1.00 0.00 C ATOM 2332 CG ASN B 591 72.319 2.382 14.577 1.00 0.00 C ATOM 2333 OD1 ASN B 591 72.971 3.339 14.210 1.00 0.00 O ATOM 2334 ND2 ASN B 591 71.963 1.469 13.729 1.00 0.00 N ATOM 0 H ASN B 591 69.434 0.833 14.725 1.00 0.00 H new ATOM 0 HA ASN B 591 70.144 1.293 16.859 1.00 0.00 H new ATOM 0 HB2 ASN B 591 72.255 3.087 16.610 1.00 0.00 H new ATOM 0 HB3 ASN B 591 72.379 1.345 16.463 1.00 0.00 H new ATOM 0 HD21 ASN B 591 72.230 1.552 12.748 1.00 0.00 H new ATOM 0 HD22 ASN B 591 71.416 0.667 14.042 1.00 0.00 H new ATOM 2341 N ASP B 592 68.559 3.766 16.292 1.00 0.00 N ATOM 2342 CA ASP B 592 67.866 5.005 16.797 1.00 0.00 C ATOM 2343 C ASP B 592 68.379 6.252 16.075 1.00 0.00 C ATOM 2344 O ASP B 592 67.884 7.344 16.277 1.00 0.00 O ATOM 2345 CB ASP B 592 68.100 5.178 18.302 1.00 0.00 C ATOM 2346 CG ASP B 592 68.083 3.812 18.993 1.00 0.00 C ATOM 2347 OD1 ASP B 592 68.917 3.594 19.855 1.00 0.00 O ATOM 2348 OD2 ASP B 592 67.235 3.006 18.645 1.00 0.00 O ATOM 0 H ASP B 592 68.028 3.241 15.597 1.00 0.00 H new ATOM 0 HA ASP B 592 66.800 4.886 16.601 1.00 0.00 H new ATOM 0 HB2 ASP B 592 69.056 5.671 18.476 1.00 0.00 H new ATOM 0 HB3 ASP B 592 67.329 5.820 18.727 1.00 0.00 H new ATOM 2353 N LYS B 593 69.374 6.108 15.259 1.00 0.00 N ATOM 2354 CA LYS B 593 69.934 7.284 14.548 1.00 0.00 C ATOM 2355 C LYS B 593 69.175 7.511 13.224 1.00 0.00 C ATOM 2356 O LYS B 593 69.209 6.658 12.359 1.00 0.00 O ATOM 2357 CB LYS B 593 71.390 6.986 14.228 1.00 0.00 C ATOM 2358 CG LYS B 593 72.144 6.584 15.506 1.00 0.00 C ATOM 2359 CD LYS B 593 73.641 6.871 15.334 1.00 0.00 C ATOM 2360 CE LYS B 593 74.378 6.554 16.635 1.00 0.00 C ATOM 2361 NZ LYS B 593 74.029 7.574 17.664 1.00 0.00 N ATOM 0 H LYS B 593 69.829 5.219 15.050 1.00 0.00 H new ATOM 0 HA LYS B 593 69.841 8.173 15.171 1.00 0.00 H new ATOM 0 HB2 LYS B 593 71.451 6.183 13.493 1.00 0.00 H new ATOM 0 HB3 LYS B 593 71.858 7.863 13.782 1.00 0.00 H new ATOM 0 HG2 LYS B 593 71.753 7.138 16.360 1.00 0.00 H new ATOM 0 HG3 LYS B 593 71.988 5.525 15.714 1.00 0.00 H new ATOM 0 HD2 LYS B 593 74.045 6.270 14.520 1.00 0.00 H new ATOM 0 HD3 LYS B 593 73.792 7.916 15.064 1.00 0.00 H new ATOM 0 HE2 LYS B 593 74.106 5.559 16.987 1.00 0.00 H new ATOM 0 HE3 LYS B 593 75.454 6.548 16.464 1.00 0.00 H new ATOM 0 HZ1 LYS B 593 74.735 7.552 18.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 593 74.020 8.518 17.228 1.00 0.00 H new ATOM 0 HZ3 LYS B 593 73.089 7.364 18.056 1.00 0.00 H new ATOM 2375 N PRO B 594 68.507 8.637 13.029 1.00 0.00 N ATOM 2376 CA PRO B 594 67.790 8.867 11.744 1.00 0.00 C ATOM 2377 C PRO B 594 68.688 8.594 10.533 1.00 0.00 C ATOM 2378 O PRO B 594 69.893 8.509 10.655 1.00 0.00 O ATOM 2379 CB PRO B 594 67.422 10.351 11.849 1.00 0.00 C ATOM 2380 CG PRO B 594 67.457 10.730 13.331 1.00 0.00 C ATOM 2381 CD PRO B 594 68.402 9.741 14.033 1.00 0.00 C ATOM 0 HA PRO B 594 66.933 8.209 11.598 1.00 0.00 H new ATOM 0 HB2 PRO B 594 68.124 10.961 11.281 1.00 0.00 H new ATOM 0 HB3 PRO B 594 66.432 10.531 11.431 1.00 0.00 H new ATOM 0 HG2 PRO B 594 67.809 11.754 13.458 1.00 0.00 H new ATOM 0 HG3 PRO B 594 66.458 10.680 13.764 1.00 0.00 H new ATOM 0 HD2 PRO B 594 69.372 10.188 14.249 1.00 0.00 H new ATOM 0 HD3 PRO B 594 67.994 9.391 14.981 1.00 0.00 H new ATOM 2389 N TYR B 595 68.114 8.455 9.371 1.00 0.00 N ATOM 2390 CA TYR B 595 68.950 8.182 8.163 1.00 0.00 C ATOM 2391 C TYR B 595 68.091 8.288 6.901 1.00 0.00 C ATOM 2392 O TYR B 595 67.009 7.746 6.840 1.00 0.00 O ATOM 2393 CB TYR B 595 69.480 6.734 8.202 1.00 0.00 C ATOM 2394 CG TYR B 595 70.680 6.565 9.115 1.00 0.00 C ATOM 2395 CD1 TYR B 595 71.859 7.283 8.878 1.00 0.00 C ATOM 2396 CD2 TYR B 595 70.628 5.645 10.174 1.00 0.00 C ATOM 2397 CE1 TYR B 595 72.978 7.083 9.699 1.00 0.00 C ATOM 2398 CE2 TYR B 595 71.745 5.452 10.992 1.00 0.00 C ATOM 2399 CZ TYR B 595 72.919 6.169 10.754 1.00 0.00 C ATOM 2400 OH TYR B 595 74.022 5.974 11.560 1.00 0.00 O ATOM 0 H TYR B 595 67.110 8.518 9.203 1.00 0.00 H new ATOM 0 HA TYR B 595 69.767 8.904 8.153 1.00 0.00 H new ATOM 0 HB2 TYR B 595 68.682 6.070 8.534 1.00 0.00 H new ATOM 0 HB3 TYR B 595 69.752 6.426 7.193 1.00 0.00 H new ATOM 0 HD1 TYR B 595 71.906 7.990 8.063 1.00 0.00 H new ATOM 0 HD2 TYR B 595 69.723 5.085 10.357 1.00 0.00 H new ATOM 0 HE1 TYR B 595 73.887 7.636 9.515 1.00 0.00 H new ATOM 0 HE2 TYR B 595 71.700 4.747 11.809 1.00 0.00 H new ATOM 0 HH TYR B 595 73.812 5.306 12.246 1.00 0.00 H new ATOM 2410 N CYS B 596 68.591 8.890 5.862 1.00 0.00 N ATOM 2411 CA CYS B 596 67.802 8.899 4.603 1.00 0.00 C ATOM 2412 C CYS B 596 67.773 7.452 4.145 1.00 0.00 C ATOM 2413 O CYS B 596 68.647 6.685 4.492 1.00 0.00 O ATOM 2414 CB CYS B 596 68.487 9.749 3.517 1.00 0.00 C ATOM 2415 SG CYS B 596 69.110 11.295 4.213 1.00 0.00 S ATOM 0 H CYS B 596 69.492 9.367 5.828 1.00 0.00 H new ATOM 0 HA CYS B 596 66.811 9.321 4.768 1.00 0.00 H new ATOM 0 HB2 CYS B 596 69.309 9.187 3.073 1.00 0.00 H new ATOM 0 HB3 CYS B 596 67.779 9.964 2.717 1.00 0.00 H new ATOM 2420 N GLN B 597 66.824 7.046 3.364 1.00 0.00 N ATOM 2421 CA GLN B 597 66.862 5.638 2.922 1.00 0.00 C ATOM 2422 C GLN B 597 68.160 5.485 2.134 1.00 0.00 C ATOM 2423 O GLN B 597 69.003 4.673 2.451 1.00 0.00 O ATOM 2424 CB GLN B 597 65.603 5.326 2.078 1.00 0.00 C ATOM 2425 CG GLN B 597 65.859 4.231 1.022 1.00 0.00 C ATOM 2426 CD GLN B 597 65.663 2.852 1.647 1.00 0.00 C ATOM 2427 OE1 GLN B 597 65.269 1.916 0.980 1.00 0.00 O ATOM 2428 NE2 GLN B 597 65.924 2.692 2.909 1.00 0.00 N ATOM 0 H GLN B 597 66.045 7.609 3.021 1.00 0.00 H new ATOM 0 HA GLN B 597 66.850 4.930 3.750 1.00 0.00 H new ATOM 0 HB2 GLN B 597 64.796 5.009 2.738 1.00 0.00 H new ATOM 0 HB3 GLN B 597 65.268 6.236 1.580 1.00 0.00 H new ATOM 0 HG2 GLN B 597 65.178 4.359 0.180 1.00 0.00 H new ATOM 0 HG3 GLN B 597 66.872 4.322 0.629 1.00 0.00 H new ATOM 0 HE21 GLN B 597 66.255 3.480 3.465 1.00 0.00 H new ATOM 0 HE22 GLN B 597 65.798 1.778 3.344 1.00 0.00 H new ATOM 2437 N ASN B 598 68.331 6.290 1.122 1.00 0.00 N ATOM 2438 CA ASN B 598 69.574 6.231 0.308 1.00 0.00 C ATOM 2439 C ASN B 598 70.777 6.151 1.249 1.00 0.00 C ATOM 2440 O ASN B 598 71.797 5.582 0.924 1.00 0.00 O ATOM 2441 CB ASN B 598 69.665 7.492 -0.566 1.00 0.00 C ATOM 2442 CG ASN B 598 68.263 7.954 -0.939 1.00 0.00 C ATOM 2443 OD1 ASN B 598 67.877 9.072 -0.656 1.00 0.00 O ATOM 2444 ND2 ASN B 598 67.483 7.131 -1.566 1.00 0.00 N ATOM 0 H ASN B 598 67.655 6.993 0.823 1.00 0.00 H new ATOM 0 HA ASN B 598 69.563 5.353 -0.338 1.00 0.00 H new ATOM 0 HB2 ASN B 598 70.189 8.283 -0.029 1.00 0.00 H new ATOM 0 HB3 ASN B 598 70.242 7.282 -1.467 1.00 0.00 H new ATOM 0 HD21 ASN B 598 66.540 7.420 -1.825 1.00 0.00 H new ATOM 0 HD22 ASN B 598 67.812 6.195 -1.801 1.00 0.00 H new ATOM 2451 N CYS B 599 70.647 6.701 2.426 1.00 0.00 N ATOM 2452 CA CYS B 599 71.762 6.638 3.402 1.00 0.00 C ATOM 2453 C CYS B 599 71.673 5.300 4.138 1.00 0.00 C ATOM 2454 O CYS B 599 72.517 4.451 3.993 1.00 0.00 O ATOM 2455 CB CYS B 599 71.630 7.788 4.411 1.00 0.00 C ATOM 2456 SG CYS B 599 72.267 9.318 3.687 1.00 0.00 S ATOM 0 H CYS B 599 69.813 7.191 2.750 1.00 0.00 H new ATOM 0 HA CYS B 599 72.720 6.727 2.889 1.00 0.00 H new ATOM 0 HB2 CYS B 599 70.585 7.917 4.694 1.00 0.00 H new ATOM 0 HB3 CYS B 599 72.180 7.550 5.321 1.00 0.00 H new ATOM 2461 N PHE B 600 70.634 5.109 4.908 1.00 0.00 N ATOM 2462 CA PHE B 600 70.453 3.832 5.662 1.00 0.00 C ATOM 2463 C PHE B 600 70.736 2.649 4.740 1.00 0.00 C ATOM 2464 O PHE B 600 71.498 1.759 5.062 1.00 0.00 O ATOM 2465 CB PHE B 600 68.994 3.782 6.170 1.00 0.00 C ATOM 2466 CG PHE B 600 68.482 2.358 6.304 1.00 0.00 C ATOM 2467 CD1 PHE B 600 68.560 1.696 7.534 1.00 0.00 C ATOM 2468 CD2 PHE B 600 67.921 1.709 5.196 1.00 0.00 C ATOM 2469 CE1 PHE B 600 68.081 0.385 7.656 1.00 0.00 C ATOM 2470 CE2 PHE B 600 67.443 0.400 5.318 1.00 0.00 C ATOM 2471 CZ PHE B 600 67.523 -0.263 6.548 1.00 0.00 C ATOM 0 H PHE B 600 69.892 5.794 5.049 1.00 0.00 H new ATOM 0 HA PHE B 600 71.142 3.781 6.505 1.00 0.00 H new ATOM 0 HB2 PHE B 600 68.930 4.282 7.137 1.00 0.00 H new ATOM 0 HB3 PHE B 600 68.353 4.334 5.483 1.00 0.00 H new ATOM 0 HD1 PHE B 600 68.990 2.196 8.390 1.00 0.00 H new ATOM 0 HD2 PHE B 600 67.858 2.220 4.247 1.00 0.00 H new ATOM 0 HE1 PHE B 600 68.142 -0.126 8.606 1.00 0.00 H new ATOM 0 HE2 PHE B 600 67.012 -0.099 4.463 1.00 0.00 H new ATOM 0 HZ PHE B 600 67.154 -1.274 6.642 1.00 0.00 H new ATOM 2481 N LEU B 601 70.102 2.623 3.613 1.00 0.00 N ATOM 2482 CA LEU B 601 70.296 1.494 2.680 1.00 0.00 C ATOM 2483 C LEU B 601 71.770 1.414 2.279 1.00 0.00 C ATOM 2484 O LEU B 601 72.338 0.347 2.179 1.00 0.00 O ATOM 2485 CB LEU B 601 69.349 1.701 1.465 1.00 0.00 C ATOM 2486 CG LEU B 601 70.102 1.974 0.142 1.00 0.00 C ATOM 2487 CD1 LEU B 601 70.852 0.709 -0.345 1.00 0.00 C ATOM 2488 CD2 LEU B 601 69.078 2.400 -0.912 1.00 0.00 C ATOM 0 H LEU B 601 69.452 3.342 3.295 1.00 0.00 H new ATOM 0 HA LEU B 601 70.044 0.541 3.145 1.00 0.00 H new ATOM 0 HB2 LEU B 601 68.726 0.815 1.344 1.00 0.00 H new ATOM 0 HB3 LEU B 601 68.680 2.536 1.673 1.00 0.00 H new ATOM 0 HG LEU B 601 70.840 2.759 0.304 1.00 0.00 H new ATOM 0 HD11 LEU B 601 71.372 0.931 -1.277 1.00 0.00 H new ATOM 0 HD12 LEU B 601 71.575 0.402 0.410 1.00 0.00 H new ATOM 0 HD13 LEU B 601 70.137 -0.097 -0.511 1.00 0.00 H new ATOM 0 HD21 LEU B 601 69.587 2.598 -1.855 1.00 0.00 H new ATOM 0 HD22 LEU B 601 68.349 1.602 -1.054 1.00 0.00 H new ATOM 0 HD23 LEU B 601 68.567 3.303 -0.579 1.00 0.00 H new ATOM 2500 N LYS B 602 72.389 2.529 2.040 1.00 0.00 N ATOM 2501 CA LYS B 602 73.819 2.503 1.632 1.00 0.00 C ATOM 2502 C LYS B 602 74.657 1.789 2.689 1.00 0.00 C ATOM 2503 O LYS B 602 75.705 1.270 2.387 1.00 0.00 O ATOM 2504 CB LYS B 602 74.337 3.936 1.458 1.00 0.00 C ATOM 2505 CG LYS B 602 75.817 3.933 1.087 1.00 0.00 C ATOM 2506 CD LYS B 602 76.046 3.112 -0.194 1.00 0.00 C ATOM 2507 CE LYS B 602 77.319 3.586 -0.901 1.00 0.00 C ATOM 2508 NZ LYS B 602 77.214 5.042 -1.207 1.00 0.00 N ATOM 0 H LYS B 602 71.971 3.457 2.108 1.00 0.00 H new ATOM 0 HA LYS B 602 73.902 1.967 0.687 1.00 0.00 H new ATOM 0 HB2 LYS B 602 73.764 4.444 0.682 1.00 0.00 H new ATOM 0 HB3 LYS B 602 74.190 4.496 2.381 1.00 0.00 H new ATOM 0 HG2 LYS B 602 76.163 4.956 0.938 1.00 0.00 H new ATOM 0 HG3 LYS B 602 76.403 3.514 1.905 1.00 0.00 H new ATOM 0 HD2 LYS B 602 76.130 2.054 0.053 1.00 0.00 H new ATOM 0 HD3 LYS B 602 75.190 3.217 -0.860 1.00 0.00 H new ATOM 0 HE2 LYS B 602 78.188 3.399 -0.270 1.00 0.00 H new ATOM 0 HE3 LYS B 602 77.467 3.021 -1.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 602 77.745 5.253 -2.076 1.00 0.00 H new ATOM 0 HZ2 LYS B 602 76.215 5.297 -1.342 1.00 0.00 H new ATOM 0 HZ3 LYS B 602 77.609 5.592 -0.417 1.00 0.00 H new ATOM 2522 N LEU B 603 74.231 1.779 3.927 1.00 0.00 N ATOM 2523 CA LEU B 603 75.054 1.119 4.997 1.00 0.00 C ATOM 2524 C LEU B 603 74.617 -0.337 5.212 1.00 0.00 C ATOM 2525 O LEU B 603 75.420 -1.246 5.135 1.00 0.00 O ATOM 2526 CB LEU B 603 74.931 1.911 6.327 1.00 0.00 C ATOM 2527 CG LEU B 603 74.362 3.316 6.076 1.00 0.00 C ATOM 2528 CD1 LEU B 603 74.212 4.048 7.411 1.00 0.00 C ATOM 2529 CD2 LEU B 603 75.294 4.134 5.157 1.00 0.00 C ATOM 0 H LEU B 603 73.356 2.195 4.246 1.00 0.00 H new ATOM 0 HA LEU B 603 76.095 1.118 4.672 1.00 0.00 H new ATOM 0 HB2 LEU B 603 74.285 1.371 7.019 1.00 0.00 H new ATOM 0 HB3 LEU B 603 75.910 1.990 6.800 1.00 0.00 H new ATOM 0 HG LEU B 603 73.393 3.212 5.589 1.00 0.00 H new ATOM 0 HD11 LEU B 603 73.808 5.045 7.236 1.00 0.00 H new ATOM 0 HD12 LEU B 603 73.534 3.491 8.057 1.00 0.00 H new ATOM 0 HD13 LEU B 603 75.187 4.130 7.892 1.00 0.00 H new ATOM 0 HD21 LEU B 603 74.868 5.124 4.995 1.00 0.00 H new ATOM 0 HD22 LEU B 603 76.273 4.232 5.626 1.00 0.00 H new ATOM 0 HD23 LEU B 603 75.400 3.624 4.200 1.00 0.00 H new ATOM 2541 N PHE B 604 73.362 -0.564 5.515 1.00 0.00 N ATOM 2542 CA PHE B 604 72.888 -1.965 5.778 1.00 0.00 C ATOM 2543 C PHE B 604 72.170 -2.538 4.543 1.00 0.00 C ATOM 2544 O PHE B 604 72.184 -3.732 4.318 1.00 0.00 O ATOM 2545 CB PHE B 604 71.930 -1.953 6.993 1.00 0.00 C ATOM 2546 CG PHE B 604 72.247 -0.774 7.888 1.00 0.00 C ATOM 2547 CD1 PHE B 604 73.219 -0.884 8.893 1.00 0.00 C ATOM 2548 CD2 PHE B 604 71.558 0.432 7.716 1.00 0.00 C ATOM 2549 CE1 PHE B 604 73.498 0.210 9.720 1.00 0.00 C ATOM 2550 CE2 PHE B 604 71.840 1.526 8.543 1.00 0.00 C ATOM 2551 CZ PHE B 604 72.809 1.414 9.545 1.00 0.00 C ATOM 0 H PHE B 604 72.644 0.157 5.592 1.00 0.00 H new ATOM 0 HA PHE B 604 73.748 -2.599 5.993 1.00 0.00 H new ATOM 0 HB2 PHE B 604 70.897 -1.894 6.652 1.00 0.00 H new ATOM 0 HB3 PHE B 604 72.028 -2.883 7.553 1.00 0.00 H new ATOM 0 HD1 PHE B 604 73.752 -1.813 9.029 1.00 0.00 H new ATOM 0 HD2 PHE B 604 70.808 0.519 6.944 1.00 0.00 H new ATOM 0 HE1 PHE B 604 74.246 0.124 10.494 1.00 0.00 H new ATOM 0 HE2 PHE B 604 71.309 2.457 8.407 1.00 0.00 H new ATOM 0 HZ PHE B 604 73.025 2.258 10.184 1.00 0.00 H new ATOM 2561 N CYS B 605 71.545 -1.707 3.745 1.00 0.00 N ATOM 2562 CA CYS B 605 70.828 -2.222 2.531 1.00 0.00 C ATOM 2563 C CYS B 605 70.027 -3.478 2.898 1.00 0.00 C ATOM 2564 O CYS B 605 70.558 -4.564 2.734 1.00 0.00 O ATOM 2565 CB CYS B 605 71.848 -2.549 1.430 1.00 0.00 C ATOM 2566 SG CYS B 605 71.101 -3.641 0.190 1.00 0.00 S ATOM 2567 OXT CYS B 605 68.898 -3.329 3.336 1.00 0.00 O ATOM 0 H CYS B 605 71.499 -0.697 3.879 1.00 0.00 H new ATOM 0 HA CYS B 605 70.141 -1.459 2.164 1.00 0.00 H new ATOM 0 HB2 CYS B 605 72.190 -1.629 0.956 1.00 0.00 H new ATOM 0 HB3 CYS B 605 72.724 -3.028 1.866 1.00 0.00 H new ATOM 0 HG CYS B 605 70.664 -4.720 0.769 1.00 0.00 H new TER 2573 CYS B 605 HETATM 2574 ZN ZN B 701 64.300 24.057 14.910 1.00 0.00 ZN HETATM 2575 ZN ZN B 702 71.329 11.105 4.795 1.00 0.00 ZN