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= 0.123 USER MOD Set 1.2: B 567 LYS NZ :NH3+ 139:sc= 0.126 (180deg=0) USER MOD Set 1.3: B 584 LYS NZ :NH3+ 154:sc= -5.33! (180deg=-6.43!) USER MOD Set 2.1: A 70 THR OG1 : rot 170:sc= 0.141 USER MOD Set 2.2: A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.3: A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 MET CE :methyl -170:sc= -0.306 (180deg=-0.567) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.0911 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 5:sc= 0.226 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-2.5!) USER MOD Single : A 25 THR OG1 : rot 150:sc= -1.1 USER MOD Single : A 28 ASN : amide:sc= -2.75! K(o=-2.8!,f=-1.4) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -168:sc= -2 USER MOD Single : A 40 HIS : no HD1:sc= -0.782 K(o=-0.78,f=-2.5!) USER MOD Single : A 45 MET CE :methyl 153:sc= -1.28 (180deg=-2.72) USER MOD Single : A 47 LYS NZ :NH3+ -154:sc= -0.202 (180deg=-1.13) USER MOD Single : A 51 LYS NZ :NH3+ -106:sc= -3.28! (180deg=-6.76!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -136:sc= -2.91 (180deg=-6.28!) USER MOD Single : A 59 SER OG : rot 91:sc= 0.347! USER MOD Single : A 61 HIS : no HE2:sc= -6.66! C(o=-6.7!,f=-17!) USER MOD Single : A 67 LYS NZ :NH3+ 159:sc= -0.0971 (180deg=-0.818) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.0581 USER MOD Single : A 76 HIS : no HD1:sc= -1.1! C(o=-1.1!,f=-2.1!) USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.304 USER MOD Single : A 81 LYS NZ :NH3+ 167:sc= -3.45! (180deg=-4.14!) USER MOD Single : A 85 GLN : amide:sc= -1.95! K(o=-2!,f=-1.4) USER MOD Single : A 89 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.221) USER MOD Single : A 91 GLN : amide:sc= -10.2! C(o=-10!,f=-13!) USER MOD Single : A 93 THR OG1 : rot 180:sc= -1.13 USER MOD Single : B 541 TYR OH : rot 180:sc= 0 USER MOD Single : B 542 HIS : no HD1:sc= 0.473 K(o=0.47,f=-2.2!) USER MOD Single : B 547 SER OG : rot 33:sc= 0.837 USER MOD Single : B 550 SER OG : rot 130:sc= 0 USER MOD Single : B 553 GLN : amide:sc= -3.62! K(o=-3.6!,f=-1.3) USER MOD Single : B 554 LYS NZ :NH3+ 152:sc= -0.0468 (180deg=-0.543) USER MOD Single : B 557 THR OG1 : rot 59:sc= 0.943 USER MOD Single : B 560 CYS SG : rot 38:sc= 0.407 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+ 157:sc= -0.0271 (180deg=-0.592) USER MOD Single : B 581 GLN : amide:sc= -3.37! K(o=-3.4!,f=-2.1) USER MOD Single : B 583 ASN : amide:sc= -2.07! C(o=-2.1!,f=-3.8!) USER MOD Single : B 586 THR OG1 : rot 66:sc= 0.494 USER MOD Single : B 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 590 GLN : amide:sc= -3.29! C(o=-3.3!,f=-4.5!) USER MOD Single : B 591 ASN : amide:sc= -12! C(o=-12!,f=-8.6!) USER MOD Single : B 593 LYS NZ :NH3+ -162:sc=-0.00964 (180deg=-0.233) USER MOD Single : B 595 TYR OH : rot 110:sc= -1.35 USER MOD Single : B 597 GLN : amide:sc= -4.32! K(o=-4.3!,f=-0.044) USER MOD Single : B 598 ASN : amide:sc= -0.518 X(o=-0.52,f=-0.49) USER MOD Single : B 602 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.578) USER MOD Single : B 605 CYS SG : rot 28:sc= 0.0509! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 95.889 -20.407 7.280 1.00 0.00 N ATOM 2 CA MET A 1 94.978 -21.460 7.811 1.00 0.00 C ATOM 3 C MET A 1 94.803 -21.268 9.323 1.00 0.00 C ATOM 4 O MET A 1 94.203 -20.310 9.767 1.00 0.00 O ATOM 5 CB MET A 1 95.574 -22.841 7.516 1.00 0.00 C ATOM 6 CG MET A 1 94.543 -23.928 7.834 1.00 0.00 C ATOM 7 SD MET A 1 95.377 -25.529 7.973 1.00 0.00 S ATOM 8 CE MET A 1 95.185 -26.040 6.247 1.00 0.00 C ATOM 0 H1 MET A 1 96.009 -20.536 6.255 1.00 0.00 H new ATOM 0 H2 MET A 1 95.481 -19.469 7.466 1.00 0.00 H new ATOM 0 H3 MET A 1 96.815 -20.480 7.748 1.00 0.00 H new ATOM 0 HA MET A 1 94.003 -21.384 7.330 1.00 0.00 H new ATOM 0 HB2 MET A 1 95.871 -22.903 6.469 1.00 0.00 H new ATOM 0 HB3 MET A 1 96.474 -22.994 8.112 1.00 0.00 H new ATOM 0 HG2 MET A 1 94.026 -23.693 8.765 1.00 0.00 H new ATOM 0 HG3 MET A 1 93.786 -23.967 7.050 1.00 0.00 H new ATOM 0 HE1 MET A 1 95.638 -27.021 6.106 1.00 0.00 H new ATOM 0 HE2 MET A 1 94.125 -26.090 5.998 1.00 0.00 H new ATOM 0 HE3 MET A 1 95.677 -25.317 5.597 1.00 0.00 H new ATOM 18 N ALA A 2 95.318 -22.169 10.120 1.00 0.00 N ATOM 19 CA ALA A 2 95.177 -22.035 11.601 1.00 0.00 C ATOM 20 C ALA A 2 96.412 -22.630 12.268 1.00 0.00 C ATOM 21 O ALA A 2 97.101 -21.980 13.029 1.00 0.00 O ATOM 22 CB ALA A 2 93.941 -22.805 12.061 1.00 0.00 C ATOM 0 H ALA A 2 95.831 -22.993 9.808 1.00 0.00 H new ATOM 0 HA ALA A 2 95.075 -20.984 11.871 1.00 0.00 H new ATOM 0 HB1 ALA A 2 93.834 -22.710 13.142 1.00 0.00 H new ATOM 0 HB2 ALA A 2 93.056 -22.398 11.572 1.00 0.00 H new ATOM 0 HB3 ALA A 2 94.049 -23.857 11.798 1.00 0.00 H new ATOM 28 N LEU A 3 96.695 -23.865 11.971 1.00 0.00 N ATOM 29 CA LEU A 3 97.882 -24.543 12.555 1.00 0.00 C ATOM 30 C LEU A 3 99.077 -23.609 12.512 1.00 0.00 C ATOM 31 O LEU A 3 99.452 -23.003 13.492 1.00 0.00 O ATOM 32 CB LEU A 3 98.210 -25.763 11.697 1.00 0.00 C ATOM 33 CG LEU A 3 97.203 -26.883 11.974 1.00 0.00 C ATOM 34 CD1 LEU A 3 97.395 -27.991 10.935 1.00 0.00 C ATOM 35 CD2 LEU A 3 97.407 -27.450 13.393 1.00 0.00 C ATOM 0 H LEU A 3 96.144 -24.443 11.337 1.00 0.00 H new ATOM 0 HA LEU A 3 97.668 -24.829 13.585 1.00 0.00 H new ATOM 0 HB2 LEU A 3 98.185 -25.493 10.641 1.00 0.00 H new ATOM 0 HB3 LEU A 3 99.221 -26.109 11.914 1.00 0.00 H new ATOM 0 HG LEU A 3 96.191 -26.485 11.907 1.00 0.00 H new ATOM 0 HD11 LEU A 3 96.682 -28.794 11.123 1.00 0.00 H new ATOM 0 HD12 LEU A 3 97.230 -27.586 9.937 1.00 0.00 H new ATOM 0 HD13 LEU A 3 98.410 -28.383 11.004 1.00 0.00 H new ATOM 0 HD21 LEU A 3 96.684 -28.245 13.575 1.00 0.00 H new ATOM 0 HD22 LEU A 3 98.417 -27.850 13.483 1.00 0.00 H new ATOM 0 HD23 LEU A 3 97.265 -26.656 14.126 1.00 0.00 H new ATOM 47 N ASP A 4 99.678 -23.533 11.364 1.00 0.00 N ATOM 48 CA ASP A 4 100.871 -22.681 11.159 1.00 0.00 C ATOM 49 C ASP A 4 102.002 -23.150 12.071 1.00 0.00 C ATOM 50 O ASP A 4 103.120 -22.684 11.974 1.00 0.00 O ATOM 51 CB ASP A 4 100.511 -21.214 11.410 1.00 0.00 C ATOM 52 CG ASP A 4 101.782 -20.361 11.434 1.00 0.00 C ATOM 53 OD1 ASP A 4 101.858 -19.469 12.263 1.00 0.00 O ATOM 54 OD2 ASP A 4 102.657 -20.616 10.623 1.00 0.00 O ATOM 0 H ASP A 4 99.380 -24.044 10.533 1.00 0.00 H new ATOM 0 HA ASP A 4 101.215 -22.767 10.128 1.00 0.00 H new ATOM 0 HB2 ASP A 4 99.838 -20.857 10.630 1.00 0.00 H new ATOM 0 HB3 ASP A 4 99.980 -21.118 12.357 1.00 0.00 H new ATOM 59 N GLY A 5 101.719 -24.083 12.948 1.00 0.00 N ATOM 60 CA GLY A 5 102.765 -24.616 13.870 1.00 0.00 C ATOM 61 C GLY A 5 102.374 -24.263 15.290 1.00 0.00 C ATOM 62 O GLY A 5 102.941 -24.740 16.254 1.00 0.00 O ATOM 0 H GLY A 5 100.796 -24.501 13.064 1.00 0.00 H new ATOM 0 HA2 GLY A 5 102.854 -25.697 13.758 1.00 0.00 H new ATOM 0 HA3 GLY A 5 103.738 -24.189 13.627 1.00 0.00 H new ATOM 66 N ILE A 6 101.409 -23.404 15.405 1.00 0.00 N ATOM 67 CA ILE A 6 100.927 -22.940 16.742 1.00 0.00 C ATOM 68 C ILE A 6 99.458 -23.374 16.925 1.00 0.00 C ATOM 69 O ILE A 6 99.180 -24.535 17.156 1.00 0.00 O ATOM 70 CB ILE A 6 101.079 -21.394 16.814 1.00 0.00 C ATOM 71 CG1 ILE A 6 101.178 -20.817 15.380 1.00 0.00 C ATOM 72 CG2 ILE A 6 102.331 -21.015 17.615 1.00 0.00 C ATOM 73 CD1 ILE A 6 102.594 -20.986 14.792 1.00 0.00 C ATOM 0 H ILE A 6 100.918 -22.990 14.613 1.00 0.00 H new ATOM 0 HA ILE A 6 101.514 -23.384 17.546 1.00 0.00 H new ATOM 0 HB ILE A 6 100.206 -20.976 17.316 1.00 0.00 H new ATOM 0 HG12 ILE A 6 100.455 -21.317 14.736 1.00 0.00 H new ATOM 0 HG13 ILE A 6 100.914 -19.760 15.394 1.00 0.00 H new ATOM 0 HG21 ILE A 6 102.422 -19.930 17.656 1.00 0.00 H new ATOM 0 HG22 ILE A 6 102.249 -21.410 18.627 1.00 0.00 H new ATOM 0 HG23 ILE A 6 103.213 -21.435 17.132 1.00 0.00 H new ATOM 0 HD11 ILE A 6 102.622 -20.569 13.785 1.00 0.00 H new ATOM 0 HD12 ILE A 6 103.314 -20.463 15.422 1.00 0.00 H new ATOM 0 HD13 ILE A 6 102.848 -22.045 14.753 1.00 0.00 H new ATOM 85 N ARG A 7 98.515 -22.464 16.843 1.00 0.00 N ATOM 86 CA ARG A 7 97.092 -22.846 17.032 1.00 0.00 C ATOM 87 C ARG A 7 96.184 -21.861 16.289 1.00 0.00 C ATOM 88 O ARG A 7 95.972 -21.992 15.101 1.00 0.00 O ATOM 89 CB ARG A 7 96.762 -22.845 18.528 1.00 0.00 C ATOM 90 CG ARG A 7 97.321 -21.581 19.228 1.00 0.00 C ATOM 91 CD ARG A 7 98.661 -21.889 19.903 1.00 0.00 C ATOM 92 NE ARG A 7 99.144 -20.680 20.627 1.00 0.00 N ATOM 93 CZ ARG A 7 98.652 -20.380 21.798 1.00 0.00 C ATOM 94 NH1 ARG A 7 99.084 -19.327 22.436 1.00 0.00 N ATOM 95 NH2 ARG A 7 97.728 -21.132 22.329 1.00 0.00 N ATOM 0 H ARG A 7 98.677 -21.475 16.653 1.00 0.00 H new ATOM 0 HA ARG A 7 96.926 -23.845 16.628 1.00 0.00 H new ATOM 0 HB2 ARG A 7 95.681 -22.891 18.664 1.00 0.00 H new ATOM 0 HB3 ARG A 7 97.180 -23.737 18.995 1.00 0.00 H new ATOM 0 HG2 ARG A 7 97.450 -20.781 18.499 1.00 0.00 H new ATOM 0 HG3 ARG A 7 96.607 -21.223 19.970 1.00 0.00 H new ATOM 0 HD2 ARG A 7 98.547 -22.721 20.598 1.00 0.00 H new ATOM 0 HD3 ARG A 7 99.394 -22.196 19.157 1.00 0.00 H new ATOM 0 HE ARG A 7 99.860 -20.086 20.207 1.00 0.00 H new ATOM 0 HH11 ARG A 7 99.806 -18.739 22.020 1.00 0.00 H new ATOM 0 HH12 ARG A 7 98.700 -19.092 23.351 1.00 0.00 H new ATOM 0 HH21 ARG A 7 97.390 -21.954 21.829 1.00 0.00 H new ATOM 0 HH22 ARG A 7 97.343 -20.898 23.244 1.00 0.00 H new ATOM 109 N MET A 8 95.634 -20.880 16.971 1.00 0.00 N ATOM 110 CA MET A 8 94.730 -19.899 16.279 1.00 0.00 C ATOM 111 C MET A 8 94.983 -18.470 16.816 1.00 0.00 C ATOM 112 O MET A 8 95.393 -17.619 16.058 1.00 0.00 O ATOM 113 CB MET A 8 93.250 -20.341 16.426 1.00 0.00 C ATOM 114 CG MET A 8 93.177 -21.639 17.253 1.00 0.00 C ATOM 115 SD MET A 8 91.444 -22.103 17.512 1.00 0.00 S ATOM 116 CE MET A 8 91.108 -21.012 18.917 1.00 0.00 C ATOM 0 H MET A 8 95.770 -20.716 17.969 1.00 0.00 H new ATOM 0 HA MET A 8 94.953 -19.882 15.212 1.00 0.00 H new ATOM 0 HB2 MET A 8 92.672 -19.555 16.912 1.00 0.00 H new ATOM 0 HB3 MET A 8 92.808 -20.499 15.442 1.00 0.00 H new ATOM 0 HG2 MET A 8 93.705 -22.441 16.736 1.00 0.00 H new ATOM 0 HG3 MET A 8 93.673 -21.498 18.213 1.00 0.00 H new ATOM 0 HE1 MET A 8 90.141 -21.266 19.351 1.00 0.00 H new ATOM 0 HE2 MET A 8 91.887 -21.136 19.669 1.00 0.00 H new ATOM 0 HE3 MET A 8 91.093 -19.976 18.578 1.00 0.00 H new ATOM 126 N PRO A 9 94.788 -18.174 18.091 1.00 0.00 N ATOM 127 CA PRO A 9 95.071 -16.806 18.610 1.00 0.00 C ATOM 128 C PRO A 9 96.405 -16.315 18.074 1.00 0.00 C ATOM 129 O PRO A 9 96.600 -15.157 17.770 1.00 0.00 O ATOM 130 CB PRO A 9 95.134 -17.010 20.121 1.00 0.00 C ATOM 131 CG PRO A 9 94.164 -18.102 20.365 1.00 0.00 C ATOM 132 CD PRO A 9 94.296 -19.050 19.168 1.00 0.00 C ATOM 0 HA PRO A 9 94.328 -16.064 18.316 1.00 0.00 H new ATOM 0 HB2 PRO A 9 96.137 -17.284 20.447 1.00 0.00 H new ATOM 0 HB3 PRO A 9 94.861 -16.103 20.660 1.00 0.00 H new ATOM 0 HG2 PRO A 9 94.383 -18.619 21.299 1.00 0.00 H new ATOM 0 HG3 PRO A 9 93.149 -17.713 20.446 1.00 0.00 H new ATOM 0 HD2 PRO A 9 94.992 -19.863 19.374 1.00 0.00 H new ATOM 0 HD3 PRO A 9 93.340 -19.506 18.910 1.00 0.00 H new ATOM 140 N ASP A 10 97.312 -17.235 17.939 1.00 0.00 N ATOM 141 CA ASP A 10 98.667 -16.920 17.395 1.00 0.00 C ATOM 142 C ASP A 10 98.783 -17.590 16.033 1.00 0.00 C ATOM 143 O ASP A 10 99.533 -17.171 15.173 1.00 0.00 O ATOM 144 CB ASP A 10 99.740 -17.473 18.339 1.00 0.00 C ATOM 145 CG ASP A 10 101.087 -16.820 18.025 1.00 0.00 C ATOM 146 OD1 ASP A 10 101.993 -16.959 18.830 1.00 0.00 O ATOM 147 OD2 ASP A 10 101.190 -16.191 16.984 1.00 0.00 O ATOM 0 H ASP A 10 97.173 -18.215 18.187 1.00 0.00 H new ATOM 0 HA ASP A 10 98.806 -15.843 17.304 1.00 0.00 H new ATOM 0 HB2 ASP A 10 99.463 -17.278 19.375 1.00 0.00 H new ATOM 0 HB3 ASP A 10 99.814 -18.555 18.227 1.00 0.00 H new ATOM 152 N GLY A 11 98.028 -18.633 15.838 1.00 0.00 N ATOM 153 CA GLY A 11 98.054 -19.358 14.541 1.00 0.00 C ATOM 154 C GLY A 11 97.046 -18.720 13.582 1.00 0.00 C ATOM 155 O GLY A 11 96.759 -19.250 12.527 1.00 0.00 O ATOM 0 H GLY A 11 97.386 -19.018 16.531 1.00 0.00 H new ATOM 0 HA2 GLY A 11 99.055 -19.321 14.111 1.00 0.00 H new ATOM 0 HA3 GLY A 11 97.811 -20.409 14.695 1.00 0.00 H new ATOM 159 N CYS A 12 96.496 -17.591 13.946 1.00 0.00 N ATOM 160 CA CYS A 12 95.495 -16.928 13.060 1.00 0.00 C ATOM 161 C CYS A 12 95.422 -15.425 13.357 1.00 0.00 C ATOM 162 O CYS A 12 95.835 -14.608 12.559 1.00 0.00 O ATOM 163 CB CYS A 12 94.121 -17.556 13.298 1.00 0.00 C ATOM 164 SG CYS A 12 92.908 -16.792 12.193 1.00 0.00 S ATOM 0 H CYS A 12 96.697 -17.100 14.817 1.00 0.00 H new ATOM 0 HA CYS A 12 95.798 -17.066 12.022 1.00 0.00 H new ATOM 0 HB2 CYS A 12 94.165 -18.630 13.120 1.00 0.00 H new ATOM 0 HB3 CYS A 12 93.821 -17.417 14.337 1.00 0.00 H new ATOM 0 HG CYS A 12 91.740 -17.327 12.394 1.00 0.00 H new ATOM 170 N TYR A 13 94.883 -15.049 14.488 1.00 0.00 N ATOM 171 CA TYR A 13 94.772 -13.593 14.807 1.00 0.00 C ATOM 172 C TYR A 13 94.534 -13.413 16.310 1.00 0.00 C ATOM 173 O TYR A 13 95.451 -13.222 17.082 1.00 0.00 O ATOM 174 CB TYR A 13 93.583 -13.002 14.023 1.00 0.00 C ATOM 175 CG TYR A 13 94.019 -12.647 12.616 1.00 0.00 C ATOM 176 CD1 TYR A 13 93.499 -13.348 11.518 1.00 0.00 C ATOM 177 CD2 TYR A 13 94.946 -11.618 12.411 1.00 0.00 C ATOM 178 CE1 TYR A 13 93.905 -13.017 10.220 1.00 0.00 C ATOM 179 CE2 TYR A 13 95.351 -11.288 11.112 1.00 0.00 C ATOM 180 CZ TYR A 13 94.831 -11.987 10.017 1.00 0.00 C ATOM 181 OH TYR A 13 95.231 -11.662 8.736 1.00 0.00 O ATOM 0 H TYR A 13 94.517 -15.681 15.200 1.00 0.00 H new ATOM 0 HA TYR A 13 95.693 -13.081 14.527 1.00 0.00 H new ATOM 0 HB2 TYR A 13 92.765 -13.721 13.989 1.00 0.00 H new ATOM 0 HB3 TYR A 13 93.206 -12.114 14.531 1.00 0.00 H new ATOM 0 HD1 TYR A 13 92.785 -14.143 11.674 1.00 0.00 H new ATOM 0 HD2 TYR A 13 95.349 -11.078 13.255 1.00 0.00 H new ATOM 0 HE1 TYR A 13 93.504 -13.556 9.375 1.00 0.00 H new ATOM 0 HE2 TYR A 13 96.065 -10.493 10.955 1.00 0.00 H new ATOM 0 HH TYR A 13 95.876 -10.925 8.772 1.00 0.00 H new ATOM 191 N ALA A 14 93.300 -13.466 16.715 1.00 0.00 N ATOM 192 CA ALA A 14 92.956 -13.295 18.154 1.00 0.00 C ATOM 193 C ALA A 14 91.468 -13.558 18.302 1.00 0.00 C ATOM 194 O ALA A 14 91.009 -14.135 19.268 1.00 0.00 O ATOM 195 CB ALA A 14 93.280 -11.867 18.595 1.00 0.00 C ATOM 0 H ALA A 14 92.500 -13.623 16.101 1.00 0.00 H new ATOM 0 HA ALA A 14 93.530 -13.984 18.774 1.00 0.00 H new ATOM 0 HB1 ALA A 14 93.027 -11.745 19.648 1.00 0.00 H new ATOM 0 HB2 ALA A 14 94.343 -11.675 18.453 1.00 0.00 H new ATOM 0 HB3 ALA A 14 92.701 -11.162 17.999 1.00 0.00 H new ATOM 201 N ASP A 15 90.719 -13.148 17.325 1.00 0.00 N ATOM 202 CA ASP A 15 89.253 -13.368 17.345 1.00 0.00 C ATOM 203 C ASP A 15 88.757 -13.447 15.900 1.00 0.00 C ATOM 204 O ASP A 15 87.572 -13.459 15.634 1.00 0.00 O ATOM 205 CB ASP A 15 88.577 -12.196 18.048 1.00 0.00 C ATOM 206 CG ASP A 15 87.106 -12.531 18.303 1.00 0.00 C ATOM 207 OD1 ASP A 15 86.310 -12.340 17.399 1.00 0.00 O ATOM 208 OD2 ASP A 15 86.801 -12.973 19.399 1.00 0.00 O ATOM 0 H ASP A 15 91.067 -12.661 16.499 1.00 0.00 H new ATOM 0 HA ASP A 15 89.017 -14.291 17.875 1.00 0.00 H new ATOM 0 HB2 ASP A 15 89.081 -11.984 18.991 1.00 0.00 H new ATOM 0 HB3 ASP A 15 88.655 -11.297 17.436 1.00 0.00 H new ATOM 213 N GLY A 16 89.669 -13.480 14.965 1.00 0.00 N ATOM 214 CA GLY A 16 89.280 -13.536 13.530 1.00 0.00 C ATOM 215 C GLY A 16 88.882 -12.141 13.084 1.00 0.00 C ATOM 216 O GLY A 16 88.328 -11.956 12.020 1.00 0.00 O ATOM 0 H GLY A 16 90.674 -13.470 15.138 1.00 0.00 H new ATOM 0 HA2 GLY A 16 90.110 -13.904 12.927 1.00 0.00 H new ATOM 0 HA3 GLY A 16 88.451 -14.230 13.389 1.00 0.00 H new ATOM 220 N THR A 17 89.157 -11.155 13.897 1.00 0.00 N ATOM 221 CA THR A 17 88.787 -9.756 13.542 1.00 0.00 C ATOM 222 C THR A 17 90.026 -8.996 13.087 1.00 0.00 C ATOM 223 O THR A 17 90.996 -8.872 13.808 1.00 0.00 O ATOM 224 CB THR A 17 88.160 -9.065 14.764 1.00 0.00 C ATOM 225 OG1 THR A 17 87.441 -7.922 14.332 1.00 0.00 O ATOM 226 CG2 THR A 17 89.243 -8.645 15.768 1.00 0.00 C ATOM 0 H THR A 17 89.625 -11.261 14.797 1.00 0.00 H new ATOM 0 HA THR A 17 88.062 -9.767 12.728 1.00 0.00 H new ATOM 0 HB THR A 17 87.487 -9.765 15.259 1.00 0.00 H new ATOM 0 HG1 THR A 17 87.445 -7.884 13.353 1.00 0.00 H new ATOM 0 HG21 THR A 17 88.776 -8.158 16.624 1.00 0.00 H new ATOM 0 HG22 THR A 17 89.789 -9.527 16.105 1.00 0.00 H new ATOM 0 HG23 THR A 17 89.934 -7.952 15.289 1.00 0.00 H new ATOM 234 N TRP A 18 89.982 -8.475 11.895 1.00 0.00 N ATOM 235 CA TRP A 18 91.129 -7.693 11.353 1.00 0.00 C ATOM 236 C TRP A 18 90.652 -6.270 11.056 1.00 0.00 C ATOM 237 O TRP A 18 89.657 -6.063 10.391 1.00 0.00 O ATOM 238 CB TRP A 18 91.660 -8.346 10.070 1.00 0.00 C ATOM 239 CG TRP A 18 90.558 -8.960 9.258 1.00 0.00 C ATOM 240 CD1 TRP A 18 89.795 -10.028 9.607 1.00 0.00 C ATOM 241 CD2 TRP A 18 90.119 -8.570 7.934 1.00 0.00 C ATOM 242 NE1 TRP A 18 88.922 -10.307 8.559 1.00 0.00 N ATOM 243 CE2 TRP A 18 89.092 -9.439 7.516 1.00 0.00 C ATOM 244 CE3 TRP A 18 90.511 -7.553 7.061 1.00 0.00 C ATOM 245 CZ2 TRP A 18 88.487 -9.309 6.277 1.00 0.00 C ATOM 246 CZ3 TRP A 18 89.897 -7.421 5.814 1.00 0.00 C ATOM 247 CH2 TRP A 18 88.893 -8.300 5.420 1.00 0.00 C ATOM 0 H TRP A 18 89.187 -8.559 11.262 1.00 0.00 H new ATOM 0 HA TRP A 18 91.936 -7.671 12.085 1.00 0.00 H new ATOM 0 HB2 TRP A 18 92.180 -7.599 9.470 1.00 0.00 H new ATOM 0 HB3 TRP A 18 92.391 -9.112 10.328 1.00 0.00 H new ATOM 0 HD1 TRP A 18 89.855 -10.569 10.540 1.00 0.00 H new ATOM 0 HE1 TRP A 18 88.240 -11.065 8.568 1.00 0.00 H new ATOM 0 HE3 TRP A 18 91.292 -6.866 7.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 87.703 -9.991 5.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 90.205 -6.628 5.148 1.00 0.00 H new ATOM 0 HH2 TRP A 18 88.432 -8.196 4.449 1.00 0.00 H new ATOM 258 N GLU A 19 91.350 -5.289 11.557 1.00 0.00 N ATOM 259 CA GLU A 19 90.932 -3.875 11.317 1.00 0.00 C ATOM 260 C GLU A 19 91.384 -3.423 9.930 1.00 0.00 C ATOM 261 O GLU A 19 92.505 -3.655 9.522 1.00 0.00 O ATOM 262 CB GLU A 19 91.533 -2.935 12.393 1.00 0.00 C ATOM 263 CG GLU A 19 92.689 -3.632 13.102 1.00 0.00 C ATOM 264 CD GLU A 19 93.702 -4.133 12.070 1.00 0.00 C ATOM 265 OE1 GLU A 19 94.234 -3.310 11.343 1.00 0.00 O ATOM 266 OE2 GLU A 19 93.927 -5.331 12.024 1.00 0.00 O ATOM 0 H GLU A 19 92.191 -5.403 12.122 1.00 0.00 H new ATOM 0 HA GLU A 19 89.845 -3.825 11.377 1.00 0.00 H new ATOM 0 HB2 GLU A 19 91.882 -2.013 11.929 1.00 0.00 H new ATOM 0 HB3 GLU A 19 90.766 -2.657 13.116 1.00 0.00 H new ATOM 0 HG2 GLU A 19 93.172 -2.943 13.795 1.00 0.00 H new ATOM 0 HG3 GLU A 19 92.315 -4.468 13.693 1.00 0.00 H new ATOM 273 N LEU A 20 90.524 -2.751 9.214 1.00 0.00 N ATOM 274 CA LEU A 20 90.909 -2.252 7.869 1.00 0.00 C ATOM 275 C LEU A 20 91.604 -0.908 8.065 1.00 0.00 C ATOM 276 O LEU A 20 91.110 -0.057 8.768 1.00 0.00 O ATOM 277 CB LEU A 20 89.639 -2.054 6.999 1.00 0.00 C ATOM 278 CG LEU A 20 89.776 -2.713 5.608 1.00 0.00 C ATOM 279 CD1 LEU A 20 91.139 -2.410 4.955 1.00 0.00 C ATOM 280 CD2 LEU A 20 89.611 -4.221 5.726 1.00 0.00 C ATOM 0 H LEU A 20 89.572 -2.527 9.505 1.00 0.00 H new ATOM 0 HA LEU A 20 91.566 -2.963 7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 20 88.777 -2.476 7.516 1.00 0.00 H new ATOM 0 HB3 LEU A 20 89.447 -0.988 6.877 1.00 0.00 H new ATOM 0 HG LEU A 20 88.993 -2.294 4.977 1.00 0.00 H new ATOM 0 HD11 LEU A 20 91.190 -2.893 3.979 1.00 0.00 H new ATOM 0 HD12 LEU A 20 91.252 -1.333 4.833 1.00 0.00 H new ATOM 0 HD13 LEU A 20 91.939 -2.789 5.590 1.00 0.00 H new ATOM 0 HD21 LEU A 20 89.709 -4.676 4.740 1.00 0.00 H new ATOM 0 HD22 LEU A 20 90.379 -4.620 6.388 1.00 0.00 H new ATOM 0 HD23 LEU A 20 88.626 -4.448 6.134 1.00 0.00 H new ATOM 292 N SER A 21 92.722 -0.691 7.447 1.00 0.00 N ATOM 293 CA SER A 21 93.397 0.621 7.621 1.00 0.00 C ATOM 294 C SER A 21 92.680 1.644 6.753 1.00 0.00 C ATOM 295 O SER A 21 92.199 1.328 5.682 1.00 0.00 O ATOM 296 CB SER A 21 94.862 0.511 7.198 1.00 0.00 C ATOM 297 OG SER A 21 95.641 1.424 7.961 1.00 0.00 O ATOM 0 H SER A 21 93.196 -1.355 6.835 1.00 0.00 H new ATOM 0 HA SER A 21 93.362 0.927 8.666 1.00 0.00 H new ATOM 0 HB2 SER A 21 95.221 -0.507 7.350 1.00 0.00 H new ATOM 0 HB3 SER A 21 94.963 0.729 6.135 1.00 0.00 H new ATOM 0 HG SER A 21 96.581 1.355 7.694 1.00 0.00 H new ATOM 303 N VAL A 22 92.598 2.865 7.204 1.00 0.00 N ATOM 304 CA VAL A 22 91.902 3.909 6.396 1.00 0.00 C ATOM 305 C VAL A 22 92.655 5.231 6.479 1.00 0.00 C ATOM 306 O VAL A 22 92.746 5.849 7.519 1.00 0.00 O ATOM 307 CB VAL A 22 90.458 4.087 6.900 1.00 0.00 C ATOM 308 CG1 VAL A 22 89.865 5.406 6.392 1.00 0.00 C ATOM 309 CG2 VAL A 22 89.602 2.946 6.363 1.00 0.00 C ATOM 0 H VAL A 22 92.981 3.186 8.093 1.00 0.00 H new ATOM 0 HA VAL A 22 91.876 3.589 5.354 1.00 0.00 H new ATOM 0 HB VAL A 22 90.470 4.091 7.990 1.00 0.00 H new ATOM 0 HG11 VAL A 22 88.844 5.512 6.760 1.00 0.00 H new ATOM 0 HG12 VAL A 22 90.469 6.239 6.752 1.00 0.00 H new ATOM 0 HG13 VAL A 22 89.860 5.407 5.302 1.00 0.00 H new ATOM 0 HG21 VAL A 22 88.577 3.063 6.715 1.00 0.00 H new ATOM 0 HG22 VAL A 22 89.616 2.963 5.273 1.00 0.00 H new ATOM 0 HG23 VAL A 22 90.000 1.995 6.716 1.00 0.00 H new ATOM 319 N HIS A 23 93.160 5.677 5.368 1.00 0.00 N ATOM 320 CA HIS A 23 93.879 6.972 5.329 1.00 0.00 C ATOM 321 C HIS A 23 92.851 8.067 5.059 1.00 0.00 C ATOM 322 O HIS A 23 92.395 8.237 3.946 1.00 0.00 O ATOM 323 CB HIS A 23 94.897 6.925 4.185 1.00 0.00 C ATOM 324 CG HIS A 23 96.152 6.229 4.644 1.00 0.00 C ATOM 325 ND1 HIS A 23 97.295 6.926 5.004 1.00 0.00 N ATOM 326 CD2 HIS A 23 96.458 4.900 4.804 1.00 0.00 C ATOM 327 CE1 HIS A 23 98.227 6.022 5.359 1.00 0.00 C ATOM 328 NE2 HIS A 23 97.768 4.771 5.255 1.00 0.00 N ATOM 0 H HIS A 23 93.104 5.191 4.473 1.00 0.00 H new ATOM 0 HA HIS A 23 94.396 7.168 6.268 1.00 0.00 H new ATOM 0 HB2 HIS A 23 94.472 6.400 3.329 1.00 0.00 H new ATOM 0 HB3 HIS A 23 95.132 7.937 3.854 1.00 0.00 H new ATOM 0 HD2 HIS A 23 95.784 4.079 4.609 1.00 0.00 H new ATOM 0 HE1 HIS A 23 99.224 6.276 5.688 1.00 0.00 H new ATOM 0 HE2 HIS A 23 98.270 3.908 5.462 1.00 0.00 H new ATOM 336 N VAL A 24 92.478 8.814 6.059 1.00 0.00 N ATOM 337 CA VAL A 24 91.480 9.886 5.824 1.00 0.00 C ATOM 338 C VAL A 24 92.152 10.961 4.966 1.00 0.00 C ATOM 339 O VAL A 24 93.032 11.660 5.414 1.00 0.00 O ATOM 340 CB VAL A 24 91.006 10.457 7.178 1.00 0.00 C ATOM 341 CG1 VAL A 24 89.559 10.947 7.062 1.00 0.00 C ATOM 342 CG2 VAL A 24 91.059 9.354 8.241 1.00 0.00 C ATOM 0 H VAL A 24 92.817 8.729 7.017 1.00 0.00 H new ATOM 0 HA VAL A 24 90.601 9.504 5.305 1.00 0.00 H new ATOM 0 HB VAL A 24 91.656 11.286 7.457 1.00 0.00 H new ATOM 0 HG11 VAL A 24 89.233 11.348 8.022 1.00 0.00 H new ATOM 0 HG12 VAL A 24 89.499 11.727 6.303 1.00 0.00 H new ATOM 0 HG13 VAL A 24 88.915 10.115 6.779 1.00 0.00 H new ATOM 0 HG21 VAL A 24 90.725 9.755 9.198 1.00 0.00 H new ATOM 0 HG22 VAL A 24 90.408 8.532 7.945 1.00 0.00 H new ATOM 0 HG23 VAL A 24 92.082 8.990 8.337 1.00 0.00 H new ATOM 352 N THR A 25 91.771 11.065 3.721 1.00 0.00 N ATOM 353 CA THR A 25 92.419 12.064 2.823 1.00 0.00 C ATOM 354 C THR A 25 91.915 13.475 3.136 1.00 0.00 C ATOM 355 O THR A 25 92.689 14.371 3.411 1.00 0.00 O ATOM 356 CB THR A 25 92.097 11.720 1.365 1.00 0.00 C ATOM 357 OG1 THR A 25 90.837 12.275 1.018 1.00 0.00 O ATOM 358 CG2 THR A 25 92.054 10.200 1.191 1.00 0.00 C ATOM 0 H THR A 25 91.040 10.502 3.287 1.00 0.00 H new ATOM 0 HA THR A 25 93.497 12.034 2.983 1.00 0.00 H new ATOM 0 HB THR A 25 92.869 12.133 0.716 1.00 0.00 H new ATOM 0 HG1 THR A 25 90.827 12.493 0.062 1.00 0.00 H new ATOM 0 HG21 THR A 25 91.825 9.959 0.153 1.00 0.00 H new ATOM 0 HG22 THR A 25 93.022 9.776 1.457 1.00 0.00 H new ATOM 0 HG23 THR A 25 91.284 9.781 1.839 1.00 0.00 H new ATOM 366 N ASP A 26 90.630 13.687 3.092 1.00 0.00 N ATOM 367 CA ASP A 26 90.089 15.047 3.384 1.00 0.00 C ATOM 368 C ASP A 26 90.517 15.486 4.788 1.00 0.00 C ATOM 369 O ASP A 26 90.160 16.554 5.247 1.00 0.00 O ATOM 370 CB ASP A 26 88.562 15.012 3.306 1.00 0.00 C ATOM 371 CG ASP A 26 88.002 16.402 3.618 1.00 0.00 C ATOM 372 OD1 ASP A 26 88.683 17.372 3.330 1.00 0.00 O ATOM 373 OD2 ASP A 26 86.901 16.472 4.140 1.00 0.00 O ATOM 0 H ASP A 26 89.930 12.980 2.867 1.00 0.00 H new ATOM 0 HA ASP A 26 90.479 15.755 2.652 1.00 0.00 H new ATOM 0 HB2 ASP A 26 88.245 14.696 2.312 1.00 0.00 H new ATOM 0 HB3 ASP A 26 88.168 14.282 4.013 1.00 0.00 H new ATOM 378 N LEU A 27 91.269 14.664 5.479 1.00 0.00 N ATOM 379 CA LEU A 27 91.720 15.014 6.865 1.00 0.00 C ATOM 380 C LEU A 27 93.216 14.697 7.011 1.00 0.00 C ATOM 381 O LEU A 27 93.897 15.270 7.833 1.00 0.00 O ATOM 382 CB LEU A 27 90.899 14.172 7.864 1.00 0.00 C ATOM 383 CG LEU A 27 89.794 15.024 8.514 1.00 0.00 C ATOM 384 CD1 LEU A 27 88.696 14.108 9.062 1.00 0.00 C ATOM 385 CD2 LEU A 27 90.386 15.853 9.661 1.00 0.00 C ATOM 0 H LEU A 27 91.593 13.758 5.140 1.00 0.00 H new ATOM 0 HA LEU A 27 91.568 16.075 7.061 1.00 0.00 H new ATOM 0 HB2 LEU A 27 90.453 13.321 7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 27 91.556 13.770 8.635 1.00 0.00 H new ATOM 0 HG LEU A 27 89.370 15.694 7.766 1.00 0.00 H new ATOM 0 HD11 LEU A 27 87.914 14.712 9.522 1.00 0.00 H new ATOM 0 HD12 LEU A 27 88.270 13.523 8.247 1.00 0.00 H new ATOM 0 HD13 LEU A 27 89.121 13.436 9.808 1.00 0.00 H new ATOM 0 HD21 LEU A 27 89.600 16.455 10.118 1.00 0.00 H new ATOM 0 HD22 LEU A 27 90.814 15.186 10.409 1.00 0.00 H new ATOM 0 HD23 LEU A 27 91.165 16.509 9.272 1.00 0.00 H new ATOM 397 N ASN A 28 93.711 13.780 6.221 1.00 0.00 N ATOM 398 CA ASN A 28 95.155 13.388 6.285 1.00 0.00 C ATOM 399 C ASN A 28 95.407 12.500 7.502 1.00 0.00 C ATOM 400 O ASN A 28 96.538 12.281 7.889 1.00 0.00 O ATOM 401 CB ASN A 28 96.055 14.630 6.369 1.00 0.00 C ATOM 402 CG ASN A 28 97.468 14.258 5.931 1.00 0.00 C ATOM 403 OD1 ASN A 28 98.251 15.106 5.551 1.00 0.00 O ATOM 404 ND2 ASN A 28 97.822 13.008 5.973 1.00 0.00 N ATOM 0 H ASN A 28 93.167 13.276 5.521 1.00 0.00 H new ATOM 0 HA ASN A 28 95.395 12.838 5.375 1.00 0.00 H new ATOM 0 HB2 ASN A 28 95.661 15.423 5.733 1.00 0.00 H new ATOM 0 HB3 ASN A 28 96.067 15.016 7.388 1.00 0.00 H new ATOM 0 HD21 ASN A 28 98.762 12.734 5.686 1.00 0.00 H new ATOM 0 HD22 ASN A 28 97.160 12.301 6.293 1.00 0.00 H new ATOM 411 N ARG A 29 94.376 11.982 8.116 1.00 0.00 N ATOM 412 CA ARG A 29 94.579 11.118 9.299 1.00 0.00 C ATOM 413 C ARG A 29 94.620 9.664 8.873 1.00 0.00 C ATOM 414 O ARG A 29 94.506 9.329 7.710 1.00 0.00 O ATOM 415 CB ARG A 29 93.420 11.293 10.263 1.00 0.00 C ATOM 416 CG ARG A 29 93.425 12.714 10.809 1.00 0.00 C ATOM 417 CD ARG A 29 92.204 12.910 11.706 1.00 0.00 C ATOM 418 NE ARG A 29 92.461 12.288 13.035 1.00 0.00 N ATOM 419 CZ ARG A 29 91.479 12.113 13.876 1.00 0.00 C ATOM 420 NH1 ARG A 29 91.704 11.559 15.036 1.00 0.00 N ATOM 421 NH2 ARG A 29 90.271 12.492 13.558 1.00 0.00 N ATOM 0 H ARG A 29 93.403 12.124 7.843 1.00 0.00 H new ATOM 0 HA ARG A 29 95.518 11.397 9.778 1.00 0.00 H new ATOM 0 HB2 ARG A 29 92.477 11.090 9.755 1.00 0.00 H new ATOM 0 HB3 ARG A 29 93.502 10.577 11.081 1.00 0.00 H new ATOM 0 HG2 ARG A 29 94.339 12.897 11.374 1.00 0.00 H new ATOM 0 HG3 ARG A 29 93.408 13.432 9.989 1.00 0.00 H new ATOM 0 HD2 ARG A 29 91.993 13.973 11.824 1.00 0.00 H new ATOM 0 HD3 ARG A 29 91.325 12.460 11.245 1.00 0.00 H new ATOM 0 HE ARG A 29 93.406 11.999 13.288 1.00 0.00 H new ATOM 0 HH11 ARG A 29 92.648 11.263 15.285 1.00 0.00 H new ATOM 0 HH12 ARG A 29 90.936 11.422 15.693 1.00 0.00 H new ATOM 0 HH21 ARG A 29 90.094 12.925 12.652 1.00 0.00 H new ATOM 0 HH22 ARG A 29 89.504 12.355 14.216 1.00 0.00 H new ATOM 435 N ASP A 30 94.755 8.800 9.828 1.00 0.00 N ATOM 436 CA ASP A 30 94.777 7.342 9.551 1.00 0.00 C ATOM 437 C ASP A 30 93.919 6.658 10.600 1.00 0.00 C ATOM 438 O ASP A 30 94.183 6.749 11.782 1.00 0.00 O ATOM 439 CB ASP A 30 96.202 6.805 9.636 1.00 0.00 C ATOM 440 CG ASP A 30 97.010 7.292 8.432 1.00 0.00 C ATOM 441 OD1 ASP A 30 98.213 7.437 8.571 1.00 0.00 O ATOM 442 OD2 ASP A 30 96.412 7.513 7.393 1.00 0.00 O ATOM 0 H ASP A 30 94.854 9.046 10.813 1.00 0.00 H new ATOM 0 HA ASP A 30 94.396 7.149 8.548 1.00 0.00 H new ATOM 0 HB2 ASP A 30 96.672 7.139 10.561 1.00 0.00 H new ATOM 0 HB3 ASP A 30 96.189 5.715 9.661 1.00 0.00 H new ATOM 447 N VAL A 31 92.881 5.990 10.177 1.00 0.00 N ATOM 448 CA VAL A 31 91.972 5.307 11.144 1.00 0.00 C ATOM 449 C VAL A 31 91.892 3.820 10.825 1.00 0.00 C ATOM 450 O VAL A 31 92.160 3.389 9.720 1.00 0.00 O ATOM 451 CB VAL A 31 90.579 5.926 11.047 1.00 0.00 C ATOM 452 CG1 VAL A 31 89.702 5.352 12.159 1.00 0.00 C ATOM 453 CG2 VAL A 31 90.683 7.450 11.204 1.00 0.00 C ATOM 0 H VAL A 31 92.621 5.887 9.196 1.00 0.00 H new ATOM 0 HA VAL A 31 92.362 5.432 12.154 1.00 0.00 H new ATOM 0 HB VAL A 31 90.138 5.696 10.077 1.00 0.00 H new ATOM 0 HG11 VAL A 31 88.705 5.788 12.098 1.00 0.00 H new ATOM 0 HG12 VAL A 31 89.632 4.270 12.046 1.00 0.00 H new ATOM 0 HG13 VAL A 31 90.142 5.588 13.128 1.00 0.00 H new ATOM 0 HG21 VAL A 31 89.689 7.892 11.135 1.00 0.00 H new ATOM 0 HG22 VAL A 31 91.118 7.687 12.175 1.00 0.00 H new ATOM 0 HG23 VAL A 31 91.316 7.855 10.414 1.00 0.00 H new ATOM 463 N THR A 32 91.523 3.036 11.801 1.00 0.00 N ATOM 464 CA THR A 32 91.409 1.559 11.607 1.00 0.00 C ATOM 465 C THR A 32 90.072 1.102 12.203 1.00 0.00 C ATOM 466 O THR A 32 89.713 1.484 13.299 1.00 0.00 O ATOM 467 CB THR A 32 92.588 0.865 12.334 1.00 0.00 C ATOM 468 OG1 THR A 32 93.334 1.844 13.041 1.00 0.00 O ATOM 469 CG2 THR A 32 93.516 0.156 11.337 1.00 0.00 C ATOM 0 H THR A 32 91.292 3.360 12.740 1.00 0.00 H new ATOM 0 HA THR A 32 91.446 1.299 10.549 1.00 0.00 H new ATOM 0 HB THR A 32 92.181 0.120 13.018 1.00 0.00 H new ATOM 0 HG1 THR A 32 94.082 1.413 13.506 1.00 0.00 H new ATOM 0 HG21 THR A 32 94.334 -0.321 11.877 1.00 0.00 H new ATOM 0 HG22 THR A 32 92.953 -0.600 10.790 1.00 0.00 H new ATOM 0 HG23 THR A 32 93.922 0.885 10.636 1.00 0.00 H new ATOM 477 N LEU A 33 89.335 0.297 11.482 1.00 0.00 N ATOM 478 CA LEU A 33 88.008 -0.182 11.974 1.00 0.00 C ATOM 479 C LEU A 33 88.040 -1.695 12.186 1.00 0.00 C ATOM 480 O LEU A 33 88.119 -2.454 11.249 1.00 0.00 O ATOM 481 CB LEU A 33 86.957 0.152 10.902 1.00 0.00 C ATOM 482 CG LEU A 33 86.395 1.571 11.106 1.00 0.00 C ATOM 483 CD1 LEU A 33 85.465 1.617 12.333 1.00 0.00 C ATOM 484 CD2 LEU A 33 87.550 2.564 11.291 1.00 0.00 C ATOM 0 H LEU A 33 89.600 -0.053 10.561 1.00 0.00 H new ATOM 0 HA LEU A 33 87.767 0.301 12.921 1.00 0.00 H new ATOM 0 HB2 LEU A 33 87.405 0.073 9.911 1.00 0.00 H new ATOM 0 HB3 LEU A 33 86.145 -0.574 10.944 1.00 0.00 H new ATOM 0 HG LEU A 33 85.817 1.846 10.224 1.00 0.00 H new ATOM 0 HD11 LEU A 33 85.079 2.628 12.459 1.00 0.00 H new ATOM 0 HD12 LEU A 33 84.634 0.927 12.186 1.00 0.00 H new ATOM 0 HD13 LEU A 33 86.023 1.328 13.224 1.00 0.00 H new ATOM 0 HD21 LEU A 33 87.148 3.567 11.435 1.00 0.00 H new ATOM 0 HD22 LEU A 33 88.138 2.280 12.164 1.00 0.00 H new ATOM 0 HD23 LEU A 33 88.186 2.552 10.406 1.00 0.00 H new ATOM 496 N ARG A 34 87.938 -2.124 13.412 1.00 0.00 N ATOM 497 CA ARG A 34 87.937 -3.574 13.714 1.00 0.00 C ATOM 498 C ARG A 34 86.775 -4.223 12.965 1.00 0.00 C ATOM 499 O ARG A 34 85.622 -3.946 13.229 1.00 0.00 O ATOM 500 CB ARG A 34 87.727 -3.750 15.230 1.00 0.00 C ATOM 501 CG ARG A 34 88.426 -5.009 15.712 1.00 0.00 C ATOM 502 CD ARG A 34 89.942 -4.869 15.534 1.00 0.00 C ATOM 503 NE ARG A 34 90.330 -3.436 15.338 1.00 0.00 N ATOM 504 CZ ARG A 34 91.495 -2.996 15.744 1.00 0.00 C ATOM 505 NH1 ARG A 34 91.807 -1.740 15.580 1.00 0.00 N ATOM 506 NH2 ARG A 34 92.351 -3.810 16.302 1.00 0.00 N ATOM 0 H ARG A 34 87.854 -1.518 14.228 1.00 0.00 H new ATOM 0 HA ARG A 34 88.877 -4.035 13.410 1.00 0.00 H new ATOM 0 HB2 ARG A 34 88.117 -2.882 15.762 1.00 0.00 H new ATOM 0 HB3 ARG A 34 86.662 -3.808 15.453 1.00 0.00 H new ATOM 0 HG2 ARG A 34 88.190 -5.187 16.761 1.00 0.00 H new ATOM 0 HG3 ARG A 34 88.064 -5.872 15.153 1.00 0.00 H new ATOM 0 HD2 ARG A 34 90.453 -5.271 16.409 1.00 0.00 H new ATOM 0 HD3 ARG A 34 90.267 -5.458 14.676 1.00 0.00 H new ATOM 0 HE ARG A 34 89.680 -2.795 14.883 1.00 0.00 H new ATOM 0 HH11 ARG A 34 91.145 -1.104 15.137 1.00 0.00 H new ATOM 0 HH12 ARG A 34 92.713 -1.394 15.895 1.00 0.00 H new ATOM 0 HH21 ARG A 34 92.114 -4.795 16.424 1.00 0.00 H new ATOM 0 HH22 ARG A 34 93.257 -3.461 16.616 1.00 0.00 H new ATOM 520 N VAL A 35 87.072 -5.071 12.020 1.00 0.00 N ATOM 521 CA VAL A 35 85.987 -5.730 11.233 1.00 0.00 C ATOM 522 C VAL A 35 86.336 -7.188 10.960 1.00 0.00 C ATOM 523 O VAL A 35 87.286 -7.732 11.488 1.00 0.00 O ATOM 524 CB VAL A 35 85.824 -5.013 9.895 1.00 0.00 C ATOM 525 CG1 VAL A 35 85.212 -3.632 10.126 1.00 0.00 C ATOM 526 CG2 VAL A 35 87.190 -4.856 9.223 1.00 0.00 C ATOM 0 H VAL A 35 88.021 -5.338 11.757 1.00 0.00 H new ATOM 0 HA VAL A 35 85.063 -5.680 11.809 1.00 0.00 H new ATOM 0 HB VAL A 35 85.169 -5.600 9.251 1.00 0.00 H new ATOM 0 HG11 VAL A 35 85.096 -3.121 9.170 1.00 0.00 H new ATOM 0 HG12 VAL A 35 84.236 -3.741 10.600 1.00 0.00 H new ATOM 0 HG13 VAL A 35 85.866 -3.048 10.773 1.00 0.00 H new ATOM 0 HG21 VAL A 35 87.069 -4.344 8.268 1.00 0.00 H new ATOM 0 HG22 VAL A 35 87.848 -4.272 9.867 1.00 0.00 H new ATOM 0 HG23 VAL A 35 87.628 -5.840 9.054 1.00 0.00 H new ATOM 536 N THR A 36 85.562 -7.810 10.116 1.00 0.00 N ATOM 537 CA THR A 36 85.793 -9.225 9.748 1.00 0.00 C ATOM 538 C THR A 36 85.425 -9.364 8.276 1.00 0.00 C ATOM 539 O THR A 36 84.946 -8.431 7.662 1.00 0.00 O ATOM 540 CB THR A 36 84.883 -10.133 10.585 1.00 0.00 C ATOM 541 OG1 THR A 36 83.579 -9.572 10.629 1.00 0.00 O ATOM 542 CG2 THR A 36 85.421 -10.270 12.010 1.00 0.00 C ATOM 0 H THR A 36 84.759 -7.381 9.657 1.00 0.00 H new ATOM 0 HA THR A 36 86.830 -9.510 9.928 1.00 0.00 H new ATOM 0 HB THR A 36 84.853 -11.121 10.126 1.00 0.00 H new ATOM 0 HG1 THR A 36 83.046 -10.036 11.308 1.00 0.00 H new ATOM 0 HG21 THR A 36 84.761 -10.918 12.587 1.00 0.00 H new ATOM 0 HG22 THR A 36 86.421 -10.703 11.981 1.00 0.00 H new ATOM 0 HG23 THR A 36 85.465 -9.287 12.478 1.00 0.00 H new ATOM 550 N GLY A 37 85.633 -10.503 7.696 1.00 0.00 N ATOM 551 CA GLY A 37 85.283 -10.673 6.266 1.00 0.00 C ATOM 552 C GLY A 37 83.799 -10.966 6.137 1.00 0.00 C ATOM 553 O GLY A 37 83.375 -11.814 5.378 1.00 0.00 O ATOM 0 H GLY A 37 86.031 -11.326 8.149 1.00 0.00 H new ATOM 0 HA2 GLY A 37 85.536 -9.770 5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 37 85.864 -11.487 5.833 1.00 0.00 H new ATOM 557 N GLU A 38 83.006 -10.240 6.869 1.00 0.00 N ATOM 558 CA GLU A 38 81.532 -10.425 6.803 1.00 0.00 C ATOM 559 C GLU A 38 80.856 -9.066 6.987 1.00 0.00 C ATOM 560 O GLU A 38 79.647 -8.974 7.066 1.00 0.00 O ATOM 561 CB GLU A 38 81.071 -11.376 7.908 1.00 0.00 C ATOM 562 CG GLU A 38 81.659 -10.935 9.252 1.00 0.00 C ATOM 563 CD GLU A 38 80.838 -11.531 10.399 1.00 0.00 C ATOM 564 OE1 GLU A 38 80.210 -12.554 10.182 1.00 0.00 O ATOM 565 OE2 GLU A 38 80.852 -10.953 11.473 1.00 0.00 O ATOM 0 H GLU A 38 83.319 -9.518 7.518 1.00 0.00 H new ATOM 0 HA GLU A 38 81.262 -10.851 5.837 1.00 0.00 H new ATOM 0 HB2 GLU A 38 79.982 -11.384 7.962 1.00 0.00 H new ATOM 0 HB3 GLU A 38 81.387 -12.394 7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 38 82.697 -11.259 9.329 1.00 0.00 H new ATOM 0 HG3 GLU A 38 81.659 -9.847 9.320 1.00 0.00 H new ATOM 572 N VAL A 39 81.623 -8.000 7.060 1.00 0.00 N ATOM 573 CA VAL A 39 81.003 -6.658 7.240 1.00 0.00 C ATOM 574 C VAL A 39 80.706 -6.034 5.880 1.00 0.00 C ATOM 575 O VAL A 39 81.514 -6.069 4.981 1.00 0.00 O ATOM 576 CB VAL A 39 81.943 -5.748 8.043 1.00 0.00 C ATOM 577 CG1 VAL A 39 82.531 -6.551 9.198 1.00 0.00 C ATOM 578 CG2 VAL A 39 83.082 -5.197 7.162 1.00 0.00 C ATOM 0 H VAL A 39 82.641 -8.007 7.003 1.00 0.00 H new ATOM 0 HA VAL A 39 80.068 -6.771 7.789 1.00 0.00 H new ATOM 0 HB VAL A 39 81.372 -4.899 8.419 1.00 0.00 H new ATOM 0 HG11 VAL A 39 83.202 -5.917 9.778 1.00 0.00 H new ATOM 0 HG12 VAL A 39 81.726 -6.909 9.839 1.00 0.00 H new ATOM 0 HG13 VAL A 39 83.087 -7.402 8.804 1.00 0.00 H new ATOM 0 HG21 VAL A 39 83.729 -4.557 7.762 1.00 0.00 H new ATOM 0 HG22 VAL A 39 83.664 -6.026 6.760 1.00 0.00 H new ATOM 0 HG23 VAL A 39 82.659 -4.618 6.341 1.00 0.00 H new ATOM 588 N HIS A 40 79.568 -5.442 5.728 1.00 0.00 N ATOM 589 CA HIS A 40 79.251 -4.801 4.424 1.00 0.00 C ATOM 590 C HIS A 40 80.046 -3.490 4.327 1.00 0.00 C ATOM 591 O HIS A 40 80.216 -2.790 5.305 1.00 0.00 O ATOM 592 CB HIS A 40 77.740 -4.528 4.333 1.00 0.00 C ATOM 593 CG HIS A 40 76.990 -5.569 5.120 1.00 0.00 C ATOM 594 ND1 HIS A 40 77.302 -6.918 5.049 1.00 0.00 N ATOM 595 CD2 HIS A 40 75.940 -5.474 6.001 1.00 0.00 C ATOM 596 CE1 HIS A 40 76.456 -7.574 5.865 1.00 0.00 C ATOM 597 NE2 HIS A 40 75.605 -6.741 6.470 1.00 0.00 N ATOM 0 H HIS A 40 78.843 -5.370 6.441 1.00 0.00 H new ATOM 0 HA HIS A 40 79.526 -5.457 3.598 1.00 0.00 H new ATOM 0 HB2 HIS A 40 77.516 -3.534 4.720 1.00 0.00 H new ATOM 0 HB3 HIS A 40 77.419 -4.544 3.291 1.00 0.00 H new ATOM 0 HD2 HIS A 40 75.449 -4.555 6.286 1.00 0.00 H new ATOM 0 HE1 HIS A 40 76.464 -8.644 6.013 1.00 0.00 H new ATOM 0 HE2 HIS A 40 74.868 -6.982 7.133 1.00 0.00 H new ATOM 605 N ILE A 41 80.547 -3.158 3.166 1.00 0.00 N ATOM 606 CA ILE A 41 81.341 -1.896 3.031 1.00 0.00 C ATOM 607 C ILE A 41 80.598 -0.747 3.708 1.00 0.00 C ATOM 608 O ILE A 41 81.105 -0.103 4.604 1.00 0.00 O ATOM 609 CB ILE A 41 81.527 -1.542 1.559 1.00 0.00 C ATOM 610 CG1 ILE A 41 82.041 -2.758 0.782 1.00 0.00 C ATOM 611 CG2 ILE A 41 82.537 -0.401 1.441 1.00 0.00 C ATOM 612 CD1 ILE A 41 82.208 -2.394 -0.699 1.00 0.00 C ATOM 0 H ILE A 41 80.443 -3.701 2.309 1.00 0.00 H new ATOM 0 HA ILE A 41 82.313 -2.050 3.499 1.00 0.00 H new ATOM 0 HB ILE A 41 80.568 -1.236 1.142 1.00 0.00 H new ATOM 0 HG12 ILE A 41 82.994 -3.089 1.195 1.00 0.00 H new ATOM 0 HG13 ILE A 41 81.343 -3.589 0.886 1.00 0.00 H new ATOM 0 HG21 ILE A 41 82.674 -0.144 0.391 1.00 0.00 H new ATOM 0 HG22 ILE A 41 82.167 0.470 1.983 1.00 0.00 H new ATOM 0 HG23 ILE A 41 83.491 -0.714 1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 41 82.574 -3.262 -1.248 1.00 0.00 H new ATOM 0 HD12 ILE A 41 81.246 -2.085 -1.108 1.00 0.00 H new ATOM 0 HD13 ILE A 41 82.923 -1.577 -0.794 1.00 0.00 H new ATOM 624 N GLY A 42 79.397 -0.488 3.281 1.00 0.00 N ATOM 625 CA GLY A 42 78.610 0.615 3.891 1.00 0.00 C ATOM 626 C GLY A 42 78.564 0.389 5.393 1.00 0.00 C ATOM 627 O GLY A 42 78.212 1.261 6.164 1.00 0.00 O ATOM 0 H GLY A 42 78.924 -0.995 2.533 1.00 0.00 H new ATOM 0 HA2 GLY A 42 79.067 1.578 3.665 1.00 0.00 H new ATOM 0 HA3 GLY A 42 77.601 0.636 3.478 1.00 0.00 H new ATOM 631 N GLY A 43 78.940 -0.784 5.808 1.00 0.00 N ATOM 632 CA GLY A 43 78.948 -1.096 7.260 1.00 0.00 C ATOM 633 C GLY A 43 80.126 -0.368 7.903 1.00 0.00 C ATOM 634 O GLY A 43 80.092 0.003 9.055 1.00 0.00 O ATOM 0 H GLY A 43 79.244 -1.545 5.200 1.00 0.00 H new ATOM 0 HA2 GLY A 43 78.011 -0.782 7.720 1.00 0.00 H new ATOM 0 HA3 GLY A 43 79.036 -2.171 7.416 1.00 0.00 H new ATOM 638 N VAL A 44 81.158 -0.150 7.142 1.00 0.00 N ATOM 639 CA VAL A 44 82.357 0.569 7.654 1.00 0.00 C ATOM 640 C VAL A 44 82.089 2.072 7.537 1.00 0.00 C ATOM 641 O VAL A 44 82.432 2.846 8.408 1.00 0.00 O ATOM 642 CB VAL A 44 83.573 0.155 6.801 1.00 0.00 C ATOM 643 CG1 VAL A 44 84.674 1.222 6.869 1.00 0.00 C ATOM 644 CG2 VAL A 44 84.133 -1.172 7.323 1.00 0.00 C ATOM 0 H VAL A 44 81.224 -0.445 6.168 1.00 0.00 H new ATOM 0 HA VAL A 44 82.562 0.323 8.696 1.00 0.00 H new ATOM 0 HB VAL A 44 83.248 0.047 5.766 1.00 0.00 H new ATOM 0 HG11 VAL A 44 85.522 0.909 6.260 1.00 0.00 H new ATOM 0 HG12 VAL A 44 84.287 2.169 6.493 1.00 0.00 H new ATOM 0 HG13 VAL A 44 84.996 1.347 7.903 1.00 0.00 H new ATOM 0 HG21 VAL A 44 84.993 -1.466 6.721 1.00 0.00 H new ATOM 0 HG22 VAL A 44 84.441 -1.053 8.362 1.00 0.00 H new ATOM 0 HG23 VAL A 44 83.364 -1.942 7.258 1.00 0.00 H new ATOM 654 N MET A 45 81.457 2.481 6.469 1.00 0.00 N ATOM 655 CA MET A 45 81.135 3.927 6.287 1.00 0.00 C ATOM 656 C MET A 45 80.544 4.465 7.591 1.00 0.00 C ATOM 657 O MET A 45 80.807 5.580 7.998 1.00 0.00 O ATOM 658 CB MET A 45 80.068 4.066 5.182 1.00 0.00 C ATOM 659 CG MET A 45 80.696 4.062 3.775 1.00 0.00 C ATOM 660 SD MET A 45 79.630 4.993 2.631 1.00 0.00 S ATOM 661 CE MET A 45 78.165 3.916 2.633 1.00 0.00 C ATOM 0 H MET A 45 81.148 1.872 5.711 1.00 0.00 H new ATOM 0 HA MET A 45 82.036 4.478 6.017 1.00 0.00 H new ATOM 0 HB2 MET A 45 79.353 3.248 5.263 1.00 0.00 H new ATOM 0 HB3 MET A 45 79.511 4.992 5.329 1.00 0.00 H new ATOM 0 HG2 MET A 45 81.690 4.509 3.808 1.00 0.00 H new ATOM 0 HG3 MET A 45 80.818 3.038 3.423 1.00 0.00 H new ATOM 0 HE1 MET A 45 77.278 4.508 2.409 1.00 0.00 H new ATOM 0 HE2 MET A 45 78.283 3.139 1.878 1.00 0.00 H new ATOM 0 HE3 MET A 45 78.054 3.454 3.614 1.00 0.00 H new ATOM 671 N LEU A 46 79.719 3.683 8.230 1.00 0.00 N ATOM 672 CA LEU A 46 79.074 4.151 9.489 1.00 0.00 C ATOM 673 C LEU A 46 80.056 4.050 10.668 1.00 0.00 C ATOM 674 O LEU A 46 80.338 5.031 11.323 1.00 0.00 O ATOM 675 CB LEU A 46 77.801 3.305 9.746 1.00 0.00 C ATOM 676 CG LEU A 46 76.599 4.226 10.062 1.00 0.00 C ATOM 677 CD1 LEU A 46 75.289 3.427 10.061 1.00 0.00 C ATOM 678 CD2 LEU A 46 76.805 4.872 11.437 1.00 0.00 C ATOM 0 H LEU A 46 79.463 2.741 7.935 1.00 0.00 H new ATOM 0 HA LEU A 46 78.791 5.199 9.390 1.00 0.00 H new ATOM 0 HB2 LEU A 46 77.579 2.694 8.871 1.00 0.00 H new ATOM 0 HB3 LEU A 46 77.972 2.621 10.577 1.00 0.00 H new ATOM 0 HG LEU A 46 76.535 4.997 9.294 1.00 0.00 H new ATOM 0 HD11 LEU A 46 74.456 4.093 10.285 1.00 0.00 H new ATOM 0 HD12 LEU A 46 75.139 2.976 9.080 1.00 0.00 H new ATOM 0 HD13 LEU A 46 75.340 2.643 10.817 1.00 0.00 H new ATOM 0 HD21 LEU A 46 75.960 5.522 11.664 1.00 0.00 H new ATOM 0 HD22 LEU A 46 76.879 4.094 12.197 1.00 0.00 H new ATOM 0 HD23 LEU A 46 77.723 5.460 11.429 1.00 0.00 H new ATOM 690 N LYS A 47 80.573 2.883 10.954 1.00 0.00 N ATOM 691 CA LYS A 47 81.520 2.762 12.107 1.00 0.00 C ATOM 692 C LYS A 47 82.577 3.869 12.032 1.00 0.00 C ATOM 693 O LYS A 47 82.717 4.668 12.936 1.00 0.00 O ATOM 694 CB LYS A 47 82.232 1.408 12.079 1.00 0.00 C ATOM 695 CG LYS A 47 81.215 0.269 12.011 1.00 0.00 C ATOM 696 CD LYS A 47 81.934 -1.029 11.617 1.00 0.00 C ATOM 697 CE LYS A 47 81.051 -2.235 11.938 1.00 0.00 C ATOM 698 NZ LYS A 47 80.793 -2.286 13.404 1.00 0.00 N ATOM 0 H LYS A 47 80.385 2.018 10.448 1.00 0.00 H new ATOM 0 HA LYS A 47 80.945 2.852 13.029 1.00 0.00 H new ATOM 0 HB2 LYS A 47 82.899 1.359 11.219 1.00 0.00 H new ATOM 0 HB3 LYS A 47 82.851 1.298 12.969 1.00 0.00 H new ATOM 0 HG2 LYS A 47 80.723 0.147 12.976 1.00 0.00 H new ATOM 0 HG3 LYS A 47 80.438 0.503 11.284 1.00 0.00 H new ATOM 0 HD2 LYS A 47 82.171 -1.014 10.553 1.00 0.00 H new ATOM 0 HD3 LYS A 47 82.880 -1.108 12.153 1.00 0.00 H new ATOM 0 HE2 LYS A 47 80.109 -2.164 11.394 1.00 0.00 H new ATOM 0 HE3 LYS A 47 81.539 -3.153 11.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 80.598 -3.267 13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 81.628 -1.937 13.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 79.972 -1.690 13.633 1.00 0.00 H new ATOM 712 N LEU A 48 83.328 3.913 10.964 1.00 0.00 N ATOM 713 CA LEU A 48 84.388 4.956 10.825 1.00 0.00 C ATOM 714 C LEU A 48 83.815 6.321 11.226 1.00 0.00 C ATOM 715 O LEU A 48 84.482 7.124 11.848 1.00 0.00 O ATOM 716 CB LEU A 48 84.874 4.969 9.362 1.00 0.00 C ATOM 717 CG LEU A 48 85.786 6.176 9.055 1.00 0.00 C ATOM 718 CD1 LEU A 48 87.110 6.062 9.800 1.00 0.00 C ATOM 719 CD2 LEU A 48 86.085 6.193 7.562 1.00 0.00 C ATOM 0 H LEU A 48 83.253 3.268 10.177 1.00 0.00 H new ATOM 0 HA LEU A 48 85.232 4.736 11.478 1.00 0.00 H new ATOM 0 HB2 LEU A 48 85.415 4.046 9.154 1.00 0.00 H new ATOM 0 HB3 LEU A 48 84.012 4.990 8.696 1.00 0.00 H new ATOM 0 HG LEU A 48 85.275 7.086 9.370 1.00 0.00 H new ATOM 0 HD11 LEU A 48 87.734 6.925 9.567 1.00 0.00 H new ATOM 0 HD12 LEU A 48 86.922 6.030 10.873 1.00 0.00 H new ATOM 0 HD13 LEU A 48 87.622 5.150 9.494 1.00 0.00 H new ATOM 0 HD21 LEU A 48 86.729 7.041 7.330 1.00 0.00 H new ATOM 0 HD22 LEU A 48 86.588 5.268 7.281 1.00 0.00 H new ATOM 0 HD23 LEU A 48 85.152 6.282 7.005 1.00 0.00 H new ATOM 731 N VAL A 49 82.587 6.588 10.881 1.00 0.00 N ATOM 732 CA VAL A 49 81.979 7.897 11.252 1.00 0.00 C ATOM 733 C VAL A 49 81.557 7.863 12.723 1.00 0.00 C ATOM 734 O VAL A 49 81.758 8.809 13.458 1.00 0.00 O ATOM 735 CB VAL A 49 80.753 8.153 10.375 1.00 0.00 C ATOM 736 CG1 VAL A 49 80.042 9.427 10.834 1.00 0.00 C ATOM 737 CG2 VAL A 49 81.193 8.315 8.917 1.00 0.00 C ATOM 0 H VAL A 49 81.978 5.958 10.359 1.00 0.00 H new ATOM 0 HA VAL A 49 82.707 8.694 11.101 1.00 0.00 H new ATOM 0 HB VAL A 49 80.069 7.308 10.461 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.170 9.604 10.205 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.725 9.313 11.871 1.00 0.00 H new ATOM 0 HG13 VAL A 49 80.724 10.273 10.754 1.00 0.00 H new ATOM 0 HG21 VAL A 49 80.319 8.498 8.291 1.00 0.00 H new ATOM 0 HG22 VAL A 49 81.880 9.157 8.836 1.00 0.00 H new ATOM 0 HG23 VAL A 49 81.693 7.405 8.585 1.00 0.00 H new ATOM 747 N GLU A 50 80.973 6.776 13.159 1.00 0.00 N ATOM 748 CA GLU A 50 80.538 6.676 14.583 1.00 0.00 C ATOM 749 C GLU A 50 81.666 7.158 15.489 1.00 0.00 C ATOM 750 O GLU A 50 81.447 7.833 16.475 1.00 0.00 O ATOM 751 CB GLU A 50 80.220 5.220 14.919 1.00 0.00 C ATOM 752 CG GLU A 50 78.911 4.814 14.244 1.00 0.00 C ATOM 753 CD GLU A 50 77.741 5.507 14.944 1.00 0.00 C ATOM 754 OE1 GLU A 50 77.151 6.387 14.339 1.00 0.00 O ATOM 755 OE2 GLU A 50 77.456 5.147 16.074 1.00 0.00 O ATOM 0 H GLU A 50 80.779 5.953 12.589 1.00 0.00 H new ATOM 0 HA GLU A 50 79.651 7.291 14.734 1.00 0.00 H new ATOM 0 HB2 GLU A 50 81.030 4.573 14.583 1.00 0.00 H new ATOM 0 HB3 GLU A 50 80.139 5.094 15.999 1.00 0.00 H new ATOM 0 HG2 GLU A 50 78.932 5.089 13.189 1.00 0.00 H new ATOM 0 HG3 GLU A 50 78.786 3.732 14.289 1.00 0.00 H new ATOM 762 N LYS A 51 82.873 6.812 15.157 1.00 0.00 N ATOM 763 CA LYS A 51 84.025 7.240 15.986 1.00 0.00 C ATOM 764 C LYS A 51 84.302 8.722 15.738 1.00 0.00 C ATOM 765 O LYS A 51 84.701 9.449 16.626 1.00 0.00 O ATOM 766 CB LYS A 51 85.235 6.403 15.605 1.00 0.00 C ATOM 767 CG LYS A 51 84.857 4.929 15.748 1.00 0.00 C ATOM 768 CD LYS A 51 86.105 4.048 15.712 1.00 0.00 C ATOM 769 CE LYS A 51 87.014 4.446 14.546 1.00 0.00 C ATOM 770 NZ LYS A 51 87.802 5.656 14.918 1.00 0.00 N ATOM 0 H LYS A 51 83.112 6.248 14.342 1.00 0.00 H new ATOM 0 HA LYS A 51 83.807 7.098 17.044 1.00 0.00 H new ATOM 0 HB2 LYS A 51 85.541 6.620 14.582 1.00 0.00 H new ATOM 0 HB3 LYS A 51 86.082 6.643 16.248 1.00 0.00 H new ATOM 0 HG2 LYS A 51 84.323 4.774 16.685 1.00 0.00 H new ATOM 0 HG3 LYS A 51 84.179 4.642 14.944 1.00 0.00 H new ATOM 0 HD2 LYS A 51 86.649 4.141 16.652 1.00 0.00 H new ATOM 0 HD3 LYS A 51 85.815 3.002 15.613 1.00 0.00 H new ATOM 0 HE2 LYS A 51 87.686 3.624 14.298 1.00 0.00 H new ATOM 0 HE3 LYS A 51 86.416 4.648 13.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 87.422 6.485 14.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 87.737 5.811 15.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 88.798 5.517 14.652 1.00 0.00 H new ATOM 784 N LEU A 52 84.084 9.176 14.533 1.00 0.00 N ATOM 785 CA LEU A 52 84.319 10.602 14.216 1.00 0.00 C ATOM 786 C LEU A 52 83.173 11.430 14.806 1.00 0.00 C ATOM 787 O LEU A 52 83.352 12.167 15.752 1.00 0.00 O ATOM 788 CB LEU A 52 84.366 10.756 12.677 1.00 0.00 C ATOM 789 CG LEU A 52 85.505 11.704 12.266 1.00 0.00 C ATOM 790 CD1 LEU A 52 86.830 10.937 12.242 1.00 0.00 C ATOM 791 CD2 LEU A 52 85.228 12.282 10.873 1.00 0.00 C ATOM 0 H LEU A 52 83.750 8.610 13.753 1.00 0.00 H new ATOM 0 HA LEU A 52 85.261 10.950 14.641 1.00 0.00 H new ATOM 0 HB2 LEU A 52 84.511 9.781 12.212 1.00 0.00 H new ATOM 0 HB3 LEU A 52 83.414 11.143 12.315 1.00 0.00 H new ATOM 0 HG LEU A 52 85.567 12.518 12.988 1.00 0.00 H new ATOM 0 HD11 LEU A 52 87.635 11.611 11.950 1.00 0.00 H new ATOM 0 HD12 LEU A 52 87.035 10.534 13.234 1.00 0.00 H new ATOM 0 HD13 LEU A 52 86.764 10.119 11.525 1.00 0.00 H new ATOM 0 HD21 LEU A 52 86.039 12.952 10.589 1.00 0.00 H new ATOM 0 HD22 LEU A 52 85.158 11.470 10.149 1.00 0.00 H new ATOM 0 HD23 LEU A 52 84.289 12.835 10.889 1.00 0.00 H new ATOM 803 N ASP A 53 82.001 11.282 14.251 1.00 0.00 N ATOM 804 CA ASP A 53 80.816 12.008 14.736 1.00 0.00 C ATOM 805 C ASP A 53 81.115 13.490 14.798 1.00 0.00 C ATOM 806 O ASP A 53 81.211 14.068 15.862 1.00 0.00 O ATOM 807 CB ASP A 53 80.491 11.505 16.112 1.00 0.00 C ATOM 808 CG ASP A 53 79.968 10.071 16.029 1.00 0.00 C ATOM 809 OD1 ASP A 53 79.829 9.450 17.071 1.00 0.00 O ATOM 810 OD2 ASP A 53 79.711 9.620 14.926 1.00 0.00 O ATOM 0 H ASP A 53 81.821 10.667 13.458 1.00 0.00 H new ATOM 0 HA ASP A 53 79.974 11.846 14.063 1.00 0.00 H new ATOM 0 HB2 ASP A 53 81.380 11.542 16.742 1.00 0.00 H new ATOM 0 HB3 ASP A 53 79.744 12.148 16.577 1.00 0.00 H new ATOM 815 N VAL A 54 81.287 14.108 13.666 1.00 0.00 N ATOM 816 CA VAL A 54 81.610 15.554 13.645 1.00 0.00 C ATOM 817 C VAL A 54 80.780 16.260 12.563 1.00 0.00 C ATOM 818 O VAL A 54 81.188 17.242 11.978 1.00 0.00 O ATOM 819 CB VAL A 54 83.137 15.701 13.448 1.00 0.00 C ATOM 820 CG1 VAL A 54 83.853 14.453 13.972 1.00 0.00 C ATOM 821 CG2 VAL A 54 83.515 15.927 11.974 1.00 0.00 C ATOM 0 H VAL A 54 81.217 13.668 12.749 1.00 0.00 H new ATOM 0 HA VAL A 54 81.347 16.038 14.585 1.00 0.00 H new ATOM 0 HB VAL A 54 83.452 16.580 14.011 1.00 0.00 H new ATOM 0 HG11 VAL A 54 84.928 14.564 13.830 1.00 0.00 H new ATOM 0 HG12 VAL A 54 83.638 14.329 15.033 1.00 0.00 H new ATOM 0 HG13 VAL A 54 83.503 13.577 13.426 1.00 0.00 H new ATOM 0 HG21 VAL A 54 84.597 16.024 11.887 1.00 0.00 H new ATOM 0 HG22 VAL A 54 83.178 15.079 11.378 1.00 0.00 H new ATOM 0 HG23 VAL A 54 83.038 16.838 11.612 1.00 0.00 H new ATOM 831 N LYS A 55 79.595 15.768 12.333 1.00 0.00 N ATOM 832 CA LYS A 55 78.687 16.386 11.326 1.00 0.00 C ATOM 833 C LYS A 55 79.468 16.787 10.067 1.00 0.00 C ATOM 834 O LYS A 55 79.008 17.586 9.276 1.00 0.00 O ATOM 835 CB LYS A 55 78.004 17.615 11.947 1.00 0.00 C ATOM 836 CG LYS A 55 76.608 17.820 11.333 1.00 0.00 C ATOM 837 CD LYS A 55 75.577 16.869 11.965 1.00 0.00 C ATOM 838 CE LYS A 55 74.165 17.354 11.629 1.00 0.00 C ATOM 839 NZ LYS A 55 73.167 16.382 12.160 1.00 0.00 N ATOM 0 H LYS A 55 79.211 14.951 12.808 1.00 0.00 H new ATOM 0 HA LYS A 55 77.929 15.659 11.034 1.00 0.00 H new ATOM 0 HB2 LYS A 55 77.918 17.485 13.026 1.00 0.00 H new ATOM 0 HB3 LYS A 55 78.615 18.502 11.780 1.00 0.00 H new ATOM 0 HG2 LYS A 55 76.292 18.853 11.479 1.00 0.00 H new ATOM 0 HG3 LYS A 55 76.652 17.650 10.257 1.00 0.00 H new ATOM 0 HD2 LYS A 55 75.724 15.856 11.591 1.00 0.00 H new ATOM 0 HD3 LYS A 55 75.714 16.833 13.046 1.00 0.00 H new ATOM 0 HE2 LYS A 55 73.995 18.340 12.062 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.051 17.456 10.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 72.207 16.711 11.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 73.326 15.450 11.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.271 16.306 13.192 1.00 0.00 H new ATOM 853 N LYS A 56 80.634 16.234 9.859 1.00 0.00 N ATOM 854 CA LYS A 56 81.400 16.600 8.628 1.00 0.00 C ATOM 855 C LYS A 56 80.755 15.890 7.446 1.00 0.00 C ATOM 856 O LYS A 56 80.168 14.837 7.586 1.00 0.00 O ATOM 857 CB LYS A 56 82.869 16.152 8.753 1.00 0.00 C ATOM 858 CG LYS A 56 83.620 16.356 7.427 1.00 0.00 C ATOM 859 CD LYS A 56 85.070 15.875 7.578 1.00 0.00 C ATOM 860 CE LYS A 56 85.807 16.710 8.638 1.00 0.00 C ATOM 861 NZ LYS A 56 87.265 16.712 8.335 1.00 0.00 N ATOM 0 H LYS A 56 81.084 15.557 10.475 1.00 0.00 H new ATOM 0 HA LYS A 56 81.381 17.681 8.490 1.00 0.00 H new ATOM 0 HB2 LYS A 56 83.360 16.718 9.544 1.00 0.00 H new ATOM 0 HB3 LYS A 56 82.910 15.101 9.041 1.00 0.00 H new ATOM 0 HG2 LYS A 56 83.124 15.804 6.628 1.00 0.00 H new ATOM 0 HG3 LYS A 56 83.603 17.409 7.146 1.00 0.00 H new ATOM 0 HD2 LYS A 56 85.083 14.823 7.862 1.00 0.00 H new ATOM 0 HD3 LYS A 56 85.587 15.953 6.621 1.00 0.00 H new ATOM 0 HE2 LYS A 56 85.424 17.730 8.645 1.00 0.00 H new ATOM 0 HE3 LYS A 56 85.631 16.296 9.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 87.802 16.560 9.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 87.481 15.950 7.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 87.532 17.627 7.919 1.00 0.00 H new ATOM 875 N ASP A 57 80.854 16.461 6.282 1.00 0.00 N ATOM 876 CA ASP A 57 80.245 15.823 5.094 1.00 0.00 C ATOM 877 C ASP A 57 80.752 14.391 4.988 1.00 0.00 C ATOM 878 O ASP A 57 81.747 14.115 4.348 1.00 0.00 O ATOM 879 CB ASP A 57 80.640 16.603 3.839 1.00 0.00 C ATOM 880 CG ASP A 57 80.448 18.100 4.086 1.00 0.00 C ATOM 881 OD1 ASP A 57 81.005 18.599 5.050 1.00 0.00 O ATOM 882 OD2 ASP A 57 79.747 18.724 3.305 1.00 0.00 O ATOM 0 H ASP A 57 81.332 17.344 6.105 1.00 0.00 H new ATOM 0 HA ASP A 57 79.159 15.822 5.188 1.00 0.00 H new ATOM 0 HB2 ASP A 57 81.679 16.397 3.582 1.00 0.00 H new ATOM 0 HB3 ASP A 57 80.032 16.283 2.993 1.00 0.00 H new ATOM 887 N TRP A 58 80.062 13.475 5.601 1.00 0.00 N ATOM 888 CA TRP A 58 80.482 12.059 5.530 1.00 0.00 C ATOM 889 C TRP A 58 80.045 11.511 4.173 1.00 0.00 C ATOM 890 O TRP A 58 80.773 10.817 3.495 1.00 0.00 O ATOM 891 CB TRP A 58 79.778 11.274 6.629 1.00 0.00 C ATOM 892 CG TRP A 58 80.023 11.875 7.982 1.00 0.00 C ATOM 893 CD1 TRP A 58 81.207 12.348 8.446 1.00 0.00 C ATOM 894 CD2 TRP A 58 79.063 12.054 9.062 1.00 0.00 C ATOM 895 NE1 TRP A 58 81.026 12.804 9.748 1.00 0.00 N ATOM 896 CE2 TRP A 58 79.721 12.642 10.166 1.00 0.00 C ATOM 897 CE3 TRP A 58 77.693 11.763 9.186 1.00 0.00 C ATOM 898 CZ2 TRP A 58 79.043 12.928 11.350 1.00 0.00 C ATOM 899 CZ3 TRP A 58 77.008 12.052 10.377 1.00 0.00 C ATOM 900 CH2 TRP A 58 77.682 12.632 11.457 1.00 0.00 C ATOM 0 H TRP A 58 79.221 13.651 6.150 1.00 0.00 H new ATOM 0 HA TRP A 58 81.561 11.972 5.654 1.00 0.00 H new ATOM 0 HB2 TRP A 58 78.707 11.249 6.430 1.00 0.00 H new ATOM 0 HB3 TRP A 58 80.128 10.242 6.620 1.00 0.00 H new ATOM 0 HD1 TRP A 58 82.136 12.367 7.896 1.00 0.00 H new ATOM 0 HE1 TRP A 58 81.766 13.208 10.322 1.00 0.00 H new ATOM 0 HE3 TRP A 58 77.164 11.314 8.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 79.568 13.376 12.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 75.955 11.825 10.460 1.00 0.00 H new ATOM 0 HH2 TRP A 58 77.151 12.851 12.372 1.00 0.00 H new ATOM 911 N SER A 59 78.848 11.833 3.778 1.00 0.00 N ATOM 912 CA SER A 59 78.330 11.358 2.466 1.00 0.00 C ATOM 913 C SER A 59 79.311 11.754 1.364 1.00 0.00 C ATOM 914 O SER A 59 79.695 10.949 0.539 1.00 0.00 O ATOM 915 CB SER A 59 76.976 12.011 2.195 1.00 0.00 C ATOM 916 OG SER A 59 76.429 11.486 0.993 1.00 0.00 O ATOM 0 H SER A 59 78.199 12.411 4.313 1.00 0.00 H new ATOM 0 HA SER A 59 78.218 10.274 2.485 1.00 0.00 H new ATOM 0 HB2 SER A 59 76.297 11.825 3.028 1.00 0.00 H new ATOM 0 HB3 SER A 59 77.091 13.092 2.113 1.00 0.00 H new ATOM 0 HG SER A 59 75.867 10.711 1.201 1.00 0.00 H new ATOM 922 N ASP A 60 79.725 12.992 1.350 1.00 0.00 N ATOM 923 CA ASP A 60 80.688 13.445 0.309 1.00 0.00 C ATOM 924 C ASP A 60 81.967 12.617 0.415 1.00 0.00 C ATOM 925 O ASP A 60 82.895 12.795 -0.346 1.00 0.00 O ATOM 926 CB ASP A 60 81.023 14.919 0.538 1.00 0.00 C ATOM 927 CG ASP A 60 82.049 15.380 -0.500 1.00 0.00 C ATOM 928 OD1 ASP A 60 82.738 16.351 -0.232 1.00 0.00 O ATOM 929 OD2 ASP A 60 82.128 14.754 -1.544 1.00 0.00 O ATOM 0 H ASP A 60 79.437 13.709 2.016 1.00 0.00 H new ATOM 0 HA ASP A 60 80.247 13.318 -0.680 1.00 0.00 H new ATOM 0 HB2 ASP A 60 80.119 15.524 0.464 1.00 0.00 H new ATOM 0 HB3 ASP A 60 81.419 15.060 1.544 1.00 0.00 H new ATOM 934 N HIS A 61 82.021 11.716 1.366 1.00 0.00 N ATOM 935 CA HIS A 61 83.228 10.863 1.556 1.00 0.00 C ATOM 936 C HIS A 61 82.828 9.388 1.477 1.00 0.00 C ATOM 937 O HIS A 61 81.737 9.006 1.853 1.00 0.00 O ATOM 938 CB HIS A 61 83.831 11.157 2.928 1.00 0.00 C ATOM 939 CG HIS A 61 84.544 12.481 2.896 1.00 0.00 C ATOM 940 ND1 HIS A 61 83.912 13.651 2.503 1.00 0.00 N ATOM 941 CD2 HIS A 61 85.833 12.838 3.207 1.00 0.00 C ATOM 942 CE1 HIS A 61 84.813 14.646 2.586 1.00 0.00 C ATOM 943 NE2 HIS A 61 86.000 14.206 3.010 1.00 0.00 N ATOM 0 H HIS A 61 81.266 11.536 2.027 1.00 0.00 H new ATOM 0 HA HIS A 61 83.960 11.078 0.778 1.00 0.00 H new ATOM 0 HB2 HIS A 61 83.046 11.174 3.685 1.00 0.00 H new ATOM 0 HB3 HIS A 61 84.526 10.365 3.207 1.00 0.00 H new ATOM 0 HD1 HIS A 61 82.941 13.741 2.205 1.00 0.00 H new ATOM 0 HD2 HIS A 61 86.600 12.161 3.552 1.00 0.00 H new ATOM 0 HE1 HIS A 61 84.602 15.676 2.340 1.00 0.00 H new ATOM 951 N ALA A 62 83.708 8.557 0.989 1.00 0.00 N ATOM 952 CA ALA A 62 83.396 7.104 0.878 1.00 0.00 C ATOM 953 C ALA A 62 84.709 6.317 0.856 1.00 0.00 C ATOM 954 O ALA A 62 85.778 6.890 0.924 1.00 0.00 O ATOM 955 CB ALA A 62 82.616 6.852 -0.413 1.00 0.00 C ATOM 0 H ALA A 62 84.636 8.824 0.660 1.00 0.00 H new ATOM 0 HA ALA A 62 82.793 6.783 1.727 1.00 0.00 H new ATOM 0 HB1 ALA A 62 82.386 5.790 -0.498 1.00 0.00 H new ATOM 0 HB2 ALA A 62 81.688 7.424 -0.395 1.00 0.00 H new ATOM 0 HB3 ALA A 62 83.217 7.162 -1.268 1.00 0.00 H new ATOM 961 N LEU A 63 84.647 5.010 0.775 1.00 0.00 N ATOM 962 CA LEU A 63 85.907 4.205 0.766 1.00 0.00 C ATOM 963 C LEU A 63 86.338 3.899 -0.672 1.00 0.00 C ATOM 964 O LEU A 63 85.532 3.612 -1.533 1.00 0.00 O ATOM 965 CB LEU A 63 85.680 2.882 1.509 1.00 0.00 C ATOM 966 CG LEU A 63 85.468 3.117 3.011 1.00 0.00 C ATOM 967 CD1 LEU A 63 86.696 3.803 3.640 1.00 0.00 C ATOM 968 CD2 LEU A 63 84.209 3.969 3.244 1.00 0.00 C ATOM 0 H LEU A 63 83.784 4.469 0.715 1.00 0.00 H new ATOM 0 HA LEU A 63 86.689 4.782 1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 63 84.811 2.372 1.092 1.00 0.00 H new ATOM 0 HB3 LEU A 63 86.537 2.226 1.359 1.00 0.00 H new ATOM 0 HG LEU A 63 85.335 2.147 3.491 1.00 0.00 H new ATOM 0 HD11 LEU A 63 86.521 3.958 4.705 1.00 0.00 H new ATOM 0 HD12 LEU A 63 87.574 3.172 3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 63 86.863 4.765 3.156 1.00 0.00 H new ATOM 0 HD21 LEU A 63 84.070 4.128 4.313 1.00 0.00 H new ATOM 0 HD22 LEU A 63 84.324 4.932 2.746 1.00 0.00 H new ATOM 0 HD23 LEU A 63 83.339 3.452 2.838 1.00 0.00 H new ATOM 980 N TRP A 64 87.622 3.959 -0.925 1.00 0.00 N ATOM 981 CA TRP A 64 88.160 3.671 -2.294 1.00 0.00 C ATOM 982 C TRP A 64 89.380 2.750 -2.128 1.00 0.00 C ATOM 983 O TRP A 64 90.084 2.815 -1.141 1.00 0.00 O ATOM 984 CB TRP A 64 88.490 5.033 -2.979 1.00 0.00 C ATOM 985 CG TRP A 64 89.949 5.215 -3.297 1.00 0.00 C ATOM 986 CD1 TRP A 64 90.971 5.131 -2.412 1.00 0.00 C ATOM 987 CD2 TRP A 64 90.550 5.565 -4.579 1.00 0.00 C ATOM 988 NE1 TRP A 64 92.158 5.373 -3.079 1.00 0.00 N ATOM 989 CE2 TRP A 64 91.951 5.651 -4.414 1.00 0.00 C ATOM 990 CE3 TRP A 64 90.019 5.804 -5.860 1.00 0.00 C ATOM 991 CZ2 TRP A 64 92.797 5.967 -5.478 1.00 0.00 C ATOM 992 CZ3 TRP A 64 90.866 6.124 -6.934 1.00 0.00 C ATOM 993 CH2 TRP A 64 92.253 6.206 -6.743 1.00 0.00 C ATOM 0 H TRP A 64 88.331 4.199 -0.232 1.00 0.00 H new ATOM 0 HA TRP A 64 87.446 3.156 -2.937 1.00 0.00 H new ATOM 0 HB2 TRP A 64 87.914 5.114 -3.901 1.00 0.00 H new ATOM 0 HB3 TRP A 64 88.166 5.845 -2.328 1.00 0.00 H new ATOM 0 HD1 TRP A 64 90.875 4.911 -1.359 1.00 0.00 H new ATOM 0 HE1 TRP A 64 93.077 5.349 -2.637 1.00 0.00 H new ATOM 0 HE3 TRP A 64 88.953 5.741 -6.019 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 93.864 6.026 -5.325 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 90.447 6.308 -7.912 1.00 0.00 H new ATOM 0 HH2 TRP A 64 92.900 6.453 -7.572 1.00 0.00 H new ATOM 1004 N TRP A 65 89.610 1.859 -3.063 1.00 0.00 N ATOM 1005 CA TRP A 65 90.764 0.909 -2.942 1.00 0.00 C ATOM 1006 C TRP A 65 91.861 1.343 -3.912 1.00 0.00 C ATOM 1007 O TRP A 65 91.861 0.952 -5.056 1.00 0.00 O ATOM 1008 CB TRP A 65 90.278 -0.503 -3.304 1.00 0.00 C ATOM 1009 CG TRP A 65 91.227 -1.549 -2.794 1.00 0.00 C ATOM 1010 CD1 TRP A 65 92.465 -1.324 -2.289 1.00 0.00 C ATOM 1011 CD2 TRP A 65 91.025 -2.993 -2.742 1.00 0.00 C ATOM 1012 NE1 TRP A 65 93.033 -2.538 -1.941 1.00 0.00 N ATOM 1013 CE2 TRP A 65 92.184 -3.594 -2.197 1.00 0.00 C ATOM 1014 CE3 TRP A 65 89.958 -3.831 -3.114 1.00 0.00 C ATOM 1015 CZ2 TRP A 65 92.282 -4.976 -2.026 1.00 0.00 C ATOM 1016 CZ3 TRP A 65 90.053 -5.223 -2.945 1.00 0.00 C ATOM 1017 CH2 TRP A 65 91.212 -5.793 -2.401 1.00 0.00 C ATOM 0 H TRP A 65 89.048 1.748 -3.907 1.00 0.00 H new ATOM 0 HA TRP A 65 91.157 0.910 -1.925 1.00 0.00 H new ATOM 0 HB2 TRP A 65 89.287 -0.669 -2.881 1.00 0.00 H new ATOM 0 HB3 TRP A 65 90.182 -0.591 -4.386 1.00 0.00 H new ATOM 0 HD1 TRP A 65 92.932 -0.357 -2.177 1.00 0.00 H new ATOM 0 HE1 TRP A 65 93.967 -2.639 -1.543 1.00 0.00 H new ATOM 0 HE3 TRP A 65 89.060 -3.402 -3.532 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 93.178 -5.410 -1.607 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 89.228 -5.857 -3.236 1.00 0.00 H new ATOM 0 HH2 TRP A 65 91.278 -6.863 -2.272 1.00 0.00 H new ATOM 1028 N GLU A 66 92.781 2.162 -3.478 1.00 0.00 N ATOM 1029 CA GLU A 66 93.853 2.629 -4.406 1.00 0.00 C ATOM 1030 C GLU A 66 94.595 1.441 -5.021 1.00 0.00 C ATOM 1031 O GLU A 66 95.175 1.560 -6.077 1.00 0.00 O ATOM 1032 CB GLU A 66 94.839 3.534 -3.676 1.00 0.00 C ATOM 1033 CG GLU A 66 95.297 2.867 -2.387 1.00 0.00 C ATOM 1034 CD GLU A 66 96.132 3.852 -1.568 1.00 0.00 C ATOM 1035 OE1 GLU A 66 95.640 4.314 -0.552 1.00 0.00 O ATOM 1036 OE2 GLU A 66 97.250 4.129 -1.971 1.00 0.00 O ATOM 0 H GLU A 66 92.838 2.526 -2.527 1.00 0.00 H new ATOM 0 HA GLU A 66 93.379 3.197 -5.206 1.00 0.00 H new ATOM 0 HB2 GLU A 66 95.698 3.740 -4.314 1.00 0.00 H new ATOM 0 HB3 GLU A 66 94.370 4.492 -3.453 1.00 0.00 H new ATOM 0 HG2 GLU A 66 94.433 2.539 -1.809 1.00 0.00 H new ATOM 0 HG3 GLU A 66 95.885 1.978 -2.615 1.00 0.00 H new ATOM 1043 N LYS A 67 94.575 0.289 -4.409 1.00 0.00 N ATOM 1044 CA LYS A 67 95.268 -0.858 -5.052 1.00 0.00 C ATOM 1045 C LYS A 67 94.505 -1.128 -6.342 1.00 0.00 C ATOM 1046 O LYS A 67 94.966 -1.798 -7.244 1.00 0.00 O ATOM 1047 CB LYS A 67 95.193 -2.120 -4.196 1.00 0.00 C ATOM 1048 CG LYS A 67 96.080 -2.036 -2.932 1.00 0.00 C ATOM 1049 CD LYS A 67 96.224 -0.609 -2.396 1.00 0.00 C ATOM 1050 CE LYS A 67 96.997 -0.645 -1.076 1.00 0.00 C ATOM 1051 NZ LYS A 67 98.265 -1.406 -1.265 1.00 0.00 N ATOM 0 H LYS A 67 94.122 0.096 -3.516 1.00 0.00 H new ATOM 0 HA LYS A 67 96.320 -0.618 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 67 94.159 -2.292 -3.898 1.00 0.00 H new ATOM 0 HB3 LYS A 67 95.499 -2.979 -4.794 1.00 0.00 H new ATOM 0 HG2 LYS A 67 95.655 -2.669 -2.154 1.00 0.00 H new ATOM 0 HG3 LYS A 67 97.069 -2.434 -3.162 1.00 0.00 H new ATOM 0 HD2 LYS A 67 96.747 0.014 -3.121 1.00 0.00 H new ATOM 0 HD3 LYS A 67 95.241 -0.164 -2.244 1.00 0.00 H new ATOM 0 HE2 LYS A 67 97.215 0.369 -0.742 1.00 0.00 H new ATOM 0 HE3 LYS A 67 96.391 -1.113 -0.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 98.941 -1.144 -0.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 98.069 -2.426 -1.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 98.671 -1.179 -2.195 1.00 0.00 H new ATOM 1065 N LYS A 68 93.301 -0.612 -6.393 1.00 0.00 N ATOM 1066 CA LYS A 68 92.405 -0.811 -7.567 1.00 0.00 C ATOM 1067 C LYS A 68 91.945 0.555 -8.091 1.00 0.00 C ATOM 1068 O LYS A 68 91.347 0.653 -9.144 1.00 0.00 O ATOM 1069 CB LYS A 68 91.160 -1.628 -7.136 1.00 0.00 C ATOM 1070 CG LYS A 68 91.498 -2.620 -6.007 1.00 0.00 C ATOM 1071 CD LYS A 68 92.225 -3.839 -6.583 1.00 0.00 C ATOM 1072 CE LYS A 68 92.753 -4.720 -5.442 1.00 0.00 C ATOM 1073 NZ LYS A 68 92.894 -6.123 -5.926 1.00 0.00 N ATOM 0 H LYS A 68 92.895 -0.047 -5.648 1.00 0.00 H new ATOM 0 HA LYS A 68 92.946 -1.347 -8.347 1.00 0.00 H new ATOM 0 HB2 LYS A 68 90.376 -0.949 -6.802 1.00 0.00 H new ATOM 0 HB3 LYS A 68 90.766 -2.172 -7.994 1.00 0.00 H new ATOM 0 HG2 LYS A 68 92.123 -2.133 -5.259 1.00 0.00 H new ATOM 0 HG3 LYS A 68 90.585 -2.935 -5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 68 91.546 -4.414 -7.214 1.00 0.00 H new ATOM 0 HD3 LYS A 68 93.051 -3.515 -7.216 1.00 0.00 H new ATOM 0 HE2 LYS A 68 93.715 -4.345 -5.094 1.00 0.00 H new ATOM 0 HE3 LYS A 68 92.070 -4.683 -4.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 93.252 -6.722 -5.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 91.967 -6.477 -6.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 93.561 -6.150 -6.723 1.00 0.00 H new ATOM 1087 N ARG A 69 92.186 1.605 -7.347 1.00 0.00 N ATOM 1088 CA ARG A 69 91.728 2.951 -7.787 1.00 0.00 C ATOM 1089 C ARG A 69 90.237 2.850 -8.083 1.00 0.00 C ATOM 1090 O ARG A 69 89.762 3.279 -9.116 1.00 0.00 O ATOM 1091 CB ARG A 69 92.479 3.395 -9.055 1.00 0.00 C ATOM 1092 CG ARG A 69 93.909 3.864 -8.713 1.00 0.00 C ATOM 1093 CD ARG A 69 94.860 2.665 -8.659 1.00 0.00 C ATOM 1094 NE ARG A 69 95.264 2.288 -10.043 1.00 0.00 N ATOM 1095 CZ ARG A 69 96.071 3.058 -10.720 1.00 0.00 C ATOM 1096 NH1 ARG A 69 96.428 2.727 -11.930 1.00 0.00 N ATOM 1097 NH2 ARG A 69 96.520 4.161 -10.186 1.00 0.00 N ATOM 0 H ARG A 69 92.680 1.585 -6.455 1.00 0.00 H new ATOM 0 HA ARG A 69 91.925 3.687 -7.008 1.00 0.00 H new ATOM 0 HB2 ARG A 69 92.523 2.569 -9.764 1.00 0.00 H new ATOM 0 HB3 ARG A 69 91.933 4.204 -9.541 1.00 0.00 H new ATOM 0 HG2 ARG A 69 94.254 4.578 -9.461 1.00 0.00 H new ATOM 0 HG3 ARG A 69 93.910 4.382 -7.754 1.00 0.00 H new ATOM 0 HD2 ARG A 69 95.741 2.912 -8.066 1.00 0.00 H new ATOM 0 HD3 ARG A 69 94.372 1.822 -8.169 1.00 0.00 H new ATOM 0 HE ARG A 69 94.910 1.428 -10.461 1.00 0.00 H new ATOM 0 HH11 ARG A 69 96.076 1.866 -12.348 1.00 0.00 H new ATOM 0 HH12 ARG A 69 97.059 3.330 -12.458 1.00 0.00 H new ATOM 0 HH21 ARG A 69 96.240 4.420 -9.240 1.00 0.00 H new ATOM 0 HH22 ARG A 69 97.151 4.764 -10.715 1.00 0.00 H new ATOM 1111 N THR A 70 89.502 2.250 -7.180 1.00 0.00 N ATOM 1112 CA THR A 70 88.035 2.065 -7.382 1.00 0.00 C ATOM 1113 C THR A 70 87.262 2.858 -6.341 1.00 0.00 C ATOM 1114 O THR A 70 87.822 3.604 -5.573 1.00 0.00 O ATOM 1115 CB THR A 70 87.715 0.572 -7.213 1.00 0.00 C ATOM 1116 OG1 THR A 70 86.445 0.289 -7.782 1.00 0.00 O ATOM 1117 CG2 THR A 70 87.712 0.176 -5.728 1.00 0.00 C ATOM 0 H THR A 70 89.862 1.877 -6.302 1.00 0.00 H new ATOM 0 HA THR A 70 87.751 2.413 -8.375 1.00 0.00 H new ATOM 0 HB THR A 70 88.486 -0.005 -7.724 1.00 0.00 H new ATOM 0 HG1 THR A 70 86.312 -0.681 -7.819 1.00 0.00 H new ATOM 0 HG21 THR A 70 87.483 -0.886 -5.635 1.00 0.00 H new ATOM 0 HG22 THR A 70 88.693 0.375 -5.296 1.00 0.00 H new ATOM 0 HG23 THR A 70 86.958 0.758 -5.198 1.00 0.00 H new ATOM 1125 N TRP A 71 85.978 2.638 -6.286 1.00 0.00 N ATOM 1126 CA TRP A 71 85.117 3.300 -5.271 1.00 0.00 C ATOM 1127 C TRP A 71 84.408 2.179 -4.532 1.00 0.00 C ATOM 1128 O TRP A 71 83.467 1.593 -5.001 1.00 0.00 O ATOM 1129 CB TRP A 71 84.108 4.256 -5.933 1.00 0.00 C ATOM 1130 CG TRP A 71 83.692 3.778 -7.291 1.00 0.00 C ATOM 1131 CD1 TRP A 71 83.644 2.489 -7.705 1.00 0.00 C ATOM 1132 CD2 TRP A 71 83.243 4.581 -8.422 1.00 0.00 C ATOM 1133 NE1 TRP A 71 83.184 2.454 -8.999 1.00 0.00 N ATOM 1134 CE2 TRP A 71 82.930 3.716 -9.493 1.00 0.00 C ATOM 1135 CE3 TRP A 71 83.079 5.965 -8.618 1.00 0.00 C ATOM 1136 CZ2 TRP A 71 82.468 4.201 -10.717 1.00 0.00 C ATOM 1137 CZ3 TRP A 71 82.616 6.459 -9.849 1.00 0.00 C ATOM 1138 CH2 TRP A 71 82.311 5.578 -10.896 1.00 0.00 C ATOM 0 H TRP A 71 85.480 2.012 -6.918 1.00 0.00 H new ATOM 0 HA TRP A 71 85.708 3.912 -4.590 1.00 0.00 H new ATOM 0 HB2 TRP A 71 83.228 4.352 -5.297 1.00 0.00 H new ATOM 0 HB3 TRP A 71 84.550 5.249 -6.017 1.00 0.00 H new ATOM 0 HD1 TRP A 71 83.922 1.629 -7.114 1.00 0.00 H new ATOM 0 HE1 TRP A 71 83.046 1.595 -9.532 1.00 0.00 H new ATOM 0 HE3 TRP A 71 83.311 6.652 -7.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 82.234 3.518 -11.520 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 82.494 7.523 -9.989 1.00 0.00 H new ATOM 0 HH2 TRP A 71 81.955 5.963 -11.840 1.00 0.00 H new ATOM 1149 N LEU A 72 84.890 1.838 -3.392 1.00 0.00 N ATOM 1150 CA LEU A 72 84.288 0.707 -2.666 1.00 0.00 C ATOM 1151 C LEU A 72 82.822 0.974 -2.366 1.00 0.00 C ATOM 1152 O LEU A 72 82.449 1.444 -1.311 1.00 0.00 O ATOM 1153 CB LEU A 72 85.081 0.496 -1.393 1.00 0.00 C ATOM 1154 CG LEU A 72 86.500 0.075 -1.775 1.00 0.00 C ATOM 1155 CD1 LEU A 72 87.402 0.147 -0.545 1.00 0.00 C ATOM 1156 CD2 LEU A 72 86.505 -1.350 -2.370 1.00 0.00 C ATOM 0 H LEU A 72 85.676 2.291 -2.927 1.00 0.00 H new ATOM 0 HA LEU A 72 84.324 -0.195 -3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 72 85.103 1.412 -0.803 1.00 0.00 H new ATOM 0 HB3 LEU A 72 84.611 -0.270 -0.776 1.00 0.00 H new ATOM 0 HG LEU A 72 86.880 0.757 -2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 72 88.414 -0.153 -0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 72 87.417 1.168 -0.164 1.00 0.00 H new ATOM 0 HD13 LEU A 72 87.020 -0.522 0.226 1.00 0.00 H new ATOM 0 HD21 LEU A 72 87.525 -1.630 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 72 86.115 -2.053 -1.634 1.00 0.00 H new ATOM 0 HD23 LEU A 72 85.879 -1.374 -3.262 1.00 0.00 H new ATOM 1168 N LEU A 73 81.993 0.636 -3.317 1.00 0.00 N ATOM 1169 CA LEU A 73 80.518 0.797 -3.169 1.00 0.00 C ATOM 1170 C LEU A 73 79.863 -0.579 -3.342 1.00 0.00 C ATOM 1171 O LEU A 73 78.654 -0.703 -3.334 1.00 0.00 O ATOM 1172 CB LEU A 73 79.967 1.795 -4.214 1.00 0.00 C ATOM 1173 CG LEU A 73 80.428 1.435 -5.652 1.00 0.00 C ATOM 1174 CD1 LEU A 73 79.426 0.503 -6.341 1.00 0.00 C ATOM 1175 CD2 LEU A 73 80.559 2.709 -6.497 1.00 0.00 C ATOM 0 H LEU A 73 82.285 0.245 -4.213 1.00 0.00 H new ATOM 0 HA LEU A 73 80.289 1.197 -2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 73 78.878 1.801 -4.172 1.00 0.00 H new ATOM 0 HB3 LEU A 73 80.301 2.802 -3.966 1.00 0.00 H new ATOM 0 HG LEU A 73 81.391 0.930 -5.570 1.00 0.00 H new ATOM 0 HD11 LEU A 73 79.778 0.270 -7.346 1.00 0.00 H new ATOM 0 HD12 LEU A 73 79.332 -0.419 -5.767 1.00 0.00 H new ATOM 0 HD13 LEU A 73 78.455 0.994 -6.401 1.00 0.00 H new ATOM 0 HD21 LEU A 73 80.883 2.446 -7.504 1.00 0.00 H new ATOM 0 HD22 LEU A 73 79.594 3.214 -6.546 1.00 0.00 H new ATOM 0 HD23 LEU A 73 81.293 3.374 -6.042 1.00 0.00 H new ATOM 1187 N LYS A 74 80.653 -1.624 -3.490 1.00 0.00 N ATOM 1188 CA LYS A 74 80.053 -2.985 -3.651 1.00 0.00 C ATOM 1189 C LYS A 74 79.418 -3.420 -2.323 1.00 0.00 C ATOM 1190 O LYS A 74 79.453 -4.582 -1.969 1.00 0.00 O ATOM 1191 CB LYS A 74 81.113 -4.048 -4.053 1.00 0.00 C ATOM 1192 CG LYS A 74 82.301 -3.420 -4.783 1.00 0.00 C ATOM 1193 CD LYS A 74 81.846 -2.791 -6.129 1.00 0.00 C ATOM 1194 CE LYS A 74 82.552 -1.454 -6.360 1.00 0.00 C ATOM 1195 NZ LYS A 74 83.925 -1.700 -6.885 1.00 0.00 N ATOM 0 H LYS A 74 81.672 -1.590 -3.506 1.00 0.00 H new ATOM 0 HA LYS A 74 79.309 -2.921 -4.445 1.00 0.00 H new ATOM 0 HB2 LYS A 74 81.467 -4.564 -3.160 1.00 0.00 H new ATOM 0 HB3 LYS A 74 80.650 -4.799 -4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 74 82.758 -2.656 -4.154 1.00 0.00 H new ATOM 0 HG3 LYS A 74 83.062 -4.178 -4.968 1.00 0.00 H new ATOM 0 HD2 LYS A 74 82.068 -3.473 -6.950 1.00 0.00 H new ATOM 0 HD3 LYS A 74 80.766 -2.642 -6.121 1.00 0.00 H new ATOM 0 HE2 LYS A 74 81.984 -0.848 -7.066 1.00 0.00 H new ATOM 0 HE3 LYS A 74 82.603 -0.892 -5.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 84.405 -0.791 -7.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 84.465 -2.262 -6.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 83.865 -2.219 -7.784 1.00 0.00 H new ATOM 1209 N THR A 75 78.853 -2.515 -1.577 1.00 0.00 N ATOM 1210 CA THR A 75 78.245 -2.916 -0.277 1.00 0.00 C ATOM 1211 C THR A 75 77.285 -4.091 -0.492 1.00 0.00 C ATOM 1212 O THR A 75 76.773 -4.666 0.448 1.00 0.00 O ATOM 1213 CB THR A 75 77.483 -1.733 0.321 1.00 0.00 C ATOM 1214 OG1 THR A 75 78.318 -0.584 0.320 1.00 0.00 O ATOM 1215 CG2 THR A 75 77.066 -2.064 1.755 1.00 0.00 C ATOM 0 H THR A 75 78.785 -1.523 -1.807 1.00 0.00 H new ATOM 0 HA THR A 75 79.036 -3.221 0.409 1.00 0.00 H new ATOM 0 HB THR A 75 76.593 -1.535 -0.276 1.00 0.00 H new ATOM 0 HG1 THR A 75 77.830 0.175 0.702 1.00 0.00 H new ATOM 0 HG21 THR A 75 76.523 -1.220 2.180 1.00 0.00 H new ATOM 0 HG22 THR A 75 76.424 -2.945 1.753 1.00 0.00 H new ATOM 0 HG23 THR A 75 77.954 -2.264 2.355 1.00 0.00 H new ATOM 1223 N HIS A 76 77.036 -4.451 -1.721 1.00 0.00 N ATOM 1224 CA HIS A 76 76.110 -5.584 -1.998 1.00 0.00 C ATOM 1225 C HIS A 76 76.503 -6.805 -1.161 1.00 0.00 C ATOM 1226 O HIS A 76 75.828 -7.163 -0.217 1.00 0.00 O ATOM 1227 CB HIS A 76 76.179 -5.943 -3.483 1.00 0.00 C ATOM 1228 CG HIS A 76 75.304 -7.136 -3.754 1.00 0.00 C ATOM 1229 ND1 HIS A 76 74.408 -7.624 -2.815 1.00 0.00 N ATOM 1230 CD2 HIS A 76 75.177 -7.950 -4.851 1.00 0.00 C ATOM 1231 CE1 HIS A 76 73.787 -8.686 -3.361 1.00 0.00 C ATOM 1232 NE2 HIS A 76 74.219 -8.928 -4.602 1.00 0.00 N ATOM 0 H HIS A 76 77.436 -4.007 -2.548 1.00 0.00 H new ATOM 0 HA HIS A 76 75.095 -5.286 -1.736 1.00 0.00 H new ATOM 0 HB2 HIS A 76 75.854 -5.096 -4.088 1.00 0.00 H new ATOM 0 HB3 HIS A 76 77.208 -6.162 -3.767 1.00 0.00 H new ATOM 0 HD2 HIS A 76 75.736 -7.847 -5.769 1.00 0.00 H new ATOM 0 HE1 HIS A 76 73.032 -9.271 -2.857 1.00 0.00 H new ATOM 0 HE2 HIS A 76 73.913 -9.670 -5.231 1.00 0.00 H new ATOM 1240 N TRP A 77 77.581 -7.463 -1.510 1.00 0.00 N ATOM 1241 CA TRP A 77 78.003 -8.678 -0.742 1.00 0.00 C ATOM 1242 C TRP A 77 78.960 -8.273 0.402 1.00 0.00 C ATOM 1243 O TRP A 77 78.532 -7.632 1.342 1.00 0.00 O ATOM 1244 CB TRP A 77 78.658 -9.675 -1.709 1.00 0.00 C ATOM 1245 CG TRP A 77 78.509 -11.085 -1.213 1.00 0.00 C ATOM 1246 CD1 TRP A 77 78.288 -11.448 0.074 1.00 0.00 C ATOM 1247 CD2 TRP A 77 78.567 -12.323 -1.981 1.00 0.00 C ATOM 1248 NE1 TRP A 77 78.209 -12.828 0.141 1.00 0.00 N ATOM 1249 CE2 TRP A 77 78.375 -13.412 -1.098 1.00 0.00 C ATOM 1250 CE3 TRP A 77 78.768 -12.603 -3.345 1.00 0.00 C ATOM 1251 CZ2 TRP A 77 78.381 -14.731 -1.553 1.00 0.00 C ATOM 1252 CZ3 TRP A 77 78.774 -13.930 -3.806 1.00 0.00 C ATOM 1253 CH2 TRP A 77 78.581 -14.992 -2.911 1.00 0.00 C ATOM 0 H TRP A 77 78.187 -7.213 -2.292 1.00 0.00 H new ATOM 0 HA TRP A 77 77.137 -9.158 -0.286 1.00 0.00 H new ATOM 0 HB2 TRP A 77 78.203 -9.583 -2.695 1.00 0.00 H new ATOM 0 HB3 TRP A 77 79.715 -9.436 -1.822 1.00 0.00 H new ATOM 0 HD1 TRP A 77 78.190 -10.771 0.910 1.00 0.00 H new ATOM 0 HE1 TRP A 77 78.048 -13.350 1.002 1.00 0.00 H new ATOM 0 HE3 TRP A 77 78.919 -11.792 -4.042 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 78.232 -15.545 -0.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 78.928 -14.133 -4.855 1.00 0.00 H new ATOM 0 HH2 TRP A 77 78.587 -16.010 -3.271 1.00 0.00 H new ATOM 1264 N THR A 78 80.239 -8.633 0.382 1.00 0.00 N ATOM 1265 CA THR A 78 81.112 -8.227 1.537 1.00 0.00 C ATOM 1266 C THR A 78 82.583 -8.097 1.111 1.00 0.00 C ATOM 1267 O THR A 78 82.921 -8.023 -0.048 1.00 0.00 O ATOM 1268 CB THR A 78 80.974 -9.294 2.662 1.00 0.00 C ATOM 1269 OG1 THR A 78 79.992 -10.241 2.277 1.00 0.00 O ATOM 1270 CG2 THR A 78 80.552 -8.666 4.005 1.00 0.00 C ATOM 0 H THR A 78 80.695 -9.169 -0.356 1.00 0.00 H new ATOM 0 HA THR A 78 80.789 -7.251 1.899 1.00 0.00 H new ATOM 0 HB THR A 78 81.947 -9.765 2.798 1.00 0.00 H new ATOM 0 HG1 THR A 78 79.898 -10.919 2.979 1.00 0.00 H new ATOM 0 HG21 THR A 78 80.468 -9.447 4.761 1.00 0.00 H new ATOM 0 HG22 THR A 78 81.300 -7.938 4.317 1.00 0.00 H new ATOM 0 HG23 THR A 78 79.589 -8.169 3.888 1.00 0.00 H new ATOM 1278 N LEU A 79 83.454 -8.083 2.078 1.00 0.00 N ATOM 1279 CA LEU A 79 84.914 -7.981 1.798 1.00 0.00 C ATOM 1280 C LEU A 79 85.347 -9.303 1.181 1.00 0.00 C ATOM 1281 O LEU A 79 85.883 -9.372 0.093 1.00 0.00 O ATOM 1282 CB LEU A 79 85.677 -7.821 3.115 1.00 0.00 C ATOM 1283 CG LEU A 79 85.479 -6.427 3.730 1.00 0.00 C ATOM 1284 CD1 LEU A 79 83.991 -6.112 3.853 1.00 0.00 C ATOM 1285 CD2 LEU A 79 86.115 -6.402 5.132 1.00 0.00 C ATOM 0 H LEU A 79 83.213 -8.139 3.068 1.00 0.00 H new ATOM 0 HA LEU A 79 85.114 -7.133 1.143 1.00 0.00 H new ATOM 0 HB2 LEU A 79 85.342 -8.580 3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 79 86.739 -7.993 2.942 1.00 0.00 H new ATOM 0 HG LEU A 79 85.950 -5.683 3.088 1.00 0.00 H new ATOM 0 HD11 LEU A 79 83.864 -5.122 4.290 1.00 0.00 H new ATOM 0 HD12 LEU A 79 83.531 -6.134 2.865 1.00 0.00 H new ATOM 0 HD13 LEU A 79 83.513 -6.855 4.492 1.00 0.00 H new ATOM 0 HD21 LEU A 79 85.979 -5.416 5.576 1.00 0.00 H new ATOM 0 HD22 LEU A 79 85.637 -7.152 5.762 1.00 0.00 H new ATOM 0 HD23 LEU A 79 87.180 -6.620 5.052 1.00 0.00 H new ATOM 1297 N ASP A 80 85.103 -10.351 1.909 1.00 0.00 N ATOM 1298 CA ASP A 80 85.465 -11.717 1.458 1.00 0.00 C ATOM 1299 C ASP A 80 85.126 -11.917 -0.009 1.00 0.00 C ATOM 1300 O ASP A 80 85.904 -12.461 -0.769 1.00 0.00 O ATOM 1301 CB ASP A 80 84.639 -12.699 2.266 1.00 0.00 C ATOM 1302 CG ASP A 80 85.074 -14.130 1.948 1.00 0.00 C ATOM 1303 OD1 ASP A 80 84.856 -14.560 0.827 1.00 0.00 O ATOM 1304 OD2 ASP A 80 85.618 -14.773 2.831 1.00 0.00 O ATOM 0 H ASP A 80 84.655 -10.315 2.824 1.00 0.00 H new ATOM 0 HA ASP A 80 86.536 -11.867 1.594 1.00 0.00 H new ATOM 0 HB2 ASP A 80 84.761 -12.501 3.331 1.00 0.00 H new ATOM 0 HB3 ASP A 80 83.581 -12.572 2.037 1.00 0.00 H new ATOM 1309 N LYS A 81 83.963 -11.510 -0.411 1.00 0.00 N ATOM 1310 CA LYS A 81 83.573 -11.709 -1.817 1.00 0.00 C ATOM 1311 C LYS A 81 84.566 -10.956 -2.701 1.00 0.00 C ATOM 1312 O LYS A 81 84.851 -11.350 -3.814 1.00 0.00 O ATOM 1313 CB LYS A 81 82.092 -11.263 -1.984 1.00 0.00 C ATOM 1314 CG LYS A 81 81.876 -10.342 -3.198 1.00 0.00 C ATOM 1315 CD LYS A 81 82.194 -8.893 -2.834 1.00 0.00 C ATOM 1316 CE LYS A 81 81.624 -7.958 -3.900 1.00 0.00 C ATOM 1317 NZ LYS A 81 82.347 -6.658 -3.855 1.00 0.00 N ATOM 0 H LYS A 81 83.268 -11.049 0.176 1.00 0.00 H new ATOM 0 HA LYS A 81 83.616 -12.754 -2.124 1.00 0.00 H new ATOM 0 HB2 LYS A 81 81.462 -12.146 -2.088 1.00 0.00 H new ATOM 0 HB3 LYS A 81 81.770 -10.746 -1.080 1.00 0.00 H new ATOM 0 HG2 LYS A 81 82.511 -10.664 -4.023 1.00 0.00 H new ATOM 0 HG3 LYS A 81 80.844 -10.419 -3.541 1.00 0.00 H new ATOM 0 HD2 LYS A 81 81.770 -8.651 -1.860 1.00 0.00 H new ATOM 0 HD3 LYS A 81 83.272 -8.756 -2.755 1.00 0.00 H new ATOM 0 HE2 LYS A 81 81.725 -8.409 -4.887 1.00 0.00 H new ATOM 0 HE3 LYS A 81 80.559 -7.800 -3.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 82.121 -6.106 -4.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 82.054 -6.127 -3.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 83.372 -6.832 -3.817 1.00 0.00 H new ATOM 1331 N TYR A 82 85.092 -9.878 -2.210 1.00 0.00 N ATOM 1332 CA TYR A 82 86.066 -9.090 -3.009 1.00 0.00 C ATOM 1333 C TYR A 82 87.454 -9.725 -2.849 1.00 0.00 C ATOM 1334 O TYR A 82 88.158 -9.959 -3.812 1.00 0.00 O ATOM 1335 CB TYR A 82 86.062 -7.641 -2.483 1.00 0.00 C ATOM 1336 CG TYR A 82 86.274 -6.646 -3.610 1.00 0.00 C ATOM 1337 CD1 TYR A 82 85.593 -5.422 -3.589 1.00 0.00 C ATOM 1338 CD2 TYR A 82 87.147 -6.940 -4.666 1.00 0.00 C ATOM 1339 CE1 TYR A 82 85.783 -4.495 -4.621 1.00 0.00 C ATOM 1340 CE2 TYR A 82 87.336 -6.012 -5.698 1.00 0.00 C ATOM 1341 CZ TYR A 82 86.655 -4.790 -5.675 1.00 0.00 C ATOM 1342 OH TYR A 82 86.842 -3.877 -6.692 1.00 0.00 O ATOM 0 H TYR A 82 84.890 -9.504 -1.283 1.00 0.00 H new ATOM 0 HA TYR A 82 85.801 -9.086 -4.066 1.00 0.00 H new ATOM 0 HB2 TYR A 82 85.114 -7.435 -1.986 1.00 0.00 H new ATOM 0 HB3 TYR A 82 86.847 -7.521 -1.736 1.00 0.00 H new ATOM 0 HD1 TYR A 82 84.920 -5.193 -2.776 1.00 0.00 H new ATOM 0 HD2 TYR A 82 87.674 -7.882 -4.684 1.00 0.00 H new ATOM 0 HE1 TYR A 82 85.257 -3.552 -4.604 1.00 0.00 H new ATOM 0 HE2 TYR A 82 88.008 -6.240 -6.512 1.00 0.00 H new ATOM 0 HH TYR A 82 87.480 -4.238 -7.343 1.00 0.00 H new ATOM 1352 N GLY A 83 87.844 -10.011 -1.631 1.00 0.00 N ATOM 1353 CA GLY A 83 89.187 -10.633 -1.380 1.00 0.00 C ATOM 1354 C GLY A 83 90.018 -9.670 -0.538 1.00 0.00 C ATOM 1355 O GLY A 83 91.190 -9.881 -0.297 1.00 0.00 O ATOM 0 H GLY A 83 87.288 -9.840 -0.793 1.00 0.00 H new ATOM 0 HA2 GLY A 83 89.072 -11.586 -0.863 1.00 0.00 H new ATOM 0 HA3 GLY A 83 89.690 -10.841 -2.324 1.00 0.00 H new ATOM 1359 N ILE A 84 89.405 -8.616 -0.086 1.00 0.00 N ATOM 1360 CA ILE A 84 90.123 -7.620 0.750 1.00 0.00 C ATOM 1361 C ILE A 84 90.613 -8.316 2.021 1.00 0.00 C ATOM 1362 O ILE A 84 90.116 -9.359 2.393 1.00 0.00 O ATOM 1363 CB ILE A 84 89.133 -6.493 1.086 1.00 0.00 C ATOM 1364 CG1 ILE A 84 88.748 -5.756 -0.208 1.00 0.00 C ATOM 1365 CG2 ILE A 84 89.751 -5.490 2.057 1.00 0.00 C ATOM 1366 CD1 ILE A 84 87.369 -5.109 -0.043 1.00 0.00 C ATOM 0 H ILE A 84 88.424 -8.400 -0.263 1.00 0.00 H new ATOM 0 HA ILE A 84 90.985 -7.201 0.230 1.00 0.00 H new ATOM 0 HB ILE A 84 88.254 -6.937 1.553 1.00 0.00 H new ATOM 0 HG12 ILE A 84 89.492 -4.994 -0.439 1.00 0.00 H new ATOM 0 HG13 ILE A 84 88.735 -6.454 -1.045 1.00 0.00 H new ATOM 0 HG21 ILE A 84 89.029 -4.704 2.277 1.00 0.00 H new ATOM 0 HG22 ILE A 84 90.025 -5.999 2.981 1.00 0.00 H new ATOM 0 HG23 ILE A 84 90.641 -5.049 1.608 1.00 0.00 H new ATOM 0 HD11 ILE A 84 87.099 -4.588 -0.962 1.00 0.00 H new ATOM 0 HD12 ILE A 84 86.628 -5.880 0.167 1.00 0.00 H new ATOM 0 HD13 ILE A 84 87.397 -4.398 0.783 1.00 0.00 H new ATOM 1378 N GLN A 85 91.577 -7.749 2.695 1.00 0.00 N ATOM 1379 CA GLN A 85 92.087 -8.385 3.947 1.00 0.00 C ATOM 1380 C GLN A 85 92.687 -7.299 4.850 1.00 0.00 C ATOM 1381 O GLN A 85 92.466 -6.121 4.655 1.00 0.00 O ATOM 1382 CB GLN A 85 93.170 -9.434 3.616 1.00 0.00 C ATOM 1383 CG GLN A 85 93.073 -10.632 4.601 1.00 0.00 C ATOM 1384 CD GLN A 85 92.117 -11.680 4.036 1.00 0.00 C ATOM 1385 OE1 GLN A 85 92.417 -12.857 4.015 1.00 0.00 O ATOM 1386 NE2 GLN A 85 90.968 -11.287 3.575 1.00 0.00 N ATOM 0 H GLN A 85 92.034 -6.875 2.435 1.00 0.00 H new ATOM 0 HA GLN A 85 91.262 -8.883 4.456 1.00 0.00 H new ATOM 0 HB2 GLN A 85 93.046 -9.785 2.591 1.00 0.00 H new ATOM 0 HB3 GLN A 85 94.159 -8.980 3.680 1.00 0.00 H new ATOM 0 HG2 GLN A 85 94.059 -11.070 4.756 1.00 0.00 H new ATOM 0 HG3 GLN A 85 92.720 -10.289 5.574 1.00 0.00 H new ATOM 0 HE21 GLN A 85 90.722 -10.297 3.595 1.00 0.00 H new ATOM 0 HE22 GLN A 85 90.312 -11.968 3.193 1.00 0.00 H new ATOM 1395 N ALA A 86 93.450 -7.692 5.829 1.00 0.00 N ATOM 1396 CA ALA A 86 94.079 -6.698 6.742 1.00 0.00 C ATOM 1397 C ALA A 86 95.249 -6.013 6.034 1.00 0.00 C ATOM 1398 O ALA A 86 95.721 -4.976 6.455 1.00 0.00 O ATOM 1399 CB ALA A 86 94.592 -7.439 7.979 1.00 0.00 C ATOM 0 H ALA A 86 93.667 -8.666 6.038 1.00 0.00 H new ATOM 0 HA ALA A 86 93.350 -5.941 7.030 1.00 0.00 H new ATOM 0 HB1 ALA A 86 95.057 -6.728 8.662 1.00 0.00 H new ATOM 0 HB2 ALA A 86 93.758 -7.931 8.480 1.00 0.00 H new ATOM 0 HB3 ALA A 86 95.326 -8.186 7.677 1.00 0.00 H new ATOM 1405 N ASP A 87 95.728 -6.593 4.971 1.00 0.00 N ATOM 1406 CA ASP A 87 96.877 -5.989 4.244 1.00 0.00 C ATOM 1407 C ASP A 87 96.360 -5.012 3.187 1.00 0.00 C ATOM 1408 O ASP A 87 97.120 -4.456 2.420 1.00 0.00 O ATOM 1409 CB ASP A 87 97.677 -7.104 3.565 1.00 0.00 C ATOM 1410 CG ASP A 87 96.717 -8.165 3.026 1.00 0.00 C ATOM 1411 OD1 ASP A 87 96.663 -9.237 3.606 1.00 0.00 O ATOM 1412 OD2 ASP A 87 96.053 -7.889 2.041 1.00 0.00 O ATOM 0 H ASP A 87 95.372 -7.462 4.573 1.00 0.00 H new ATOM 0 HA ASP A 87 97.515 -5.451 4.945 1.00 0.00 H new ATOM 0 HB2 ASP A 87 98.276 -6.693 2.752 1.00 0.00 H new ATOM 0 HB3 ASP A 87 98.370 -7.553 4.276 1.00 0.00 H new ATOM 1417 N ALA A 88 95.072 -4.803 3.136 1.00 0.00 N ATOM 1418 CA ALA A 88 94.500 -3.869 2.126 1.00 0.00 C ATOM 1419 C ALA A 88 94.239 -2.511 2.793 1.00 0.00 C ATOM 1420 O ALA A 88 93.402 -2.391 3.660 1.00 0.00 O ATOM 1421 CB ALA A 88 93.187 -4.479 1.612 1.00 0.00 C ATOM 0 H ALA A 88 94.389 -5.241 3.754 1.00 0.00 H new ATOM 0 HA ALA A 88 95.186 -3.720 1.293 1.00 0.00 H new ATOM 0 HB1 ALA A 88 92.744 -3.816 0.869 1.00 0.00 H new ATOM 0 HB2 ALA A 88 93.390 -5.449 1.158 1.00 0.00 H new ATOM 0 HB3 ALA A 88 92.494 -4.606 2.444 1.00 0.00 H new ATOM 1427 N LYS A 89 94.956 -1.486 2.400 1.00 0.00 N ATOM 1428 CA LYS A 89 94.751 -0.137 3.020 1.00 0.00 C ATOM 1429 C LYS A 89 93.807 0.696 2.157 1.00 0.00 C ATOM 1430 O LYS A 89 94.034 0.917 0.984 1.00 0.00 O ATOM 1431 CB LYS A 89 96.095 0.596 3.165 1.00 0.00 C ATOM 1432 CG LYS A 89 97.207 -0.380 3.571 1.00 0.00 C ATOM 1433 CD LYS A 89 96.987 -0.891 5.003 1.00 0.00 C ATOM 1434 CE LYS A 89 97.791 -2.172 5.213 1.00 0.00 C ATOM 1435 NZ LYS A 89 99.237 -1.897 4.982 1.00 0.00 N ATOM 0 H LYS A 89 95.674 -1.524 1.677 1.00 0.00 H new ATOM 0 HA LYS A 89 94.313 -0.274 4.009 1.00 0.00 H new ATOM 0 HB2 LYS A 89 96.355 1.079 2.223 1.00 0.00 H new ATOM 0 HB3 LYS A 89 96.006 1.384 3.913 1.00 0.00 H new ATOM 0 HG2 LYS A 89 97.229 -1.222 2.879 1.00 0.00 H new ATOM 0 HG3 LYS A 89 98.175 0.115 3.501 1.00 0.00 H new ATOM 0 HD2 LYS A 89 97.295 -0.133 5.723 1.00 0.00 H new ATOM 0 HD3 LYS A 89 95.927 -1.081 5.174 1.00 0.00 H new ATOM 0 HE2 LYS A 89 97.639 -2.547 6.225 1.00 0.00 H new ATOM 0 HE3 LYS A 89 97.444 -2.947 4.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 99.806 -2.672 5.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 99.417 -1.823 3.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 99.499 -1.003 5.445 1.00 0.00 H new ATOM 1449 N LEU A 90 92.741 1.156 2.752 1.00 0.00 N ATOM 1450 CA LEU A 90 91.731 1.985 2.025 1.00 0.00 C ATOM 1451 C LEU A 90 91.861 3.438 2.473 1.00 0.00 C ATOM 1452 O LEU A 90 92.662 3.776 3.315 1.00 0.00 O ATOM 1453 CB LEU A 90 90.301 1.486 2.318 1.00 0.00 C ATOM 1454 CG LEU A 90 90.306 -0.025 2.526 1.00 0.00 C ATOM 1455 CD1 LEU A 90 88.892 -0.496 2.884 1.00 0.00 C ATOM 1456 CD2 LEU A 90 90.777 -0.731 1.244 1.00 0.00 C ATOM 0 H LEU A 90 92.521 0.989 3.734 1.00 0.00 H new ATOM 0 HA LEU A 90 91.915 1.903 0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 90 89.909 1.982 3.206 1.00 0.00 H new ATOM 0 HB3 LEU A 90 89.640 1.745 1.491 1.00 0.00 H new ATOM 0 HG LEU A 90 90.989 -0.272 3.339 1.00 0.00 H new ATOM 0 HD11 LEU A 90 88.895 -1.576 3.033 1.00 0.00 H new ATOM 0 HD12 LEU A 90 88.566 -0.004 3.801 1.00 0.00 H new ATOM 0 HD13 LEU A 90 88.208 -0.243 2.074 1.00 0.00 H new ATOM 0 HD21 LEU A 90 90.777 -1.810 1.402 1.00 0.00 H new ATOM 0 HD22 LEU A 90 90.102 -0.484 0.424 1.00 0.00 H new ATOM 0 HD23 LEU A 90 91.786 -0.400 0.996 1.00 0.00 H new ATOM 1468 N GLN A 91 91.074 4.294 1.897 1.00 0.00 N ATOM 1469 CA GLN A 91 91.092 5.737 2.261 1.00 0.00 C ATOM 1470 C GLN A 91 89.640 6.155 2.475 1.00 0.00 C ATOM 1471 O GLN A 91 88.737 5.455 2.070 1.00 0.00 O ATOM 1472 CB GLN A 91 91.666 6.571 1.108 1.00 0.00 C ATOM 1473 CG GLN A 91 93.013 6.002 0.619 1.00 0.00 C ATOM 1474 CD GLN A 91 93.224 6.384 -0.840 1.00 0.00 C ATOM 1475 OE1 GLN A 91 94.094 5.858 -1.505 1.00 0.00 O ATOM 1476 NE2 GLN A 91 92.459 7.294 -1.358 1.00 0.00 N ATOM 0 H GLN A 91 90.401 4.050 1.170 1.00 0.00 H new ATOM 0 HA GLN A 91 91.704 5.895 3.149 1.00 0.00 H new ATOM 0 HB2 GLN A 91 90.956 6.590 0.282 1.00 0.00 H new ATOM 0 HB3 GLN A 91 91.802 7.602 1.435 1.00 0.00 H new ATOM 0 HG2 GLN A 91 93.828 6.391 1.230 1.00 0.00 H new ATOM 0 HG3 GLN A 91 93.023 4.917 0.728 1.00 0.00 H new ATOM 0 HE21 GLN A 91 91.731 7.731 -0.793 1.00 0.00 H new ATOM 0 HE22 GLN A 91 92.585 7.573 -2.331 1.00 0.00 H new ATOM 1485 N PHE A 92 89.401 7.290 3.081 1.00 0.00 N ATOM 1486 CA PHE A 92 87.991 7.756 3.292 1.00 0.00 C ATOM 1487 C PHE A 92 87.799 9.062 2.522 1.00 0.00 C ATOM 1488 O PHE A 92 88.066 10.142 3.010 1.00 0.00 O ATOM 1489 CB PHE A 92 87.738 7.944 4.792 1.00 0.00 C ATOM 1490 CG PHE A 92 86.357 8.512 5.034 1.00 0.00 C ATOM 1491 CD1 PHE A 92 86.199 9.832 5.480 1.00 0.00 C ATOM 1492 CD2 PHE A 92 85.233 7.703 4.837 1.00 0.00 C ATOM 1493 CE1 PHE A 92 84.917 10.339 5.727 1.00 0.00 C ATOM 1494 CE2 PHE A 92 83.951 8.211 5.080 1.00 0.00 C ATOM 1495 CZ PHE A 92 83.793 9.528 5.526 1.00 0.00 C ATOM 0 H PHE A 92 90.121 7.917 3.440 1.00 0.00 H new ATOM 0 HA PHE A 92 87.275 7.021 2.924 1.00 0.00 H new ATOM 0 HB2 PHE A 92 87.839 6.988 5.305 1.00 0.00 H new ATOM 0 HB3 PHE A 92 88.490 8.612 5.212 1.00 0.00 H new ATOM 0 HD1 PHE A 92 87.066 10.458 5.633 1.00 0.00 H new ATOM 0 HD2 PHE A 92 85.354 6.685 4.497 1.00 0.00 H new ATOM 0 HE1 PHE A 92 84.795 11.355 6.072 1.00 0.00 H new ATOM 0 HE2 PHE A 92 83.084 7.586 4.923 1.00 0.00 H new ATOM 0 HZ PHE A 92 82.804 9.919 5.715 1.00 0.00 H new ATOM 1505 N THR A 93 87.358 8.945 1.295 1.00 0.00 N ATOM 1506 CA THR A 93 87.158 10.145 0.422 1.00 0.00 C ATOM 1507 C THR A 93 85.955 9.900 -0.499 1.00 0.00 C ATOM 1508 O THR A 93 85.544 8.774 -0.693 1.00 0.00 O ATOM 1509 CB THR A 93 88.424 10.358 -0.441 1.00 0.00 C ATOM 1510 OG1 THR A 93 88.053 10.797 -1.742 1.00 0.00 O ATOM 1511 CG2 THR A 93 89.201 9.044 -0.573 1.00 0.00 C ATOM 0 H THR A 93 87.124 8.056 0.853 1.00 0.00 H new ATOM 0 HA THR A 93 86.978 11.026 1.038 1.00 0.00 H new ATOM 0 HB THR A 93 89.049 11.108 0.043 1.00 0.00 H new ATOM 0 HG1 THR A 93 88.858 10.932 -2.284 1.00 0.00 H new ATOM 0 HG21 THR A 93 90.090 9.207 -1.183 1.00 0.00 H new ATOM 0 HG22 THR A 93 89.498 8.696 0.416 1.00 0.00 H new ATOM 0 HG23 THR A 93 88.568 8.293 -1.047 1.00 0.00 H new ATOM 1519 N PRO A 94 85.393 10.942 -1.071 1.00 0.00 N ATOM 1520 CA PRO A 94 84.225 10.816 -1.987 1.00 0.00 C ATOM 1521 C PRO A 94 84.354 9.594 -2.910 1.00 0.00 C ATOM 1522 O PRO A 94 83.341 8.971 -3.179 1.00 0.00 O ATOM 1523 CB PRO A 94 84.235 12.140 -2.797 1.00 0.00 C ATOM 1524 CG PRO A 94 85.393 12.956 -2.266 1.00 0.00 C ATOM 1525 CD PRO A 94 85.786 12.349 -0.919 1.00 0.00 C ATOM 0 HA PRO A 94 83.292 10.664 -1.445 1.00 0.00 H new ATOM 0 HB2 PRO A 94 84.355 11.943 -3.862 1.00 0.00 H new ATOM 0 HB3 PRO A 94 83.294 12.677 -2.676 1.00 0.00 H new ATOM 0 HG2 PRO A 94 86.233 12.931 -2.960 1.00 0.00 H new ATOM 0 HG3 PRO A 94 85.107 14.001 -2.149 1.00 0.00 H new ATOM 0 HD2 PRO A 94 86.854 12.452 -0.724 1.00 0.00 H new ATOM 0 HD3 PRO A 94 85.263 12.828 -0.091 1.00 0.00 H new TER 1533 PRO A 94 ATOM 1534 N TYR B 541 58.430 41.309 15.401 1.00 0.00 N ATOM 1535 CA TYR B 541 57.309 40.450 15.876 1.00 0.00 C ATOM 1536 C TYR B 541 56.124 40.583 14.916 1.00 0.00 C ATOM 1537 O TYR B 541 55.121 41.191 15.234 1.00 0.00 O ATOM 1538 CB TYR B 541 56.886 40.894 17.277 1.00 0.00 C ATOM 1539 CG TYR B 541 55.811 39.967 17.797 1.00 0.00 C ATOM 1540 CD1 TYR B 541 56.143 38.665 18.189 1.00 0.00 C ATOM 1541 CD2 TYR B 541 54.484 40.407 17.886 1.00 0.00 C ATOM 1542 CE1 TYR B 541 55.150 37.803 18.669 1.00 0.00 C ATOM 1543 CE2 TYR B 541 53.492 39.545 18.367 1.00 0.00 C ATOM 1544 CZ TYR B 541 53.824 38.244 18.758 1.00 0.00 C ATOM 1545 OH TYR B 541 52.846 37.394 19.232 1.00 0.00 O ATOM 0 HA TYR B 541 57.634 39.410 15.908 1.00 0.00 H new ATOM 0 HB2 TYR B 541 57.745 40.884 17.948 1.00 0.00 H new ATOM 0 HB3 TYR B 541 56.515 41.919 17.249 1.00 0.00 H new ATOM 0 HD1 TYR B 541 57.166 38.325 18.121 1.00 0.00 H new ATOM 0 HD2 TYR B 541 54.227 41.411 17.583 1.00 0.00 H new ATOM 0 HE1 TYR B 541 55.407 36.798 18.971 1.00 0.00 H new ATOM 0 HE2 TYR B 541 52.469 39.885 18.436 1.00 0.00 H new ATOM 0 HH TYR B 541 51.982 37.856 19.230 1.00 0.00 H new ATOM 1555 N HIS B 542 56.234 40.022 13.743 1.00 0.00 N ATOM 1556 CA HIS B 542 55.122 40.115 12.763 1.00 0.00 C ATOM 1557 C HIS B 542 53.863 39.469 13.345 1.00 0.00 C ATOM 1558 O HIS B 542 53.819 39.111 14.505 1.00 0.00 O ATOM 1559 CB HIS B 542 55.530 39.387 11.484 1.00 0.00 C ATOM 1560 CG HIS B 542 56.922 39.803 11.093 1.00 0.00 C ATOM 1561 ND1 HIS B 542 58.050 39.163 11.580 1.00 0.00 N ATOM 1562 CD2 HIS B 542 57.382 40.796 10.265 1.00 0.00 C ATOM 1563 CE1 HIS B 542 59.125 39.772 11.045 1.00 0.00 C ATOM 1564 NE2 HIS B 542 58.773 40.775 10.236 1.00 0.00 N ATOM 0 H HIS B 542 57.051 39.502 13.423 1.00 0.00 H new ATOM 0 HA HIS B 542 54.912 41.162 12.542 1.00 0.00 H new ATOM 0 HB2 HIS B 542 55.491 38.309 11.638 1.00 0.00 H new ATOM 0 HB3 HIS B 542 54.830 39.620 10.681 1.00 0.00 H new ATOM 0 HD2 HIS B 542 56.759 41.489 9.719 1.00 0.00 H new ATOM 0 HE1 HIS B 542 60.147 39.485 11.245 1.00 0.00 H new ATOM 0 HE2 HIS B 542 59.391 41.393 9.710 1.00 0.00 H new ATOM 1572 N GLU B 543 52.835 39.324 12.543 1.00 0.00 N ATOM 1573 CA GLU B 543 51.560 38.708 13.025 1.00 0.00 C ATOM 1574 C GLU B 543 51.431 37.304 12.413 1.00 0.00 C ATOM 1575 O GLU B 543 50.897 36.397 13.019 1.00 0.00 O ATOM 1576 CB GLU B 543 50.391 39.641 12.603 1.00 0.00 C ATOM 1577 CG GLU B 543 49.173 38.857 12.092 1.00 0.00 C ATOM 1578 CD GLU B 543 48.721 37.850 13.152 1.00 0.00 C ATOM 1579 OE1 GLU B 543 49.188 37.951 14.275 1.00 0.00 O ATOM 1580 OE2 GLU B 543 47.914 36.995 12.824 1.00 0.00 O ATOM 0 H GLU B 543 52.826 39.610 11.564 1.00 0.00 H new ATOM 0 HA GLU B 543 51.542 38.600 14.109 1.00 0.00 H new ATOM 0 HB2 GLU B 543 50.094 40.255 13.453 1.00 0.00 H new ATOM 0 HB3 GLU B 543 50.735 40.321 11.824 1.00 0.00 H new ATOM 0 HG2 GLU B 543 48.359 39.544 11.859 1.00 0.00 H new ATOM 0 HG3 GLU B 543 49.426 38.337 11.168 1.00 0.00 H new ATOM 1587 N ARG B 544 51.910 37.126 11.215 1.00 0.00 N ATOM 1588 CA ARG B 544 51.813 35.785 10.561 1.00 0.00 C ATOM 1589 C ARG B 544 52.942 34.878 11.070 1.00 0.00 C ATOM 1590 O ARG B 544 54.031 34.864 10.530 1.00 0.00 O ATOM 1591 CB ARG B 544 51.899 35.920 9.026 1.00 0.00 C ATOM 1592 CG ARG B 544 51.253 37.247 8.573 1.00 0.00 C ATOM 1593 CD ARG B 544 52.294 38.379 8.590 1.00 0.00 C ATOM 1594 NE ARG B 544 52.841 38.569 7.217 1.00 0.00 N ATOM 1595 CZ ARG B 544 53.496 39.658 6.921 1.00 0.00 C ATOM 1596 NH1 ARG B 544 53.983 39.823 5.721 1.00 0.00 N ATOM 1597 NH2 ARG B 544 53.662 40.585 7.825 1.00 0.00 N ATOM 0 H ARG B 544 52.365 37.849 10.657 1.00 0.00 H new ATOM 0 HA ARG B 544 50.850 35.342 10.815 1.00 0.00 H new ATOM 0 HB2 ARG B 544 52.941 35.887 8.708 1.00 0.00 H new ATOM 0 HB3 ARG B 544 51.394 35.080 8.550 1.00 0.00 H new ATOM 0 HG2 ARG B 544 50.843 37.136 7.569 1.00 0.00 H new ATOM 0 HG3 ARG B 544 50.421 37.498 9.231 1.00 0.00 H new ATOM 0 HD2 ARG B 544 51.836 39.303 8.942 1.00 0.00 H new ATOM 0 HD3 ARG B 544 53.099 38.137 9.284 1.00 0.00 H new ATOM 0 HE ARG B 544 52.703 37.848 6.509 1.00 0.00 H new ATOM 0 HH11 ARG B 544 53.852 39.100 5.013 1.00 0.00 H new ATOM 0 HH12 ARG B 544 54.495 40.675 5.491 1.00 0.00 H new ATOM 0 HH21 ARG B 544 53.280 40.458 8.762 1.00 0.00 H new ATOM 0 HH22 ARG B 544 54.174 41.437 7.594 1.00 0.00 H new ATOM 1611 N ARG B 545 52.689 34.120 12.104 1.00 0.00 N ATOM 1612 CA ARG B 545 53.737 33.216 12.647 1.00 0.00 C ATOM 1613 C ARG B 545 53.950 32.044 11.681 1.00 0.00 C ATOM 1614 O ARG B 545 53.634 32.128 10.510 1.00 0.00 O ATOM 1615 CB ARG B 545 53.279 32.678 14.010 1.00 0.00 C ATOM 1616 CG ARG B 545 53.291 33.805 15.070 1.00 0.00 C ATOM 1617 CD ARG B 545 52.001 34.668 15.010 1.00 0.00 C ATOM 1618 NE ARG B 545 51.320 34.693 16.351 1.00 0.00 N ATOM 1619 CZ ARG B 545 51.024 33.594 16.999 1.00 0.00 C ATOM 1620 NH1 ARG B 545 50.479 33.669 18.182 1.00 0.00 N ATOM 1621 NH2 ARG B 545 51.252 32.427 16.463 1.00 0.00 N ATOM 0 H ARG B 545 51.796 34.090 12.596 1.00 0.00 H new ATOM 0 HA ARG B 545 54.672 33.764 12.763 1.00 0.00 H new ATOM 0 HB2 ARG B 545 52.275 32.262 13.925 1.00 0.00 H new ATOM 0 HB3 ARG B 545 53.935 31.867 14.326 1.00 0.00 H new ATOM 0 HG2 ARG B 545 53.390 33.368 16.064 1.00 0.00 H new ATOM 0 HG3 ARG B 545 54.162 34.442 14.914 1.00 0.00 H new ATOM 0 HD2 ARG B 545 52.250 35.684 14.703 1.00 0.00 H new ATOM 0 HD3 ARG B 545 51.322 34.266 14.258 1.00 0.00 H new ATOM 0 HE ARG B 545 51.082 35.593 16.768 1.00 0.00 H new ATOM 0 HH11 ARG B 545 50.286 34.580 18.598 1.00 0.00 H new ATOM 0 HH12 ARG B 545 50.246 32.816 18.691 1.00 0.00 H new ATOM 0 HH21 ARG B 545 51.664 32.365 15.532 1.00 0.00 H new ATOM 0 HH22 ARG B 545 51.018 31.576 16.975 1.00 0.00 H new ATOM 1635 N GLY B 546 54.484 30.951 12.164 1.00 0.00 N ATOM 1636 CA GLY B 546 54.721 29.767 11.283 1.00 0.00 C ATOM 1637 C GLY B 546 54.558 28.487 12.105 1.00 0.00 C ATOM 1638 O GLY B 546 53.459 28.029 12.348 1.00 0.00 O ATOM 0 H GLY B 546 54.768 30.827 13.136 1.00 0.00 H new ATOM 0 HA2 GLY B 546 54.017 29.771 10.451 1.00 0.00 H new ATOM 0 HA3 GLY B 546 55.722 29.813 10.854 1.00 0.00 H new ATOM 1642 N SER B 547 55.645 27.911 12.541 1.00 0.00 N ATOM 1643 CA SER B 547 55.561 26.667 13.355 1.00 0.00 C ATOM 1644 C SER B 547 56.869 26.524 14.127 1.00 0.00 C ATOM 1645 O SER B 547 57.918 26.398 13.548 1.00 0.00 O ATOM 1646 CB SER B 547 55.361 25.460 12.433 1.00 0.00 C ATOM 1647 OG SER B 547 53.971 25.271 12.205 1.00 0.00 O ATOM 0 H SER B 547 56.591 28.251 12.367 1.00 0.00 H new ATOM 0 HA SER B 547 54.719 26.717 14.046 1.00 0.00 H new ATOM 0 HB2 SER B 547 55.878 25.620 11.487 1.00 0.00 H new ATOM 0 HB3 SER B 547 55.792 24.567 12.885 1.00 0.00 H new ATOM 0 HG SER B 547 53.518 26.140 12.207 1.00 0.00 H new ATOM 1653 N LEU B 548 56.823 26.566 15.423 1.00 0.00 N ATOM 1654 CA LEU B 548 58.080 26.456 16.206 1.00 0.00 C ATOM 1655 C LEU B 548 58.749 25.112 15.944 1.00 0.00 C ATOM 1656 O LEU B 548 58.113 24.086 15.966 1.00 0.00 O ATOM 1657 CB LEU B 548 57.753 26.601 17.711 1.00 0.00 C ATOM 1658 CG LEU B 548 58.068 28.030 18.189 1.00 0.00 C ATOM 1659 CD1 LEU B 548 57.061 29.017 17.592 1.00 0.00 C ATOM 1660 CD2 LEU B 548 58.000 28.100 19.712 1.00 0.00 C ATOM 0 H LEU B 548 55.972 26.672 15.975 1.00 0.00 H new ATOM 0 HA LEU B 548 58.766 27.247 15.903 1.00 0.00 H new ATOM 0 HB2 LEU B 548 56.701 26.375 17.885 1.00 0.00 H new ATOM 0 HB3 LEU B 548 58.333 25.881 18.288 1.00 0.00 H new ATOM 0 HG LEU B 548 59.073 28.294 17.859 1.00 0.00 H new ATOM 0 HD11 LEU B 548 57.292 30.025 17.936 1.00 0.00 H new ATOM 0 HD12 LEU B 548 57.119 28.983 16.504 1.00 0.00 H new ATOM 0 HD13 LEU B 548 56.054 28.747 17.910 1.00 0.00 H new ATOM 0 HD21 LEU B 548 58.224 29.115 20.040 1.00 0.00 H new ATOM 0 HD22 LEU B 548 56.999 27.824 20.045 1.00 0.00 H new ATOM 0 HD23 LEU B 548 58.728 27.411 20.141 1.00 0.00 H new ATOM 1672 N CYS B 549 60.043 25.108 15.740 1.00 0.00 N ATOM 1673 CA CYS B 549 60.744 23.820 15.516 1.00 0.00 C ATOM 1674 C CYS B 549 61.021 23.247 16.896 1.00 0.00 C ATOM 1675 O CYS B 549 61.891 23.697 17.614 1.00 0.00 O ATOM 1676 CB CYS B 549 62.062 24.101 14.772 1.00 0.00 C ATOM 1677 SG CYS B 549 63.285 22.780 15.055 1.00 0.00 S ATOM 0 H CYS B 549 60.635 25.938 15.720 1.00 0.00 H new ATOM 0 HA CYS B 549 60.157 23.122 14.919 1.00 0.00 H new ATOM 0 HB2 CYS B 549 61.865 24.193 13.704 1.00 0.00 H new ATOM 0 HB3 CYS B 549 62.472 25.055 15.104 1.00 0.00 H new ATOM 1682 N SER B 550 60.248 22.275 17.281 1.00 0.00 N ATOM 1683 CA SER B 550 60.413 21.681 18.631 1.00 0.00 C ATOM 1684 C SER B 550 61.871 21.326 18.857 1.00 0.00 C ATOM 1685 O SER B 550 62.506 20.663 18.061 1.00 0.00 O ATOM 1686 CB SER B 550 59.510 20.462 18.792 1.00 0.00 C ATOM 1687 OG SER B 550 59.897 19.740 19.954 1.00 0.00 O ATOM 0 H SER B 550 59.505 21.865 16.715 1.00 0.00 H new ATOM 0 HA SER B 550 60.116 22.410 19.385 1.00 0.00 H new ATOM 0 HB2 SER B 550 58.469 20.775 18.874 1.00 0.00 H new ATOM 0 HB3 SER B 550 59.582 19.823 17.912 1.00 0.00 H new ATOM 0 HG SER B 550 59.108 19.562 20.507 1.00 0.00 H new ATOM 1693 N GLY B 551 62.407 21.822 19.932 1.00 0.00 N ATOM 1694 CA GLY B 551 63.846 21.603 20.255 1.00 0.00 C ATOM 1695 C GLY B 551 64.532 22.944 20.074 1.00 0.00 C ATOM 1696 O GLY B 551 65.442 23.310 20.791 1.00 0.00 O ATOM 0 H GLY B 551 61.900 22.382 20.617 1.00 0.00 H new ATOM 0 HA2 GLY B 551 63.964 21.240 21.276 1.00 0.00 H new ATOM 0 HA3 GLY B 551 64.282 20.851 19.597 1.00 0.00 H new ATOM 1700 N CYS B 552 64.055 23.692 19.121 1.00 0.00 N ATOM 1701 CA CYS B 552 64.595 25.042 18.850 1.00 0.00 C ATOM 1702 C CYS B 552 63.571 26.047 19.364 1.00 0.00 C ATOM 1703 O CYS B 552 63.896 27.105 19.860 1.00 0.00 O ATOM 1704 CB CYS B 552 64.731 25.206 17.336 1.00 0.00 C ATOM 1705 SG CYS B 552 66.321 24.553 16.781 1.00 0.00 S ATOM 0 H CYS B 552 63.292 23.412 18.504 1.00 0.00 H new ATOM 0 HA CYS B 552 65.562 25.191 19.329 1.00 0.00 H new ATOM 0 HB2 CYS B 552 63.918 24.683 16.831 1.00 0.00 H new ATOM 0 HB3 CYS B 552 64.648 26.259 17.068 1.00 0.00 H new ATOM 1710 N GLN B 553 62.324 25.702 19.221 1.00 0.00 N ATOM 1711 CA GLN B 553 61.227 26.595 19.651 1.00 0.00 C ATOM 1712 C GLN B 553 61.373 27.951 18.990 1.00 0.00 C ATOM 1713 O GLN B 553 61.400 28.988 19.621 1.00 0.00 O ATOM 1714 CB GLN B 553 61.178 26.718 21.160 1.00 0.00 C ATOM 1715 CG GLN B 553 60.820 25.351 21.741 1.00 0.00 C ATOM 1716 CD GLN B 553 59.385 24.961 21.372 1.00 0.00 C ATOM 1717 OE1 GLN B 553 58.466 25.163 22.141 1.00 0.00 O ATOM 1718 NE2 GLN B 553 59.164 24.404 20.214 1.00 0.00 N ATOM 0 H GLN B 553 62.017 24.818 18.815 1.00 0.00 H new ATOM 0 HA GLN B 553 60.280 26.158 19.335 1.00 0.00 H new ATOM 0 HB2 GLN B 553 62.141 27.054 21.545 1.00 0.00 H new ATOM 0 HB3 GLN B 553 60.439 27.462 21.457 1.00 0.00 H new ATOM 0 HG2 GLN B 553 61.514 24.599 21.366 1.00 0.00 H new ATOM 0 HG3 GLN B 553 60.928 25.372 22.825 1.00 0.00 H new ATOM 0 HE21 GLN B 553 59.939 24.237 19.572 1.00 0.00 H new ATOM 0 HE22 GLN B 553 58.216 24.136 19.950 1.00 0.00 H new ATOM 1727 N LYS B 554 61.419 27.913 17.698 1.00 0.00 N ATOM 1728 CA LYS B 554 61.512 29.149 16.866 1.00 0.00 C ATOM 1729 C LYS B 554 60.611 28.929 15.631 1.00 0.00 C ATOM 1730 O LYS B 554 60.780 27.945 14.938 1.00 0.00 O ATOM 1731 CB LYS B 554 62.956 29.370 16.400 1.00 0.00 C ATOM 1732 CG LYS B 554 63.875 29.611 17.603 1.00 0.00 C ATOM 1733 CD LYS B 554 63.535 30.948 18.281 1.00 0.00 C ATOM 1734 CE LYS B 554 64.738 31.440 19.093 1.00 0.00 C ATOM 1735 NZ LYS B 554 65.822 31.870 18.166 1.00 0.00 N ATOM 0 H LYS B 554 61.396 27.048 17.158 1.00 0.00 H new ATOM 0 HA LYS B 554 61.200 30.020 17.442 1.00 0.00 H new ATOM 0 HB2 LYS B 554 63.301 28.501 15.839 1.00 0.00 H new ATOM 0 HB3 LYS B 554 63.000 30.224 15.724 1.00 0.00 H new ATOM 0 HG2 LYS B 554 63.768 28.796 18.319 1.00 0.00 H new ATOM 0 HG3 LYS B 554 64.915 29.615 17.278 1.00 0.00 H new ATOM 0 HD2 LYS B 554 63.265 31.689 17.529 1.00 0.00 H new ATOM 0 HD3 LYS B 554 62.670 30.826 18.933 1.00 0.00 H new ATOM 0 HE2 LYS B 554 64.442 32.271 19.734 1.00 0.00 H new ATOM 0 HE3 LYS B 554 65.098 30.646 19.747 1.00 0.00 H new ATOM 0 HZ1 LYS B 554 66.400 32.603 18.624 1.00 0.00 H new ATOM 0 HZ2 LYS B 554 66.422 31.054 17.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 554 65.402 32.254 17.295 1.00 0.00 H new ATOM 1749 N PRO B 555 59.648 29.783 15.346 1.00 0.00 N ATOM 1750 CA PRO B 555 58.752 29.556 14.175 1.00 0.00 C ATOM 1751 C PRO B 555 59.471 29.123 12.898 1.00 0.00 C ATOM 1752 O PRO B 555 60.491 29.659 12.512 1.00 0.00 O ATOM 1753 CB PRO B 555 58.094 30.924 14.003 1.00 0.00 C ATOM 1754 CG PRO B 555 58.209 31.657 15.348 1.00 0.00 C ATOM 1755 CD PRO B 555 59.357 31.005 16.146 1.00 0.00 C ATOM 0 HA PRO B 555 58.061 28.732 14.351 1.00 0.00 H new ATOM 0 HB2 PRO B 555 58.586 31.491 13.213 1.00 0.00 H new ATOM 0 HB3 PRO B 555 57.049 30.814 13.713 1.00 0.00 H new ATOM 0 HG2 PRO B 555 58.408 32.717 15.189 1.00 0.00 H new ATOM 0 HG3 PRO B 555 57.272 31.588 15.901 1.00 0.00 H new ATOM 0 HD2 PRO B 555 60.225 31.660 16.218 1.00 0.00 H new ATOM 0 HD3 PRO B 555 59.056 30.762 17.165 1.00 0.00 H new ATOM 1763 N ILE B 556 58.904 28.151 12.244 1.00 0.00 N ATOM 1764 CA ILE B 556 59.468 27.629 10.976 1.00 0.00 C ATOM 1765 C ILE B 556 58.754 28.338 9.824 1.00 0.00 C ATOM 1766 O ILE B 556 57.648 27.986 9.463 1.00 0.00 O ATOM 1767 CB ILE B 556 59.179 26.129 10.918 1.00 0.00 C ATOM 1768 CG1 ILE B 556 59.979 25.390 12.018 1.00 0.00 C ATOM 1769 CG2 ILE B 556 59.573 25.585 9.548 1.00 0.00 C ATOM 1770 CD1 ILE B 556 59.278 24.070 12.408 1.00 0.00 C ATOM 0 H ILE B 556 58.049 27.685 12.547 1.00 0.00 H new ATOM 0 HA ILE B 556 60.542 27.801 10.910 1.00 0.00 H new ATOM 0 HB ILE B 556 58.114 25.966 11.083 1.00 0.00 H new ATOM 0 HG12 ILE B 556 60.988 25.181 11.663 1.00 0.00 H new ATOM 0 HG13 ILE B 556 60.076 26.029 12.896 1.00 0.00 H new ATOM 0 HG21 ILE B 556 59.366 24.515 9.508 1.00 0.00 H new ATOM 0 HG22 ILE B 556 58.998 26.095 8.775 1.00 0.00 H new ATOM 0 HG23 ILE B 556 60.637 25.756 9.381 1.00 0.00 H new ATOM 0 HD11 ILE B 556 59.856 23.566 13.182 1.00 0.00 H new ATOM 0 HD12 ILE B 556 58.278 24.286 12.785 1.00 0.00 H new ATOM 0 HD13 ILE B 556 59.204 23.425 11.533 1.00 0.00 H new ATOM 1782 N THR B 557 59.356 29.359 9.270 1.00 0.00 N ATOM 1783 CA THR B 557 58.691 30.125 8.169 1.00 0.00 C ATOM 1784 C THR B 557 59.226 29.702 6.801 1.00 0.00 C ATOM 1785 O THR B 557 60.185 30.247 6.290 1.00 0.00 O ATOM 1786 CB THR B 557 58.949 31.610 8.397 1.00 0.00 C ATOM 1787 OG1 THR B 557 60.257 31.940 7.950 1.00 0.00 O ATOM 1788 CG2 THR B 557 58.824 31.900 9.893 1.00 0.00 C ATOM 0 H THR B 557 60.282 29.697 9.532 1.00 0.00 H new ATOM 0 HA THR B 557 57.621 29.919 8.180 1.00 0.00 H new ATOM 0 HB THR B 557 58.226 32.207 7.841 1.00 0.00 H new ATOM 0 HG1 THR B 557 60.341 31.725 6.997 1.00 0.00 H new ATOM 0 HG21 THR B 557 59.006 32.959 10.075 1.00 0.00 H new ATOM 0 HG22 THR B 557 57.821 31.641 10.231 1.00 0.00 H new ATOM 0 HG23 THR B 557 59.556 31.307 10.441 1.00 0.00 H new ATOM 1796 N GLY B 558 58.590 28.734 6.212 1.00 0.00 N ATOM 1797 CA GLY B 558 59.004 28.237 4.872 1.00 0.00 C ATOM 1798 C GLY B 558 58.482 26.813 4.733 1.00 0.00 C ATOM 1799 O GLY B 558 57.334 26.587 4.403 1.00 0.00 O ATOM 0 H GLY B 558 57.783 28.255 6.611 1.00 0.00 H new ATOM 0 HA2 GLY B 558 58.599 28.873 4.085 1.00 0.00 H new ATOM 0 HA3 GLY B 558 60.089 28.259 4.773 1.00 0.00 H new ATOM 1803 N ARG B 559 59.313 25.856 5.025 1.00 0.00 N ATOM 1804 CA ARG B 559 58.902 24.427 4.969 1.00 0.00 C ATOM 1805 C ARG B 559 58.923 23.904 6.396 1.00 0.00 C ATOM 1806 O ARG B 559 59.695 24.363 7.213 1.00 0.00 O ATOM 1807 CB ARG B 559 59.906 23.646 4.106 1.00 0.00 C ATOM 1808 CG ARG B 559 59.491 23.720 2.628 1.00 0.00 C ATOM 1809 CD ARG B 559 58.472 22.619 2.309 1.00 0.00 C ATOM 1810 NE ARG B 559 57.713 22.987 1.081 1.00 0.00 N ATOM 1811 CZ ARG B 559 57.008 22.085 0.455 1.00 0.00 C ATOM 1812 NH1 ARG B 559 56.340 22.407 -0.619 1.00 0.00 N ATOM 1813 NH2 ARG B 559 56.972 20.859 0.903 1.00 0.00 N ATOM 0 H ARG B 559 60.282 26.007 5.307 1.00 0.00 H new ATOM 0 HA ARG B 559 57.910 24.313 4.532 1.00 0.00 H new ATOM 0 HB2 ARG B 559 60.907 24.059 4.233 1.00 0.00 H new ATOM 0 HB3 ARG B 559 59.946 22.606 4.430 1.00 0.00 H new ATOM 0 HG2 ARG B 559 59.061 24.698 2.412 1.00 0.00 H new ATOM 0 HG3 ARG B 559 60.368 23.610 1.990 1.00 0.00 H new ATOM 0 HD2 ARG B 559 58.983 21.667 2.163 1.00 0.00 H new ATOM 0 HD3 ARG B 559 57.788 22.488 3.147 1.00 0.00 H new ATOM 0 HE ARG B 559 57.744 23.944 0.730 1.00 0.00 H new ATOM 0 HH11 ARG B 559 56.369 23.364 -0.970 1.00 0.00 H new ATOM 0 HH12 ARG B 559 55.789 21.701 -1.108 1.00 0.00 H new ATOM 0 HH21 ARG B 559 57.495 20.607 1.742 1.00 0.00 H new ATOM 0 HH22 ARG B 559 56.421 20.153 0.414 1.00 0.00 H new ATOM 1827 N CYS B 560 58.085 22.959 6.721 1.00 0.00 N ATOM 1828 CA CYS B 560 58.084 22.436 8.119 1.00 0.00 C ATOM 1829 C CYS B 560 57.798 20.950 8.154 1.00 0.00 C ATOM 1830 O CYS B 560 56.807 20.469 7.643 1.00 0.00 O ATOM 1831 CB CYS B 560 57.039 23.172 8.954 1.00 0.00 C ATOM 1832 SG CYS B 560 55.412 22.997 8.180 1.00 0.00 S ATOM 0 H CYS B 560 57.409 22.530 6.090 1.00 0.00 H new ATOM 0 HA CYS B 560 59.077 22.606 8.536 1.00 0.00 H new ATOM 0 HB2 CYS B 560 57.017 22.768 9.966 1.00 0.00 H new ATOM 0 HB3 CYS B 560 57.302 24.227 9.037 1.00 0.00 H new ATOM 0 HG CYS B 560 55.291 21.799 7.689 1.00 0.00 H new ATOM 1838 N ILE B 561 58.668 20.226 8.794 1.00 0.00 N ATOM 1839 CA ILE B 561 58.488 18.769 8.928 1.00 0.00 C ATOM 1840 C ILE B 561 57.726 18.510 10.206 1.00 0.00 C ATOM 1841 O ILE B 561 57.868 19.216 11.182 1.00 0.00 O ATOM 1842 CB ILE B 561 59.852 18.101 9.010 1.00 0.00 C ATOM 1843 CG1 ILE B 561 60.546 18.331 7.679 1.00 0.00 C ATOM 1844 CG2 ILE B 561 59.698 16.593 9.263 1.00 0.00 C ATOM 1845 CD1 ILE B 561 61.895 17.620 7.664 1.00 0.00 C ATOM 0 H ILE B 561 59.510 20.595 9.236 1.00 0.00 H new ATOM 0 HA ILE B 561 57.944 18.370 8.072 1.00 0.00 H new ATOM 0 HB ILE B 561 60.432 18.520 9.832 1.00 0.00 H new ATOM 0 HG12 ILE B 561 59.922 17.961 6.865 1.00 0.00 H new ATOM 0 HG13 ILE B 561 60.687 19.399 7.513 1.00 0.00 H new ATOM 0 HG21 ILE B 561 60.684 16.131 9.319 1.00 0.00 H new ATOM 0 HG22 ILE B 561 59.169 16.434 10.203 1.00 0.00 H new ATOM 0 HG23 ILE B 561 59.132 16.143 8.447 1.00 0.00 H new ATOM 0 HD11 ILE B 561 62.385 17.790 6.706 1.00 0.00 H new ATOM 0 HD12 ILE B 561 62.521 18.010 8.467 1.00 0.00 H new ATOM 0 HD13 ILE B 561 61.744 16.550 7.809 1.00 0.00 H new ATOM 1857 N THR B 562 56.924 17.494 10.197 1.00 0.00 N ATOM 1858 CA THR B 562 56.123 17.135 11.404 1.00 0.00 C ATOM 1859 C THR B 562 56.539 15.760 11.885 1.00 0.00 C ATOM 1860 O THR B 562 56.919 14.900 11.114 1.00 0.00 O ATOM 1861 CB THR B 562 54.626 17.129 11.097 1.00 0.00 C ATOM 1862 OG1 THR B 562 54.287 18.293 10.356 1.00 0.00 O ATOM 1863 CG2 THR B 562 53.846 17.109 12.418 1.00 0.00 C ATOM 0 H THR B 562 56.782 16.882 9.394 1.00 0.00 H new ATOM 0 HA THR B 562 56.310 17.882 12.175 1.00 0.00 H new ATOM 0 HB THR B 562 54.373 16.247 10.509 1.00 0.00 H new ATOM 0 HG1 THR B 562 53.327 18.287 10.158 1.00 0.00 H new ATOM 0 HG21 THR B 562 52.776 17.105 12.209 1.00 0.00 H new ATOM 0 HG22 THR B 562 54.109 16.214 12.982 1.00 0.00 H new ATOM 0 HG23 THR B 562 54.098 17.994 13.003 1.00 0.00 H new ATOM 1871 N ALA B 563 56.490 15.565 13.165 1.00 0.00 N ATOM 1872 CA ALA B 563 56.896 14.274 13.770 1.00 0.00 C ATOM 1873 C ALA B 563 55.744 13.718 14.596 1.00 0.00 C ATOM 1874 O ALA B 563 54.622 13.620 14.138 1.00 0.00 O ATOM 1875 CB ALA B 563 58.107 14.524 14.656 1.00 0.00 C ATOM 0 H ALA B 563 56.177 16.266 13.837 1.00 0.00 H new ATOM 0 HA ALA B 563 57.149 13.550 12.996 1.00 0.00 H new ATOM 0 HB1 ALA B 563 58.424 13.586 15.112 1.00 0.00 H new ATOM 0 HB2 ALA B 563 58.921 14.928 14.054 1.00 0.00 H new ATOM 0 HB3 ALA B 563 57.845 15.238 15.437 1.00 0.00 H new ATOM 1881 N MET B 564 56.018 13.356 15.812 1.00 0.00 N ATOM 1882 CA MET B 564 54.966 12.805 16.710 1.00 0.00 C ATOM 1883 C MET B 564 53.937 13.892 17.005 1.00 0.00 C ATOM 1884 O MET B 564 53.309 13.895 18.041 1.00 0.00 O ATOM 1885 CB MET B 564 55.629 12.376 18.014 1.00 0.00 C ATOM 1886 CG MET B 564 57.001 11.770 17.713 1.00 0.00 C ATOM 1887 SD MET B 564 57.575 10.828 19.148 1.00 0.00 S ATOM 1888 CE MET B 564 59.314 10.709 18.662 1.00 0.00 C ATOM 0 H MET B 564 56.945 13.419 16.233 1.00 0.00 H new ATOM 0 HA MET B 564 54.471 11.956 16.238 1.00 0.00 H new ATOM 0 HB2 MET B 564 55.736 13.233 18.679 1.00 0.00 H new ATOM 0 HB3 MET B 564 55.003 11.648 18.530 1.00 0.00 H new ATOM 0 HG2 MET B 564 56.940 11.121 16.840 1.00 0.00 H new ATOM 0 HG3 MET B 564 57.714 12.559 17.474 1.00 0.00 H new ATOM 0 HE1 MET B 564 59.867 10.155 19.421 1.00 0.00 H new ATOM 0 HE2 MET B 564 59.390 10.191 17.706 1.00 0.00 H new ATOM 0 HE3 MET B 564 59.734 11.710 18.566 1.00 0.00 H new ATOM 1898 N ALA B 565 53.830 14.813 16.092 1.00 0.00 N ATOM 1899 CA ALA B 565 52.919 15.994 16.188 1.00 0.00 C ATOM 1900 C ALA B 565 53.804 17.208 16.398 1.00 0.00 C ATOM 1901 O ALA B 565 53.364 18.339 16.333 1.00 0.00 O ATOM 1902 CB ALA B 565 51.914 15.894 17.339 1.00 0.00 C ATOM 0 H ALA B 565 54.371 14.794 15.228 1.00 0.00 H new ATOM 0 HA ALA B 565 52.326 16.055 15.275 1.00 0.00 H new ATOM 0 HB1 ALA B 565 51.284 16.784 17.351 1.00 0.00 H new ATOM 0 HB2 ALA B 565 51.291 15.010 17.202 1.00 0.00 H new ATOM 0 HB3 ALA B 565 52.450 15.817 18.285 1.00 0.00 H new ATOM 1908 N LYS B 566 55.069 16.974 16.630 1.00 0.00 N ATOM 1909 CA LYS B 566 56.008 18.107 16.822 1.00 0.00 C ATOM 1910 C LYS B 566 56.407 18.629 15.449 1.00 0.00 C ATOM 1911 O LYS B 566 56.223 17.964 14.457 1.00 0.00 O ATOM 1912 CB LYS B 566 57.264 17.609 17.553 1.00 0.00 C ATOM 1913 CG LYS B 566 57.122 17.819 19.062 1.00 0.00 C ATOM 1914 CD LYS B 566 58.175 16.972 19.798 1.00 0.00 C ATOM 1915 CE LYS B 566 57.618 15.565 20.067 1.00 0.00 C ATOM 1916 NZ LYS B 566 58.747 14.605 20.224 1.00 0.00 N ATOM 0 H LYS B 566 55.488 16.046 16.694 1.00 0.00 H new ATOM 0 HA LYS B 566 55.535 18.894 17.409 1.00 0.00 H new ATOM 0 HB2 LYS B 566 57.421 16.552 17.340 1.00 0.00 H new ATOM 0 HB3 LYS B 566 58.141 18.142 17.186 1.00 0.00 H new ATOM 0 HG2 LYS B 566 57.251 18.873 19.307 1.00 0.00 H new ATOM 0 HG3 LYS B 566 56.121 17.537 19.387 1.00 0.00 H new ATOM 0 HD2 LYS B 566 59.084 16.905 19.200 1.00 0.00 H new ATOM 0 HD3 LYS B 566 58.447 17.451 20.738 1.00 0.00 H new ATOM 0 HE2 LYS B 566 57.004 15.571 20.968 1.00 0.00 H new ATOM 0 HE3 LYS B 566 56.974 15.254 19.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 566 58.370 13.653 20.406 1.00 0.00 H new ATOM 0 HZ2 LYS B 566 59.315 14.592 19.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 566 59.345 14.899 21.023 1.00 0.00 H new ATOM 1930 N LYS B 567 56.972 19.803 15.393 1.00 0.00 N ATOM 1931 CA LYS B 567 57.416 20.376 14.093 1.00 0.00 C ATOM 1932 C LYS B 567 58.937 20.302 14.068 1.00 0.00 C ATOM 1933 O LYS B 567 59.551 19.913 15.042 1.00 0.00 O ATOM 1934 CB LYS B 567 56.945 21.826 13.991 1.00 0.00 C ATOM 1935 CG LYS B 567 55.536 21.959 14.592 1.00 0.00 C ATOM 1936 CD LYS B 567 54.536 21.054 13.847 1.00 0.00 C ATOM 1937 CE LYS B 567 54.478 21.445 12.369 1.00 0.00 C ATOM 1938 NZ LYS B 567 53.196 20.965 11.779 1.00 0.00 N ATOM 0 H LYS B 567 57.147 20.397 16.204 1.00 0.00 H new ATOM 0 HA LYS B 567 56.998 19.826 13.250 1.00 0.00 H new ATOM 0 HB2 LYS B 567 57.639 22.481 14.518 1.00 0.00 H new ATOM 0 HB3 LYS B 567 56.937 22.143 12.948 1.00 0.00 H new ATOM 0 HG2 LYS B 567 55.559 21.691 15.648 1.00 0.00 H new ATOM 0 HG3 LYS B 567 55.207 22.997 14.534 1.00 0.00 H new ATOM 0 HD2 LYS B 567 54.835 20.010 13.944 1.00 0.00 H new ATOM 0 HD3 LYS B 567 53.547 21.145 14.295 1.00 0.00 H new ATOM 0 HE2 LYS B 567 54.556 22.527 12.265 1.00 0.00 H new ATOM 0 HE3 LYS B 567 55.322 21.011 11.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 567 52.811 21.694 11.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 567 53.367 20.093 11.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 567 52.514 20.773 12.540 1.00 0.00 H new ATOM 1952 N PHE B 568 59.567 20.645 12.984 1.00 0.00 N ATOM 1953 CA PHE B 568 61.052 20.546 12.975 1.00 0.00 C ATOM 1954 C PHE B 568 61.623 21.402 11.858 1.00 0.00 C ATOM 1955 O PHE B 568 61.148 21.385 10.741 1.00 0.00 O ATOM 1956 CB PHE B 568 61.457 19.063 12.751 1.00 0.00 C ATOM 1957 CG PHE B 568 62.317 18.560 13.899 1.00 0.00 C ATOM 1958 CD1 PHE B 568 63.501 19.231 14.228 1.00 0.00 C ATOM 1959 CD2 PHE B 568 61.931 17.426 14.627 1.00 0.00 C ATOM 1960 CE1 PHE B 568 64.298 18.771 15.284 1.00 0.00 C ATOM 1961 CE2 PHE B 568 62.728 16.966 15.683 1.00 0.00 C ATOM 1962 CZ PHE B 568 63.911 17.639 16.011 1.00 0.00 C ATOM 0 H PHE B 568 59.134 20.981 12.124 1.00 0.00 H new ATOM 0 HA PHE B 568 61.446 20.900 13.928 1.00 0.00 H new ATOM 0 HB2 PHE B 568 60.563 18.446 12.663 1.00 0.00 H new ATOM 0 HB3 PHE B 568 62.003 18.968 11.813 1.00 0.00 H new ATOM 0 HD1 PHE B 568 63.800 20.104 13.667 1.00 0.00 H new ATOM 0 HD2 PHE B 568 61.019 16.907 14.374 1.00 0.00 H new ATOM 0 HE1 PHE B 568 65.211 19.290 15.537 1.00 0.00 H new ATOM 0 HE2 PHE B 568 62.430 16.093 16.244 1.00 0.00 H new ATOM 0 HZ PHE B 568 64.525 17.285 16.825 1.00 0.00 H new ATOM 1972 N HIS B 569 62.679 22.107 12.136 1.00 0.00 N ATOM 1973 CA HIS B 569 63.312 22.906 11.065 1.00 0.00 C ATOM 1974 C HIS B 569 63.655 21.900 9.952 1.00 0.00 C ATOM 1975 O HIS B 569 64.432 20.997 10.188 1.00 0.00 O ATOM 1976 CB HIS B 569 64.605 23.532 11.594 1.00 0.00 C ATOM 1977 CG HIS B 569 64.334 24.858 12.252 1.00 0.00 C ATOM 1978 ND1 HIS B 569 64.636 25.079 13.583 1.00 0.00 N ATOM 1979 CD2 HIS B 569 63.832 26.042 11.775 1.00 0.00 C ATOM 1980 CE1 HIS B 569 64.323 26.355 13.863 1.00 0.00 C ATOM 1981 NE2 HIS B 569 63.826 26.989 12.796 1.00 0.00 N ATOM 0 H HIS B 569 63.126 22.163 13.051 1.00 0.00 H new ATOM 0 HA HIS B 569 62.661 23.706 10.712 1.00 0.00 H new ATOM 0 HB2 HIS B 569 65.074 22.856 12.309 1.00 0.00 H new ATOM 0 HB3 HIS B 569 65.310 23.667 10.774 1.00 0.00 H new ATOM 0 HD2 HIS B 569 63.494 26.213 10.764 1.00 0.00 H new ATOM 0 HE1 HIS B 569 64.457 26.813 14.832 1.00 0.00 H new ATOM 0 HE2 HIS B 569 63.510 27.957 12.742 1.00 0.00 H new ATOM 1988 N PRO B 570 63.078 21.995 8.778 1.00 0.00 N ATOM 1989 CA PRO B 570 63.378 21.003 7.712 1.00 0.00 C ATOM 1990 C PRO B 570 64.878 20.687 7.599 1.00 0.00 C ATOM 1991 O PRO B 570 65.270 19.766 6.914 1.00 0.00 O ATOM 1992 CB PRO B 570 62.826 21.713 6.472 1.00 0.00 C ATOM 1993 CG PRO B 570 61.748 22.687 6.968 1.00 0.00 C ATOM 1994 CD PRO B 570 62.105 23.062 8.410 1.00 0.00 C ATOM 0 HA PRO B 570 62.939 20.021 7.888 1.00 0.00 H new ATOM 0 HB2 PRO B 570 63.618 22.246 5.946 1.00 0.00 H new ATOM 0 HB3 PRO B 570 62.405 20.994 5.769 1.00 0.00 H new ATOM 0 HG2 PRO B 570 61.712 23.575 6.337 1.00 0.00 H new ATOM 0 HG3 PRO B 570 60.762 22.225 6.924 1.00 0.00 H new ATOM 0 HD2 PRO B 570 62.547 24.056 8.475 1.00 0.00 H new ATOM 0 HD3 PRO B 570 61.230 23.058 9.061 1.00 0.00 H new ATOM 2002 N GLU B 571 65.717 21.431 8.284 1.00 0.00 N ATOM 2003 CA GLU B 571 67.187 21.166 8.232 1.00 0.00 C ATOM 2004 C GLU B 571 67.647 20.498 9.534 1.00 0.00 C ATOM 2005 O GLU B 571 68.278 19.465 9.533 1.00 0.00 O ATOM 2006 CB GLU B 571 67.916 22.504 8.079 1.00 0.00 C ATOM 2007 CG GLU B 571 67.099 23.405 7.164 1.00 0.00 C ATOM 2008 CD GLU B 571 67.950 24.591 6.708 1.00 0.00 C ATOM 2009 OE1 GLU B 571 67.678 25.694 7.152 1.00 0.00 O ATOM 2010 OE2 GLU B 571 68.858 24.376 5.923 1.00 0.00 O ATOM 0 H GLU B 571 65.442 22.213 8.878 1.00 0.00 H new ATOM 0 HA GLU B 571 67.409 20.507 7.393 1.00 0.00 H new ATOM 0 HB2 GLU B 571 68.048 22.975 9.053 1.00 0.00 H new ATOM 0 HB3 GLU B 571 68.911 22.346 7.663 1.00 0.00 H new ATOM 0 HG2 GLU B 571 66.752 22.841 6.298 1.00 0.00 H new ATOM 0 HG3 GLU B 571 66.212 23.762 7.688 1.00 0.00 H new ATOM 2017 N HIS B 572 67.335 21.086 10.649 1.00 0.00 N ATOM 2018 CA HIS B 572 67.770 20.480 11.948 1.00 0.00 C ATOM 2019 C HIS B 572 67.266 19.044 12.041 1.00 0.00 C ATOM 2020 O HIS B 572 67.595 18.324 12.963 1.00 0.00 O ATOM 2021 CB HIS B 572 67.232 21.299 13.127 1.00 0.00 C ATOM 2022 CG HIS B 572 67.548 22.750 12.880 1.00 0.00 C ATOM 2023 ND1 HIS B 572 66.881 23.808 13.504 1.00 0.00 N ATOM 2024 CD2 HIS B 572 68.479 23.334 12.057 1.00 0.00 C ATOM 2025 CE1 HIS B 572 67.428 24.949 13.039 1.00 0.00 C ATOM 2026 NE2 HIS B 572 68.402 24.716 12.159 1.00 0.00 N ATOM 0 H HIS B 572 66.803 21.953 10.726 1.00 0.00 H new ATOM 0 HA HIS B 572 68.859 20.483 11.990 1.00 0.00 H new ATOM 0 HB2 HIS B 572 66.156 21.157 13.228 1.00 0.00 H new ATOM 0 HB3 HIS B 572 67.687 20.965 14.060 1.00 0.00 H new ATOM 0 HD2 HIS B 572 69.170 22.797 11.424 1.00 0.00 H new ATOM 0 HE1 HIS B 572 67.114 25.936 13.344 1.00 0.00 H new ATOM 0 HE2 HIS B 572 68.969 25.406 11.666 1.00 0.00 H new ATOM 2033 N PHE B 573 66.487 18.614 11.080 1.00 0.00 N ATOM 2034 CA PHE B 573 65.973 17.214 11.082 1.00 0.00 C ATOM 2035 C PHE B 573 66.419 16.552 9.786 1.00 0.00 C ATOM 2036 O PHE B 573 65.630 15.997 9.048 1.00 0.00 O ATOM 2037 CB PHE B 573 64.445 17.224 11.162 1.00 0.00 C ATOM 2038 CG PHE B 573 63.949 15.862 11.595 1.00 0.00 C ATOM 2039 CD1 PHE B 573 64.047 15.478 12.939 1.00 0.00 C ATOM 2040 CD2 PHE B 573 63.394 14.983 10.656 1.00 0.00 C ATOM 2041 CE1 PHE B 573 63.591 14.218 13.342 1.00 0.00 C ATOM 2042 CE2 PHE B 573 62.938 13.723 11.060 1.00 0.00 C ATOM 2043 CZ PHE B 573 63.037 13.340 12.404 1.00 0.00 C ATOM 0 H PHE B 573 66.184 19.180 10.288 1.00 0.00 H new ATOM 0 HA PHE B 573 66.360 16.666 11.941 1.00 0.00 H new ATOM 0 HB2 PHE B 573 64.113 17.984 11.869 1.00 0.00 H new ATOM 0 HB3 PHE B 573 64.022 17.484 10.192 1.00 0.00 H new ATOM 0 HD1 PHE B 573 64.475 16.155 13.664 1.00 0.00 H new ATOM 0 HD2 PHE B 573 63.318 15.278 9.620 1.00 0.00 H new ATOM 0 HE1 PHE B 573 63.667 13.923 14.378 1.00 0.00 H new ATOM 0 HE2 PHE B 573 62.510 13.046 10.336 1.00 0.00 H new ATOM 0 HZ PHE B 573 62.686 12.367 12.716 1.00 0.00 H new ATOM 2053 N VAL B 574 67.690 16.620 9.503 1.00 0.00 N ATOM 2054 CA VAL B 574 68.217 16.014 8.255 1.00 0.00 C ATOM 2055 C VAL B 574 68.677 14.582 8.545 1.00 0.00 C ATOM 2056 O VAL B 574 68.629 14.113 9.664 1.00 0.00 O ATOM 2057 CB VAL B 574 69.427 16.808 7.748 1.00 0.00 C ATOM 2058 CG1 VAL B 574 68.992 18.214 7.264 1.00 0.00 C ATOM 2059 CG2 VAL B 574 70.465 16.917 8.875 1.00 0.00 C ATOM 0 H VAL B 574 68.390 17.074 10.090 1.00 0.00 H new ATOM 0 HA VAL B 574 67.428 16.023 7.503 1.00 0.00 H new ATOM 0 HB VAL B 574 69.872 16.288 6.899 1.00 0.00 H new ATOM 0 HG11 VAL B 574 69.864 18.762 6.908 1.00 0.00 H new ATOM 0 HG12 VAL B 574 68.271 18.113 6.453 1.00 0.00 H new ATOM 0 HG13 VAL B 574 68.534 18.758 8.090 1.00 0.00 H new ATOM 0 HG21 VAL B 574 71.328 17.481 8.521 1.00 0.00 H new ATOM 0 HG22 VAL B 574 70.022 17.429 9.729 1.00 0.00 H new ATOM 0 HG23 VAL B 574 70.782 15.918 9.176 1.00 0.00 H new ATOM 2069 N CYS B 575 69.123 13.892 7.539 1.00 0.00 N ATOM 2070 CA CYS B 575 69.597 12.483 7.726 1.00 0.00 C ATOM 2071 C CYS B 575 71.004 12.504 8.291 1.00 0.00 C ATOM 2072 O CYS B 575 71.788 13.362 7.940 1.00 0.00 O ATOM 2073 CB CYS B 575 69.593 11.781 6.356 1.00 0.00 C ATOM 2074 SG CYS B 575 71.143 10.890 6.049 1.00 0.00 S ATOM 0 H CYS B 575 69.183 14.241 6.582 1.00 0.00 H new ATOM 0 HA CYS B 575 68.943 11.948 8.415 1.00 0.00 H new ATOM 0 HB2 CYS B 575 68.757 11.083 6.308 1.00 0.00 H new ATOM 0 HB3 CYS B 575 69.437 12.520 5.570 1.00 0.00 H new ATOM 2079 N ALA B 576 71.369 11.559 9.132 1.00 0.00 N ATOM 2080 CA ALA B 576 72.774 11.597 9.624 1.00 0.00 C ATOM 2081 C ALA B 576 73.643 10.699 8.718 1.00 0.00 C ATOM 2082 O ALA B 576 74.095 9.637 9.093 1.00 0.00 O ATOM 2083 CB ALA B 576 72.794 11.056 11.063 1.00 0.00 C ATOM 0 H ALA B 576 70.783 10.801 9.481 1.00 0.00 H new ATOM 0 HA ALA B 576 73.164 12.615 9.604 1.00 0.00 H new ATOM 0 HB1 ALA B 576 73.815 11.075 11.445 1.00 0.00 H new ATOM 0 HB2 ALA B 576 72.159 11.678 11.694 1.00 0.00 H new ATOM 0 HB3 ALA B 576 72.422 10.032 11.072 1.00 0.00 H new ATOM 2089 N PHE B 577 73.953 11.227 7.567 1.00 0.00 N ATOM 2090 CA PHE B 577 74.883 10.608 6.568 1.00 0.00 C ATOM 2091 C PHE B 577 75.443 11.829 5.868 1.00 0.00 C ATOM 2092 O PHE B 577 76.625 12.018 5.666 1.00 0.00 O ATOM 2093 CB PHE B 577 74.142 9.695 5.578 1.00 0.00 C ATOM 2094 CG PHE B 577 75.114 9.033 4.612 1.00 0.00 C ATOM 2095 CD1 PHE B 577 75.939 7.975 5.035 1.00 0.00 C ATOM 2096 CD2 PHE B 577 75.175 9.468 3.280 1.00 0.00 C ATOM 2097 CE1 PHE B 577 76.816 7.366 4.129 1.00 0.00 C ATOM 2098 CE2 PHE B 577 76.054 8.856 2.379 1.00 0.00 C ATOM 2099 CZ PHE B 577 76.874 7.806 2.804 1.00 0.00 C ATOM 0 H PHE B 577 73.575 12.122 7.257 1.00 0.00 H new ATOM 0 HA PHE B 577 75.637 9.964 7.021 1.00 0.00 H new ATOM 0 HB2 PHE B 577 73.591 8.930 6.126 1.00 0.00 H new ATOM 0 HB3 PHE B 577 73.409 10.277 5.020 1.00 0.00 H new ATOM 0 HD1 PHE B 577 75.896 7.632 6.058 1.00 0.00 H new ATOM 0 HD2 PHE B 577 74.542 10.278 2.949 1.00 0.00 H new ATOM 0 HE1 PHE B 577 77.449 6.554 4.455 1.00 0.00 H new ATOM 0 HE2 PHE B 577 76.099 9.195 1.355 1.00 0.00 H new ATOM 0 HZ PHE B 577 77.552 7.335 2.108 1.00 0.00 H new ATOM 2109 N CYS B 578 74.496 12.686 5.554 1.00 0.00 N ATOM 2110 CA CYS B 578 74.742 13.996 4.909 1.00 0.00 C ATOM 2111 C CYS B 578 74.041 15.028 5.806 1.00 0.00 C ATOM 2112 O CYS B 578 73.125 14.688 6.527 1.00 0.00 O ATOM 2113 CB CYS B 578 74.121 14.006 3.503 1.00 0.00 C ATOM 2114 SG CYS B 578 72.605 13.006 3.491 1.00 0.00 S ATOM 0 H CYS B 578 73.509 12.506 5.735 1.00 0.00 H new ATOM 0 HA CYS B 578 75.805 14.210 4.801 1.00 0.00 H new ATOM 0 HB2 CYS B 578 73.895 15.029 3.203 1.00 0.00 H new ATOM 0 HB3 CYS B 578 74.833 13.611 2.778 1.00 0.00 H new ATOM 2119 N LEU B 579 74.463 16.265 5.803 1.00 0.00 N ATOM 2120 CA LEU B 579 73.825 17.286 6.695 1.00 0.00 C ATOM 2121 C LEU B 579 72.906 18.229 5.897 1.00 0.00 C ATOM 2122 O LEU B 579 72.579 19.289 6.393 1.00 0.00 O ATOM 2123 CB LEU B 579 74.913 18.167 7.382 1.00 0.00 C ATOM 2124 CG LEU B 579 76.278 17.454 7.493 1.00 0.00 C ATOM 2125 CD1 LEU B 579 76.136 16.116 8.242 1.00 0.00 C ATOM 2126 CD2 LEU B 579 76.911 17.240 6.096 1.00 0.00 C ATOM 0 H LEU B 579 75.224 16.616 5.221 1.00 0.00 H new ATOM 0 HA LEU B 579 73.244 16.739 7.437 1.00 0.00 H new ATOM 0 HB2 LEU B 579 75.036 19.091 6.817 1.00 0.00 H new ATOM 0 HB3 LEU B 579 74.572 18.446 8.379 1.00 0.00 H new ATOM 0 HG LEU B 579 76.946 18.096 8.067 1.00 0.00 H new ATOM 0 HD11 LEU B 579 77.110 15.631 8.308 1.00 0.00 H new ATOM 0 HD12 LEU B 579 75.753 16.300 9.246 1.00 0.00 H new ATOM 0 HD13 LEU B 579 75.444 15.469 7.703 1.00 0.00 H new ATOM 0 HD21 LEU B 579 77.871 16.736 6.205 1.00 0.00 H new ATOM 0 HD22 LEU B 579 76.247 16.628 5.486 1.00 0.00 H new ATOM 0 HD23 LEU B 579 77.061 18.205 5.613 1.00 0.00 H new ATOM 2138 N LYS B 580 72.530 17.929 4.661 1.00 0.00 N ATOM 2139 CA LYS B 580 71.700 18.947 3.913 1.00 0.00 C ATOM 2140 C LYS B 580 70.186 18.669 3.875 1.00 0.00 C ATOM 2141 O LYS B 580 69.419 19.606 3.992 1.00 0.00 O ATOM 2142 CB LYS B 580 72.249 19.028 2.459 1.00 0.00 C ATOM 2143 CG LYS B 580 71.585 18.014 1.494 1.00 0.00 C ATOM 2144 CD LYS B 580 71.966 16.579 1.873 1.00 0.00 C ATOM 2145 CE LYS B 580 71.030 15.603 1.164 1.00 0.00 C ATOM 2146 NZ LYS B 580 70.890 15.997 -0.267 1.00 0.00 N ATOM 0 H LYS B 580 72.749 17.068 4.160 1.00 0.00 H new ATOM 0 HA LYS B 580 71.795 19.887 4.457 1.00 0.00 H new ATOM 0 HB2 LYS B 580 72.096 20.037 2.076 1.00 0.00 H new ATOM 0 HB3 LYS B 580 73.325 18.853 2.474 1.00 0.00 H new ATOM 0 HG2 LYS B 580 70.502 18.129 1.526 1.00 0.00 H new ATOM 0 HG3 LYS B 580 71.897 18.220 0.470 1.00 0.00 H new ATOM 0 HD2 LYS B 580 73.000 16.379 1.591 1.00 0.00 H new ATOM 0 HD3 LYS B 580 71.898 16.446 2.953 1.00 0.00 H new ATOM 0 HE2 LYS B 580 71.423 14.589 1.236 1.00 0.00 H new ATOM 0 HE3 LYS B 580 70.054 15.602 1.649 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 70.600 15.171 -0.828 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 70.171 16.744 -0.353 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 71.802 16.352 -0.620 1.00 0.00 H new ATOM 2160 N GLN B 581 69.697 17.455 3.726 1.00 0.00 N ATOM 2161 CA GLN B 581 68.199 17.331 3.712 1.00 0.00 C ATOM 2162 C GLN B 581 67.644 15.927 3.955 1.00 0.00 C ATOM 2163 O GLN B 581 68.123 14.939 3.436 1.00 0.00 O ATOM 2164 CB GLN B 581 67.649 17.880 2.400 1.00 0.00 C ATOM 2165 CG GLN B 581 66.140 18.125 2.529 1.00 0.00 C ATOM 2166 CD GLN B 581 65.881 19.368 3.379 1.00 0.00 C ATOM 2167 OE1 GLN B 581 65.592 20.426 2.856 1.00 0.00 O ATOM 2168 NE2 GLN B 581 65.972 19.288 4.676 1.00 0.00 N ATOM 0 H GLN B 581 70.232 16.593 3.619 1.00 0.00 H new ATOM 0 HA GLN B 581 67.862 17.918 4.566 1.00 0.00 H new ATOM 0 HB2 GLN B 581 68.157 18.810 2.143 1.00 0.00 H new ATOM 0 HB3 GLN B 581 67.844 17.176 1.591 1.00 0.00 H new ATOM 0 HG2 GLN B 581 65.699 18.252 1.541 1.00 0.00 H new ATOM 0 HG3 GLN B 581 65.660 17.258 2.983 1.00 0.00 H new ATOM 0 HE21 GLN B 581 66.214 18.401 5.116 1.00 0.00 H new ATOM 0 HE22 GLN B 581 65.801 20.113 5.251 1.00 0.00 H new ATOM 2177 N LEU B 582 66.553 15.883 4.670 1.00 0.00 N ATOM 2178 CA LEU B 582 65.809 14.615 4.906 1.00 0.00 C ATOM 2179 C LEU B 582 64.317 14.926 4.742 1.00 0.00 C ATOM 2180 O LEU B 582 63.929 16.072 4.647 1.00 0.00 O ATOM 2181 CB LEU B 582 66.086 14.127 6.313 1.00 0.00 C ATOM 2182 CG LEU B 582 65.589 12.690 6.529 1.00 0.00 C ATOM 2183 CD1 LEU B 582 66.280 11.716 5.544 1.00 0.00 C ATOM 2184 CD2 LEU B 582 65.891 12.295 7.985 1.00 0.00 C ATOM 0 H LEU B 582 66.135 16.701 5.114 1.00 0.00 H new ATOM 0 HA LEU B 582 66.117 13.840 4.204 1.00 0.00 H new ATOM 0 HB2 LEU B 582 67.157 14.174 6.509 1.00 0.00 H new ATOM 0 HB3 LEU B 582 65.601 14.790 7.029 1.00 0.00 H new ATOM 0 HG LEU B 582 64.517 12.635 6.341 1.00 0.00 H new ATOM 0 HD11 LEU B 582 65.913 10.704 5.715 1.00 0.00 H new ATOM 0 HD12 LEU B 582 66.056 12.015 4.520 1.00 0.00 H new ATOM 0 HD13 LEU B 582 67.358 11.742 5.702 1.00 0.00 H new ATOM 0 HD21 LEU B 582 65.547 11.276 8.164 1.00 0.00 H new ATOM 0 HD22 LEU B 582 66.965 12.352 8.162 1.00 0.00 H new ATOM 0 HD23 LEU B 582 65.375 12.977 8.661 1.00 0.00 H new ATOM 2196 N ASN B 583 63.479 13.928 4.702 1.00 0.00 N ATOM 2197 CA ASN B 583 62.013 14.184 4.535 1.00 0.00 C ATOM 2198 C ASN B 583 61.225 13.114 5.287 1.00 0.00 C ATOM 2199 O ASN B 583 61.455 11.933 5.131 1.00 0.00 O ATOM 2200 CB ASN B 583 61.654 14.131 3.042 1.00 0.00 C ATOM 2201 CG ASN B 583 61.986 15.460 2.373 1.00 0.00 C ATOM 2202 OD1 ASN B 583 62.256 16.443 3.033 1.00 0.00 O ATOM 2203 ND2 ASN B 583 61.968 15.529 1.075 1.00 0.00 N ATOM 0 H ASN B 583 63.741 12.945 4.777 1.00 0.00 H new ATOM 0 HA ASN B 583 61.764 15.167 4.934 1.00 0.00 H new ATOM 0 HB2 ASN B 583 62.203 13.324 2.557 1.00 0.00 H new ATOM 0 HB3 ASN B 583 60.593 13.911 2.923 1.00 0.00 H new ATOM 0 HD21 ASN B 583 62.181 16.411 0.608 1.00 0.00 H new ATOM 0 HD22 ASN B 583 61.741 14.702 0.523 1.00 0.00 H new ATOM 2210 N LYS B 584 60.291 13.525 6.096 1.00 0.00 N ATOM 2211 CA LYS B 584 59.476 12.551 6.862 1.00 0.00 C ATOM 2212 C LYS B 584 58.909 11.496 5.916 1.00 0.00 C ATOM 2213 O LYS B 584 58.473 10.441 6.331 1.00 0.00 O ATOM 2214 CB LYS B 584 58.321 13.304 7.508 1.00 0.00 C ATOM 2215 CG LYS B 584 57.643 14.206 6.446 1.00 0.00 C ATOM 2216 CD LYS B 584 56.160 14.408 6.777 1.00 0.00 C ATOM 2217 CE LYS B 584 56.012 15.309 8.005 1.00 0.00 C ATOM 2218 NZ LYS B 584 56.286 16.721 7.618 1.00 0.00 N ATOM 0 H LYS B 584 60.057 14.504 6.259 1.00 0.00 H new ATOM 0 HA LYS B 584 60.092 12.063 7.617 1.00 0.00 H new ATOM 0 HB2 LYS B 584 57.598 12.600 7.920 1.00 0.00 H new ATOM 0 HB3 LYS B 584 58.685 13.910 8.338 1.00 0.00 H new ATOM 0 HG2 LYS B 584 58.147 15.172 6.406 1.00 0.00 H new ATOM 0 HG3 LYS B 584 57.743 13.753 5.459 1.00 0.00 H new ATOM 0 HD2 LYS B 584 55.647 14.854 5.925 1.00 0.00 H new ATOM 0 HD3 LYS B 584 55.687 13.444 6.965 1.00 0.00 H new ATOM 0 HE2 LYS B 584 55.006 15.221 8.415 1.00 0.00 H new ATOM 0 HE3 LYS B 584 56.703 14.994 8.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 584 55.786 17.362 8.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 584 57.309 16.903 7.671 1.00 0.00 H new ATOM 0 HZ3 LYS B 584 55.955 16.885 6.646 1.00 0.00 H new ATOM 2232 N GLY B 585 58.900 11.783 4.646 1.00 0.00 N ATOM 2233 CA GLY B 585 58.352 10.813 3.661 1.00 0.00 C ATOM 2234 C GLY B 585 59.457 9.860 3.244 1.00 0.00 C ATOM 2235 O GLY B 585 59.214 8.771 2.763 1.00 0.00 O ATOM 0 H GLY B 585 59.251 12.653 4.246 1.00 0.00 H new ATOM 0 HA2 GLY B 585 57.522 10.259 4.099 1.00 0.00 H new ATOM 0 HA3 GLY B 585 57.960 11.340 2.791 1.00 0.00 H new ATOM 2239 N THR B 586 60.674 10.271 3.437 1.00 0.00 N ATOM 2240 CA THR B 586 61.840 9.418 3.074 1.00 0.00 C ATOM 2241 C THR B 586 62.830 9.436 4.225 1.00 0.00 C ATOM 2242 O THR B 586 64.020 9.278 4.037 1.00 0.00 O ATOM 2243 CB THR B 586 62.507 9.978 1.819 1.00 0.00 C ATOM 2244 OG1 THR B 586 63.417 11.006 2.190 1.00 0.00 O ATOM 2245 CG2 THR B 586 61.430 10.552 0.898 1.00 0.00 C ATOM 0 H THR B 586 60.917 11.177 3.838 1.00 0.00 H new ATOM 0 HA THR B 586 61.512 8.397 2.881 1.00 0.00 H new ATOM 0 HB THR B 586 63.049 9.187 1.300 1.00 0.00 H new ATOM 0 HG1 THR B 586 64.156 10.619 2.704 1.00 0.00 H new ATOM 0 HG21 THR B 586 61.897 10.954 -0.001 1.00 0.00 H new ATOM 0 HG22 THR B 586 60.730 9.764 0.622 1.00 0.00 H new ATOM 0 HG23 THR B 586 60.895 11.348 1.416 1.00 0.00 H new ATOM 2253 N PHE B 587 62.350 9.632 5.426 1.00 0.00 N ATOM 2254 CA PHE B 587 63.281 9.663 6.595 1.00 0.00 C ATOM 2255 C PHE B 587 63.449 8.253 7.162 1.00 0.00 C ATOM 2256 O PHE B 587 62.579 7.693 7.799 1.00 0.00 O ATOM 2257 CB PHE B 587 62.771 10.632 7.680 1.00 0.00 C ATOM 2258 CG PHE B 587 61.719 9.986 8.570 1.00 0.00 C ATOM 2259 CD1 PHE B 587 61.878 10.000 9.965 1.00 0.00 C ATOM 2260 CD2 PHE B 587 60.589 9.378 8.006 1.00 0.00 C ATOM 2261 CE1 PHE B 587 60.911 9.408 10.787 1.00 0.00 C ATOM 2262 CE2 PHE B 587 59.624 8.787 8.831 1.00 0.00 C ATOM 2263 CZ PHE B 587 59.785 8.802 10.220 1.00 0.00 C ATOM 0 H PHE B 587 61.364 9.771 5.647 1.00 0.00 H new ATOM 0 HA PHE B 587 64.252 10.025 6.258 1.00 0.00 H new ATOM 0 HB2 PHE B 587 63.609 10.965 8.292 1.00 0.00 H new ATOM 0 HB3 PHE B 587 62.350 11.519 7.206 1.00 0.00 H new ATOM 0 HD1 PHE B 587 62.747 10.468 10.404 1.00 0.00 H new ATOM 0 HD2 PHE B 587 60.462 9.365 6.934 1.00 0.00 H new ATOM 0 HE1 PHE B 587 61.035 9.419 11.860 1.00 0.00 H new ATOM 0 HE2 PHE B 587 58.754 8.319 8.394 1.00 0.00 H new ATOM 0 HZ PHE B 587 59.040 8.346 10.855 1.00 0.00 H new ATOM 2273 N LYS B 588 64.590 7.688 6.921 1.00 0.00 N ATOM 2274 CA LYS B 588 64.907 6.323 7.416 1.00 0.00 C ATOM 2275 C LYS B 588 65.741 6.492 8.689 1.00 0.00 C ATOM 2276 O LYS B 588 66.183 7.579 9.003 1.00 0.00 O ATOM 2277 CB LYS B 588 65.695 5.590 6.298 1.00 0.00 C ATOM 2278 CG LYS B 588 65.165 4.159 6.015 1.00 0.00 C ATOM 2279 CD LYS B 588 63.629 4.070 5.815 1.00 0.00 C ATOM 2280 CE LYS B 588 63.052 5.308 5.112 1.00 0.00 C ATOM 2281 NZ LYS B 588 61.823 4.915 4.367 1.00 0.00 N ATOM 0 H LYS B 588 65.340 8.126 6.386 1.00 0.00 H new ATOM 0 HA LYS B 588 64.020 5.735 7.651 1.00 0.00 H new ATOM 0 HB2 LYS B 588 65.644 6.177 5.381 1.00 0.00 H new ATOM 0 HB3 LYS B 588 66.746 5.532 6.581 1.00 0.00 H new ATOM 0 HG2 LYS B 588 65.658 3.772 5.123 1.00 0.00 H new ATOM 0 HG3 LYS B 588 65.449 3.510 6.843 1.00 0.00 H new ATOM 0 HD2 LYS B 588 63.394 3.181 5.229 1.00 0.00 H new ATOM 0 HD3 LYS B 588 63.146 3.950 6.785 1.00 0.00 H new ATOM 0 HE2 LYS B 588 62.817 6.081 5.844 1.00 0.00 H new ATOM 0 HE3 LYS B 588 63.788 5.730 4.428 1.00 0.00 H new ATOM 0 HZ1 LYS B 588 61.426 5.748 3.888 1.00 0.00 H new ATOM 0 HZ2 LYS B 588 62.062 4.191 3.660 1.00 0.00 H new ATOM 0 HZ3 LYS B 588 61.122 4.531 5.032 1.00 0.00 H new ATOM 2295 N GLU B 589 65.938 5.450 9.443 1.00 0.00 N ATOM 2296 CA GLU B 589 66.719 5.599 10.707 1.00 0.00 C ATOM 2297 C GLU B 589 67.412 4.293 11.069 1.00 0.00 C ATOM 2298 O GLU B 589 67.017 3.212 10.680 1.00 0.00 O ATOM 2299 CB GLU B 589 65.770 6.033 11.841 1.00 0.00 C ATOM 2300 CG GLU B 589 66.364 5.712 13.222 1.00 0.00 C ATOM 2301 CD GLU B 589 65.556 6.435 14.300 1.00 0.00 C ATOM 2302 OE1 GLU B 589 64.486 5.954 14.634 1.00 0.00 O ATOM 2303 OE2 GLU B 589 66.020 7.460 14.773 1.00 0.00 O ATOM 0 H GLU B 589 65.598 4.509 9.245 1.00 0.00 H new ATOM 0 HA GLU B 589 67.487 6.359 10.564 1.00 0.00 H new ATOM 0 HB2 GLU B 589 65.576 7.103 11.766 1.00 0.00 H new ATOM 0 HB3 GLU B 589 64.811 5.527 11.729 1.00 0.00 H new ATOM 0 HG2 GLU B 589 66.345 4.636 13.397 1.00 0.00 H new ATOM 0 HG3 GLU B 589 67.408 6.024 13.263 1.00 0.00 H new ATOM 2310 N GLN B 590 68.440 4.424 11.840 1.00 0.00 N ATOM 2311 CA GLN B 590 69.218 3.260 12.308 1.00 0.00 C ATOM 2312 C GLN B 590 69.886 3.679 13.613 1.00 0.00 C ATOM 2313 O GLN B 590 70.256 4.823 13.781 1.00 0.00 O ATOM 2314 CB GLN B 590 70.285 2.881 11.266 1.00 0.00 C ATOM 2315 CG GLN B 590 70.727 1.417 11.471 1.00 0.00 C ATOM 2316 CD GLN B 590 69.848 0.475 10.642 1.00 0.00 C ATOM 2317 OE1 GLN B 590 68.643 0.455 10.795 1.00 0.00 O ATOM 2318 NE2 GLN B 590 70.408 -0.311 9.763 1.00 0.00 N ATOM 0 H GLN B 590 68.786 5.322 12.177 1.00 0.00 H new ATOM 0 HA GLN B 590 68.576 2.392 12.455 1.00 0.00 H new ATOM 0 HB2 GLN B 590 69.885 3.011 10.260 1.00 0.00 H new ATOM 0 HB3 GLN B 590 71.145 3.545 11.356 1.00 0.00 H new ATOM 0 HG2 GLN B 590 71.771 1.301 11.180 1.00 0.00 H new ATOM 0 HG3 GLN B 590 70.659 1.154 12.527 1.00 0.00 H new ATOM 0 HE21 GLN B 590 71.420 -0.294 9.635 1.00 0.00 H new ATOM 0 HE22 GLN B 590 69.834 -0.942 9.204 1.00 0.00 H new ATOM 2327 N ASN B 591 70.047 2.782 14.538 1.00 0.00 N ATOM 2328 CA ASN B 591 70.691 3.145 15.835 1.00 0.00 C ATOM 2329 C ASN B 591 70.109 4.473 16.363 1.00 0.00 C ATOM 2330 O ASN B 591 70.739 5.156 17.141 1.00 0.00 O ATOM 2331 CB ASN B 591 72.229 3.251 15.670 1.00 0.00 C ATOM 2332 CG ASN B 591 72.588 3.559 14.225 1.00 0.00 C ATOM 2333 OD1 ASN B 591 73.106 4.613 13.918 1.00 0.00 O ATOM 2334 ND2 ASN B 591 72.327 2.668 13.323 1.00 0.00 N ATOM 0 H ASN B 591 69.760 1.807 14.456 1.00 0.00 H new ATOM 0 HA ASN B 591 70.481 2.359 16.560 1.00 0.00 H new ATOM 0 HB2 ASN B 591 72.618 4.033 16.322 1.00 0.00 H new ATOM 0 HB3 ASN B 591 72.699 2.317 15.977 1.00 0.00 H new ATOM 0 HD21 ASN B 591 72.557 2.849 12.346 1.00 0.00 H new ATOM 0 HD22 ASN B 591 71.892 1.785 13.589 1.00 0.00 H new ATOM 2341 N ASP B 592 68.904 4.824 15.953 1.00 0.00 N ATOM 2342 CA ASP B 592 68.242 6.091 16.431 1.00 0.00 C ATOM 2343 C ASP B 592 68.744 7.299 15.638 1.00 0.00 C ATOM 2344 O ASP B 592 68.281 8.408 15.816 1.00 0.00 O ATOM 2345 CB ASP B 592 68.532 6.326 17.919 1.00 0.00 C ATOM 2346 CG ASP B 592 68.527 4.993 18.672 1.00 0.00 C ATOM 2347 OD1 ASP B 592 67.495 4.342 18.677 1.00 0.00 O ATOM 2348 OD2 ASP B 592 69.554 4.646 19.230 1.00 0.00 O ATOM 0 H ASP B 592 68.344 4.278 15.298 1.00 0.00 H new ATOM 0 HA ASP B 592 67.169 5.976 16.280 1.00 0.00 H new ATOM 0 HB2 ASP B 592 69.499 6.815 18.036 1.00 0.00 H new ATOM 0 HB3 ASP B 592 67.783 6.995 18.342 1.00 0.00 H new ATOM 2353 N LYS B 593 69.692 7.096 14.781 1.00 0.00 N ATOM 2354 CA LYS B 593 70.244 8.221 13.986 1.00 0.00 C ATOM 2355 C LYS B 593 69.433 8.377 12.686 1.00 0.00 C ATOM 2356 O LYS B 593 69.361 7.448 11.907 1.00 0.00 O ATOM 2357 CB LYS B 593 71.685 7.879 13.639 1.00 0.00 C ATOM 2358 CG LYS B 593 72.460 7.519 14.919 1.00 0.00 C ATOM 2359 CD LYS B 593 73.960 7.762 14.712 1.00 0.00 C ATOM 2360 CE LYS B 593 74.690 7.593 16.046 1.00 0.00 C ATOM 2361 NZ LYS B 593 74.414 8.772 16.915 1.00 0.00 N ATOM 0 H LYS B 593 70.116 6.188 14.592 1.00 0.00 H new ATOM 0 HA LYS B 593 70.193 9.151 14.552 1.00 0.00 H new ATOM 0 HB2 LYS B 593 71.711 7.043 12.940 1.00 0.00 H new ATOM 0 HB3 LYS B 593 72.159 8.725 13.142 1.00 0.00 H new ATOM 0 HG2 LYS B 593 72.098 8.119 15.754 1.00 0.00 H new ATOM 0 HG3 LYS B 593 72.285 6.475 15.178 1.00 0.00 H new ATOM 0 HD2 LYS B 593 74.355 7.061 13.977 1.00 0.00 H new ATOM 0 HD3 LYS B 593 74.126 8.765 14.318 1.00 0.00 H new ATOM 0 HE2 LYS B 593 74.361 6.679 16.540 1.00 0.00 H new ATOM 0 HE3 LYS B 593 75.762 7.496 15.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 593 75.125 8.819 17.673 1.00 0.00 H new ATOM 0 HZ2 LYS B 593 74.458 9.641 16.345 1.00 0.00 H new ATOM 0 HZ3 LYS B 593 73.467 8.680 17.334 1.00 0.00 H new ATOM 2375 N PRO B 594 68.829 9.523 12.418 1.00 0.00 N ATOM 2376 CA PRO B 594 68.055 9.681 11.156 1.00 0.00 C ATOM 2377 C PRO B 594 68.853 9.207 9.935 1.00 0.00 C ATOM 2378 O PRO B 594 70.050 9.008 10.007 1.00 0.00 O ATOM 2379 CB PRO B 594 67.812 11.193 11.131 1.00 0.00 C ATOM 2380 CG PRO B 594 67.934 11.701 12.567 1.00 0.00 C ATOM 2381 CD PRO B 594 68.851 10.722 13.315 1.00 0.00 C ATOM 0 HA PRO B 594 67.141 9.088 11.119 1.00 0.00 H new ATOM 0 HB2 PRO B 594 68.538 11.688 10.486 1.00 0.00 H new ATOM 0 HB3 PRO B 594 66.824 11.416 10.728 1.00 0.00 H new ATOM 0 HG2 PRO B 594 68.349 12.709 12.585 1.00 0.00 H new ATOM 0 HG3 PRO B 594 66.954 11.751 13.042 1.00 0.00 H new ATOM 0 HD2 PRO B 594 69.858 11.120 13.438 1.00 0.00 H new ATOM 0 HD3 PRO B 594 68.475 10.492 14.312 1.00 0.00 H new ATOM 2389 N TYR B 595 68.204 9.005 8.822 1.00 0.00 N ATOM 2390 CA TYR B 595 68.946 8.522 7.620 1.00 0.00 C ATOM 2391 C TYR B 595 68.052 8.577 6.375 1.00 0.00 C ATOM 2392 O TYR B 595 66.905 8.197 6.418 1.00 0.00 O ATOM 2393 CB TYR B 595 69.342 7.045 7.832 1.00 0.00 C ATOM 2394 CG TYR B 595 70.697 6.908 8.496 1.00 0.00 C ATOM 2395 CD1 TYR B 595 71.837 7.394 7.852 1.00 0.00 C ATOM 2396 CD2 TYR B 595 70.818 6.258 9.732 1.00 0.00 C ATOM 2397 CE1 TYR B 595 73.098 7.235 8.444 1.00 0.00 C ATOM 2398 CE2 TYR B 595 72.078 6.105 10.322 1.00 0.00 C ATOM 2399 CZ TYR B 595 73.216 6.592 9.676 1.00 0.00 C ATOM 2400 OH TYR B 595 74.458 6.436 10.256 1.00 0.00 O ATOM 0 H TYR B 595 67.203 9.151 8.691 1.00 0.00 H new ATOM 0 HA TYR B 595 69.821 9.157 7.481 1.00 0.00 H new ATOM 0 HB2 TYR B 595 68.587 6.552 8.445 1.00 0.00 H new ATOM 0 HB3 TYR B 595 69.357 6.532 6.870 1.00 0.00 H new ATOM 0 HD1 TYR B 595 71.747 7.892 6.898 1.00 0.00 H new ATOM 0 HD2 TYR B 595 69.939 5.875 10.229 1.00 0.00 H new ATOM 0 HE1 TYR B 595 73.979 7.611 7.945 1.00 0.00 H new ATOM 0 HE2 TYR B 595 72.170 5.610 11.277 1.00 0.00 H new ATOM 0 HH TYR B 595 74.525 7.013 11.045 1.00 0.00 H new ATOM 2410 N CYS B 596 68.592 8.944 5.245 1.00 0.00 N ATOM 2411 CA CYS B 596 67.770 8.890 4.009 1.00 0.00 C ATOM 2412 C CYS B 596 67.720 7.422 3.653 1.00 0.00 C ATOM 2413 O CYS B 596 68.604 6.673 4.024 1.00 0.00 O ATOM 2414 CB CYS B 596 68.423 9.653 2.842 1.00 0.00 C ATOM 2415 SG CYS B 596 68.976 11.294 3.353 1.00 0.00 S ATOM 0 H CYS B 596 69.550 9.273 5.127 1.00 0.00 H new ATOM 0 HA CYS B 596 66.793 9.344 4.176 1.00 0.00 H new ATOM 0 HB2 CYS B 596 69.271 9.083 2.463 1.00 0.00 H new ATOM 0 HB3 CYS B 596 67.710 9.747 2.023 1.00 0.00 H new ATOM 2420 N GLN B 597 66.742 6.971 2.941 1.00 0.00 N ATOM 2421 CA GLN B 597 66.755 5.536 2.607 1.00 0.00 C ATOM 2422 C GLN B 597 68.032 5.292 1.803 1.00 0.00 C ATOM 2423 O GLN B 597 68.874 4.503 2.176 1.00 0.00 O ATOM 2424 CB GLN B 597 65.471 5.177 1.823 1.00 0.00 C ATOM 2425 CG GLN B 597 65.677 3.974 0.883 1.00 0.00 C ATOM 2426 CD GLN B 597 65.451 2.672 1.648 1.00 0.00 C ATOM 2427 OE1 GLN B 597 64.980 1.698 1.095 1.00 0.00 O ATOM 2428 NE2 GLN B 597 65.770 2.618 2.905 1.00 0.00 N ATOM 0 H GLN B 597 65.956 7.514 2.584 1.00 0.00 H new ATOM 0 HA GLN B 597 66.759 4.898 3.491 1.00 0.00 H new ATOM 0 HB2 GLN B 597 64.669 4.952 2.526 1.00 0.00 H new ATOM 0 HB3 GLN B 597 65.151 6.040 1.240 1.00 0.00 H new ATOM 0 HG2 GLN B 597 64.987 4.036 0.042 1.00 0.00 H new ATOM 0 HG3 GLN B 597 66.685 3.993 0.470 1.00 0.00 H new ATOM 0 HE21 GLN B 597 66.165 3.437 3.367 1.00 0.00 H new ATOM 0 HE22 GLN B 597 65.625 1.756 3.431 1.00 0.00 H new ATOM 2437 N ASN B 598 68.185 5.985 0.711 1.00 0.00 N ATOM 2438 CA ASN B 598 69.405 5.818 -0.125 1.00 0.00 C ATOM 2439 C ASN B 598 70.641 5.825 0.775 1.00 0.00 C ATOM 2440 O ASN B 598 71.644 5.208 0.477 1.00 0.00 O ATOM 2441 CB ASN B 598 69.482 6.970 -1.139 1.00 0.00 C ATOM 2442 CG ASN B 598 68.074 7.400 -1.526 1.00 0.00 C ATOM 2443 OD1 ASN B 598 67.698 8.542 -1.353 1.00 0.00 O ATOM 2444 ND2 ASN B 598 67.278 6.521 -2.047 1.00 0.00 N ATOM 0 H ASN B 598 67.512 6.666 0.359 1.00 0.00 H new ATOM 0 HA ASN B 598 69.363 4.870 -0.662 1.00 0.00 H new ATOM 0 HB2 ASN B 598 70.026 7.811 -0.709 1.00 0.00 H new ATOM 0 HB3 ASN B 598 70.033 6.653 -2.024 1.00 0.00 H new ATOM 0 HD21 ASN B 598 66.330 6.786 -2.314 1.00 0.00 H new ATOM 0 HD22 ASN B 598 67.599 5.563 -2.190 1.00 0.00 H new ATOM 2451 N CYS B 599 70.569 6.509 1.882 1.00 0.00 N ATOM 2452 CA CYS B 599 71.726 6.544 2.804 1.00 0.00 C ATOM 2453 C CYS B 599 71.722 5.269 3.646 1.00 0.00 C ATOM 2454 O CYS B 599 72.611 4.458 3.539 1.00 0.00 O ATOM 2455 CB CYS B 599 71.619 7.768 3.719 1.00 0.00 C ATOM 2456 SG CYS B 599 72.063 9.260 2.795 1.00 0.00 S ATOM 0 H CYS B 599 69.755 7.045 2.184 1.00 0.00 H new ATOM 0 HA CYS B 599 72.653 6.608 2.234 1.00 0.00 H new ATOM 0 HB2 CYS B 599 70.604 7.857 4.106 1.00 0.00 H new ATOM 0 HB3 CYS B 599 72.279 7.651 4.578 1.00 0.00 H new ATOM 2461 N PHE B 600 70.721 5.088 4.473 1.00 0.00 N ATOM 2462 CA PHE B 600 70.648 3.869 5.333 1.00 0.00 C ATOM 2463 C PHE B 600 70.776 2.610 4.469 1.00 0.00 C ATOM 2464 O PHE B 600 71.594 1.752 4.733 1.00 0.00 O ATOM 2465 CB PHE B 600 69.299 3.889 6.100 1.00 0.00 C ATOM 2466 CG PHE B 600 68.684 2.505 6.203 1.00 0.00 C ATOM 2467 CD1 PHE B 600 67.892 2.015 5.159 1.00 0.00 C ATOM 2468 CD2 PHE B 600 68.904 1.720 7.340 1.00 0.00 C ATOM 2469 CE1 PHE B 600 67.321 0.740 5.250 1.00 0.00 C ATOM 2470 CE2 PHE B 600 68.333 0.445 7.432 1.00 0.00 C ATOM 2471 CZ PHE B 600 67.541 -0.045 6.387 1.00 0.00 C ATOM 0 H PHE B 600 69.945 5.740 4.589 1.00 0.00 H new ATOM 0 HA PHE B 600 71.468 3.861 6.051 1.00 0.00 H new ATOM 0 HB2 PHE B 600 69.457 4.291 7.101 1.00 0.00 H new ATOM 0 HB3 PHE B 600 68.604 4.558 5.593 1.00 0.00 H new ATOM 0 HD1 PHE B 600 67.721 2.621 4.282 1.00 0.00 H new ATOM 0 HD2 PHE B 600 69.514 2.098 8.147 1.00 0.00 H new ATOM 0 HE1 PHE B 600 66.711 0.363 4.443 1.00 0.00 H new ATOM 0 HE2 PHE B 600 68.504 -0.161 8.310 1.00 0.00 H new ATOM 0 HZ PHE B 600 67.100 -1.028 6.458 1.00 0.00 H new ATOM 2481 N LEU B 601 69.966 2.479 3.456 1.00 0.00 N ATOM 2482 CA LEU B 601 70.043 1.264 2.602 1.00 0.00 C ATOM 2483 C LEU B 601 71.505 1.021 2.222 1.00 0.00 C ATOM 2484 O LEU B 601 71.982 -0.096 2.233 1.00 0.00 O ATOM 2485 CB LEU B 601 69.123 1.460 1.364 1.00 0.00 C ATOM 2486 CG LEU B 601 69.909 1.658 0.040 1.00 0.00 C ATOM 2487 CD1 LEU B 601 70.629 0.348 -0.377 1.00 0.00 C ATOM 2488 CD2 LEU B 601 68.928 2.076 -1.068 1.00 0.00 C ATOM 0 H LEU B 601 69.256 3.159 3.184 1.00 0.00 H new ATOM 0 HA LEU B 601 69.691 0.379 3.133 1.00 0.00 H new ATOM 0 HB2 LEU B 601 68.470 0.593 1.264 1.00 0.00 H new ATOM 0 HB3 LEU B 601 68.481 2.325 1.530 1.00 0.00 H new ATOM 0 HG LEU B 601 70.661 2.432 0.191 1.00 0.00 H new ATOM 0 HD11 LEU B 601 71.173 0.512 -1.307 1.00 0.00 H new ATOM 0 HD12 LEU B 601 71.329 0.053 0.405 1.00 0.00 H new ATOM 0 HD13 LEU B 601 69.892 -0.442 -0.522 1.00 0.00 H new ATOM 0 HD21 LEU B 601 69.472 2.217 -2.002 1.00 0.00 H new ATOM 0 HD22 LEU B 601 68.176 1.298 -1.200 1.00 0.00 H new ATOM 0 HD23 LEU B 601 68.439 3.009 -0.788 1.00 0.00 H new ATOM 2500 N LYS B 602 72.214 2.056 1.885 1.00 0.00 N ATOM 2501 CA LYS B 602 73.637 1.880 1.503 1.00 0.00 C ATOM 2502 C LYS B 602 74.432 1.296 2.674 1.00 0.00 C ATOM 2503 O LYS B 602 75.496 0.750 2.490 1.00 0.00 O ATOM 2504 CB LYS B 602 74.228 3.236 1.101 1.00 0.00 C ATOM 2505 CG LYS B 602 75.546 3.041 0.340 1.00 0.00 C ATOM 2506 CD LYS B 602 75.284 2.726 -1.141 1.00 0.00 C ATOM 2507 CE LYS B 602 76.518 2.043 -1.746 1.00 0.00 C ATOM 2508 NZ LYS B 602 76.292 1.805 -3.199 1.00 0.00 N ATOM 0 H LYS B 602 71.870 3.016 1.857 1.00 0.00 H new ATOM 0 HA LYS B 602 73.697 1.191 0.661 1.00 0.00 H new ATOM 0 HB2 LYS B 602 73.518 3.779 0.477 1.00 0.00 H new ATOM 0 HB3 LYS B 602 74.400 3.843 1.990 1.00 0.00 H new ATOM 0 HG2 LYS B 602 76.154 3.942 0.422 1.00 0.00 H new ATOM 0 HG3 LYS B 602 76.115 2.229 0.793 1.00 0.00 H new ATOM 0 HD2 LYS B 602 74.413 2.078 -1.237 1.00 0.00 H new ATOM 0 HD3 LYS B 602 75.060 3.644 -1.685 1.00 0.00 H new ATOM 0 HE2 LYS B 602 77.400 2.667 -1.602 1.00 0.00 H new ATOM 0 HE3 LYS B 602 76.710 1.098 -1.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 602 76.942 1.066 -3.535 1.00 0.00 H new ATOM 0 HZ2 LYS B 602 75.310 1.498 -3.352 1.00 0.00 H new ATOM 0 HZ3 LYS B 602 76.465 2.685 -3.726 1.00 0.00 H new ATOM 2522 N LEU B 603 73.942 1.413 3.880 1.00 0.00 N ATOM 2523 CA LEU B 603 74.700 0.866 5.052 1.00 0.00 C ATOM 2524 C LEU B 603 74.266 -0.574 5.344 1.00 0.00 C ATOM 2525 O LEU B 603 75.078 -1.477 5.377 1.00 0.00 O ATOM 2526 CB LEU B 603 74.445 1.747 6.279 1.00 0.00 C ATOM 2527 CG LEU B 603 74.404 3.213 5.843 1.00 0.00 C ATOM 2528 CD1 LEU B 603 74.291 4.123 7.067 1.00 0.00 C ATOM 2529 CD2 LEU B 603 75.678 3.560 5.067 1.00 0.00 C ATOM 0 H LEU B 603 73.054 1.861 4.107 1.00 0.00 H new ATOM 0 HA LEU B 603 75.765 0.866 4.818 1.00 0.00 H new ATOM 0 HB2 LEU B 603 73.503 1.469 6.752 1.00 0.00 H new ATOM 0 HB3 LEU B 603 75.231 1.597 7.020 1.00 0.00 H new ATOM 0 HG LEU B 603 73.535 3.364 5.202 1.00 0.00 H new ATOM 0 HD11 LEU B 603 74.263 5.164 6.745 1.00 0.00 H new ATOM 0 HD12 LEU B 603 73.378 3.887 7.613 1.00 0.00 H new ATOM 0 HD13 LEU B 603 75.152 3.968 7.717 1.00 0.00 H new ATOM 0 HD21 LEU B 603 75.643 4.605 4.759 1.00 0.00 H new ATOM 0 HD22 LEU B 603 76.548 3.398 5.704 1.00 0.00 H new ATOM 0 HD23 LEU B 603 75.751 2.924 4.185 1.00 0.00 H new ATOM 2541 N PHE B 604 72.997 -0.801 5.565 1.00 0.00 N ATOM 2542 CA PHE B 604 72.524 -2.190 5.864 1.00 0.00 C ATOM 2543 C PHE B 604 72.083 -2.875 4.564 1.00 0.00 C ATOM 2544 O PHE B 604 71.512 -3.947 4.584 1.00 0.00 O ATOM 2545 CB PHE B 604 71.341 -2.126 6.853 1.00 0.00 C ATOM 2546 CG PHE B 604 71.855 -2.125 8.281 1.00 0.00 C ATOM 2547 CD1 PHE B 604 72.905 -1.275 8.652 1.00 0.00 C ATOM 2548 CD2 PHE B 604 71.280 -2.979 9.233 1.00 0.00 C ATOM 2549 CE1 PHE B 604 73.379 -1.279 9.969 1.00 0.00 C ATOM 2550 CE2 PHE B 604 71.754 -2.982 10.550 1.00 0.00 C ATOM 2551 CZ PHE B 604 72.803 -2.132 10.918 1.00 0.00 C ATOM 0 H PHE B 604 72.268 -0.088 5.552 1.00 0.00 H new ATOM 0 HA PHE B 604 73.336 -2.765 6.311 1.00 0.00 H new ATOM 0 HB2 PHE B 604 70.752 -1.228 6.670 1.00 0.00 H new ATOM 0 HB3 PHE B 604 70.680 -2.978 6.697 1.00 0.00 H new ATOM 0 HD1 PHE B 604 73.349 -0.616 7.921 1.00 0.00 H new ATOM 0 HD2 PHE B 604 70.470 -3.635 8.950 1.00 0.00 H new ATOM 0 HE1 PHE B 604 74.189 -0.624 10.253 1.00 0.00 H new ATOM 0 HE2 PHE B 604 71.310 -3.640 11.282 1.00 0.00 H new ATOM 0 HZ PHE B 604 73.168 -2.134 11.934 1.00 0.00 H new ATOM 2561 N CYS B 605 72.347 -2.270 3.438 1.00 0.00 N ATOM 2562 CA CYS B 605 71.944 -2.896 2.146 1.00 0.00 C ATOM 2563 C CYS B 605 72.758 -2.274 1.006 1.00 0.00 C ATOM 2564 O CYS B 605 72.469 -2.582 -0.139 1.00 0.00 O ATOM 2565 CB CYS B 605 70.446 -2.659 1.908 1.00 0.00 C ATOM 2566 SG CYS B 605 69.489 -3.905 2.806 1.00 0.00 S ATOM 2567 OXT CYS B 605 73.654 -1.500 1.298 1.00 0.00 O ATOM 0 H CYS B 605 72.823 -1.372 3.356 1.00 0.00 H new ATOM 0 HA CYS B 605 72.135 -3.969 2.181 1.00 0.00 H new ATOM 0 HB2 CYS B 605 70.167 -1.660 2.243 1.00 0.00 H new ATOM 0 HB3 CYS B 605 70.223 -2.712 0.842 1.00 0.00 H new ATOM 0 HG CYS B 605 70.163 -4.305 3.843 1.00 0.00 H new TER 2573 CYS B 605 HETATM 2574 ZN ZN B 701 65.388 23.722 14.845 1.00 0.00 ZN HETATM 2575 ZN ZN B 702 71.236 11.171 3.774 1.00 0.00 ZN