USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1290 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 45 MET CE :methyl 155:sc= -2.23! (180deg=-4.05!) USER MOD Set 1.2: B 49 GLN : amide:sc= -0.0592 X(o=-2.3,f=-2.4) USER MOD Set 2.1: A 45 MET CE :methyl 169:sc= 0 (180deg=0) USER MOD Set 2.2: A 49 GLN :FLIP amide:sc= -3.62! C(o=-4.3!,f=-3.6!) USER MOD Single : A 1 MET CE :methyl -173:sc= -0.113 (180deg=-0.217) USER MOD Single : A 1 MET N :NH3+ -106:sc= 0.00401 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -163:sc= -0.218 (180deg=-0.9) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -136:sc= -0.602 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 23 THR OG1 : rot -80:sc= -0.384 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 67:sc= 0.553 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 MET CE :methyl -160:sc= -1.44 (180deg=-2.79!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0985 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.0068) USER MOD Single : A 51 LYS NZ :NH3+ 168:sc= -7.43! (180deg=-8.47!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.0782 X(o=-0.078,f=-0.57) USER MOD Single : A 59 LYS NZ :NH3+ 166:sc= -0.0848 (180deg=-0.476) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -120:sc= 0.3 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 167:sc= -1.68! (180deg=-2.04!) USER MOD Single : B 1 MET N :NH3+ 145:sc= 0.0126 (180deg=0) USER MOD Single : B 4 SER OG : rot 31:sc= 1.25 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ -156:sc= -0.0527 (180deg=-0.339) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.127) USER MOD Single : B 12 THR OG1 : rot -121:sc= 0.496 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc=-0.00844 X(o=-0.0084,f=0) USER MOD Single : B 23 THR OG1 : rot -79:sc= -2.95! USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 100:sc= 1.16 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.0909 K(o=-0.091,f=-1.8!) USER MOD Single : B 35 MET CE :methyl -174:sc= -0.17 (180deg=-0.231) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0803 USER MOD Single : B 50 ASN : amide:sc= -4.72! C(o=-4.7!,f=-8!) USER MOD Single : B 51 LYS NZ :NH3+ 147:sc= -7! (180deg=-10.1!) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= -0.199 X(o=-0.2,f=-0.019) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -155:sc= -0.0432 (180deg=-0.403) USER MOD Single : B 66 SER OG : rot 180:sc= 0 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.765 18.513 -18.236 1.00 0.00 N ATOM 2 CA MET A 1 11.418 17.943 -17.976 1.00 0.00 C ATOM 3 C MET A 1 10.368 19.043 -17.858 1.00 0.00 C ATOM 4 O MET A 1 10.624 20.099 -17.279 1.00 0.00 O ATOM 5 CB MET A 1 11.475 17.126 -16.685 1.00 0.00 C ATOM 6 CG MET A 1 10.164 16.435 -16.343 1.00 0.00 C ATOM 7 SD MET A 1 9.326 17.186 -14.934 1.00 0.00 S ATOM 8 CE MET A 1 9.395 15.848 -13.746 1.00 0.00 C ATOM 0 H1 MET A 1 13.027 18.346 -19.229 1.00 0.00 H new ATOM 0 H2 MET A 1 12.751 19.536 -18.049 1.00 0.00 H new ATOM 0 H3 MET A 1 13.461 18.056 -17.613 1.00 0.00 H new ATOM 0 HA MET A 1 11.132 17.304 -18.812 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.259 16.375 -16.775 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.756 17.783 -15.861 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.505 16.466 -17.211 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.358 15.384 -16.127 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.809 16.112 -12.866 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.988 14.942 -14.194 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.431 15.674 -13.454 1.00 0.00 H new ATOM 20 N VAL A 2 9.186 18.786 -18.407 1.00 0.00 N ATOM 21 CA VAL A 2 8.096 19.754 -18.363 1.00 0.00 C ATOM 22 C VAL A 2 6.750 19.061 -18.172 1.00 0.00 C ATOM 23 O VAL A 2 5.710 19.586 -18.567 1.00 0.00 O ATOM 24 CB VAL A 2 8.044 20.601 -19.647 1.00 0.00 C ATOM 25 CG1 VAL A 2 9.217 21.568 -19.699 1.00 0.00 C ATOM 26 CG2 VAL A 2 8.029 19.704 -20.877 1.00 0.00 C ATOM 0 H VAL A 2 8.958 17.916 -18.888 1.00 0.00 H new ATOM 0 HA VAL A 2 8.290 20.407 -17.512 1.00 0.00 H new ATOM 0 HB VAL A 2 7.123 21.184 -19.638 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.162 22.158 -20.614 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.179 22.233 -18.836 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.152 21.007 -19.684 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.992 20.320 -21.776 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.931 19.093 -20.893 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.153 19.057 -20.844 1.00 0.00 H new ATOM 36 N GLU A 3 6.777 17.878 -17.563 1.00 0.00 N ATOM 37 CA GLU A 3 5.560 17.113 -17.321 1.00 0.00 C ATOM 38 C GLU A 3 4.898 16.710 -18.635 1.00 0.00 C ATOM 39 O GLU A 3 4.744 17.527 -19.541 1.00 0.00 O ATOM 40 CB GLU A 3 4.579 17.926 -16.472 1.00 0.00 C ATOM 41 CG GLU A 3 3.431 17.102 -15.911 1.00 0.00 C ATOM 42 CD GLU A 3 3.526 16.913 -14.410 1.00 0.00 C ATOM 43 OE1 GLU A 3 3.675 15.755 -13.965 1.00 0.00 O ATOM 44 OE2 GLU A 3 3.451 17.922 -13.679 1.00 0.00 O ATOM 0 H GLU A 3 7.630 17.429 -17.228 1.00 0.00 H new ATOM 0 HA GLU A 3 5.834 16.207 -16.780 1.00 0.00 H new ATOM 0 HB2 GLU A 3 5.121 18.387 -15.647 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.172 18.736 -17.078 1.00 0.00 H new ATOM 0 HG2 GLU A 3 2.487 17.590 -16.153 1.00 0.00 H new ATOM 0 HG3 GLU A 3 3.419 16.126 -16.396 1.00 0.00 H new ATOM 51 N SER A 4 4.507 15.442 -18.730 1.00 0.00 N ATOM 52 CA SER A 4 3.860 14.930 -19.932 1.00 0.00 C ATOM 53 C SER A 4 4.793 15.018 -21.136 1.00 0.00 C ATOM 54 O SER A 4 5.784 15.749 -21.114 1.00 0.00 O ATOM 55 CB SER A 4 2.572 15.705 -20.215 1.00 0.00 C ATOM 56 OG SER A 4 1.776 15.040 -21.180 1.00 0.00 O ATOM 0 H SER A 4 4.627 14.751 -17.989 1.00 0.00 H new ATOM 0 HA SER A 4 3.616 13.882 -19.761 1.00 0.00 H new ATOM 0 HB2 SER A 4 2.005 15.824 -19.291 1.00 0.00 H new ATOM 0 HB3 SER A 4 2.817 16.706 -20.569 1.00 0.00 H new ATOM 0 HG SER A 4 0.958 15.556 -21.341 1.00 0.00 H new ATOM 62 N LYS A 5 4.469 14.270 -22.185 1.00 0.00 N ATOM 63 CA LYS A 5 5.275 14.262 -23.401 1.00 0.00 C ATOM 64 C LYS A 5 6.698 13.785 -23.119 1.00 0.00 C ATOM 65 O LYS A 5 7.611 14.037 -23.906 1.00 0.00 O ATOM 66 CB LYS A 5 5.309 15.660 -24.021 1.00 0.00 C ATOM 67 CG LYS A 5 5.704 15.665 -25.489 1.00 0.00 C ATOM 68 CD LYS A 5 4.657 14.980 -26.353 1.00 0.00 C ATOM 69 CE LYS A 5 5.294 14.067 -27.390 1.00 0.00 C ATOM 70 NZ LYS A 5 4.898 14.439 -28.776 1.00 0.00 N ATOM 0 H LYS A 5 3.652 13.660 -22.218 1.00 0.00 H new ATOM 0 HA LYS A 5 4.815 13.567 -24.103 1.00 0.00 H new ATOM 0 HB2 LYS A 5 4.326 16.119 -23.916 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.011 16.279 -23.462 1.00 0.00 H new ATOM 0 HG2 LYS A 5 5.839 16.693 -25.826 1.00 0.00 H new ATOM 0 HG3 LYS A 5 6.663 15.161 -25.610 1.00 0.00 H new ATOM 0 HD2 LYS A 5 3.986 14.399 -25.720 1.00 0.00 H new ATOM 0 HD3 LYS A 5 4.050 15.733 -26.855 1.00 0.00 H new ATOM 0 HE2 LYS A 5 6.379 14.114 -27.298 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.002 13.035 -27.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 5.353 13.793 -29.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 3.865 14.370 -28.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 5.199 15.415 -28.973 1.00 0.00 H new ATOM 84 N LYS A 6 6.883 13.094 -21.996 1.00 0.00 N ATOM 85 CA LYS A 6 8.197 12.582 -21.620 1.00 0.00 C ATOM 86 C LYS A 6 8.151 11.922 -20.245 1.00 0.00 C ATOM 87 O LYS A 6 8.242 10.699 -20.129 1.00 0.00 O ATOM 88 CB LYS A 6 9.233 13.711 -21.625 1.00 0.00 C ATOM 89 CG LYS A 6 10.400 13.460 -22.566 1.00 0.00 C ATOM 90 CD LYS A 6 11.504 12.664 -21.886 1.00 0.00 C ATOM 91 CE LYS A 6 12.691 13.545 -21.531 1.00 0.00 C ATOM 92 NZ LYS A 6 13.592 13.760 -22.696 1.00 0.00 N ATOM 0 H LYS A 6 6.140 12.876 -21.332 1.00 0.00 H new ATOM 0 HA LYS A 6 8.489 11.831 -22.354 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.742 14.642 -21.908 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.615 13.847 -20.613 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.050 12.920 -23.446 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.799 14.413 -22.915 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.113 12.197 -20.982 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.831 11.859 -22.544 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.332 14.508 -21.167 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.253 13.086 -20.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.388 14.366 -22.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.955 12.844 -23.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 13.063 14.221 -23.464 1.00 0.00 H new ATOM 106 N ILE A 7 8.014 12.738 -19.205 1.00 0.00 N ATOM 107 CA ILE A 7 7.960 12.233 -17.839 1.00 0.00 C ATOM 108 C ILE A 7 6.646 12.608 -17.160 1.00 0.00 C ATOM 109 O ILE A 7 6.418 13.771 -16.824 1.00 0.00 O ATOM 110 CB ILE A 7 9.132 12.770 -16.995 1.00 0.00 C ATOM 111 CG1 ILE A 7 10.443 12.673 -17.779 1.00 0.00 C ATOM 112 CG2 ILE A 7 9.236 12.009 -15.680 1.00 0.00 C ATOM 113 CD1 ILE A 7 10.851 13.972 -18.438 1.00 0.00 C ATOM 0 H ILE A 7 7.938 13.752 -19.283 1.00 0.00 H new ATOM 0 HA ILE A 7 8.033 11.147 -17.903 1.00 0.00 H new ATOM 0 HB ILE A 7 8.943 13.819 -16.769 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.237 12.352 -17.105 1.00 0.00 H new ATOM 0 HG13 ILE A 7 10.343 11.903 -18.544 1.00 0.00 H new ATOM 0 HG21 ILE A 7 10.069 12.402 -15.097 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.311 12.128 -15.116 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.403 10.951 -15.884 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.788 13.829 -18.975 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.076 14.284 -19.138 1.00 0.00 H new ATOM 0 HD13 ILE A 7 10.983 14.740 -17.676 1.00 0.00 H new ATOM 125 N ALA A 8 5.785 11.614 -16.959 1.00 0.00 N ATOM 126 CA ALA A 8 4.493 11.836 -16.318 1.00 0.00 C ATOM 127 C ALA A 8 4.051 10.600 -15.543 1.00 0.00 C ATOM 128 O ALA A 8 4.817 9.651 -15.381 1.00 0.00 O ATOM 129 CB ALA A 8 3.446 12.214 -17.355 1.00 0.00 C ATOM 0 H ALA A 8 5.959 10.647 -17.231 1.00 0.00 H new ATOM 0 HA ALA A 8 4.600 12.660 -15.612 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.488 12.376 -16.862 1.00 0.00 H new ATOM 0 HB2 ALA A 8 3.752 13.128 -17.864 1.00 0.00 H new ATOM 0 HB3 ALA A 8 3.348 11.409 -18.083 1.00 0.00 H new ATOM 135 N LYS A 9 2.809 10.615 -15.066 1.00 0.00 N ATOM 136 CA LYS A 9 2.269 9.490 -14.309 1.00 0.00 C ATOM 137 C LYS A 9 1.953 8.336 -15.250 1.00 0.00 C ATOM 138 O LYS A 9 1.524 8.553 -16.385 1.00 0.00 O ATOM 139 CB LYS A 9 1.015 9.931 -13.537 1.00 0.00 C ATOM 140 CG LYS A 9 -0.019 8.833 -13.317 1.00 0.00 C ATOM 141 CD LYS A 9 -1.135 8.905 -14.348 1.00 0.00 C ATOM 142 CE LYS A 9 -2.093 10.049 -14.052 1.00 0.00 C ATOM 143 NZ LYS A 9 -2.488 10.085 -12.617 1.00 0.00 N ATOM 0 H LYS A 9 2.159 11.392 -15.190 1.00 0.00 H new ATOM 0 HA LYS A 9 3.012 9.149 -13.588 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.322 10.322 -12.567 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.543 10.752 -14.077 1.00 0.00 H new ATOM 0 HG2 LYS A 9 0.466 7.858 -13.372 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -0.440 8.924 -12.316 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -0.706 9.036 -15.342 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -1.683 7.963 -14.359 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.624 10.995 -14.323 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -2.984 9.946 -14.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -3.339 10.672 -12.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.689 9.119 -12.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -1.713 10.489 -12.054 1.00 0.00 H new ATOM 157 N LYS A 10 2.178 7.109 -14.790 1.00 0.00 N ATOM 158 CA LYS A 10 1.923 5.942 -15.623 1.00 0.00 C ATOM 159 C LYS A 10 1.157 4.871 -14.850 1.00 0.00 C ATOM 160 O LYS A 10 1.450 4.611 -13.689 1.00 0.00 O ATOM 161 CB LYS A 10 3.254 5.376 -16.130 1.00 0.00 C ATOM 162 CG LYS A 10 4.020 6.322 -17.043 1.00 0.00 C ATOM 163 CD LYS A 10 5.499 6.371 -16.679 1.00 0.00 C ATOM 164 CE LYS A 10 6.384 6.165 -17.899 1.00 0.00 C ATOM 165 NZ LYS A 10 7.090 4.854 -17.857 1.00 0.00 N ATOM 0 H LYS A 10 2.532 6.900 -13.857 1.00 0.00 H new ATOM 0 HA LYS A 10 1.309 6.247 -16.470 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.881 5.126 -15.274 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.061 4.447 -16.666 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.909 6.000 -18.078 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.593 7.323 -16.973 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.729 7.332 -16.220 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.717 5.603 -15.937 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.776 6.222 -18.802 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.116 6.970 -17.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.683 4.752 -18.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.690 4.810 -17.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.391 4.084 -17.828 1.00 0.00 H new ATOM 179 N LYS A 11 0.178 4.238 -15.492 1.00 0.00 N ATOM 180 CA LYS A 11 -0.587 3.194 -14.819 1.00 0.00 C ATOM 181 C LYS A 11 0.342 2.049 -14.451 1.00 0.00 C ATOM 182 O LYS A 11 0.809 1.313 -15.321 1.00 0.00 O ATOM 183 CB LYS A 11 -1.726 2.685 -15.704 1.00 0.00 C ATOM 184 CG LYS A 11 -2.652 3.786 -16.195 1.00 0.00 C ATOM 185 CD LYS A 11 -3.788 4.034 -15.216 1.00 0.00 C ATOM 186 CE LYS A 11 -4.483 5.357 -15.492 1.00 0.00 C ATOM 187 NZ LYS A 11 -5.949 5.277 -15.245 1.00 0.00 N ATOM 0 H LYS A 11 -0.099 4.424 -16.456 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.030 3.614 -13.916 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.303 2.167 -16.564 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.309 1.953 -15.146 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.084 4.705 -16.336 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.061 3.512 -17.168 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.511 3.221 -15.283 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.399 4.032 -14.198 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -4.050 6.133 -14.860 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.305 5.652 -16.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.386 6.200 -15.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.367 4.555 -15.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.120 5.021 -14.252 1.00 0.00 H new ATOM 201 N THR A 12 0.636 1.920 -13.163 1.00 0.00 N ATOM 202 CA THR A 12 1.542 0.880 -12.704 1.00 0.00 C ATOM 203 C THR A 12 0.800 -0.295 -12.079 1.00 0.00 C ATOM 204 O THR A 12 -0.151 -0.109 -11.321 1.00 0.00 O ATOM 205 CB THR A 12 2.541 1.454 -11.698 1.00 0.00 C ATOM 206 OG1 THR A 12 3.131 2.639 -12.199 1.00 0.00 O ATOM 207 CG2 THR A 12 3.660 0.495 -11.353 1.00 0.00 C ATOM 0 H THR A 12 0.263 2.518 -12.425 1.00 0.00 H new ATOM 0 HA THR A 12 2.074 0.508 -13.580 1.00 0.00 H new ATOM 0 HB THR A 12 1.962 1.652 -10.796 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.096 2.622 -12.027 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.333 0.964 -10.635 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.241 -0.412 -10.918 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.214 0.241 -12.257 1.00 0.00 H new ATOM 215 N THR A 13 1.255 -1.508 -12.386 1.00 0.00 N ATOM 216 CA THR A 13 0.640 -2.709 -11.833 1.00 0.00 C ATOM 217 C THR A 13 1.557 -3.374 -10.822 1.00 0.00 C ATOM 218 O THR A 13 2.779 -3.364 -10.967 1.00 0.00 O ATOM 219 CB THR A 13 0.288 -3.719 -12.925 1.00 0.00 C ATOM 220 OG1 THR A 13 0.105 -3.079 -14.176 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.965 -4.503 -12.610 1.00 0.00 C ATOM 0 H THR A 13 2.042 -1.683 -13.011 1.00 0.00 H new ATOM 0 HA THR A 13 -0.278 -2.391 -11.339 1.00 0.00 H new ATOM 0 HB THR A 13 1.132 -4.407 -12.971 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.117 -3.748 -14.856 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.168 -5.205 -13.419 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.826 -5.052 -11.679 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.806 -3.818 -12.505 1.00 0.00 H new ATOM 229 N LEU A 14 0.948 -3.966 -9.811 1.00 0.00 N ATOM 230 CA LEU A 14 1.676 -4.663 -8.768 1.00 0.00 C ATOM 231 C LEU A 14 0.912 -5.912 -8.375 1.00 0.00 C ATOM 232 O LEU A 14 -0.290 -5.845 -8.129 1.00 0.00 O ATOM 233 CB LEU A 14 1.854 -3.760 -7.545 1.00 0.00 C ATOM 234 CG LEU A 14 2.075 -2.279 -7.855 1.00 0.00 C ATOM 235 CD1 LEU A 14 1.683 -1.426 -6.659 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.522 -2.022 -8.247 1.00 0.00 C ATOM 0 H LEU A 14 -0.065 -3.977 -9.690 1.00 0.00 H new ATOM 0 HA LEU A 14 2.662 -4.936 -9.144 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.971 -3.854 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.702 -4.124 -6.965 1.00 0.00 H new ATOM 0 HG LEU A 14 1.442 -2.004 -8.699 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.845 -0.374 -6.894 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.630 -1.588 -6.426 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.292 -1.704 -5.799 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.658 -0.962 -8.463 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.178 -2.312 -7.426 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.769 -2.608 -9.133 1.00 0.00 H new ATOM 248 N ALA A 15 1.585 -7.055 -8.323 1.00 0.00 N ATOM 249 CA ALA A 15 0.886 -8.275 -7.965 1.00 0.00 C ATOM 250 C ALA A 15 0.853 -8.456 -6.462 1.00 0.00 C ATOM 251 O ALA A 15 1.755 -9.042 -5.866 1.00 0.00 O ATOM 252 CB ALA A 15 1.528 -9.478 -8.638 1.00 0.00 C ATOM 0 H ALA A 15 2.581 -7.160 -8.518 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.142 -8.194 -8.318 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.989 -10.383 -8.357 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.488 -9.354 -9.720 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.567 -9.561 -8.320 1.00 0.00 H new ATOM 258 N PHE A 16 -0.229 -7.964 -5.876 1.00 0.00 N ATOM 259 CA PHE A 16 -0.472 -8.064 -4.455 1.00 0.00 C ATOM 260 C PHE A 16 -1.930 -7.814 -4.162 1.00 0.00 C ATOM 261 O PHE A 16 -2.699 -7.441 -5.041 1.00 0.00 O ATOM 262 CB PHE A 16 0.377 -7.085 -3.658 1.00 0.00 C ATOM 263 CG PHE A 16 1.847 -7.200 -3.935 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.639 -8.066 -3.195 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.440 -6.446 -4.934 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.993 -8.176 -3.448 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.794 -6.551 -5.191 1.00 0.00 C ATOM 268 CZ PHE A 16 4.571 -7.417 -4.447 1.00 0.00 C ATOM 0 H PHE A 16 -0.968 -7.479 -6.385 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.196 -9.073 -4.150 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.052 -6.069 -3.882 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.202 -7.248 -2.594 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.192 -8.661 -2.412 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.837 -5.768 -5.519 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.599 -8.854 -2.865 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.244 -5.957 -5.973 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.629 -7.501 -4.646 1.00 0.00 H new ATOM 278 N ASP A 17 -2.291 -7.996 -2.916 1.00 0.00 N ATOM 279 CA ASP A 17 -3.646 -7.769 -2.460 1.00 0.00 C ATOM 280 C ASP A 17 -3.873 -8.544 -1.203 1.00 0.00 C ATOM 281 O ASP A 17 -4.539 -8.081 -0.283 1.00 0.00 O ATOM 282 CB ASP A 17 -4.682 -8.172 -3.500 1.00 0.00 C ATOM 283 CG ASP A 17 -5.241 -6.980 -4.253 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.343 -7.103 -4.827 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.576 -5.922 -4.268 1.00 0.00 O ATOM 0 H ASP A 17 -1.653 -8.307 -2.184 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.764 -6.700 -2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.230 -8.866 -4.209 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.498 -8.703 -3.009 1.00 0.00 H new ATOM 290 N GLU A 18 -3.300 -9.725 -1.149 1.00 0.00 N ATOM 291 CA GLU A 18 -3.451 -10.534 0.030 1.00 0.00 C ATOM 292 C GLU A 18 -3.187 -9.671 1.263 1.00 0.00 C ATOM 293 O GLU A 18 -4.088 -9.399 2.064 1.00 0.00 O ATOM 294 CB GLU A 18 -2.494 -11.727 0.002 1.00 0.00 C ATOM 295 CG GLU A 18 -3.084 -12.994 0.595 1.00 0.00 C ATOM 296 CD GLU A 18 -3.040 -13.005 2.110 1.00 0.00 C ATOM 297 OE1 GLU A 18 -4.104 -13.202 2.734 1.00 0.00 O ATOM 298 OE2 GLU A 18 -1.941 -12.814 2.674 1.00 0.00 O ATOM 0 H GLU A 18 -2.737 -10.137 -1.893 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.468 -10.925 0.065 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.199 -11.922 -1.029 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.588 -11.468 0.549 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.118 -13.098 0.265 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.539 -13.857 0.213 1.00 0.00 H new ATOM 305 N ASP A 19 -1.948 -9.206 1.381 1.00 0.00 N ATOM 306 CA ASP A 19 -1.558 -8.353 2.496 1.00 0.00 C ATOM 307 C ASP A 19 -1.865 -6.889 2.216 1.00 0.00 C ATOM 308 O ASP A 19 -2.420 -6.195 3.067 1.00 0.00 O ATOM 309 CB ASP A 19 -0.072 -8.528 2.806 1.00 0.00 C ATOM 310 CG ASP A 19 0.214 -8.516 4.295 1.00 0.00 C ATOM 311 OD1 ASP A 19 -0.287 -7.605 4.988 1.00 0.00 O ATOM 312 OD2 ASP A 19 0.937 -9.417 4.769 1.00 0.00 O ATOM 0 H ASP A 19 -1.198 -9.405 0.719 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.143 -8.658 3.364 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.277 -9.468 2.380 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.493 -7.730 2.324 1.00 0.00 H new ATOM 317 N VAL A 20 -1.496 -6.413 1.033 1.00 0.00 N ATOM 318 CA VAL A 20 -1.740 -5.022 0.685 1.00 0.00 C ATOM 319 C VAL A 20 -3.234 -4.709 0.685 1.00 0.00 C ATOM 320 O VAL A 20 -3.645 -3.677 1.202 1.00 0.00 O ATOM 321 CB VAL A 20 -1.113 -4.638 -0.674 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.336 -5.089 -0.736 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.900 -5.227 -1.827 1.00 0.00 C ATOM 0 H VAL A 20 -1.033 -6.962 0.309 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.254 -4.419 1.452 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.146 -3.552 -0.764 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.763 -4.811 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.901 -4.609 0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.386 -6.171 -0.616 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.435 -4.939 -2.770 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.909 -6.314 -1.744 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.923 -4.852 -1.798 1.00 0.00 H new ATOM 333 N TYR A 21 -4.052 -5.606 0.128 1.00 0.00 N ATOM 334 CA TYR A 21 -5.496 -5.381 0.110 1.00 0.00 C ATOM 335 C TYR A 21 -6.054 -5.451 1.525 1.00 0.00 C ATOM 336 O TYR A 21 -6.839 -4.590 1.924 1.00 0.00 O ATOM 337 CB TYR A 21 -6.232 -6.379 -0.797 1.00 0.00 C ATOM 338 CG TYR A 21 -7.522 -5.836 -1.367 1.00 0.00 C ATOM 339 CD1 TYR A 21 -7.530 -5.113 -2.553 1.00 0.00 C ATOM 340 CD2 TYR A 21 -8.733 -6.048 -0.719 1.00 0.00 C ATOM 341 CE1 TYR A 21 -8.708 -4.616 -3.077 1.00 0.00 C ATOM 342 CE2 TYR A 21 -9.915 -5.554 -1.238 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.898 -4.839 -2.416 1.00 0.00 C ATOM 344 OH TYR A 21 -11.073 -4.346 -2.935 1.00 0.00 O ATOM 0 H TYR A 21 -3.746 -6.476 -0.307 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.663 -4.386 -0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.574 -6.666 -1.617 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.447 -7.284 -0.229 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.601 -4.936 -3.074 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.751 -6.608 0.205 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.697 -4.055 -4.000 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -10.848 -5.728 -0.722 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.818 -4.592 -2.348 1.00 0.00 H new ATOM 354 N HIS A 22 -5.645 -6.462 2.298 1.00 0.00 N ATOM 355 CA HIS A 22 -6.129 -6.574 3.668 1.00 0.00 C ATOM 356 C HIS A 22 -5.632 -5.396 4.495 1.00 0.00 C ATOM 357 O HIS A 22 -6.394 -4.793 5.249 1.00 0.00 O ATOM 358 CB HIS A 22 -5.685 -7.895 4.299 1.00 0.00 C ATOM 359 CG HIS A 22 -6.701 -8.486 5.226 1.00 0.00 C ATOM 360 ND1 HIS A 22 -7.204 -9.760 5.076 1.00 0.00 N ATOM 361 CD2 HIS A 22 -7.308 -7.969 6.321 1.00 0.00 C ATOM 362 CE1 HIS A 22 -8.079 -10.002 6.037 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.159 -8.932 6.805 1.00 0.00 N ATOM 0 H HIS A 22 -4.998 -7.194 2.005 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.219 -6.559 3.650 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -5.467 -8.612 3.507 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -4.756 -7.733 4.846 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.152 -6.984 6.736 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.634 -10.919 6.171 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -8.757 -8.836 7.626 1.00 0.00 H new ATOM 372 N THR A 23 -4.356 -5.056 4.337 1.00 0.00 N ATOM 373 CA THR A 23 -3.788 -3.927 5.064 1.00 0.00 C ATOM 374 C THR A 23 -4.423 -2.629 4.588 1.00 0.00 C ATOM 375 O THR A 23 -4.830 -1.795 5.395 1.00 0.00 O ATOM 376 CB THR A 23 -2.276 -3.857 4.887 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.931 -3.715 3.522 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.549 -5.072 5.424 1.00 0.00 C ATOM 0 H THR A 23 -3.703 -5.540 3.720 1.00 0.00 H new ATOM 0 HA THR A 23 -4.000 -4.070 6.124 1.00 0.00 H new ATOM 0 HB THR A 23 -1.963 -2.986 5.462 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.971 -4.590 3.082 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.477 -4.955 5.265 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.748 -5.173 6.491 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.898 -5.964 4.904 1.00 0.00 H new ATOM 386 N LEU A 24 -4.538 -2.473 3.269 1.00 0.00 N ATOM 387 CA LEU A 24 -5.166 -1.283 2.705 1.00 0.00 C ATOM 388 C LEU A 24 -6.574 -1.132 3.268 1.00 0.00 C ATOM 389 O LEU A 24 -7.161 -0.054 3.222 1.00 0.00 O ATOM 390 CB LEU A 24 -5.219 -1.354 1.175 1.00 0.00 C ATOM 391 CG LEU A 24 -4.133 -0.548 0.455 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.101 0.884 0.969 1.00 0.00 C ATOM 393 CD2 LEU A 24 -2.774 -1.205 0.629 1.00 0.00 C ATOM 0 H LEU A 24 -4.208 -3.148 2.580 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.566 -0.416 2.980 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.138 -2.398 0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.195 -1.000 0.843 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.371 -0.528 -0.608 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.324 1.441 0.446 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.067 1.356 0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.889 0.882 2.038 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.017 -0.617 0.110 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.529 -1.258 1.690 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.800 -2.212 0.212 1.00 0.00 H new ATOM 405 N LYS A 25 -7.109 -2.229 3.805 1.00 0.00 N ATOM 406 CA LYS A 25 -8.441 -2.225 4.380 1.00 0.00 C ATOM 407 C LYS A 25 -8.502 -1.372 5.642 1.00 0.00 C ATOM 408 O LYS A 25 -9.399 -0.542 5.784 1.00 0.00 O ATOM 409 CB LYS A 25 -8.898 -3.652 4.688 1.00 0.00 C ATOM 410 CG LYS A 25 -10.401 -3.786 4.880 1.00 0.00 C ATOM 411 CD LYS A 25 -11.173 -3.187 3.712 1.00 0.00 C ATOM 412 CE LYS A 25 -11.827 -1.867 4.092 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.313 -1.962 4.084 1.00 0.00 N ATOM 0 H LYS A 25 -6.634 -3.130 3.850 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.115 -1.787 3.644 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.585 -4.307 3.875 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.393 -3.999 5.590 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.662 -4.839 4.987 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.696 -3.289 5.804 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.498 -3.030 2.871 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.937 -3.890 3.381 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.488 -1.566 5.083 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.509 -1.091 3.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.721 -1.043 4.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.639 -2.225 3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.618 -2.685 4.766 1.00 0.00 H new ATOM 427 N LEU A 26 -7.554 -1.565 6.559 1.00 0.00 N ATOM 428 CA LEU A 26 -7.553 -0.780 7.790 1.00 0.00 C ATOM 429 C LEU A 26 -7.216 0.674 7.483 1.00 0.00 C ATOM 430 O LEU A 26 -7.860 1.590 7.990 1.00 0.00 O ATOM 431 CB LEU A 26 -6.603 -1.358 8.846 1.00 0.00 C ATOM 432 CG LEU A 26 -5.243 -1.807 8.335 1.00 0.00 C ATOM 433 CD1 LEU A 26 -4.337 -0.607 8.131 1.00 0.00 C ATOM 434 CD2 LEU A 26 -4.612 -2.803 9.297 1.00 0.00 C ATOM 0 H LEU A 26 -6.795 -2.241 6.476 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.556 -0.827 8.215 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.450 -0.606 9.620 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.091 -2.209 9.320 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.378 -2.304 7.374 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.366 -0.942 7.765 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.786 0.068 7.403 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.207 -0.084 9.079 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.640 -3.113 8.914 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.485 -2.336 10.274 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.258 -3.675 9.393 1.00 0.00 H new ATOM 446 N VAL A 27 -6.226 0.873 6.625 1.00 0.00 N ATOM 447 CA VAL A 27 -5.820 2.216 6.215 1.00 0.00 C ATOM 448 C VAL A 27 -6.919 2.888 5.420 1.00 0.00 C ATOM 449 O VAL A 27 -7.215 4.059 5.627 1.00 0.00 O ATOM 450 CB VAL A 27 -4.540 2.209 5.359 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.330 2.600 6.186 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.327 0.874 4.722 1.00 0.00 C ATOM 0 H VAL A 27 -5.686 0.121 6.196 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.622 2.767 7.135 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.668 2.948 4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.440 2.587 5.557 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.474 3.602 6.590 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.205 1.892 7.006 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.416 0.898 4.124 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.233 0.112 5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.176 0.637 4.081 1.00 0.00 H new ATOM 462 N SER A 28 -7.518 2.157 4.496 1.00 0.00 N ATOM 463 CA SER A 28 -8.568 2.733 3.682 1.00 0.00 C ATOM 464 C SER A 28 -9.768 3.128 4.534 1.00 0.00 C ATOM 465 O SER A 28 -10.435 4.125 4.254 1.00 0.00 O ATOM 466 CB SER A 28 -8.997 1.770 2.574 1.00 0.00 C ATOM 467 OG SER A 28 -10.134 2.260 1.884 1.00 0.00 O ATOM 0 H SER A 28 -7.299 1.181 4.294 1.00 0.00 H new ATOM 0 HA SER A 28 -8.166 3.633 3.217 1.00 0.00 H new ATOM 0 HB2 SER A 28 -8.175 1.629 1.872 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.221 0.793 3.003 1.00 0.00 H new ATOM 0 HG SER A 28 -9.893 3.072 1.391 1.00 0.00 H new ATOM 473 N VAL A 29 -10.030 2.351 5.580 1.00 0.00 N ATOM 474 CA VAL A 29 -11.139 2.630 6.476 1.00 0.00 C ATOM 475 C VAL A 29 -10.744 3.709 7.473 1.00 0.00 C ATOM 476 O VAL A 29 -11.475 4.677 7.688 1.00 0.00 O ATOM 477 CB VAL A 29 -11.576 1.340 7.214 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.347 1.432 8.715 1.00 0.00 C ATOM 479 CG2 VAL A 29 -13.030 1.014 6.909 1.00 0.00 C ATOM 0 H VAL A 29 -9.487 1.523 5.826 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.984 2.990 5.889 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.950 0.528 6.843 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.668 0.505 9.190 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.287 1.592 8.912 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.921 2.265 9.120 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.317 0.105 7.437 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.664 1.839 7.235 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.152 0.865 5.836 1.00 0.00 H new ATOM 489 N TYR A 30 -9.580 3.527 8.079 1.00 0.00 N ATOM 490 CA TYR A 30 -9.071 4.477 9.060 1.00 0.00 C ATOM 491 C TYR A 30 -8.650 5.783 8.396 1.00 0.00 C ATOM 492 O TYR A 30 -8.644 6.834 9.037 1.00 0.00 O ATOM 493 CB TYR A 30 -7.890 3.883 9.829 1.00 0.00 C ATOM 494 CG TYR A 30 -8.300 3.029 11.008 1.00 0.00 C ATOM 495 CD1 TYR A 30 -7.784 1.751 11.178 1.00 0.00 C ATOM 496 CD2 TYR A 30 -9.204 3.503 11.950 1.00 0.00 C ATOM 497 CE1 TYR A 30 -8.157 0.970 12.256 1.00 0.00 C ATOM 498 CE2 TYR A 30 -9.583 2.728 13.030 1.00 0.00 C ATOM 499 CZ TYR A 30 -9.057 1.462 13.178 1.00 0.00 C ATOM 500 OH TYR A 30 -9.430 0.687 14.252 1.00 0.00 O ATOM 0 H TYR A 30 -8.968 2.729 7.909 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.879 4.689 9.760 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -7.290 3.281 9.147 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -7.253 4.694 10.183 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -7.081 1.361 10.457 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -9.618 4.494 11.837 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -7.745 -0.021 12.376 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -10.287 3.112 13.754 1.00 0.00 H new ATOM 0 HH TYR A 30 -10.069 1.182 14.806 1.00 0.00 H new ATOM 510 N LEU A 31 -8.298 5.725 7.112 1.00 0.00 N ATOM 511 CA LEU A 31 -7.883 6.922 6.395 1.00 0.00 C ATOM 512 C LEU A 31 -8.954 7.354 5.398 1.00 0.00 C ATOM 513 O LEU A 31 -8.837 8.407 4.771 1.00 0.00 O ATOM 514 CB LEU A 31 -6.558 6.691 5.650 1.00 0.00 C ATOM 515 CG LEU A 31 -5.435 5.954 6.413 1.00 0.00 C ATOM 516 CD1 LEU A 31 -4.093 6.627 6.162 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.712 5.878 7.909 1.00 0.00 C ATOM 0 H LEU A 31 -8.293 4.870 6.555 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.740 7.711 7.134 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.775 6.128 4.743 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.173 7.662 5.338 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.403 4.933 6.033 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.312 6.096 6.706 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.870 6.607 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.135 7.661 6.504 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.896 5.352 8.404 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.793 6.886 8.316 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.646 5.342 8.079 1.00 0.00 H new ATOM 529 N ASN A 32 -9.991 6.530 5.238 1.00 0.00 N ATOM 530 CA ASN A 32 -11.061 6.835 4.296 1.00 0.00 C ATOM 531 C ASN A 32 -10.471 7.084 2.915 1.00 0.00 C ATOM 532 O ASN A 32 -10.962 7.916 2.153 1.00 0.00 O ATOM 533 CB ASN A 32 -11.853 8.059 4.760 1.00 0.00 C ATOM 534 CG ASN A 32 -12.255 7.968 6.219 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.265 7.353 6.559 1.00 0.00 O ATOM 536 ND2 ASN A 32 -11.465 8.585 7.090 1.00 0.00 N ATOM 0 H ASN A 32 -10.110 5.653 5.746 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.742 5.985 4.248 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.253 8.956 4.606 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -12.747 8.164 4.145 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -11.686 8.560 8.085 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -10.637 9.083 6.764 1.00 0.00 H new ATOM 543 N ARG A 33 -9.396 6.363 2.617 1.00 0.00 N ATOM 544 CA ARG A 33 -8.704 6.506 1.341 1.00 0.00 C ATOM 545 C ARG A 33 -8.613 5.176 0.605 1.00 0.00 C ATOM 546 O ARG A 33 -8.253 4.156 1.190 1.00 0.00 O ATOM 547 CB ARG A 33 -7.297 7.055 1.576 1.00 0.00 C ATOM 548 CG ARG A 33 -7.276 8.513 2.004 1.00 0.00 C ATOM 549 CD ARG A 33 -5.961 9.187 1.638 1.00 0.00 C ATOM 550 NE ARG A 33 -6.152 10.279 0.686 1.00 0.00 N ATOM 551 CZ ARG A 33 -6.840 11.387 0.957 1.00 0.00 C ATOM 552 NH1 ARG A 33 -7.396 11.559 2.149 1.00 0.00 N ATOM 553 NH2 ARG A 33 -6.968 12.329 0.031 1.00 0.00 N ATOM 0 H ARG A 33 -8.984 5.672 3.244 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.276 7.199 0.724 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.804 6.454 2.340 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.716 6.945 0.660 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -8.102 9.044 1.530 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -7.432 8.579 3.081 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -5.487 9.572 2.541 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.282 8.449 1.212 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.734 10.188 -0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.298 10.840 2.866 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.921 12.410 2.349 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.540 12.204 -0.886 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -7.494 13.178 0.237 1.00 0.00 H new ATOM 567 N ASP A 34 -8.919 5.192 -0.687 1.00 0.00 N ATOM 568 CA ASP A 34 -8.842 3.982 -1.497 1.00 0.00 C ATOM 569 C ASP A 34 -7.458 3.362 -1.364 1.00 0.00 C ATOM 570 O ASP A 34 -6.521 4.019 -0.909 1.00 0.00 O ATOM 571 CB ASP A 34 -9.143 4.294 -2.963 1.00 0.00 C ATOM 572 CG ASP A 34 -9.919 3.183 -3.643 1.00 0.00 C ATOM 573 OD1 ASP A 34 -9.450 2.025 -3.609 1.00 0.00 O ATOM 574 OD2 ASP A 34 -10.996 3.468 -4.207 1.00 0.00 O ATOM 0 H ASP A 34 -9.221 6.024 -1.194 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.588 3.273 -1.139 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.712 5.221 -3.025 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.207 4.459 -3.496 1.00 0.00 H new ATOM 579 N MET A 35 -7.324 2.100 -1.751 1.00 0.00 N ATOM 580 CA MET A 35 -6.049 1.422 -1.655 1.00 0.00 C ATOM 581 C MET A 35 -4.978 2.189 -2.430 1.00 0.00 C ATOM 582 O MET A 35 -3.886 2.439 -1.921 1.00 0.00 O ATOM 583 CB MET A 35 -6.180 -0.015 -2.169 1.00 0.00 C ATOM 584 CG MET A 35 -5.032 -0.452 -3.053 1.00 0.00 C ATOM 585 SD MET A 35 -5.045 -2.222 -3.399 1.00 0.00 S ATOM 586 CE MET A 35 -3.325 -2.634 -3.120 1.00 0.00 C ATOM 0 H MET A 35 -8.081 1.532 -2.132 1.00 0.00 H new ATOM 0 HA MET A 35 -5.743 1.385 -0.609 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.249 -0.691 -1.317 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.112 -0.109 -2.726 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.075 0.097 -3.994 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.090 -0.188 -2.573 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.091 -3.574 -3.619 1.00 0.00 H new ATOM 0 HE2 MET A 35 -2.692 -1.843 -3.521 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.144 -2.736 -2.050 1.00 0.00 H new ATOM 596 N THR A 36 -5.307 2.564 -3.661 1.00 0.00 N ATOM 597 CA THR A 36 -4.382 3.307 -4.506 1.00 0.00 C ATOM 598 C THR A 36 -4.032 4.645 -3.863 1.00 0.00 C ATOM 599 O THR A 36 -2.870 5.040 -3.828 1.00 0.00 O ATOM 600 CB THR A 36 -4.997 3.532 -5.894 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.083 2.650 -6.111 1.00 0.00 O ATOM 602 CG2 THR A 36 -4.025 3.344 -7.042 1.00 0.00 C ATOM 0 H THR A 36 -6.208 2.365 -4.095 1.00 0.00 H new ATOM 0 HA THR A 36 -3.467 2.724 -4.616 1.00 0.00 H new ATOM 0 HB THR A 36 -5.317 4.574 -5.887 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.462 2.811 -7.000 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.539 3.521 -7.987 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.200 4.049 -6.940 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.636 2.326 -7.026 1.00 0.00 H new ATOM 610 N GLU A 37 -5.045 5.334 -3.352 1.00 0.00 N ATOM 611 CA GLU A 37 -4.838 6.626 -2.709 1.00 0.00 C ATOM 612 C GLU A 37 -3.920 6.490 -1.497 1.00 0.00 C ATOM 613 O GLU A 37 -3.090 7.360 -1.234 1.00 0.00 O ATOM 614 CB GLU A 37 -6.181 7.227 -2.287 1.00 0.00 C ATOM 615 CG GLU A 37 -6.269 8.729 -2.502 1.00 0.00 C ATOM 616 CD GLU A 37 -7.116 9.098 -3.703 1.00 0.00 C ATOM 617 OE1 GLU A 37 -6.813 8.615 -4.815 1.00 0.00 O ATOM 618 OE2 GLU A 37 -8.084 9.868 -3.533 1.00 0.00 O ATOM 0 H GLU A 37 -6.016 5.021 -3.370 1.00 0.00 H new ATOM 0 HA GLU A 37 -4.360 7.292 -3.428 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.979 6.741 -2.847 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -6.352 7.008 -1.233 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.687 9.196 -1.610 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.265 9.133 -2.632 1.00 0.00 H new ATOM 625 N ILE A 38 -4.073 5.391 -0.764 1.00 0.00 N ATOM 626 CA ILE A 38 -3.256 5.139 0.419 1.00 0.00 C ATOM 627 C ILE A 38 -1.857 4.673 0.026 1.00 0.00 C ATOM 628 O ILE A 38 -0.860 5.240 0.471 1.00 0.00 O ATOM 629 CB ILE A 38 -3.908 4.074 1.331 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.987 4.689 2.235 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.871 3.375 2.192 1.00 0.00 C ATOM 632 CD1 ILE A 38 -4.542 5.960 2.928 1.00 0.00 C ATOM 0 H ILE A 38 -4.755 4.661 -0.968 1.00 0.00 H new ATOM 0 HA ILE A 38 -3.182 6.079 0.966 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.376 3.342 0.673 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.873 4.902 1.637 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.279 3.957 2.988 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.361 2.632 2.821 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.139 2.882 1.552 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.367 4.108 2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.353 6.339 3.549 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.674 5.749 3.553 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -4.277 6.708 2.181 1.00 0.00 H new ATOM 644 N ILE A 39 -1.785 3.636 -0.810 1.00 0.00 N ATOM 645 CA ILE A 39 -0.496 3.117 -1.244 1.00 0.00 C ATOM 646 C ILE A 39 0.271 4.191 -1.996 1.00 0.00 C ATOM 647 O ILE A 39 1.499 4.253 -1.942 1.00 0.00 O ATOM 648 CB ILE A 39 -0.650 1.875 -2.145 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.158 2.283 -3.527 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.589 0.863 -1.505 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.054 2.438 -4.553 1.00 0.00 C ATOM 0 H ILE A 39 -2.594 3.148 -1.193 1.00 0.00 H new ATOM 0 HA ILE A 39 0.054 2.822 -0.350 1.00 0.00 H new ATOM 0 HB ILE A 39 0.327 1.406 -2.260 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.869 1.536 -3.880 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.700 3.225 -3.443 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.685 -0.006 -2.155 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.186 0.552 -0.541 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.569 1.317 -1.359 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.486 2.729 -5.511 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.645 3.206 -4.222 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.474 1.491 -4.665 1.00 0.00 H new ATOM 663 N GLU A 40 -0.473 5.042 -2.692 1.00 0.00 N ATOM 664 CA GLU A 40 0.122 6.123 -3.451 1.00 0.00 C ATOM 665 C GLU A 40 0.515 7.259 -2.524 1.00 0.00 C ATOM 666 O GLU A 40 1.428 8.028 -2.824 1.00 0.00 O ATOM 667 CB GLU A 40 -0.848 6.627 -4.521 1.00 0.00 C ATOM 668 CG GLU A 40 -0.310 7.786 -5.344 1.00 0.00 C ATOM 669 CD GLU A 40 -0.430 9.117 -4.629 1.00 0.00 C ATOM 670 OE1 GLU A 40 0.448 9.982 -4.833 1.00 0.00 O ATOM 671 OE2 GLU A 40 -1.402 9.296 -3.865 1.00 0.00 O ATOM 0 H GLU A 40 -1.491 5.000 -2.743 1.00 0.00 H new ATOM 0 HA GLU A 40 1.017 5.746 -3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.095 5.803 -5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.776 6.936 -4.040 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.737 7.600 -5.584 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.850 7.836 -6.290 1.00 0.00 H new ATOM 678 N GLU A 41 -0.164 7.355 -1.385 1.00 0.00 N ATOM 679 CA GLU A 41 0.152 8.399 -0.422 1.00 0.00 C ATOM 680 C GLU A 41 1.308 7.949 0.463 1.00 0.00 C ATOM 681 O GLU A 41 2.135 8.757 0.890 1.00 0.00 O ATOM 682 CB GLU A 41 -1.077 8.735 0.427 1.00 0.00 C ATOM 683 CG GLU A 41 -0.776 9.627 1.621 1.00 0.00 C ATOM 684 CD GLU A 41 -1.984 9.832 2.514 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.988 10.396 2.034 1.00 0.00 O ATOM 686 OE2 GLU A 41 -1.924 9.426 3.695 1.00 0.00 O ATOM 0 H GLU A 41 -0.924 6.733 -1.111 1.00 0.00 H new ATOM 0 HA GLU A 41 0.449 9.300 -0.960 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.818 9.226 -0.203 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.525 7.807 0.783 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.032 9.186 2.205 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.422 10.595 1.267 1.00 0.00 H new ATOM 693 N ALA A 42 1.366 6.647 0.725 1.00 0.00 N ATOM 694 CA ALA A 42 2.426 6.092 1.554 1.00 0.00 C ATOM 695 C ALA A 42 3.719 5.956 0.765 1.00 0.00 C ATOM 696 O ALA A 42 4.801 6.243 1.277 1.00 0.00 O ATOM 697 CB ALA A 42 2.004 4.749 2.128 1.00 0.00 C ATOM 0 H ALA A 42 0.695 5.962 0.377 1.00 0.00 H new ATOM 0 HA ALA A 42 2.607 6.780 2.380 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.808 4.348 2.745 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.109 4.879 2.737 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.792 4.056 1.314 1.00 0.00 H new ATOM 703 N VAL A 43 3.606 5.528 -0.491 1.00 0.00 N ATOM 704 CA VAL A 43 4.780 5.374 -1.343 1.00 0.00 C ATOM 705 C VAL A 43 5.624 6.630 -1.310 1.00 0.00 C ATOM 706 O VAL A 43 6.784 6.616 -0.903 1.00 0.00 O ATOM 707 CB VAL A 43 4.393 5.089 -2.815 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.291 6.011 -3.290 1.00 0.00 C ATOM 709 CG2 VAL A 43 5.595 5.228 -3.730 1.00 0.00 C ATOM 0 H VAL A 43 2.722 5.284 -0.937 1.00 0.00 H new ATOM 0 HA VAL A 43 5.342 4.525 -0.953 1.00 0.00 H new ATOM 0 HB VAL A 43 4.029 4.062 -2.854 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.046 5.781 -4.327 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.406 5.871 -2.669 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.626 7.046 -3.217 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.296 5.023 -4.758 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.988 6.242 -3.662 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.366 4.519 -3.428 1.00 0.00 H new ATOM 719 N VAL A 44 5.013 7.710 -1.747 1.00 0.00 N ATOM 720 CA VAL A 44 5.664 8.998 -1.788 1.00 0.00 C ATOM 721 C VAL A 44 6.162 9.387 -0.404 1.00 0.00 C ATOM 722 O VAL A 44 7.283 9.871 -0.246 1.00 0.00 O ATOM 723 CB VAL A 44 4.695 10.063 -2.340 1.00 0.00 C ATOM 724 CG1 VAL A 44 4.841 11.401 -1.621 1.00 0.00 C ATOM 725 CG2 VAL A 44 4.885 10.236 -3.837 1.00 0.00 C ATOM 0 H VAL A 44 4.050 7.718 -2.084 1.00 0.00 H new ATOM 0 HA VAL A 44 6.526 8.936 -2.453 1.00 0.00 H new ATOM 0 HB VAL A 44 3.682 9.705 -2.153 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.139 12.120 -2.044 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.630 11.269 -0.560 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.858 11.772 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.192 10.992 -4.207 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.908 10.552 -4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.691 9.289 -4.340 1.00 0.00 H new ATOM 735 N MET A 45 5.327 9.166 0.600 1.00 0.00 N ATOM 736 CA MET A 45 5.696 9.491 1.965 1.00 0.00 C ATOM 737 C MET A 45 6.942 8.721 2.377 1.00 0.00 C ATOM 738 O MET A 45 7.789 9.243 3.102 1.00 0.00 O ATOM 739 CB MET A 45 4.545 9.173 2.928 1.00 0.00 C ATOM 740 CG MET A 45 4.854 9.477 4.389 1.00 0.00 C ATOM 741 SD MET A 45 5.834 8.192 5.191 1.00 0.00 S ATOM 742 CE MET A 45 6.153 8.951 6.781 1.00 0.00 C ATOM 0 H MET A 45 4.395 8.765 0.494 1.00 0.00 H new ATOM 0 HA MET A 45 5.908 10.559 2.013 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.666 9.743 2.627 1.00 0.00 H new ATOM 0 HB3 MET A 45 4.288 8.118 2.834 1.00 0.00 H new ATOM 0 HG2 MET A 45 5.389 10.425 4.451 1.00 0.00 H new ATOM 0 HG3 MET A 45 3.918 9.603 4.933 1.00 0.00 H new ATOM 0 HE1 MET A 45 6.577 8.211 7.459 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.856 9.774 6.657 1.00 0.00 H new ATOM 0 HE3 MET A 45 5.220 9.331 7.197 1.00 0.00 H new ATOM 752 N TRP A 46 7.053 7.477 1.918 1.00 0.00 N ATOM 753 CA TRP A 46 8.207 6.664 2.261 1.00 0.00 C ATOM 754 C TRP A 46 9.457 7.197 1.587 1.00 0.00 C ATOM 755 O TRP A 46 10.456 7.458 2.250 1.00 0.00 O ATOM 756 CB TRP A 46 7.983 5.201 1.876 1.00 0.00 C ATOM 757 CG TRP A 46 8.938 4.266 2.550 1.00 0.00 C ATOM 758 CD1 TRP A 46 9.725 3.324 1.953 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.214 4.188 3.953 1.00 0.00 C ATOM 760 NE1 TRP A 46 10.470 2.661 2.899 1.00 0.00 N ATOM 761 CE2 TRP A 46 10.173 3.175 4.135 1.00 0.00 C ATOM 762 CE3 TRP A 46 8.739 4.876 5.073 1.00 0.00 C ATOM 763 CZ2 TRP A 46 10.667 2.836 5.391 1.00 0.00 C ATOM 764 CZ3 TRP A 46 9.231 4.539 6.319 1.00 0.00 C ATOM 765 CH2 TRP A 46 10.187 3.526 6.470 1.00 0.00 C ATOM 0 H TRP A 46 6.368 7.019 1.317 1.00 0.00 H new ATOM 0 HA TRP A 46 8.342 6.717 3.341 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.963 4.916 2.132 1.00 0.00 H new ATOM 0 HB3 TRP A 46 8.082 5.096 0.796 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.758 3.128 0.891 1.00 0.00 H new ATOM 0 HE1 TRP A 46 11.135 1.910 2.712 1.00 0.00 H new ATOM 0 HE3 TRP A 46 8.001 5.657 4.966 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.404 2.055 5.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.873 5.065 7.191 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.552 3.285 7.458 1.00 0.00 H new ATOM 776 N LEU A 47 9.402 7.367 0.272 1.00 0.00 N ATOM 777 CA LEU A 47 10.553 7.883 -0.457 1.00 0.00 C ATOM 778 C LEU A 47 10.992 9.216 0.111 1.00 0.00 C ATOM 779 O LEU A 47 12.185 9.469 0.285 1.00 0.00 O ATOM 780 CB LEU A 47 10.251 8.087 -1.939 1.00 0.00 C ATOM 781 CG LEU A 47 8.812 8.449 -2.292 1.00 0.00 C ATOM 782 CD1 LEU A 47 8.725 9.936 -2.575 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.331 7.639 -3.492 1.00 0.00 C ATOM 0 H LEU A 47 8.586 7.159 -0.304 1.00 0.00 H new ATOM 0 HA LEU A 47 11.341 7.138 -0.349 1.00 0.00 H new ATOM 0 HB2 LEU A 47 10.904 8.874 -2.316 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.514 7.173 -2.471 1.00 0.00 H new ATOM 0 HG LEU A 47 8.164 8.208 -1.450 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.698 10.199 -2.828 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.035 10.493 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.379 10.186 -3.410 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.302 7.913 -3.727 1.00 0.00 H new ATOM 0 HD22 LEU A 47 8.968 7.849 -4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.379 6.576 -3.256 1.00 0.00 H new ATOM 795 N ILE A 48 10.021 10.077 0.380 1.00 0.00 N ATOM 796 CA ILE A 48 10.311 11.388 0.901 1.00 0.00 C ATOM 797 C ILE A 48 11.064 11.312 2.215 1.00 0.00 C ATOM 798 O ILE A 48 12.085 11.976 2.394 1.00 0.00 O ATOM 799 CB ILE A 48 9.008 12.183 1.093 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.880 13.246 0.023 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.956 12.825 2.468 1.00 0.00 C ATOM 802 CD1 ILE A 48 9.030 12.739 -1.392 1.00 0.00 C ATOM 0 H ILE A 48 9.029 9.883 0.243 1.00 0.00 H new ATOM 0 HA ILE A 48 10.946 11.898 0.177 1.00 0.00 H new ATOM 0 HB ILE A 48 8.174 11.486 1.008 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.906 13.726 0.121 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.633 14.014 0.201 1.00 0.00 H new ATOM 0 HG21 ILE A 48 8.024 13.380 2.575 1.00 0.00 H new ATOM 0 HG22 ILE A 48 9.007 12.051 3.233 1.00 0.00 H new ATOM 0 HG23 ILE A 48 9.799 13.506 2.584 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.924 13.570 -2.089 1.00 0.00 H new ATOM 0 HD12 ILE A 48 10.014 12.287 -1.514 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.261 11.994 -1.595 1.00 0.00 H new ATOM 814 N GLN A 49 10.546 10.525 3.141 1.00 0.00 N ATOM 815 CA GLN A 49 11.173 10.409 4.438 1.00 0.00 C ATOM 816 C GLN A 49 12.318 9.396 4.427 1.00 0.00 C ATOM 817 O GLN A 49 13.123 9.355 5.355 1.00 0.00 O ATOM 818 CB GLN A 49 10.139 10.026 5.501 1.00 0.00 C ATOM 819 CG GLN A 49 9.640 8.594 5.384 1.00 0.00 C ATOM 820 CD GLN A 49 9.853 7.796 6.654 1.00 0.00 C ATOM 821 OE1 GLN A 49 9.146 8.170 7.715 1.00 0.00 O flip ATOM 822 NE2 GLN A 49 10.644 6.854 6.684 1.00 0.00 N flip ATOM 0 H GLN A 49 9.703 9.964 3.018 1.00 0.00 H new ATOM 0 HA GLN A 49 11.594 11.384 4.685 1.00 0.00 H new ATOM 0 HB2 GLN A 49 10.577 10.169 6.489 1.00 0.00 H new ATOM 0 HB3 GLN A 49 9.289 10.704 5.429 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.578 8.602 5.139 1.00 0.00 H new ATOM 0 HG3 GLN A 49 10.154 8.101 4.559 1.00 0.00 H new ATOM 0 HE21 GLN A 49 11.167 6.600 5.846 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.777 6.327 7.547 1.00 0.00 H new ATOM 831 N ASN A 50 12.373 8.564 3.389 1.00 0.00 N ATOM 832 CA ASN A 50 13.412 7.542 3.296 1.00 0.00 C ATOM 833 C ASN A 50 14.584 7.987 2.428 1.00 0.00 C ATOM 834 O ASN A 50 15.719 8.051 2.893 1.00 0.00 O ATOM 835 CB ASN A 50 12.828 6.237 2.750 1.00 0.00 C ATOM 836 CG ASN A 50 13.848 5.113 2.725 1.00 0.00 C ATOM 837 OD1 ASN A 50 14.487 4.817 3.733 1.00 0.00 O ATOM 838 ND2 ASN A 50 14.004 4.483 1.566 1.00 0.00 N ATOM 0 H ASN A 50 11.717 8.577 2.608 1.00 0.00 H new ATOM 0 HA ASN A 50 13.792 7.379 4.305 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.977 5.938 3.362 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.451 6.405 1.741 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.676 3.720 1.487 1.00 0.00 H new ATOM 0 HD22 ASN A 50 13.452 4.763 0.755 1.00 0.00 H new ATOM 845 N LYS A 51 14.308 8.269 1.165 1.00 0.00 N ATOM 846 CA LYS A 51 15.350 8.682 0.227 1.00 0.00 C ATOM 847 C LYS A 51 15.957 10.030 0.611 1.00 0.00 C ATOM 848 O LYS A 51 17.177 10.174 0.675 1.00 0.00 O ATOM 849 CB LYS A 51 14.788 8.747 -1.195 1.00 0.00 C ATOM 850 CG LYS A 51 15.420 7.738 -2.141 1.00 0.00 C ATOM 851 CD LYS A 51 14.876 6.335 -1.907 1.00 0.00 C ATOM 852 CE LYS A 51 15.987 5.350 -1.575 1.00 0.00 C ATOM 853 NZ LYS A 51 16.758 5.761 -0.371 1.00 0.00 N ATOM 0 H LYS A 51 13.372 8.221 0.762 1.00 0.00 H new ATOM 0 HA LYS A 51 16.143 7.936 0.269 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.712 8.577 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.940 9.751 -1.592 1.00 0.00 H new ATOM 0 HG2 LYS A 51 15.229 8.036 -3.172 1.00 0.00 H new ATOM 0 HG3 LYS A 51 16.501 7.737 -2.004 1.00 0.00 H new ATOM 0 HD2 LYS A 51 14.153 6.356 -1.092 1.00 0.00 H new ATOM 0 HD3 LYS A 51 14.344 5.998 -2.797 1.00 0.00 H new ATOM 0 HE2 LYS A 51 15.557 4.362 -1.410 1.00 0.00 H new ATOM 0 HE3 LYS A 51 16.663 5.266 -2.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 17.363 4.974 -0.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 17.351 6.584 -0.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 16.100 6.013 0.394 1.00 0.00 H new ATOM 867 N GLU A 52 15.100 11.016 0.848 1.00 0.00 N ATOM 868 CA GLU A 52 15.554 12.358 1.207 1.00 0.00 C ATOM 869 C GLU A 52 16.553 12.330 2.363 1.00 0.00 C ATOM 870 O GLU A 52 17.508 13.106 2.387 1.00 0.00 O ATOM 871 CB GLU A 52 14.359 13.236 1.579 1.00 0.00 C ATOM 872 CG GLU A 52 14.614 14.722 1.391 1.00 0.00 C ATOM 873 CD GLU A 52 13.940 15.568 2.453 1.00 0.00 C ATOM 874 OE1 GLU A 52 13.378 16.626 2.100 1.00 0.00 O ATOM 875 OE2 GLU A 52 13.975 15.173 3.636 1.00 0.00 O ATOM 0 H GLU A 52 14.086 10.913 0.799 1.00 0.00 H new ATOM 0 HA GLU A 52 16.060 12.776 0.337 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.501 12.944 0.973 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.092 13.050 2.619 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.688 14.908 1.411 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.256 15.027 0.408 1.00 0.00 H new ATOM 882 N LYS A 53 16.318 11.447 3.326 1.00 0.00 N ATOM 883 CA LYS A 53 17.192 11.339 4.491 1.00 0.00 C ATOM 884 C LYS A 53 17.703 9.913 4.687 1.00 0.00 C ATOM 885 O LYS A 53 17.970 9.500 5.814 1.00 0.00 O ATOM 886 CB LYS A 53 16.454 11.800 5.749 1.00 0.00 C ATOM 887 CG LYS A 53 15.212 10.979 6.060 1.00 0.00 C ATOM 888 CD LYS A 53 15.154 10.587 7.528 1.00 0.00 C ATOM 889 CE LYS A 53 15.722 9.195 7.756 1.00 0.00 C ATOM 890 NZ LYS A 53 15.244 8.597 9.034 1.00 0.00 N ATOM 0 H LYS A 53 15.532 10.796 3.325 1.00 0.00 H new ATOM 0 HA LYS A 53 18.053 11.983 4.314 1.00 0.00 H new ATOM 0 HB2 LYS A 53 17.135 11.750 6.599 1.00 0.00 H new ATOM 0 HB3 LYS A 53 16.168 12.845 5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.322 11.552 5.800 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.205 10.081 5.442 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.713 11.311 8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.121 10.621 7.874 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.439 8.548 6.926 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.811 9.245 7.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.656 7.649 9.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 15.536 9.200 9.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.207 8.524 9.017 1.00 0.00 H new ATOM 904 N LEU A 54 17.834 9.164 3.593 1.00 0.00 N ATOM 905 CA LEU A 54 18.307 7.782 3.664 1.00 0.00 C ATOM 906 C LEU A 54 19.643 7.695 4.401 1.00 0.00 C ATOM 907 O LEU A 54 20.692 7.999 3.835 1.00 0.00 O ATOM 908 CB LEU A 54 18.460 7.196 2.260 1.00 0.00 C ATOM 909 CG LEU A 54 18.909 5.733 2.217 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.718 4.803 2.389 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.639 5.439 0.915 1.00 0.00 C ATOM 0 H LEU A 54 17.620 9.489 2.650 1.00 0.00 H new ATOM 0 HA LEU A 54 17.565 7.206 4.217 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.506 7.283 1.740 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.181 7.798 1.707 1.00 0.00 H new ATOM 0 HG LEU A 54 19.599 5.559 3.043 1.00 0.00 H new ATOM 0 HD11 LEU A 54 18.057 3.768 2.356 1.00 0.00 H new ATOM 0 HD12 LEU A 54 17.240 4.998 3.349 1.00 0.00 H new ATOM 0 HD13 LEU A 54 17.002 4.976 1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.951 4.395 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 54 18.973 5.630 0.073 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.516 6.081 0.837 1.00 0.00 H new ATOM 923 N PRO A 55 19.620 7.281 5.683 1.00 0.00 N ATOM 924 CA PRO A 55 20.827 7.159 6.502 1.00 0.00 C ATOM 925 C PRO A 55 21.603 5.882 6.204 1.00 0.00 C ATOM 926 O PRO A 55 21.042 4.903 5.711 1.00 0.00 O ATOM 927 CB PRO A 55 20.290 7.128 7.945 1.00 0.00 C ATOM 928 CG PRO A 55 18.807 7.306 7.841 1.00 0.00 C ATOM 929 CD PRO A 55 18.430 6.901 6.446 1.00 0.00 C ATOM 0 HA PRO A 55 21.525 7.974 6.311 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.536 6.184 8.432 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.737 7.922 8.544 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.289 6.691 8.577 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.525 8.341 8.035 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.223 5.833 6.374 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.539 7.422 6.097 1.00 0.00 H new ATOM 937 N ASN A 56 22.893 5.894 6.518 1.00 0.00 N ATOM 938 CA ASN A 56 23.742 4.730 6.297 1.00 0.00 C ATOM 939 C ASN A 56 23.463 3.657 7.348 1.00 0.00 C ATOM 940 O ASN A 56 23.664 2.468 7.105 1.00 0.00 O ATOM 941 CB ASN A 56 25.219 5.133 6.337 1.00 0.00 C ATOM 942 CG ASN A 56 26.002 4.569 5.167 1.00 0.00 C ATOM 943 OD1 ASN A 56 25.666 3.514 4.632 1.00 0.00 O ATOM 944 ND2 ASN A 56 27.053 5.274 4.765 1.00 0.00 N ATOM 0 H ASN A 56 23.373 6.696 6.926 1.00 0.00 H new ATOM 0 HA ASN A 56 23.515 4.321 5.312 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.297 6.220 6.333 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.663 4.785 7.270 1.00 0.00 H new ATOM 0 HD21 ASN A 56 27.619 4.945 3.982 1.00 0.00 H new ATOM 0 HD22 ASN A 56 27.295 6.144 5.239 1.00 0.00 H new ATOM 951 N GLU A 57 22.995 4.091 8.516 1.00 0.00 N ATOM 952 CA GLU A 57 22.684 3.175 9.607 1.00 0.00 C ATOM 953 C GLU A 57 21.339 2.490 9.382 1.00 0.00 C ATOM 954 O GLU A 57 21.097 1.396 9.891 1.00 0.00 O ATOM 955 CB GLU A 57 22.669 3.927 10.939 1.00 0.00 C ATOM 956 CG GLU A 57 21.607 5.011 11.011 1.00 0.00 C ATOM 957 CD GLU A 57 21.691 5.827 12.286 1.00 0.00 C ATOM 958 OE1 GLU A 57 21.214 5.343 13.333 1.00 0.00 O ATOM 959 OE2 GLU A 57 22.235 6.950 12.237 1.00 0.00 O ATOM 0 H GLU A 57 22.823 5.073 8.730 1.00 0.00 H new ATOM 0 HA GLU A 57 23.458 2.408 9.635 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.505 3.215 11.748 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.648 4.377 11.104 1.00 0.00 H new ATOM 0 HG2 GLU A 57 21.711 5.674 10.152 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.620 4.553 10.942 1.00 0.00 H new ATOM 966 N LEU A 58 20.465 3.139 8.615 1.00 0.00 N ATOM 967 CA LEU A 58 19.148 2.585 8.323 1.00 0.00 C ATOM 968 C LEU A 58 19.236 1.498 7.259 1.00 0.00 C ATOM 969 O LEU A 58 18.359 0.642 7.171 1.00 0.00 O ATOM 970 CB LEU A 58 18.193 3.686 7.855 1.00 0.00 C ATOM 971 CG LEU A 58 16.939 3.863 8.714 1.00 0.00 C ATOM 972 CD1 LEU A 58 17.191 4.863 9.830 1.00 0.00 C ATOM 973 CD2 LEU A 58 15.765 4.306 7.853 1.00 0.00 C ATOM 0 H LEU A 58 20.646 4.047 8.186 1.00 0.00 H new ATOM 0 HA LEU A 58 18.763 2.144 9.242 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.736 4.631 7.832 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.886 3.469 6.832 1.00 0.00 H new ATOM 0 HG LEU A 58 16.693 2.902 9.167 1.00 0.00 H new ATOM 0 HD11 LEU A 58 16.287 4.975 10.429 1.00 0.00 H new ATOM 0 HD12 LEU A 58 18.004 4.506 10.462 1.00 0.00 H new ATOM 0 HD13 LEU A 58 17.463 5.827 9.400 1.00 0.00 H new ATOM 0 HD21 LEU A 58 14.881 4.428 8.478 1.00 0.00 H new ATOM 0 HD22 LEU A 58 16.003 5.255 7.373 1.00 0.00 H new ATOM 0 HD23 LEU A 58 15.569 3.553 7.090 1.00 0.00 H new ATOM 985 N LYS A 59 20.296 1.545 6.449 1.00 0.00 N ATOM 986 CA LYS A 59 20.505 0.567 5.380 1.00 0.00 C ATOM 987 C LYS A 59 20.023 -0.828 5.782 1.00 0.00 C ATOM 988 O LYS A 59 19.202 -1.427 5.089 1.00 0.00 O ATOM 989 CB LYS A 59 21.983 0.515 4.990 1.00 0.00 C ATOM 990 CG LYS A 59 22.213 0.216 3.518 1.00 0.00 C ATOM 991 CD LYS A 59 23.669 -0.121 3.237 1.00 0.00 C ATOM 992 CE LYS A 59 24.104 -1.377 3.974 1.00 0.00 C ATOM 993 NZ LYS A 59 23.160 -2.507 3.753 1.00 0.00 N ATOM 0 H LYS A 59 21.026 2.254 6.514 1.00 0.00 H new ATOM 0 HA LYS A 59 19.914 0.890 4.523 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.449 1.469 5.236 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.482 -0.247 5.589 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.580 -0.617 3.212 1.00 0.00 H new ATOM 0 HG3 LYS A 59 21.916 1.078 2.920 1.00 0.00 H new ATOM 0 HD2 LYS A 59 23.811 -0.260 2.165 1.00 0.00 H new ATOM 0 HD3 LYS A 59 24.301 0.715 3.537 1.00 0.00 H new ATOM 0 HE2 LYS A 59 25.101 -1.666 3.641 1.00 0.00 H new ATOM 0 HE3 LYS A 59 24.174 -1.166 5.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 23.602 -3.395 4.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 22.289 -2.343 4.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 22.929 -2.573 2.741 1.00 0.00 H new ATOM 1007 N PRO A 60 20.521 -1.371 6.908 1.00 0.00 N ATOM 1008 CA PRO A 60 20.118 -2.699 7.377 1.00 0.00 C ATOM 1009 C PRO A 60 18.635 -2.763 7.723 1.00 0.00 C ATOM 1010 O PRO A 60 18.008 -3.817 7.614 1.00 0.00 O ATOM 1011 CB PRO A 60 20.973 -2.923 8.629 1.00 0.00 C ATOM 1012 CG PRO A 60 21.384 -1.559 9.064 1.00 0.00 C ATOM 1013 CD PRO A 60 21.506 -0.744 7.809 1.00 0.00 C ATOM 0 HA PRO A 60 20.266 -3.460 6.611 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.406 -3.432 9.408 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.840 -3.545 8.408 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.647 -1.126 9.740 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.331 -1.590 9.603 1.00 0.00 H new ATOM 0 HD2 PRO A 60 21.278 0.307 7.987 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.514 -0.786 7.397 1.00 0.00 H new ATOM 1021 N LYS A 61 18.076 -1.630 8.132 1.00 0.00 N ATOM 1022 CA LYS A 61 16.663 -1.562 8.485 1.00 0.00 C ATOM 1023 C LYS A 61 15.791 -1.776 7.258 1.00 0.00 C ATOM 1024 O LYS A 61 14.688 -2.310 7.356 1.00 0.00 O ATOM 1025 CB LYS A 61 16.325 -0.218 9.123 1.00 0.00 C ATOM 1026 CG LYS A 61 14.961 -0.204 9.794 1.00 0.00 C ATOM 1027 CD LYS A 61 15.054 -0.672 11.234 1.00 0.00 C ATOM 1028 CE LYS A 61 15.860 0.301 12.080 1.00 0.00 C ATOM 1029 NZ LYS A 61 16.845 -0.401 12.948 1.00 0.00 N ATOM 0 H LYS A 61 18.578 -0.747 8.227 1.00 0.00 H new ATOM 0 HA LYS A 61 16.464 -2.355 9.206 1.00 0.00 H new ATOM 0 HB2 LYS A 61 17.089 0.030 9.860 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.356 0.558 8.359 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.547 0.804 9.762 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.275 -0.847 9.243 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.052 -0.776 11.650 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.517 -1.658 11.269 1.00 0.00 H new ATOM 0 HE2 LYS A 61 16.384 1.000 11.429 1.00 0.00 H new ATOM 0 HE3 LYS A 61 15.184 0.889 12.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 17.374 0.298 13.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 16.344 -1.050 13.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 17.507 -0.942 12.355 1.00 0.00 H new ATOM 1043 N ILE A 62 16.293 -1.363 6.099 1.00 0.00 N ATOM 1044 CA ILE A 62 15.552 -1.525 4.856 1.00 0.00 C ATOM 1045 C ILE A 62 15.091 -2.973 4.718 1.00 0.00 C ATOM 1046 O ILE A 62 14.006 -3.247 4.202 1.00 0.00 O ATOM 1047 CB ILE A 62 16.403 -1.093 3.640 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.367 0.432 3.498 1.00 0.00 C ATOM 1049 CG2 ILE A 62 15.921 -1.759 2.357 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.537 1.165 4.813 1.00 0.00 C ATOM 0 H ILE A 62 17.204 -0.916 5.996 1.00 0.00 H new ATOM 0 HA ILE A 62 14.675 -0.878 4.883 1.00 0.00 H new ATOM 0 HB ILE A 62 17.430 -1.415 3.811 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.155 0.744 2.813 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.419 0.725 3.048 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.542 -1.433 1.522 1.00 0.00 H new ATOM 0 HG22 ILE A 62 15.992 -2.842 2.460 1.00 0.00 H new ATOM 0 HG23 ILE A 62 14.884 -1.479 2.169 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.501 2.240 4.637 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.734 0.882 5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.498 0.901 5.255 1.00 0.00 H new ATOM 1062 N ASP A 63 15.902 -3.891 5.234 1.00 0.00 N ATOM 1063 CA ASP A 63 15.550 -5.297 5.218 1.00 0.00 C ATOM 1064 C ASP A 63 14.393 -5.497 6.178 1.00 0.00 C ATOM 1065 O ASP A 63 13.422 -6.189 5.873 1.00 0.00 O ATOM 1066 CB ASP A 63 16.747 -6.159 5.628 1.00 0.00 C ATOM 1067 CG ASP A 63 17.353 -6.903 4.454 1.00 0.00 C ATOM 1068 OD1 ASP A 63 17.620 -6.259 3.418 1.00 0.00 O ATOM 1069 OD2 ASP A 63 17.560 -8.129 4.571 1.00 0.00 O ATOM 0 H ASP A 63 16.803 -3.683 5.666 1.00 0.00 H new ATOM 0 HA ASP A 63 15.261 -5.601 4.212 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.508 -5.526 6.085 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.432 -6.876 6.386 1.00 0.00 H new ATOM 1074 N GLU A 64 14.495 -4.837 7.333 1.00 0.00 N ATOM 1075 CA GLU A 64 13.452 -4.887 8.347 1.00 0.00 C ATOM 1076 C GLU A 64 12.129 -4.444 7.736 1.00 0.00 C ATOM 1077 O GLU A 64 11.104 -5.095 7.907 1.00 0.00 O ATOM 1078 CB GLU A 64 13.815 -3.988 9.533 1.00 0.00 C ATOM 1079 CG GLU A 64 14.129 -4.757 10.805 1.00 0.00 C ATOM 1080 CD GLU A 64 15.428 -4.316 11.451 1.00 0.00 C ATOM 1081 OE1 GLU A 64 15.375 -3.741 12.560 1.00 0.00 O ATOM 1082 OE2 GLU A 64 16.498 -4.543 10.848 1.00 0.00 O ATOM 0 H GLU A 64 15.297 -4.259 7.586 1.00 0.00 H new ATOM 0 HA GLU A 64 13.357 -5.910 8.710 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.677 -3.378 9.265 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.988 -3.304 9.726 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.312 -4.626 11.515 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.185 -5.821 10.577 1.00 0.00 H new ATOM 1089 N ILE A 65 12.175 -3.337 7.000 1.00 0.00 N ATOM 1090 CA ILE A 65 10.995 -2.800 6.331 1.00 0.00 C ATOM 1091 C ILE A 65 10.385 -3.844 5.406 1.00 0.00 C ATOM 1092 O ILE A 65 9.168 -3.924 5.266 1.00 0.00 O ATOM 1093 CB ILE A 65 11.346 -1.539 5.511 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.032 -0.502 6.403 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.097 -0.947 4.869 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.141 0.010 7.511 1.00 0.00 C ATOM 0 H ILE A 65 13.024 -2.791 6.852 1.00 0.00 H new ATOM 0 HA ILE A 65 10.274 -2.531 7.103 1.00 0.00 H new ATOM 0 HB ILE A 65 12.034 -1.826 4.715 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.928 -0.943 6.840 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.357 0.338 5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.368 -0.060 4.296 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.645 -1.684 4.205 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.383 -0.673 5.646 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.686 0.742 8.107 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.257 0.480 7.079 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.836 -0.822 8.147 1.00 0.00 H new ATOM 1108 N SER A 66 11.244 -4.640 4.777 1.00 0.00 N ATOM 1109 CA SER A 66 10.792 -5.682 3.861 1.00 0.00 C ATOM 1110 C SER A 66 10.306 -6.915 4.621 1.00 0.00 C ATOM 1111 O SER A 66 9.193 -7.389 4.400 1.00 0.00 O ATOM 1112 CB SER A 66 11.920 -6.073 2.905 1.00 0.00 C ATOM 1113 OG SER A 66 11.410 -6.441 1.635 1.00 0.00 O ATOM 0 H SER A 66 12.257 -4.584 4.885 1.00 0.00 H new ATOM 0 HA SER A 66 9.956 -5.282 3.287 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.612 -5.238 2.794 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.487 -6.903 3.327 1.00 0.00 H new ATOM 0 HG SER A 66 11.666 -7.366 1.435 1.00 0.00 H new ATOM 1119 N LYS A 67 11.148 -7.433 5.511 1.00 0.00 N ATOM 1120 CA LYS A 67 10.794 -8.615 6.292 1.00 0.00 C ATOM 1121 C LYS A 67 9.644 -8.319 7.253 1.00 0.00 C ATOM 1122 O LYS A 67 8.867 -9.209 7.594 1.00 0.00 O ATOM 1123 CB LYS A 67 12.007 -9.141 7.067 1.00 0.00 C ATOM 1124 CG LYS A 67 12.856 -8.050 7.698 1.00 0.00 C ATOM 1125 CD LYS A 67 13.177 -8.356 9.154 1.00 0.00 C ATOM 1126 CE LYS A 67 14.677 -8.351 9.408 1.00 0.00 C ATOM 1127 NZ LYS A 67 15.041 -9.159 10.605 1.00 0.00 N ATOM 0 H LYS A 67 12.075 -7.056 5.709 1.00 0.00 H new ATOM 0 HA LYS A 67 10.466 -9.384 5.593 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.661 -9.816 7.849 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.630 -9.728 6.392 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.784 -7.941 7.136 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.330 -7.097 7.634 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.696 -7.618 9.796 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.765 -9.329 9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.194 -8.745 8.533 1.00 0.00 H new ATOM 0 HE3 LYS A 67 15.018 -7.325 9.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 16.071 -9.130 10.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.568 -8.768 11.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.738 -10.144 10.464 1.00 0.00 H new ATOM 1141 N ARG A 68 9.534 -7.063 7.680 1.00 0.00 N ATOM 1142 CA ARG A 68 8.467 -6.664 8.592 1.00 0.00 C ATOM 1143 C ARG A 68 7.163 -6.474 7.833 1.00 0.00 C ATOM 1144 O ARG A 68 6.087 -6.789 8.341 1.00 0.00 O ATOM 1145 CB ARG A 68 8.830 -5.377 9.333 1.00 0.00 C ATOM 1146 CG ARG A 68 9.952 -5.557 10.341 1.00 0.00 C ATOM 1147 CD ARG A 68 10.576 -4.223 10.729 1.00 0.00 C ATOM 1148 NE ARG A 68 9.596 -3.307 11.306 1.00 0.00 N ATOM 1149 CZ ARG A 68 9.179 -3.364 12.569 1.00 0.00 C ATOM 1150 NH1 ARG A 68 9.652 -4.294 13.390 1.00 0.00 N ATOM 1151 NH2 ARG A 68 8.288 -2.489 13.014 1.00 0.00 N ATOM 0 H ARG A 68 10.166 -6.309 7.411 1.00 0.00 H new ATOM 0 HA ARG A 68 8.339 -7.460 9.326 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.122 -4.619 8.607 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.946 -5.001 9.848 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.565 -6.051 11.232 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.718 -6.209 9.921 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.379 -4.393 11.446 1.00 0.00 H new ATOM 0 HD3 ARG A 68 11.027 -3.764 9.849 1.00 0.00 H new ATOM 0 HE ARG A 68 9.208 -2.580 10.705 1.00 0.00 H new ATOM 0 HH11 ARG A 68 10.338 -4.970 13.054 1.00 0.00 H new ATOM 0 HH12 ARG A 68 9.329 -4.333 14.357 1.00 0.00 H new ATOM 0 HH21 ARG A 68 7.921 -1.771 12.389 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.969 -2.533 13.982 1.00 0.00 H new ATOM 1165 N PHE A 69 7.264 -5.966 6.607 1.00 0.00 N ATOM 1166 CA PHE A 69 6.086 -5.752 5.779 1.00 0.00 C ATOM 1167 C PHE A 69 5.397 -7.088 5.516 1.00 0.00 C ATOM 1168 O PHE A 69 4.171 -7.170 5.446 1.00 0.00 O ATOM 1169 CB PHE A 69 6.481 -5.048 4.468 1.00 0.00 C ATOM 1170 CG PHE A 69 6.154 -5.816 3.214 1.00 0.00 C ATOM 1171 CD1 PHE A 69 4.840 -5.973 2.803 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.164 -6.375 2.447 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.540 -6.676 1.651 1.00 0.00 C ATOM 1174 CE2 PHE A 69 6.869 -7.079 1.295 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.555 -7.229 0.896 1.00 0.00 C ATOM 0 H PHE A 69 8.145 -5.697 6.169 1.00 0.00 H new ATOM 0 HA PHE A 69 5.382 -5.104 6.301 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.979 -4.081 4.426 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.553 -4.850 4.487 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.042 -5.542 3.389 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.193 -6.259 2.753 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.512 -6.793 1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.665 -7.512 0.707 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.322 -7.778 -0.005 1.00 0.00 H new ATOM 1185 N PHE A 70 6.203 -8.137 5.402 1.00 0.00 N ATOM 1186 CA PHE A 70 5.690 -9.481 5.183 1.00 0.00 C ATOM 1187 C PHE A 70 5.915 -10.321 6.436 1.00 0.00 C ATOM 1188 O PHE A 70 6.792 -11.184 6.469 1.00 0.00 O ATOM 1189 CB PHE A 70 6.379 -10.129 3.979 1.00 0.00 C ATOM 1190 CG PHE A 70 5.508 -11.109 3.246 1.00 0.00 C ATOM 1191 CD1 PHE A 70 4.700 -10.689 2.202 1.00 0.00 C ATOM 1192 CD2 PHE A 70 5.498 -12.448 3.600 1.00 0.00 C ATOM 1193 CE1 PHE A 70 3.896 -11.587 1.525 1.00 0.00 C ATOM 1194 CE2 PHE A 70 4.698 -13.351 2.928 1.00 0.00 C ATOM 1195 CZ PHE A 70 3.895 -12.920 1.889 1.00 0.00 C ATOM 0 H PHE A 70 7.220 -8.080 5.458 1.00 0.00 H new ATOM 0 HA PHE A 70 4.622 -9.424 4.974 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.695 -9.348 3.288 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.281 -10.639 4.318 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.698 -9.648 1.914 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.123 -12.790 4.411 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.270 -11.247 0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.700 -14.392 3.214 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.268 -13.624 1.362 1.00 0.00 H new ATOM 1205 N PRO A 71 5.128 -10.062 7.495 1.00 0.00 N ATOM 1206 CA PRO A 71 5.250 -10.782 8.766 1.00 0.00 C ATOM 1207 C PRO A 71 4.835 -12.246 8.648 1.00 0.00 C ATOM 1208 O PRO A 71 4.054 -12.610 7.770 1.00 0.00 O ATOM 1209 CB PRO A 71 4.296 -10.027 9.696 1.00 0.00 C ATOM 1210 CG PRO A 71 3.306 -9.387 8.788 1.00 0.00 C ATOM 1211 CD PRO A 71 4.065 -9.041 7.537 1.00 0.00 C ATOM 0 HA PRO A 71 6.280 -10.808 9.121 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.809 -10.704 10.398 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.828 -9.283 10.289 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.480 -10.064 8.570 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.876 -8.495 9.244 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.428 -9.086 6.654 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.477 -8.033 7.582 1.00 0.00 H new ATOM 1219 N ALA A 72 5.364 -13.079 9.539 1.00 0.00 N ATOM 1220 CA ALA A 72 5.048 -14.502 9.535 1.00 0.00 C ATOM 1221 C ALA A 72 4.550 -14.957 10.902 1.00 0.00 C ATOM 1222 O ALA A 72 4.568 -14.192 11.867 1.00 0.00 O ATOM 1223 CB ALA A 72 6.267 -15.311 9.120 1.00 0.00 C ATOM 0 H ALA A 72 6.013 -12.793 10.272 1.00 0.00 H new ATOM 0 HA ALA A 72 4.250 -14.670 8.812 1.00 0.00 H new ATOM 0 HB1 ALA A 72 6.017 -16.372 9.121 1.00 0.00 H new ATOM 0 HB2 ALA A 72 6.578 -15.013 8.119 1.00 0.00 H new ATOM 0 HB3 ALA A 72 7.081 -15.129 9.822 1.00 0.00 H new ATOM 1229 N LYS A 73 4.106 -16.207 10.979 1.00 0.00 N ATOM 1230 CA LYS A 73 3.604 -16.765 12.230 1.00 0.00 C ATOM 1231 C LYS A 73 2.394 -15.980 12.728 1.00 0.00 C ATOM 1232 O LYS A 73 2.588 -14.852 13.228 1.00 0.00 O ATOM 1233 CB LYS A 73 4.704 -16.760 13.291 1.00 0.00 C ATOM 1234 CG LYS A 73 4.355 -17.564 14.534 1.00 0.00 C ATOM 1235 CD LYS A 73 5.524 -18.425 14.988 1.00 0.00 C ATOM 1236 CE LYS A 73 5.338 -18.907 16.417 1.00 0.00 C ATOM 1237 NZ LYS A 73 5.865 -20.286 16.612 1.00 0.00 N ATOM 1238 OXT LYS A 73 1.264 -16.499 12.615 1.00 0.00 O ATOM 0 H LYS A 73 4.083 -16.853 10.190 1.00 0.00 H new ATOM 0 HA LYS A 73 3.295 -17.793 12.044 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.619 -17.160 12.855 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.913 -15.730 13.581 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.067 -16.886 15.338 1.00 0.00 H new ATOM 0 HG3 LYS A 73 3.493 -18.198 14.328 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.625 -19.283 14.324 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.449 -17.853 14.913 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.846 -18.225 17.099 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.279 -18.884 16.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.719 -20.577 17.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.363 -20.942 15.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.882 -20.303 16.393 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -12.576 -22.416 -0.556 1.00 0.00 N ATOM 1254 CA MET B 1 -11.450 -21.451 -0.452 1.00 0.00 C ATOM 1255 C MET B 1 -10.133 -22.095 -0.873 1.00 0.00 C ATOM 1256 O MET B 1 -9.888 -23.270 -0.599 1.00 0.00 O ATOM 1257 CB MET B 1 -11.358 -20.962 0.995 1.00 0.00 C ATOM 1258 CG MET B 1 -10.207 -19.997 1.243 1.00 0.00 C ATOM 1259 SD MET B 1 -9.307 -20.362 2.763 1.00 0.00 S ATOM 1260 CE MET B 1 -7.705 -20.819 2.105 1.00 0.00 C ATOM 0 H1 MET B 1 -13.257 -22.239 0.210 1.00 0.00 H new ATOM 0 H2 MET B 1 -13.050 -22.299 -1.474 1.00 0.00 H new ATOM 0 H3 MET B 1 -12.210 -23.386 -0.476 1.00 0.00 H new ATOM 0 HA MET B 1 -11.636 -20.611 -1.122 1.00 0.00 H new ATOM 0 HB2 MET B 1 -12.294 -20.473 1.264 1.00 0.00 H new ATOM 0 HB3 MET B 1 -11.247 -21.823 1.654 1.00 0.00 H new ATOM 0 HG2 MET B 1 -9.518 -20.036 0.399 1.00 0.00 H new ATOM 0 HG3 MET B 1 -10.595 -18.980 1.291 1.00 0.00 H new ATOM 0 HE1 MET B 1 -6.975 -20.849 2.914 1.00 0.00 H new ATOM 0 HE2 MET B 1 -7.770 -21.802 1.639 1.00 0.00 H new ATOM 0 HE3 MET B 1 -7.394 -20.085 1.362 1.00 0.00 H new ATOM 1272 N VAL B 2 -9.287 -21.315 -1.539 1.00 0.00 N ATOM 1273 CA VAL B 2 -7.994 -21.806 -1.996 1.00 0.00 C ATOM 1274 C VAL B 2 -6.895 -20.787 -1.722 1.00 0.00 C ATOM 1275 O VAL B 2 -7.011 -19.618 -2.092 1.00 0.00 O ATOM 1276 CB VAL B 2 -8.014 -22.129 -3.502 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -8.775 -23.420 -3.762 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -8.618 -20.976 -4.289 1.00 0.00 C ATOM 0 H VAL B 2 -9.475 -20.340 -1.774 1.00 0.00 H new ATOM 0 HA VAL B 2 -7.788 -22.721 -1.440 1.00 0.00 H new ATOM 0 HB VAL B 2 -6.986 -22.267 -3.838 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -8.778 -23.631 -4.831 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -8.292 -24.240 -3.231 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -9.801 -23.315 -3.410 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -8.623 -21.223 -5.351 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -9.640 -20.801 -3.952 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -8.024 -20.076 -4.129 1.00 0.00 H new ATOM 1288 N GLU B 3 -5.825 -21.236 -1.073 1.00 0.00 N ATOM 1289 CA GLU B 3 -4.702 -20.363 -0.749 1.00 0.00 C ATOM 1290 C GLU B 3 -3.916 -19.997 -2.006 1.00 0.00 C ATOM 1291 O GLU B 3 -2.737 -20.328 -2.135 1.00 0.00 O ATOM 1292 CB GLU B 3 -3.781 -21.047 0.261 1.00 0.00 C ATOM 1293 CG GLU B 3 -3.112 -22.295 -0.289 1.00 0.00 C ATOM 1294 CD GLU B 3 -3.470 -23.546 0.490 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -2.550 -24.184 1.044 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -4.671 -23.886 0.548 1.00 0.00 O ATOM 0 H GLU B 3 -5.712 -22.200 -0.761 1.00 0.00 H new ATOM 0 HA GLU B 3 -5.097 -19.446 -0.312 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -3.014 -20.341 0.579 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -4.357 -21.312 1.147 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -3.401 -22.427 -1.332 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -2.031 -22.159 -0.272 1.00 0.00 H new ATOM 1303 N SER B 4 -4.578 -19.314 -2.931 1.00 0.00 N ATOM 1304 CA SER B 4 -3.944 -18.905 -4.179 1.00 0.00 C ATOM 1305 C SER B 4 -4.860 -17.987 -4.981 1.00 0.00 C ATOM 1306 O SER B 4 -4.519 -16.836 -5.255 1.00 0.00 O ATOM 1307 CB SER B 4 -3.575 -20.132 -5.015 1.00 0.00 C ATOM 1308 OG SER B 4 -2.265 -20.580 -4.713 1.00 0.00 O ATOM 0 H SER B 4 -5.554 -19.031 -2.841 1.00 0.00 H new ATOM 0 HA SER B 4 -3.036 -18.356 -3.931 1.00 0.00 H new ATOM 0 HB2 SER B 4 -4.289 -20.933 -4.826 1.00 0.00 H new ATOM 0 HB3 SER B 4 -3.644 -19.888 -6.075 1.00 0.00 H new ATOM 0 HG SER B 4 -2.059 -20.382 -3.776 1.00 0.00 H new ATOM 1314 N LYS B 5 -6.027 -18.503 -5.355 1.00 0.00 N ATOM 1315 CA LYS B 5 -6.992 -17.728 -6.124 1.00 0.00 C ATOM 1316 C LYS B 5 -7.842 -16.853 -5.207 1.00 0.00 C ATOM 1317 O LYS B 5 -8.294 -15.779 -5.603 1.00 0.00 O ATOM 1318 CB LYS B 5 -7.888 -18.659 -6.946 1.00 0.00 C ATOM 1319 CG LYS B 5 -7.892 -18.341 -8.432 1.00 0.00 C ATOM 1320 CD LYS B 5 -8.347 -19.536 -9.258 1.00 0.00 C ATOM 1321 CE LYS B 5 -9.666 -19.259 -9.962 1.00 0.00 C ATOM 1322 NZ LYS B 5 -9.688 -19.819 -11.342 1.00 0.00 N ATOM 0 H LYS B 5 -6.326 -19.454 -5.138 1.00 0.00 H new ATOM 0 HA LYS B 5 -6.441 -17.078 -6.804 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -7.557 -19.688 -6.804 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -8.908 -18.597 -6.567 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -8.551 -17.494 -8.622 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -6.891 -18.042 -8.744 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -7.584 -19.780 -9.997 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -8.455 -20.407 -8.611 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -10.484 -19.688 -9.383 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -9.836 -18.183 -10.004 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -10.604 -19.609 -11.787 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -8.924 -19.391 -11.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -9.552 -20.849 -11.301 1.00 0.00 H new ATOM 1336 N LYS B 6 -8.052 -17.319 -3.980 1.00 0.00 N ATOM 1337 CA LYS B 6 -8.844 -16.577 -3.008 1.00 0.00 C ATOM 1338 C LYS B 6 -7.942 -15.823 -2.037 1.00 0.00 C ATOM 1339 O LYS B 6 -7.956 -14.592 -1.989 1.00 0.00 O ATOM 1340 CB LYS B 6 -9.764 -17.524 -2.236 1.00 0.00 C ATOM 1341 CG LYS B 6 -10.864 -16.810 -1.467 1.00 0.00 C ATOM 1342 CD LYS B 6 -12.156 -17.612 -1.465 1.00 0.00 C ATOM 1343 CE LYS B 6 -13.017 -17.278 -0.260 1.00 0.00 C ATOM 1344 NZ LYS B 6 -14.378 -17.874 -0.366 1.00 0.00 N ATOM 0 H LYS B 6 -7.685 -18.206 -3.636 1.00 0.00 H new ATOM 0 HA LYS B 6 -9.453 -15.853 -3.550 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -10.218 -18.227 -2.935 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -9.166 -18.110 -1.538 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -10.539 -16.639 -0.441 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -11.043 -15.831 -1.912 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -12.713 -17.408 -2.379 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -11.924 -18.677 -1.464 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -12.531 -17.642 0.645 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -13.101 -16.196 -0.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -14.934 -17.622 0.476 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -14.852 -17.507 -1.216 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -14.300 -18.909 -0.432 1.00 0.00 H new ATOM 1358 N ILE B 7 -7.156 -16.568 -1.266 1.00 0.00 N ATOM 1359 CA ILE B 7 -6.246 -15.968 -0.299 1.00 0.00 C ATOM 1360 C ILE B 7 -4.816 -15.957 -0.826 1.00 0.00 C ATOM 1361 O ILE B 7 -4.021 -16.844 -0.512 1.00 0.00 O ATOM 1362 CB ILE B 7 -6.283 -16.710 1.050 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -7.728 -16.872 1.528 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -5.454 -15.966 2.087 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -7.848 -17.541 2.881 1.00 0.00 C ATOM 0 H ILE B 7 -7.132 -17.587 -1.293 1.00 0.00 H new ATOM 0 HA ILE B 7 -6.581 -14.942 -0.145 1.00 0.00 H new ATOM 0 HB ILE B 7 -5.852 -17.702 0.915 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -8.199 -15.890 1.575 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -8.282 -17.456 0.793 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -5.490 -16.503 3.035 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -4.421 -15.899 1.747 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -5.857 -14.962 2.223 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -8.900 -17.622 3.155 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -7.407 -18.537 2.835 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -7.323 -16.946 3.629 1.00 0.00 H new ATOM 1377 N ALA B 8 -4.495 -14.948 -1.627 1.00 0.00 N ATOM 1378 CA ALA B 8 -3.162 -14.818 -2.199 1.00 0.00 C ATOM 1379 C ALA B 8 -2.961 -13.434 -2.805 1.00 0.00 C ATOM 1380 O ALA B 8 -3.802 -12.548 -2.646 1.00 0.00 O ATOM 1381 CB ALA B 8 -2.929 -15.896 -3.247 1.00 0.00 C ATOM 0 H ALA B 8 -5.142 -14.207 -1.895 1.00 0.00 H new ATOM 0 HA ALA B 8 -2.434 -14.945 -1.398 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -1.929 -15.786 -3.666 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.023 -16.879 -2.785 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -3.668 -15.796 -4.042 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.844 -13.252 -3.498 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.534 -11.974 -4.127 1.00 0.00 C ATOM 1389 C LYS B 9 -2.381 -11.766 -5.377 1.00 0.00 C ATOM 1390 O LYS B 9 -2.709 -12.720 -6.083 1.00 0.00 O ATOM 1391 CB LYS B 9 -0.047 -11.907 -4.476 1.00 0.00 C ATOM 1392 CG LYS B 9 0.737 -10.959 -3.584 1.00 0.00 C ATOM 1393 CD LYS B 9 1.789 -11.691 -2.765 1.00 0.00 C ATOM 1394 CE LYS B 9 1.165 -12.758 -1.880 1.00 0.00 C ATOM 1395 NZ LYS B 9 2.063 -13.142 -0.754 1.00 0.00 N ATOM 0 H LYS B 9 -1.137 -13.974 -3.639 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.768 -11.177 -3.421 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.383 -12.906 -4.399 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.062 -11.592 -5.514 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.219 -10.198 -4.198 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.051 -10.440 -2.914 1.00 0.00 H new ATOM 0 HD2 LYS B 9 2.516 -12.151 -3.434 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.332 -10.976 -2.147 1.00 0.00 H new ATOM 0 HE2 LYS B 9 0.219 -12.391 -1.481 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.938 -13.639 -2.480 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 1.822 -14.100 -0.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 3.052 -13.124 -1.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 1.943 -12.470 0.031 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.748 -10.515 -5.634 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.579 -10.186 -6.793 1.00 0.00 C ATOM 1411 C LYS B 10 -2.961 -9.062 -7.623 1.00 0.00 C ATOM 1412 O LYS B 10 -2.389 -8.126 -7.077 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.961 -9.754 -6.312 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.811 -10.886 -5.759 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.594 -10.440 -4.529 1.00 0.00 C ATOM 1416 CE LYS B 10 -8.024 -10.955 -4.560 1.00 0.00 C ATOM 1417 NZ LYS B 10 -9.005 -9.895 -4.193 1.00 0.00 N ATOM 0 H LYS B 10 -2.486 -9.714 -5.060 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.653 -11.073 -7.423 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.843 -8.993 -5.541 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.492 -9.287 -7.141 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.502 -11.233 -6.527 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.172 -11.730 -5.500 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -6.096 -10.801 -3.629 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.600 -9.351 -4.475 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.253 -11.332 -5.557 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.122 -11.795 -3.872 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.968 -10.287 -4.226 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -8.803 -9.553 -3.232 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.929 -9.105 -4.865 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.093 -9.134 -8.943 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.548 -8.084 -9.798 1.00 0.00 C ATOM 1433 C LYS B 11 -3.332 -6.793 -9.598 1.00 0.00 C ATOM 1434 O LYS B 11 -4.477 -6.675 -10.033 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.583 -8.494 -11.269 1.00 0.00 C ATOM 1436 CG LYS B 11 -2.047 -9.893 -11.525 1.00 0.00 C ATOM 1437 CD LYS B 11 -0.577 -9.863 -11.912 1.00 0.00 C ATOM 1438 CE LYS B 11 0.135 -11.141 -11.499 1.00 0.00 C ATOM 1439 NZ LYS B 11 -0.565 -12.355 -12.005 1.00 0.00 N ATOM 0 H LYS B 11 -3.563 -9.892 -9.438 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.507 -7.924 -9.517 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.610 -8.436 -11.629 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.001 -7.779 -11.850 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.177 -10.503 -10.631 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.624 -10.365 -12.320 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.486 -9.727 -12.990 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.093 -9.007 -11.441 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.157 -11.126 -11.879 1.00 0.00 H new ATOM 0 HE3 LYS B 11 0.199 -11.186 -10.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 0.041 -13.188 -11.866 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.456 -12.485 -11.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -0.770 -12.241 -13.018 1.00 0.00 H new ATOM 1453 N THR B 12 -2.708 -5.830 -8.932 1.00 0.00 N ATOM 1454 CA THR B 12 -3.346 -4.548 -8.663 1.00 0.00 C ATOM 1455 C THR B 12 -2.735 -3.449 -9.523 1.00 0.00 C ATOM 1456 O THR B 12 -1.550 -3.492 -9.846 1.00 0.00 O ATOM 1457 CB THR B 12 -3.214 -4.189 -7.183 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.139 -5.358 -6.388 1.00 0.00 O ATOM 1459 CG2 THR B 12 -4.365 -3.355 -6.665 1.00 0.00 C ATOM 0 H THR B 12 -1.759 -5.913 -8.568 1.00 0.00 H new ATOM 0 HA THR B 12 -4.403 -4.635 -8.913 1.00 0.00 H new ATOM 0 HB THR B 12 -2.299 -3.602 -7.109 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.874 -5.360 -5.739 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.209 -3.135 -5.609 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.419 -2.422 -7.225 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.297 -3.906 -6.787 1.00 0.00 H new ATOM 1467 N THR B 13 -3.545 -2.463 -9.901 1.00 0.00 N ATOM 1468 CA THR B 13 -3.057 -1.367 -10.731 1.00 0.00 C ATOM 1469 C THR B 13 -3.234 -0.016 -10.060 1.00 0.00 C ATOM 1470 O THR B 13 -4.211 0.227 -9.350 1.00 0.00 O ATOM 1471 CB THR B 13 -3.765 -1.339 -12.081 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.238 -2.626 -12.438 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.879 -0.842 -13.200 1.00 0.00 C ATOM 0 H THR B 13 -4.531 -2.401 -9.649 1.00 0.00 H new ATOM 0 HA THR B 13 -1.992 -1.549 -10.877 1.00 0.00 H new ATOM 0 HB THR B 13 -4.597 -0.645 -11.957 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.689 -2.579 -13.307 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.438 -0.845 -14.136 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.547 0.172 -12.978 1.00 0.00 H new ATOM 0 HG23 THR B 13 -2.011 -1.495 -13.294 1.00 0.00 H new ATOM 1481 N LEU B 14 -2.288 0.869 -10.332 1.00 0.00 N ATOM 1482 CA LEU B 14 -2.313 2.223 -9.813 1.00 0.00 C ATOM 1483 C LEU B 14 -1.991 3.181 -10.950 1.00 0.00 C ATOM 1484 O LEU B 14 -1.730 2.741 -12.069 1.00 0.00 O ATOM 1485 CB LEU B 14 -1.310 2.395 -8.667 1.00 0.00 C ATOM 1486 CG LEU B 14 -1.047 1.144 -7.823 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.381 1.149 -7.305 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -2.034 1.053 -6.667 1.00 0.00 C ATOM 0 H LEU B 14 -1.480 0.666 -10.921 1.00 0.00 H new ATOM 0 HA LEU B 14 -3.304 2.438 -9.412 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.363 2.735 -9.085 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.670 3.186 -8.009 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.186 0.268 -8.456 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.554 0.254 -6.707 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.073 1.162 -8.147 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.542 2.034 -6.689 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.828 0.157 -6.082 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.932 1.933 -6.031 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.050 1.004 -7.059 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.012 4.480 -10.686 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.720 5.450 -11.735 1.00 0.00 C ATOM 1502 C ALA B 15 -0.641 6.438 -11.310 1.00 0.00 C ATOM 1503 O ALA B 15 -0.931 7.487 -10.738 1.00 0.00 O ATOM 1504 CB ALA B 15 -2.987 6.184 -12.146 1.00 0.00 C ATOM 0 H ALA B 15 -2.224 4.882 -9.773 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.336 4.900 -12.594 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -2.752 6.904 -12.930 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.718 5.467 -12.519 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.400 6.708 -11.284 1.00 0.00 H new ATOM 1510 N PHE B 16 0.600 6.087 -11.615 1.00 0.00 N ATOM 1511 CA PHE B 16 1.760 6.907 -11.302 1.00 0.00 C ATOM 1512 C PHE B 16 3.005 6.210 -11.802 1.00 0.00 C ATOM 1513 O PHE B 16 2.940 5.103 -12.311 1.00 0.00 O ATOM 1514 CB PHE B 16 1.888 7.197 -9.805 1.00 0.00 C ATOM 1515 CG PHE B 16 1.163 8.441 -9.375 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.146 8.379 -8.438 1.00 0.00 C ATOM 1517 CD2 PHE B 16 1.500 9.673 -9.913 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -0.523 9.523 -8.044 1.00 0.00 C ATOM 1519 CE2 PHE B 16 0.835 10.819 -9.524 1.00 0.00 C ATOM 1520 CZ PHE B 16 -0.178 10.744 -8.588 1.00 0.00 C ATOM 0 H PHE B 16 0.832 5.216 -12.092 1.00 0.00 H new ATOM 0 HA PHE B 16 1.634 7.868 -11.800 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.501 6.347 -9.243 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.943 7.294 -9.550 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -0.128 7.426 -8.010 1.00 0.00 H new ATOM 0 HD2 PHE B 16 2.292 9.737 -10.645 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -1.314 9.462 -7.312 1.00 0.00 H new ATOM 0 HE2 PHE B 16 1.107 11.773 -9.951 1.00 0.00 H new ATOM 0 HZ PHE B 16 -0.699 11.639 -8.282 1.00 0.00 H new ATOM 1530 N ASP B 17 4.127 6.870 -11.680 1.00 0.00 N ATOM 1531 CA ASP B 17 5.395 6.323 -12.132 1.00 0.00 C ATOM 1532 C ASP B 17 6.387 7.440 -12.226 1.00 0.00 C ATOM 1533 O ASP B 17 7.564 7.278 -11.926 1.00 0.00 O ATOM 1534 CB ASP B 17 5.261 5.642 -13.491 1.00 0.00 C ATOM 1535 CG ASP B 17 5.240 4.128 -13.387 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.044 3.465 -14.427 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.422 3.605 -12.268 1.00 0.00 O ATOM 0 H ASP B 17 4.196 7.800 -11.267 1.00 0.00 H new ATOM 0 HA ASP B 17 5.726 5.570 -11.417 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.345 5.982 -13.974 1.00 0.00 H new ATOM 0 HB3 ASP B 17 6.090 5.947 -14.129 1.00 0.00 H new ATOM 1542 N GLU B 18 5.901 8.594 -12.627 1.00 0.00 N ATOM 1543 CA GLU B 18 6.765 9.741 -12.734 1.00 0.00 C ATOM 1544 C GLU B 18 7.638 9.836 -11.484 1.00 0.00 C ATOM 1545 O GLU B 18 8.866 9.716 -11.547 1.00 0.00 O ATOM 1546 CB GLU B 18 5.948 11.022 -12.897 1.00 0.00 C ATOM 1547 CG GLU B 18 6.675 12.117 -13.657 1.00 0.00 C ATOM 1548 CD GLU B 18 6.424 13.494 -13.074 1.00 0.00 C ATOM 1549 OE1 GLU B 18 5.297 14.010 -13.231 1.00 0.00 O ATOM 1550 OE2 GLU B 18 7.355 14.056 -12.459 1.00 0.00 O ATOM 0 H GLU B 18 4.927 8.759 -12.880 1.00 0.00 H new ATOM 0 HA GLU B 18 7.396 9.624 -13.615 1.00 0.00 H new ATOM 0 HB2 GLU B 18 5.019 10.786 -13.417 1.00 0.00 H new ATOM 0 HB3 GLU B 18 5.675 11.396 -11.910 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.745 11.912 -13.648 1.00 0.00 H new ATOM 0 HG3 GLU B 18 6.357 12.104 -14.699 1.00 0.00 H new ATOM 1557 N ASP B 19 6.982 10.017 -10.342 1.00 0.00 N ATOM 1558 CA ASP B 19 7.683 10.113 -9.070 1.00 0.00 C ATOM 1559 C ASP B 19 7.945 8.741 -8.466 1.00 0.00 C ATOM 1560 O ASP B 19 9.066 8.446 -8.059 1.00 0.00 O ATOM 1561 CB ASP B 19 6.887 10.975 -8.086 1.00 0.00 C ATOM 1562 CG ASP B 19 7.308 12.431 -8.122 1.00 0.00 C ATOM 1563 OD1 ASP B 19 7.752 12.895 -9.194 1.00 0.00 O ATOM 1564 OD2 ASP B 19 7.192 13.108 -7.079 1.00 0.00 O ATOM 0 H ASP B 19 5.968 10.100 -10.273 1.00 0.00 H new ATOM 0 HA ASP B 19 8.647 10.583 -9.263 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.825 10.901 -8.319 1.00 0.00 H new ATOM 0 HB3 ASP B 19 7.020 10.586 -7.076 1.00 0.00 H new ATOM 1569 N VAL B 20 6.916 7.906 -8.398 1.00 0.00 N ATOM 1570 CA VAL B 20 7.076 6.578 -7.826 1.00 0.00 C ATOM 1571 C VAL B 20 8.093 5.757 -8.618 1.00 0.00 C ATOM 1572 O VAL B 20 8.935 5.085 -8.031 1.00 0.00 O ATOM 1573 CB VAL B 20 5.736 5.816 -7.727 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.701 6.656 -6.997 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.225 5.421 -9.099 1.00 0.00 C ATOM 0 H VAL B 20 5.975 8.121 -8.727 1.00 0.00 H new ATOM 0 HA VAL B 20 7.449 6.719 -6.812 1.00 0.00 H new ATOM 0 HB VAL B 20 5.911 4.902 -7.159 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.763 6.105 -6.936 1.00 0.00 H new ATOM 0 HG12 VAL B 20 5.057 6.879 -5.991 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.540 7.587 -7.540 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.281 4.886 -8.996 1.00 0.00 H new ATOM 0 HG22 VAL B 20 5.071 6.316 -9.702 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.955 4.776 -9.587 1.00 0.00 H new ATOM 1585 N TYR B 21 8.033 5.826 -9.948 1.00 0.00 N ATOM 1586 CA TYR B 21 8.982 5.085 -10.776 1.00 0.00 C ATOM 1587 C TYR B 21 10.385 5.656 -10.614 1.00 0.00 C ATOM 1588 O TYR B 21 11.346 4.904 -10.446 1.00 0.00 O ATOM 1589 CB TYR B 21 8.581 5.085 -12.260 1.00 0.00 C ATOM 1590 CG TYR B 21 9.104 3.890 -13.028 1.00 0.00 C ATOM 1591 CD1 TYR B 21 9.037 2.612 -12.490 1.00 0.00 C ATOM 1592 CD2 TYR B 21 9.664 4.044 -14.290 1.00 0.00 C ATOM 1593 CE1 TYR B 21 9.516 1.518 -13.188 1.00 0.00 C ATOM 1594 CE2 TYR B 21 10.143 2.956 -14.994 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.067 1.695 -14.439 1.00 0.00 C ATOM 1596 OH TYR B 21 10.544 0.610 -15.137 1.00 0.00 O ATOM 0 H TYR B 21 7.350 6.377 -10.467 1.00 0.00 H new ATOM 0 HA TYR B 21 8.969 4.050 -10.433 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.494 5.107 -12.334 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.951 5.997 -12.728 1.00 0.00 H new ATOM 0 HD1 TYR B 21 8.604 2.470 -11.511 1.00 0.00 H new ATOM 0 HD2 TYR B 21 9.726 5.029 -14.728 1.00 0.00 H new ATOM 0 HE1 TYR B 21 9.459 0.530 -12.755 1.00 0.00 H new ATOM 0 HE2 TYR B 21 10.575 3.092 -15.974 1.00 0.00 H new ATOM 0 HH TYR B 21 10.898 0.907 -16.001 1.00 0.00 H new ATOM 1606 N HIS B 22 10.513 6.986 -10.649 1.00 0.00 N ATOM 1607 CA HIS B 22 11.825 7.601 -10.484 1.00 0.00 C ATOM 1608 C HIS B 22 12.327 7.389 -9.063 1.00 0.00 C ATOM 1609 O HIS B 22 13.498 7.080 -8.851 1.00 0.00 O ATOM 1610 CB HIS B 22 11.773 9.092 -10.818 1.00 0.00 C ATOM 1611 CG HIS B 22 13.077 9.641 -11.308 1.00 0.00 C ATOM 1612 ND1 HIS B 22 13.164 10.632 -12.264 1.00 0.00 N ATOM 1613 CD2 HIS B 22 14.352 9.333 -10.972 1.00 0.00 C ATOM 1614 CE1 HIS B 22 14.436 10.908 -12.494 1.00 0.00 C ATOM 1615 NE2 HIS B 22 15.177 10.134 -11.722 1.00 0.00 N ATOM 0 H HIS B 22 9.743 7.640 -10.787 1.00 0.00 H new ATOM 0 HA HIS B 22 12.519 7.125 -11.176 1.00 0.00 H new ATOM 0 HB2 HIS B 22 11.009 9.260 -11.577 1.00 0.00 H new ATOM 0 HB3 HIS B 22 11.466 9.645 -9.930 1.00 0.00 H new ATOM 0 HD2 HIS B 22 14.662 8.594 -10.248 1.00 0.00 H new ATOM 0 HE1 HIS B 22 14.806 11.642 -13.194 1.00 0.00 H new ATOM 0 HE2 HIS B 22 16.196 10.132 -11.688 1.00 0.00 H new ATOM 1624 N THR B 23 11.434 7.534 -8.089 1.00 0.00 N ATOM 1625 CA THR B 23 11.808 7.327 -6.698 1.00 0.00 C ATOM 1626 C THR B 23 12.195 5.871 -6.490 1.00 0.00 C ATOM 1627 O THR B 23 13.185 5.564 -5.827 1.00 0.00 O ATOM 1628 CB THR B 23 10.670 7.695 -5.755 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.489 6.989 -6.091 1.00 0.00 O ATOM 1630 CG2 THR B 23 10.342 9.172 -5.751 1.00 0.00 C ATOM 0 H THR B 23 10.458 7.791 -8.236 1.00 0.00 H new ATOM 0 HA THR B 23 12.655 7.975 -6.472 1.00 0.00 H new ATOM 0 HB THR B 23 11.023 7.420 -4.761 1.00 0.00 H new ATOM 0 HG1 THR B 23 9.053 7.424 -6.853 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.523 9.361 -5.057 1.00 0.00 H new ATOM 0 HG22 THR B 23 11.219 9.739 -5.439 1.00 0.00 H new ATOM 0 HG23 THR B 23 10.047 9.482 -6.754 1.00 0.00 H new ATOM 1638 N LEU B 24 11.417 4.974 -7.090 1.00 0.00 N ATOM 1639 CA LEU B 24 11.692 3.547 -6.996 1.00 0.00 C ATOM 1640 C LEU B 24 13.102 3.253 -7.498 1.00 0.00 C ATOM 1641 O LEU B 24 13.667 2.198 -7.211 1.00 0.00 O ATOM 1642 CB LEU B 24 10.669 2.741 -7.807 1.00 0.00 C ATOM 1643 CG LEU B 24 9.612 1.998 -6.980 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.251 1.291 -5.796 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.529 2.953 -6.506 1.00 0.00 C ATOM 0 H LEU B 24 10.594 5.211 -7.644 1.00 0.00 H new ATOM 0 HA LEU B 24 11.614 3.250 -5.950 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.159 3.418 -8.493 1.00 0.00 H new ATOM 0 HB3 LEU B 24 11.206 2.014 -8.417 1.00 0.00 H new ATOM 0 HG LEU B 24 9.151 1.246 -7.621 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.482 0.771 -5.224 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.985 0.570 -6.156 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.744 2.024 -5.158 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.790 2.404 -5.922 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.976 3.731 -5.887 1.00 0.00 H new ATOM 0 HD23 LEU B 24 8.043 3.409 -7.369 1.00 0.00 H new ATOM 1657 N LYS B 25 13.662 4.192 -8.259 1.00 0.00 N ATOM 1658 CA LYS B 25 14.995 4.027 -8.807 1.00 0.00 C ATOM 1659 C LYS B 25 16.064 4.046 -7.721 1.00 0.00 C ATOM 1660 O LYS B 25 16.957 3.199 -7.718 1.00 0.00 O ATOM 1661 CB LYS B 25 15.286 5.109 -9.849 1.00 0.00 C ATOM 1662 CG LYS B 25 16.566 4.869 -10.633 1.00 0.00 C ATOM 1663 CD LYS B 25 16.528 3.543 -11.380 1.00 0.00 C ATOM 1664 CE LYS B 25 17.673 2.633 -10.965 1.00 0.00 C ATOM 1665 NZ LYS B 25 18.765 2.620 -11.977 1.00 0.00 N ATOM 0 H LYS B 25 13.209 5.072 -8.506 1.00 0.00 H new ATOM 0 HA LYS B 25 15.027 3.049 -9.287 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.449 5.166 -10.545 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.352 6.075 -9.349 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.716 5.682 -11.343 1.00 0.00 H new ATOM 0 HG3 LYS B 25 17.417 4.879 -9.952 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.578 3.044 -11.188 1.00 0.00 H new ATOM 0 HD3 LYS B 25 16.580 3.728 -12.453 1.00 0.00 H new ATOM 0 HE2 LYS B 25 18.071 2.964 -10.006 1.00 0.00 H new ATOM 0 HE3 LYS B 25 17.298 1.620 -10.822 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 19.527 1.988 -11.658 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 18.392 2.280 -12.886 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 19.140 3.583 -12.095 1.00 0.00 H new ATOM 1679 N LEU B 26 15.983 5.000 -6.794 1.00 0.00 N ATOM 1680 CA LEU B 26 16.975 5.063 -5.725 1.00 0.00 C ATOM 1681 C LEU B 26 16.747 3.921 -4.755 1.00 0.00 C ATOM 1682 O LEU B 26 17.678 3.214 -4.383 1.00 0.00 O ATOM 1683 CB LEU B 26 16.950 6.398 -4.975 1.00 0.00 C ATOM 1684 CG LEU B 26 16.395 7.579 -5.758 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.893 7.626 -5.595 1.00 0.00 C ATOM 1686 CD2 LEU B 26 17.033 8.879 -5.292 1.00 0.00 C ATOM 0 H LEU B 26 15.262 5.720 -6.761 1.00 0.00 H new ATOM 0 HA LEU B 26 17.958 4.976 -6.187 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.357 6.275 -4.069 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.966 6.638 -4.661 1.00 0.00 H new ATOM 0 HG LEU B 26 16.633 7.454 -6.814 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.493 8.471 -6.155 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.457 6.701 -5.973 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.645 7.740 -4.540 1.00 0.00 H new ATOM 0 HD21 LEU B 26 16.623 9.711 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.823 9.028 -4.233 1.00 0.00 H new ATOM 0 HD23 LEU B 26 18.111 8.830 -5.445 1.00 0.00 H new ATOM 1698 N VAL B 27 15.494 3.736 -4.367 1.00 0.00 N ATOM 1699 CA VAL B 27 15.130 2.664 -3.451 1.00 0.00 C ATOM 1700 C VAL B 27 15.482 1.313 -4.033 1.00 0.00 C ATOM 1701 O VAL B 27 15.975 0.437 -3.329 1.00 0.00 O ATOM 1702 CB VAL B 27 13.629 2.655 -3.113 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.380 3.188 -1.718 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.854 3.443 -4.122 1.00 0.00 C ATOM 0 H VAL B 27 14.711 4.314 -4.672 1.00 0.00 H new ATOM 0 HA VAL B 27 15.696 2.851 -2.539 1.00 0.00 H new ATOM 0 HB VAL B 27 13.286 1.621 -3.145 1.00 0.00 H new ATOM 0 HG11 VAL B 27 12.311 3.170 -1.507 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.904 2.566 -0.992 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.746 4.212 -1.649 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.795 3.423 -3.864 1.00 0.00 H new ATOM 0 HG22 VAL B 27 13.207 4.474 -4.128 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.994 3.006 -5.111 1.00 0.00 H new ATOM 1714 N SER B 28 15.210 1.127 -5.313 1.00 0.00 N ATOM 1715 CA SER B 28 15.494 -0.150 -5.929 1.00 0.00 C ATOM 1716 C SER B 28 16.987 -0.444 -5.924 1.00 0.00 C ATOM 1717 O SER B 28 17.401 -1.586 -5.717 1.00 0.00 O ATOM 1718 CB SER B 28 14.940 -0.211 -7.353 1.00 0.00 C ATOM 1719 OG SER B 28 13.525 -0.294 -7.348 1.00 0.00 O ATOM 0 H SER B 28 14.802 1.828 -5.931 1.00 0.00 H new ATOM 0 HA SER B 28 14.995 -0.917 -5.337 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.253 0.674 -7.906 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.356 -1.075 -7.871 1.00 0.00 H new ATOM 0 HG SER B 28 13.145 0.593 -7.519 1.00 0.00 H new ATOM 1725 N VAL B 29 17.787 0.591 -6.143 1.00 0.00 N ATOM 1726 CA VAL B 29 19.232 0.455 -6.160 1.00 0.00 C ATOM 1727 C VAL B 29 19.781 0.431 -4.738 1.00 0.00 C ATOM 1728 O VAL B 29 20.621 -0.400 -4.393 1.00 0.00 O ATOM 1729 CB VAL B 29 19.865 1.618 -6.960 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.739 2.505 -6.087 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.649 1.087 -8.151 1.00 0.00 C ATOM 0 H VAL B 29 17.453 1.540 -6.312 1.00 0.00 H new ATOM 0 HA VAL B 29 19.489 -0.487 -6.645 1.00 0.00 H new ATOM 0 HB VAL B 29 19.049 2.239 -7.330 1.00 0.00 H new ATOM 0 HG11 VAL B 29 21.162 3.307 -6.692 1.00 0.00 H new ATOM 0 HG12 VAL B 29 20.137 2.933 -5.286 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.546 1.911 -5.657 1.00 0.00 H new ATOM 0 HG21 VAL B 29 21.086 1.921 -8.700 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.443 0.428 -7.799 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.980 0.531 -8.808 1.00 0.00 H new ATOM 1741 N TYR B 30 19.303 1.364 -3.928 1.00 0.00 N ATOM 1742 CA TYR B 30 19.742 1.477 -2.544 1.00 0.00 C ATOM 1743 C TYR B 30 19.159 0.369 -1.674 1.00 0.00 C ATOM 1744 O TYR B 30 19.719 0.046 -0.626 1.00 0.00 O ATOM 1745 CB TYR B 30 19.361 2.842 -1.964 1.00 0.00 C ATOM 1746 CG TYR B 30 20.427 3.899 -2.146 1.00 0.00 C ATOM 1747 CD1 TYR B 30 20.189 5.027 -2.921 1.00 0.00 C ATOM 1748 CD2 TYR B 30 21.670 3.770 -1.540 1.00 0.00 C ATOM 1749 CE1 TYR B 30 21.161 5.996 -3.087 1.00 0.00 C ATOM 1750 CE2 TYR B 30 22.646 4.734 -1.702 1.00 0.00 C ATOM 1751 CZ TYR B 30 22.387 5.845 -2.476 1.00 0.00 C ATOM 1752 OH TYR B 30 23.357 6.807 -2.639 1.00 0.00 O ATOM 0 H TYR B 30 18.608 2.057 -4.206 1.00 0.00 H new ATOM 0 HA TYR B 30 20.827 1.376 -2.543 1.00 0.00 H new ATOM 0 HB2 TYR B 30 18.440 3.183 -2.436 1.00 0.00 H new ATOM 0 HB3 TYR B 30 19.152 2.729 -0.900 1.00 0.00 H new ATOM 0 HD1 TYR B 30 19.229 5.149 -3.401 1.00 0.00 H new ATOM 0 HD2 TYR B 30 21.877 2.902 -0.932 1.00 0.00 H new ATOM 0 HE1 TYR B 30 20.960 6.867 -3.693 1.00 0.00 H new ATOM 0 HE2 TYR B 30 23.608 4.618 -1.224 1.00 0.00 H new ATOM 0 HH TYR B 30 24.161 6.549 -2.142 1.00 0.00 H new ATOM 1762 N LEU B 31 18.039 -0.221 -2.095 1.00 0.00 N ATOM 1763 CA LEU B 31 17.429 -1.288 -1.315 1.00 0.00 C ATOM 1764 C LEU B 31 17.582 -2.631 -2.022 1.00 0.00 C ATOM 1765 O LEU B 31 17.221 -3.671 -1.475 1.00 0.00 O ATOM 1766 CB LEU B 31 15.941 -1.002 -1.053 1.00 0.00 C ATOM 1767 CG LEU B 31 15.570 0.431 -0.611 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.466 0.396 0.436 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.776 1.195 -0.076 1.00 0.00 C ATOM 0 H LEU B 31 17.547 0.019 -2.956 1.00 0.00 H new ATOM 0 HA LEU B 31 17.947 -1.333 -0.357 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.387 -1.230 -1.963 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.593 -1.694 -0.286 1.00 0.00 H new ATOM 0 HG LEU B 31 15.211 0.959 -1.495 1.00 0.00 H new ATOM 0 HD11 LEU B 31 14.217 1.414 0.736 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.582 -0.085 0.017 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.807 -0.166 1.306 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.469 2.197 0.223 1.00 0.00 H new ATOM 0 HD22 LEU B 31 17.187 0.669 0.786 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.536 1.266 -0.854 1.00 0.00 H new ATOM 1781 N ASN B 32 18.111 -2.605 -3.246 1.00 0.00 N ATOM 1782 CA ASN B 32 18.292 -3.827 -4.021 1.00 0.00 C ATOM 1783 C ASN B 32 16.967 -4.562 -4.132 1.00 0.00 C ATOM 1784 O ASN B 32 16.915 -5.791 -4.089 1.00 0.00 O ATOM 1785 CB ASN B 32 19.342 -4.727 -3.366 1.00 0.00 C ATOM 1786 CG ASN B 32 20.759 -4.287 -3.674 1.00 0.00 C ATOM 1787 OD1 ASN B 32 20.995 -3.528 -4.615 1.00 0.00 O ATOM 1788 ND2 ASN B 32 21.712 -4.761 -2.880 1.00 0.00 N ATOM 0 H ASN B 32 18.419 -1.755 -3.718 1.00 0.00 H new ATOM 0 HA ASN B 32 18.641 -3.563 -5.019 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.192 -4.728 -2.286 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.201 -5.752 -3.708 1.00 0.00 H new ATOM 0 HD21 ASN B 32 22.685 -4.499 -3.038 1.00 0.00 H new ATOM 0 HD22 ASN B 32 21.471 -5.387 -2.112 1.00 0.00 H new ATOM 1795 N ARG B 33 15.894 -3.789 -4.254 1.00 0.00 N ATOM 1796 CA ARG B 33 14.553 -4.353 -4.348 1.00 0.00 C ATOM 1797 C ARG B 33 13.796 -3.797 -5.543 1.00 0.00 C ATOM 1798 O ARG B 33 13.755 -2.587 -5.755 1.00 0.00 O ATOM 1799 CB ARG B 33 13.771 -4.052 -3.067 1.00 0.00 C ATOM 1800 CG ARG B 33 14.238 -4.861 -1.869 1.00 0.00 C ATOM 1801 CD ARG B 33 13.341 -4.643 -0.661 1.00 0.00 C ATOM 1802 NE ARG B 33 13.545 -5.665 0.363 1.00 0.00 N ATOM 1803 CZ ARG B 33 14.629 -5.738 1.131 1.00 0.00 C ATOM 1804 NH1 ARG B 33 15.607 -4.851 0.997 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.736 -6.702 2.035 1.00 0.00 N ATOM 0 H ARG B 33 15.927 -2.770 -4.290 1.00 0.00 H new ATOM 0 HA ARG B 33 14.654 -5.430 -4.479 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.861 -2.991 -2.836 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.714 -4.252 -3.241 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.250 -5.920 -2.127 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.261 -4.582 -1.618 1.00 0.00 H new ATOM 0 HD2 ARG B 33 13.538 -3.659 -0.236 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.298 -4.650 -0.978 1.00 0.00 H new ATOM 0 HE ARG B 33 12.814 -6.363 0.497 1.00 0.00 H new ATOM 0 HH11 ARG B 33 15.530 -4.108 0.302 1.00 0.00 H new ATOM 0 HH12 ARG B 33 16.436 -4.912 1.589 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.988 -7.387 2.141 1.00 0.00 H new ATOM 0 HH22 ARG B 33 15.567 -6.759 2.624 1.00 0.00 H new ATOM 1819 N ASP B 34 13.172 -4.685 -6.311 1.00 0.00 N ATOM 1820 CA ASP B 34 12.391 -4.265 -7.466 1.00 0.00 C ATOM 1821 C ASP B 34 11.404 -3.186 -7.045 1.00 0.00 C ATOM 1822 O ASP B 34 11.147 -3.007 -5.855 1.00 0.00 O ATOM 1823 CB ASP B 34 11.648 -5.454 -8.078 1.00 0.00 C ATOM 1824 CG ASP B 34 11.161 -5.168 -9.484 1.00 0.00 C ATOM 1825 OD1 ASP B 34 10.113 -4.504 -9.626 1.00 0.00 O ATOM 1826 OD2 ASP B 34 11.829 -5.607 -10.443 1.00 0.00 O ATOM 0 H ASP B 34 13.192 -5.693 -6.155 1.00 0.00 H new ATOM 0 HA ASP B 34 13.066 -3.863 -8.222 1.00 0.00 H new ATOM 0 HB2 ASP B 34 12.307 -6.322 -8.094 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.797 -5.712 -7.447 1.00 0.00 H new ATOM 1831 N MET B 35 10.857 -2.459 -8.010 1.00 0.00 N ATOM 1832 CA MET B 35 9.915 -1.405 -7.698 1.00 0.00 C ATOM 1833 C MET B 35 8.787 -1.936 -6.819 1.00 0.00 C ATOM 1834 O MET B 35 8.617 -1.495 -5.683 1.00 0.00 O ATOM 1835 CB MET B 35 9.373 -0.781 -8.990 1.00 0.00 C ATOM 1836 CG MET B 35 7.869 -0.595 -9.001 1.00 0.00 C ATOM 1837 SD MET B 35 7.305 0.484 -10.331 1.00 0.00 S ATOM 1838 CE MET B 35 7.375 -0.635 -11.729 1.00 0.00 C ATOM 0 H MET B 35 11.050 -2.581 -9.004 1.00 0.00 H new ATOM 0 HA MET B 35 10.430 -0.625 -7.137 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.850 0.187 -9.141 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.657 -1.411 -9.833 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.388 -1.568 -9.101 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.552 -0.180 -8.044 1.00 0.00 H new ATOM 0 HE1 MET B 35 7.158 -0.086 -12.645 1.00 0.00 H new ATOM 0 HE2 MET B 35 8.371 -1.072 -11.796 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.639 -1.428 -11.598 1.00 0.00 H new ATOM 1848 N THR B 36 8.029 -2.895 -7.345 1.00 0.00 N ATOM 1849 CA THR B 36 6.923 -3.491 -6.600 1.00 0.00 C ATOM 1850 C THR B 36 7.362 -3.850 -5.185 1.00 0.00 C ATOM 1851 O THR B 36 6.782 -3.387 -4.207 1.00 0.00 O ATOM 1852 CB THR B 36 6.411 -4.750 -7.317 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.390 -5.252 -8.208 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.139 -4.535 -8.113 1.00 0.00 C ATOM 0 H THR B 36 8.160 -3.275 -8.282 1.00 0.00 H new ATOM 0 HA THR B 36 6.117 -2.759 -6.545 1.00 0.00 H new ATOM 0 HB THR B 36 6.195 -5.457 -6.516 1.00 0.00 H new ATOM 0 HG1 THR B 36 7.046 -6.054 -8.654 1.00 0.00 H new ATOM 0 HG21 THR B 36 4.844 -5.471 -8.588 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.344 -4.201 -7.446 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.312 -3.779 -8.878 1.00 0.00 H new ATOM 1862 N GLU B 37 8.398 -4.676 -5.087 1.00 0.00 N ATOM 1863 CA GLU B 37 8.920 -5.100 -3.793 1.00 0.00 C ATOM 1864 C GLU B 37 9.127 -3.909 -2.858 1.00 0.00 C ATOM 1865 O GLU B 37 8.919 -4.016 -1.651 1.00 0.00 O ATOM 1866 CB GLU B 37 10.238 -5.858 -3.979 1.00 0.00 C ATOM 1867 CG GLU B 37 10.157 -7.323 -3.579 1.00 0.00 C ATOM 1868 CD GLU B 37 11.491 -7.874 -3.118 1.00 0.00 C ATOM 1869 OE1 GLU B 37 12.219 -8.446 -3.956 1.00 0.00 O ATOM 1870 OE2 GLU B 37 11.809 -7.735 -1.917 1.00 0.00 O ATOM 0 H GLU B 37 8.893 -5.066 -5.889 1.00 0.00 H new ATOM 0 HA GLU B 37 8.185 -5.763 -3.336 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.542 -5.791 -5.024 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.014 -5.371 -3.389 1.00 0.00 H new ATOM 0 HG2 GLU B 37 9.425 -7.438 -2.780 1.00 0.00 H new ATOM 0 HG3 GLU B 37 9.799 -7.908 -4.426 1.00 0.00 H new ATOM 1877 N ILE B 38 9.545 -2.778 -3.419 1.00 0.00 N ATOM 1878 CA ILE B 38 9.787 -1.579 -2.624 1.00 0.00 C ATOM 1879 C ILE B 38 8.494 -0.819 -2.339 1.00 0.00 C ATOM 1880 O ILE B 38 8.181 -0.536 -1.183 1.00 0.00 O ATOM 1881 CB ILE B 38 10.780 -0.636 -3.335 1.00 0.00 C ATOM 1882 CG1 ILE B 38 12.233 -1.067 -3.096 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.599 0.803 -2.881 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.547 -1.350 -1.643 1.00 0.00 C ATOM 0 H ILE B 38 9.723 -2.667 -4.417 1.00 0.00 H new ATOM 0 HA ILE B 38 10.214 -1.911 -1.677 1.00 0.00 H new ATOM 0 HB ILE B 38 10.565 -0.700 -4.402 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.440 -1.960 -3.685 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.900 -0.285 -3.458 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.314 1.441 -3.401 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.585 1.132 -3.110 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.768 0.869 -1.806 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.591 -1.649 -1.548 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.372 -0.452 -1.051 1.00 0.00 H new ATOM 0 HD13 ILE B 38 11.905 -2.153 -1.282 1.00 0.00 H new ATOM 1896 N ILE B 39 7.748 -0.476 -3.386 1.00 0.00 N ATOM 1897 CA ILE B 39 6.503 0.263 -3.190 1.00 0.00 C ATOM 1898 C ILE B 39 5.538 -0.566 -2.360 1.00 0.00 C ATOM 1899 O ILE B 39 4.702 -0.029 -1.633 1.00 0.00 O ATOM 1900 CB ILE B 39 5.817 0.710 -4.524 1.00 0.00 C ATOM 1901 CG1 ILE B 39 4.374 0.196 -4.613 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.605 0.267 -5.750 1.00 0.00 C ATOM 1903 CD1 ILE B 39 4.270 -1.290 -4.882 1.00 0.00 C ATOM 0 H ILE B 39 7.976 -0.691 -4.357 1.00 0.00 H new ATOM 0 HA ILE B 39 6.768 1.180 -2.663 1.00 0.00 H new ATOM 0 HB ILE B 39 5.799 1.800 -4.511 1.00 0.00 H new ATOM 0 HG12 ILE B 39 3.859 0.424 -3.680 1.00 0.00 H new ATOM 0 HG13 ILE B 39 3.854 0.736 -5.404 1.00 0.00 H new ATOM 0 HG21 ILE B 39 6.091 0.599 -6.652 1.00 0.00 H new ATOM 0 HG22 ILE B 39 7.603 0.704 -5.719 1.00 0.00 H new ATOM 0 HG23 ILE B 39 6.685 -0.820 -5.758 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.220 -1.578 -4.931 1.00 0.00 H new ATOM 0 HD12 ILE B 39 4.755 -1.523 -5.830 1.00 0.00 H new ATOM 0 HD13 ILE B 39 4.760 -1.840 -4.079 1.00 0.00 H new ATOM 1915 N GLU B 40 5.655 -1.881 -2.479 1.00 0.00 N ATOM 1916 CA GLU B 40 4.789 -2.781 -1.748 1.00 0.00 C ATOM 1917 C GLU B 40 5.317 -3.018 -0.340 1.00 0.00 C ATOM 1918 O GLU B 40 4.540 -3.301 0.573 1.00 0.00 O ATOM 1919 CB GLU B 40 4.638 -4.110 -2.487 1.00 0.00 C ATOM 1920 CG GLU B 40 3.236 -4.682 -2.414 1.00 0.00 C ATOM 1921 CD GLU B 40 2.266 -3.953 -3.323 1.00 0.00 C ATOM 1922 OE1 GLU B 40 1.168 -3.588 -2.850 1.00 0.00 O ATOM 1923 OE2 GLU B 40 2.603 -3.747 -4.507 1.00 0.00 O ATOM 0 H GLU B 40 6.342 -2.343 -3.075 1.00 0.00 H new ATOM 0 HA GLU B 40 3.807 -2.313 -1.674 1.00 0.00 H new ATOM 0 HB2 GLU B 40 4.911 -3.969 -3.533 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.339 -4.832 -2.069 1.00 0.00 H new ATOM 0 HG2 GLU B 40 3.262 -5.737 -2.687 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.877 -4.627 -1.386 1.00 0.00 H new ATOM 1930 N GLU B 41 6.628 -2.884 -0.147 1.00 0.00 N ATOM 1931 CA GLU B 41 7.184 -3.071 1.190 1.00 0.00 C ATOM 1932 C GLU B 41 7.073 -1.772 1.985 1.00 0.00 C ATOM 1933 O GLU B 41 6.992 -1.788 3.215 1.00 0.00 O ATOM 1934 CB GLU B 41 8.638 -3.557 1.139 1.00 0.00 C ATOM 1935 CG GLU B 41 9.634 -2.502 0.687 1.00 0.00 C ATOM 1936 CD GLU B 41 10.691 -2.210 1.733 1.00 0.00 C ATOM 1937 OE1 GLU B 41 10.990 -3.113 2.543 1.00 0.00 O ATOM 1938 OE2 GLU B 41 11.221 -1.079 1.742 1.00 0.00 O ATOM 0 H GLU B 41 7.306 -2.654 -0.874 1.00 0.00 H new ATOM 0 HA GLU B 41 6.605 -3.846 1.692 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.926 -3.911 2.129 1.00 0.00 H new ATOM 0 HB3 GLU B 41 8.700 -4.411 0.465 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.119 -2.835 -0.231 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.100 -1.582 0.449 1.00 0.00 H new ATOM 1945 N ALA B 42 7.044 -0.649 1.269 1.00 0.00 N ATOM 1946 CA ALA B 42 6.920 0.654 1.904 1.00 0.00 C ATOM 1947 C ALA B 42 5.475 0.911 2.307 1.00 0.00 C ATOM 1948 O ALA B 42 5.198 1.397 3.404 1.00 0.00 O ATOM 1949 CB ALA B 42 7.410 1.748 0.968 1.00 0.00 C ATOM 0 H ALA B 42 7.105 -0.619 0.251 1.00 0.00 H new ATOM 0 HA ALA B 42 7.538 0.663 2.802 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.311 2.717 1.457 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.457 1.572 0.720 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.814 1.740 0.055 1.00 0.00 H new ATOM 1955 N VAL B 43 4.556 0.570 1.409 1.00 0.00 N ATOM 1956 CA VAL B 43 3.130 0.752 1.658 1.00 0.00 C ATOM 1957 C VAL B 43 2.724 0.121 2.974 1.00 0.00 C ATOM 1958 O VAL B 43 2.263 0.797 3.893 1.00 0.00 O ATOM 1959 CB VAL B 43 2.273 0.120 0.534 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.755 -1.266 0.174 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.810 0.059 0.934 1.00 0.00 C ATOM 0 H VAL B 43 4.775 0.165 0.499 1.00 0.00 H new ATOM 0 HA VAL B 43 2.953 1.827 1.690 1.00 0.00 H new ATOM 0 HB VAL B 43 2.379 0.760 -0.342 1.00 0.00 H new ATOM 0 HG11 VAL B 43 2.128 -1.675 -0.618 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.788 -1.214 -0.171 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.698 -1.910 1.051 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.230 -0.389 0.127 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.704 -0.545 1.835 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.443 1.067 1.128 1.00 0.00 H new ATOM 1971 N VAL B 44 2.896 -1.181 3.044 1.00 0.00 N ATOM 1972 CA VAL B 44 2.550 -1.932 4.231 1.00 0.00 C ATOM 1973 C VAL B 44 3.292 -1.383 5.438 1.00 0.00 C ATOM 1974 O VAL B 44 2.691 -1.093 6.469 1.00 0.00 O ATOM 1975 CB VAL B 44 2.861 -3.430 4.035 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.404 -4.062 5.311 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.624 -4.172 3.552 1.00 0.00 C ATOM 0 H VAL B 44 3.277 -1.746 2.285 1.00 0.00 H new ATOM 0 HA VAL B 44 1.479 -1.827 4.408 1.00 0.00 H new ATOM 0 HB VAL B 44 3.636 -3.511 3.273 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.611 -5.117 5.135 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.323 -3.556 5.605 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.666 -3.966 6.107 1.00 0.00 H new ATOM 0 HG21 VAL B 44 1.862 -5.227 3.419 1.00 0.00 H new ATOM 0 HG22 VAL B 44 0.827 -4.069 4.289 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.295 -3.752 2.602 1.00 0.00 H new ATOM 1987 N MET B 45 4.600 -1.225 5.301 1.00 0.00 N ATOM 1988 CA MET B 45 5.403 -0.694 6.388 1.00 0.00 C ATOM 1989 C MET B 45 4.863 0.659 6.832 1.00 0.00 C ATOM 1990 O MET B 45 4.958 1.018 8.004 1.00 0.00 O ATOM 1991 CB MET B 45 6.868 -0.565 5.975 1.00 0.00 C ATOM 1992 CG MET B 45 7.793 -0.240 7.135 1.00 0.00 C ATOM 1993 SD MET B 45 7.922 -1.594 8.319 1.00 0.00 S ATOM 1994 CE MET B 45 7.418 -0.773 9.829 1.00 0.00 C ATOM 0 H MET B 45 5.122 -1.455 4.456 1.00 0.00 H new ATOM 0 HA MET B 45 5.344 -1.391 7.224 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.191 -1.497 5.512 1.00 0.00 H new ATOM 0 HB3 MET B 45 6.958 0.215 5.218 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.785 -0.004 6.749 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.429 0.651 7.646 1.00 0.00 H new ATOM 0 HE1 MET B 45 7.021 -1.509 10.528 1.00 0.00 H new ATOM 0 HE2 MET B 45 8.278 -0.274 10.276 1.00 0.00 H new ATOM 0 HE3 MET B 45 6.648 -0.035 9.603 1.00 0.00 H new ATOM 2004 N TRP B 46 4.273 1.401 5.895 1.00 0.00 N ATOM 2005 CA TRP B 46 3.704 2.698 6.223 1.00 0.00 C ATOM 2006 C TRP B 46 2.497 2.514 7.126 1.00 0.00 C ATOM 2007 O TRP B 46 2.477 2.990 8.261 1.00 0.00 O ATOM 2008 CB TRP B 46 3.301 3.451 4.957 1.00 0.00 C ATOM 2009 CG TRP B 46 2.829 4.844 5.230 1.00 0.00 C ATOM 2010 CD1 TRP B 46 3.607 5.930 5.499 1.00 0.00 C ATOM 2011 CD2 TRP B 46 1.473 5.299 5.271 1.00 0.00 C ATOM 2012 NE1 TRP B 46 2.818 7.038 5.699 1.00 0.00 N ATOM 2013 CE2 TRP B 46 1.504 6.675 5.565 1.00 0.00 C ATOM 2014 CE3 TRP B 46 0.236 4.677 5.084 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 0.343 7.439 5.678 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 -0.914 5.435 5.196 1.00 0.00 C ATOM 2017 CH2 TRP B 46 -0.853 6.803 5.490 1.00 0.00 C ATOM 0 H TRP B 46 4.179 1.127 4.917 1.00 0.00 H new ATOM 0 HA TRP B 46 4.459 3.287 6.744 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.152 3.488 4.277 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.511 2.899 4.449 1.00 0.00 H new ATOM 0 HD1 TRP B 46 4.686 5.922 5.548 1.00 0.00 H new ATOM 0 HE1 TRP B 46 3.156 7.977 5.912 1.00 0.00 H new ATOM 0 HE3 TRP B 46 0.180 3.623 4.856 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 0.387 8.494 5.906 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -1.876 4.965 5.054 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -1.770 7.368 5.570 1.00 0.00 H new ATOM 2028 N LEU B 47 1.496 1.801 6.621 1.00 0.00 N ATOM 2029 CA LEU B 47 0.291 1.534 7.395 1.00 0.00 C ATOM 2030 C LEU B 47 0.644 0.892 8.718 1.00 0.00 C ATOM 2031 O LEU B 47 0.094 1.233 9.762 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.656 0.584 6.658 1.00 0.00 C ATOM 2033 CG LEU B 47 -0.002 -0.447 5.736 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.060 -1.797 6.433 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.768 -0.556 4.426 1.00 0.00 C ATOM 0 H LEU B 47 1.495 1.400 5.683 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.201 2.494 7.549 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.251 0.051 7.400 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.348 1.183 6.065 1.00 0.00 H new ATOM 0 HG LEU B 47 1.013 -0.121 5.508 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.527 -2.527 5.772 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.647 -1.708 7.347 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.949 -2.125 6.681 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.287 -1.294 3.784 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.794 -0.864 4.629 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.772 0.412 3.925 1.00 0.00 H new ATOM 2047 N ILE B 48 1.549 -0.067 8.649 1.00 0.00 N ATOM 2048 CA ILE B 48 1.971 -0.801 9.816 1.00 0.00 C ATOM 2049 C ILE B 48 2.626 0.102 10.848 1.00 0.00 C ATOM 2050 O ILE B 48 2.379 -0.035 12.048 1.00 0.00 O ATOM 2051 CB ILE B 48 2.924 -1.937 9.403 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.268 -3.275 9.689 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.267 -1.828 10.107 1.00 0.00 C ATOM 2054 CD1 ILE B 48 0.966 -3.483 8.944 1.00 0.00 C ATOM 0 H ILE B 48 2.007 -0.354 7.784 1.00 0.00 H new ATOM 0 HA ILE B 48 1.084 -1.229 10.283 1.00 0.00 H new ATOM 0 HB ILE B 48 3.119 -1.853 8.334 1.00 0.00 H new ATOM 0 HG12 ILE B 48 2.960 -4.074 9.424 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.082 -3.357 10.760 1.00 0.00 H new ATOM 0 HG21 ILE B 48 4.912 -2.647 9.789 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.736 -0.878 9.852 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.118 -1.881 11.185 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.554 -4.460 9.197 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.256 -2.706 9.227 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.149 -3.433 7.871 1.00 0.00 H new ATOM 2066 N GLN B 49 3.461 1.019 10.390 1.00 0.00 N ATOM 2067 CA GLN B 49 4.136 1.922 11.301 1.00 0.00 C ATOM 2068 C GLN B 49 3.215 3.067 11.720 1.00 0.00 C ATOM 2069 O GLN B 49 3.491 3.772 12.692 1.00 0.00 O ATOM 2070 CB GLN B 49 5.417 2.473 10.666 1.00 0.00 C ATOM 2071 CG GLN B 49 5.174 3.535 9.605 1.00 0.00 C ATOM 2072 CD GLN B 49 6.462 4.142 9.084 1.00 0.00 C ATOM 2073 OE1 GLN B 49 6.578 5.361 8.953 1.00 0.00 O ATOM 2074 NE2 GLN B 49 7.438 3.293 8.784 1.00 0.00 N ATOM 0 H GLN B 49 3.685 1.156 9.404 1.00 0.00 H new ATOM 0 HA GLN B 49 4.406 1.358 12.194 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.047 2.894 11.450 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.973 1.648 10.220 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.622 3.095 8.775 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.547 4.323 10.022 1.00 0.00 H new ATOM 0 HE21 GLN B 49 7.298 2.290 8.908 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.328 3.644 8.429 1.00 0.00 H new ATOM 2083 N ASN B 50 2.122 3.255 10.981 1.00 0.00 N ATOM 2084 CA ASN B 50 1.174 4.322 11.282 1.00 0.00 C ATOM 2085 C ASN B 50 -0.009 3.805 12.100 1.00 0.00 C ATOM 2086 O ASN B 50 -0.577 4.534 12.910 1.00 0.00 O ATOM 2087 CB ASN B 50 0.670 4.965 9.987 1.00 0.00 C ATOM 2088 CG ASN B 50 -0.117 6.236 10.240 1.00 0.00 C ATOM 2089 OD1 ASN B 50 -0.807 6.363 11.252 1.00 0.00 O ATOM 2090 ND2 ASN B 50 -0.020 7.186 9.317 1.00 0.00 N ATOM 0 H ASN B 50 1.874 2.684 10.173 1.00 0.00 H new ATOM 0 HA ASN B 50 1.696 5.071 11.878 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.519 5.189 9.342 1.00 0.00 H new ATOM 0 HB3 ASN B 50 0.042 4.253 9.452 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.529 8.063 9.432 1.00 0.00 H new ATOM 0 HD22 ASN B 50 0.563 7.039 8.493 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.378 2.546 11.879 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.501 1.941 12.592 1.00 0.00 C ATOM 2099 C LYS B 51 -1.146 1.643 14.044 1.00 0.00 C ATOM 2100 O LYS B 51 -1.899 1.978 14.958 1.00 0.00 O ATOM 2101 CB LYS B 51 -1.947 0.654 11.892 1.00 0.00 C ATOM 2102 CG LYS B 51 -3.157 0.844 10.992 1.00 0.00 C ATOM 2103 CD LYS B 51 -2.835 1.736 9.804 1.00 0.00 C ATOM 2104 CE LYS B 51 -3.975 2.694 9.500 1.00 0.00 C ATOM 2105 NZ LYS B 51 -4.396 3.459 10.705 1.00 0.00 N ATOM 0 H LYS B 51 0.083 1.925 11.213 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.321 2.659 12.583 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -1.119 0.267 11.298 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -2.179 -0.099 12.645 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -3.503 -0.127 10.636 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -3.973 1.282 11.566 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -1.927 2.303 10.009 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -2.634 1.119 8.928 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.666 3.389 8.719 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -4.825 2.134 9.111 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -4.712 4.408 10.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -5.177 2.961 11.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.593 3.544 11.361 1.00 0.00 H new ATOM 2119 N GLU B 52 0.001 1.003 14.251 1.00 0.00 N ATOM 2120 CA GLU B 52 0.453 0.649 15.595 1.00 0.00 C ATOM 2121 C GLU B 52 0.317 1.824 16.559 1.00 0.00 C ATOM 2122 O GLU B 52 -0.063 1.649 17.716 1.00 0.00 O ATOM 2123 CB GLU B 52 1.906 0.172 15.556 1.00 0.00 C ATOM 2124 CG GLU B 52 2.052 -1.312 15.264 1.00 0.00 C ATOM 2125 CD GLU B 52 3.332 -1.894 15.829 1.00 0.00 C ATOM 2126 OE1 GLU B 52 4.394 -1.257 15.671 1.00 0.00 O ATOM 2127 OE2 GLU B 52 3.272 -2.988 16.429 1.00 0.00 O ATOM 0 H GLU B 52 0.636 0.718 13.505 1.00 0.00 H new ATOM 0 HA GLU B 52 -0.183 -0.159 15.956 1.00 0.00 H new ATOM 0 HB2 GLU B 52 2.445 0.738 14.796 1.00 0.00 H new ATOM 0 HB3 GLU B 52 2.378 0.394 16.513 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.199 -1.846 15.682 1.00 0.00 H new ATOM 0 HG3 GLU B 52 2.030 -1.470 14.186 1.00 0.00 H new ATOM 2134 N LYS B 53 0.635 3.018 16.075 1.00 0.00 N ATOM 2135 CA LYS B 53 0.554 4.222 16.896 1.00 0.00 C ATOM 2136 C LYS B 53 -0.311 5.290 16.233 1.00 0.00 C ATOM 2137 O LYS B 53 -0.099 6.483 16.447 1.00 0.00 O ATOM 2138 CB LYS B 53 1.954 4.778 17.161 1.00 0.00 C ATOM 2139 CG LYS B 53 2.775 4.987 15.897 1.00 0.00 C ATOM 2140 CD LYS B 53 3.118 6.454 15.689 1.00 0.00 C ATOM 2141 CE LYS B 53 2.194 7.104 14.671 1.00 0.00 C ATOM 2142 NZ LYS B 53 2.860 7.284 13.352 1.00 0.00 N ATOM 0 H LYS B 53 0.951 3.180 15.119 1.00 0.00 H new ATOM 0 HA LYS B 53 0.090 3.948 17.843 1.00 0.00 H new ATOM 0 HB2 LYS B 53 1.865 5.728 17.688 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.488 4.096 17.822 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.693 4.403 15.958 1.00 0.00 H new ATOM 0 HG3 LYS B 53 2.219 4.617 15.036 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.045 6.984 16.639 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.151 6.543 15.353 1.00 0.00 H new ATOM 0 HE2 LYS B 53 1.302 6.490 14.546 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.864 8.073 15.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 2.197 7.730 12.686 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 3.697 7.891 13.466 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 3.152 6.357 12.981 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.281 4.859 15.428 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.171 5.789 14.731 1.00 0.00 C ATOM 2158 C LEU B 54 -2.842 6.752 15.709 1.00 0.00 C ATOM 2159 O LEU B 54 -3.801 6.389 16.389 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.242 5.020 13.956 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.171 5.885 13.101 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.527 6.195 11.759 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.510 5.192 12.904 1.00 0.00 C ATOM 0 H LEU B 54 -1.471 3.874 15.242 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.564 6.369 14.035 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.749 4.294 13.309 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.847 4.456 14.666 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.344 6.826 13.623 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.202 6.811 11.165 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.592 6.732 11.919 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -3.324 5.264 11.229 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.159 5.821 12.294 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.355 4.236 12.403 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.978 5.022 13.874 1.00 0.00 H new ATOM 2175 N PRO B 55 -2.344 7.999 15.792 1.00 0.00 N ATOM 2176 CA PRO B 55 -2.895 9.016 16.688 1.00 0.00 C ATOM 2177 C PRO B 55 -4.183 9.626 16.148 1.00 0.00 C ATOM 2178 O PRO B 55 -4.407 9.654 14.937 1.00 0.00 O ATOM 2179 CB PRO B 55 -1.791 10.088 16.752 1.00 0.00 C ATOM 2180 CG PRO B 55 -0.635 9.536 15.980 1.00 0.00 C ATOM 2181 CD PRO B 55 -1.208 8.526 15.031 1.00 0.00 C ATOM 0 HA PRO B 55 -3.156 8.595 17.659 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -2.135 11.028 16.321 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -1.508 10.295 17.784 1.00 0.00 H new ATOM 0 HG2 PRO B 55 -0.115 10.327 15.439 1.00 0.00 H new ATOM 0 HG3 PRO B 55 0.093 9.074 16.647 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -1.523 8.982 14.092 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.488 7.747 14.782 1.00 0.00 H new ATOM 2189 N ASN B 56 -5.020 10.124 17.050 1.00 0.00 N ATOM 2190 CA ASN B 56 -6.279 10.746 16.658 1.00 0.00 C ATOM 2191 C ASN B 56 -6.022 12.097 15.992 1.00 0.00 C ATOM 2192 O ASN B 56 -6.845 12.585 15.218 1.00 0.00 O ATOM 2193 CB ASN B 56 -7.185 10.927 17.878 1.00 0.00 C ATOM 2194 CG ASN B 56 -8.099 9.739 18.099 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -8.115 9.144 19.178 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -8.869 9.384 17.077 1.00 0.00 N ATOM 0 H ASN B 56 -4.850 10.109 18.056 1.00 0.00 H new ATOM 0 HA ASN B 56 -6.778 10.092 15.943 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -6.570 11.079 18.765 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -7.787 11.827 17.750 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -9.505 8.592 17.169 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -8.825 9.904 16.201 1.00 0.00 H new ATOM 2203 N GLU B 57 -4.873 12.692 16.301 1.00 0.00 N ATOM 2204 CA GLU B 57 -4.497 13.982 15.737 1.00 0.00 C ATOM 2205 C GLU B 57 -3.881 13.823 14.348 1.00 0.00 C ATOM 2206 O GLU B 57 -3.752 14.796 13.606 1.00 0.00 O ATOM 2207 CB GLU B 57 -3.513 14.699 16.662 1.00 0.00 C ATOM 2208 CG GLU B 57 -2.179 13.985 16.802 1.00 0.00 C ATOM 2209 CD GLU B 57 -1.143 14.823 17.526 1.00 0.00 C ATOM 2210 OE1 GLU B 57 -0.919 14.579 18.731 1.00 0.00 O ATOM 2211 OE2 GLU B 57 -0.555 15.722 16.888 1.00 0.00 O ATOM 0 H GLU B 57 -4.184 12.298 16.942 1.00 0.00 H new ATOM 0 HA GLU B 57 -5.403 14.580 15.642 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -3.339 15.706 16.283 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -3.965 14.804 17.648 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -2.326 13.050 17.342 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -1.804 13.726 15.812 1.00 0.00 H new ATOM 2218 N LEU B 58 -3.493 12.596 14.003 1.00 0.00 N ATOM 2219 CA LEU B 58 -2.889 12.324 12.703 1.00 0.00 C ATOM 2220 C LEU B 58 -3.952 12.089 11.635 1.00 0.00 C ATOM 2221 O LEU B 58 -3.669 12.193 10.441 1.00 0.00 O ATOM 2222 CB LEU B 58 -1.964 11.108 12.787 1.00 0.00 C ATOM 2223 CG LEU B 58 -0.546 11.334 12.254 1.00 0.00 C ATOM 2224 CD1 LEU B 58 0.425 11.581 13.397 1.00 0.00 C ATOM 2225 CD2 LEU B 58 -0.094 10.146 11.416 1.00 0.00 C ATOM 0 H LEU B 58 -3.586 11.778 14.605 1.00 0.00 H new ATOM 0 HA LEU B 58 -2.306 13.201 12.421 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.898 10.792 13.828 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -2.418 10.287 12.232 1.00 0.00 H new ATOM 0 HG LEU B 58 -0.557 12.219 11.618 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.426 11.739 12.996 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.114 12.464 13.954 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.432 10.717 14.061 1.00 0.00 H new ATOM 0 HD21 LEU B 58 0.916 10.325 11.046 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -0.102 9.245 12.029 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -0.772 10.017 10.572 1.00 0.00 H new ATOM 2237 N LYS B 59 -5.175 11.771 12.067 1.00 0.00 N ATOM 2238 CA LYS B 59 -6.281 11.520 11.140 1.00 0.00 C ATOM 2239 C LYS B 59 -6.239 12.497 9.962 1.00 0.00 C ATOM 2240 O LYS B 59 -6.301 12.086 8.803 1.00 0.00 O ATOM 2241 CB LYS B 59 -7.622 11.634 11.867 1.00 0.00 C ATOM 2242 CG LYS B 59 -8.635 10.582 11.442 1.00 0.00 C ATOM 2243 CD LYS B 59 -9.645 11.147 10.455 1.00 0.00 C ATOM 2244 CE LYS B 59 -10.587 12.137 11.122 1.00 0.00 C ATOM 2245 NZ LYS B 59 -12.007 11.699 11.034 1.00 0.00 N ATOM 0 H LYS B 59 -5.424 11.681 13.052 1.00 0.00 H new ATOM 0 HA LYS B 59 -6.173 10.507 10.752 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -7.452 11.551 12.940 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -8.041 12.624 11.687 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -8.116 9.737 10.989 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -9.157 10.202 12.320 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.119 11.639 9.637 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -10.222 10.332 10.018 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -10.308 12.255 12.169 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -10.479 13.114 10.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -12.616 12.401 11.500 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -12.282 11.611 10.035 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -12.116 10.778 11.505 1.00 0.00 H new ATOM 2259 N PRO B 60 -6.116 13.805 10.247 1.00 0.00 N ATOM 2260 CA PRO B 60 -6.043 14.837 9.216 1.00 0.00 C ATOM 2261 C PRO B 60 -4.657 14.897 8.588 1.00 0.00 C ATOM 2262 O PRO B 60 -4.509 15.248 7.418 1.00 0.00 O ATOM 2263 CB PRO B 60 -6.348 16.142 9.973 1.00 0.00 C ATOM 2264 CG PRO B 60 -6.626 15.748 11.391 1.00 0.00 C ATOM 2265 CD PRO B 60 -6.018 14.389 11.585 1.00 0.00 C ATOM 0 HA PRO B 60 -6.735 14.648 8.395 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -5.504 16.830 9.919 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -7.205 16.654 9.536 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -6.194 16.469 12.085 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -7.699 15.724 11.583 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -4.985 14.452 11.926 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -6.563 13.802 12.325 1.00 0.00 H new ATOM 2273 N LYS B 61 -3.644 14.541 9.374 1.00 0.00 N ATOM 2274 CA LYS B 61 -2.269 14.544 8.891 1.00 0.00 C ATOM 2275 C LYS B 61 -2.126 13.622 7.688 1.00 0.00 C ATOM 2276 O LYS B 61 -1.278 13.838 6.826 1.00 0.00 O ATOM 2277 CB LYS B 61 -1.304 14.114 9.995 1.00 0.00 C ATOM 2278 CG LYS B 61 0.123 14.593 9.772 1.00 0.00 C ATOM 2279 CD LYS B 61 0.957 13.548 9.045 1.00 0.00 C ATOM 2280 CE LYS B 61 2.139 13.092 9.885 1.00 0.00 C ATOM 2281 NZ LYS B 61 3.050 14.221 10.220 1.00 0.00 N ATOM 0 H LYS B 61 -3.750 14.248 10.345 1.00 0.00 H new ATOM 0 HA LYS B 61 -2.020 15.561 8.589 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -1.663 14.497 10.950 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -1.307 13.026 10.067 1.00 0.00 H new ATOM 0 HG2 LYS B 61 0.111 15.517 9.194 1.00 0.00 H new ATOM 0 HG3 LYS B 61 0.584 14.824 10.732 1.00 0.00 H new ATOM 0 HD2 LYS B 61 0.332 12.690 8.799 1.00 0.00 H new ATOM 0 HD3 LYS B 61 1.317 13.960 8.103 1.00 0.00 H new ATOM 0 HE2 LYS B 61 1.776 12.634 10.805 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.694 12.325 9.345 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 4.006 13.854 10.402 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 3.081 14.890 9.424 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 2.700 14.710 11.069 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.975 12.599 7.621 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.945 11.667 6.503 1.00 0.00 C ATOM 2297 C ILE B 62 -2.954 12.455 5.195 1.00 0.00 C ATOM 2298 O ILE B 62 -2.192 12.169 4.266 1.00 0.00 O ATOM 2299 CB ILE B 62 -4.142 10.684 6.567 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.723 9.394 7.275 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.692 10.374 5.179 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -3.151 9.623 8.658 1.00 0.00 C ATOM 0 H ILE B 62 -3.686 12.397 8.324 1.00 0.00 H new ATOM 0 HA ILE B 62 -2.034 11.071 6.557 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.939 11.163 7.135 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.587 8.734 7.352 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.982 8.878 6.665 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.530 9.682 5.266 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.031 11.296 4.708 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -3.909 9.922 4.570 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -2.875 8.666 9.101 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -2.267 10.257 8.586 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -3.898 10.111 9.284 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.790 13.489 5.158 1.00 0.00 N ATOM 2315 CA ASP B 63 -3.868 14.358 4.001 1.00 0.00 C ATOM 2316 C ASP B 63 -2.523 15.044 3.823 1.00 0.00 C ATOM 2317 O ASP B 63 -2.010 15.160 2.711 1.00 0.00 O ATOM 2318 CB ASP B 63 -4.982 15.393 4.183 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.038 15.301 3.099 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -7.208 15.636 3.380 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -5.695 14.895 1.969 1.00 0.00 O ATOM 0 H ASP B 63 -4.421 13.741 5.919 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.102 13.772 3.112 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.451 15.251 5.157 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.549 16.393 4.181 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.942 15.464 4.948 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.637 16.106 4.945 1.00 0.00 C ATOM 2328 C GLU B 64 0.396 15.164 4.340 1.00 0.00 C ATOM 2329 O GLU B 64 1.186 15.556 3.487 1.00 0.00 O ATOM 2330 CB GLU B 64 -0.229 16.506 6.367 1.00 0.00 C ATOM 2331 CG GLU B 64 -0.974 17.722 6.893 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.862 17.867 8.398 1.00 0.00 C ATOM 2333 OE1 GLU B 64 -1.913 17.900 9.071 1.00 0.00 O ATOM 2334 OE2 GLU B 64 0.279 17.947 8.903 1.00 0.00 O ATOM 0 H GLU B 64 -2.361 15.368 5.873 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.690 17.012 4.341 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.405 15.664 7.037 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.842 16.710 6.385 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.581 18.619 6.415 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -2.026 17.647 6.616 1.00 0.00 H new ATOM 2341 N ILE B 65 0.356 13.903 4.766 1.00 0.00 N ATOM 2342 CA ILE B 65 1.266 12.887 4.245 1.00 0.00 C ATOM 2343 C ILE B 65 1.274 12.918 2.724 1.00 0.00 C ATOM 2344 O ILE B 65 2.323 12.798 2.100 1.00 0.00 O ATOM 2345 CB ILE B 65 0.854 11.477 4.721 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.837 11.413 6.251 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.798 10.425 4.158 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.198 11.618 6.879 1.00 0.00 C ATOM 0 H ILE B 65 -0.297 13.561 5.471 1.00 0.00 H new ATOM 0 HA ILE B 65 2.264 13.109 4.623 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.151 11.271 4.353 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.152 12.171 6.631 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.444 10.445 6.562 1.00 0.00 H new ATOM 0 HG21 ILE B 65 1.491 9.438 4.505 1.00 0.00 H new ATOM 0 HG22 ILE B 65 1.766 10.453 3.069 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.814 10.629 4.497 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.111 11.560 7.964 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.881 10.844 6.528 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.584 12.598 6.598 1.00 0.00 H new ATOM 2360 N SER B 66 0.098 13.073 2.131 1.00 0.00 N ATOM 2361 CA SER B 66 -0.015 13.109 0.677 1.00 0.00 C ATOM 2362 C SER B 66 0.272 14.496 0.101 1.00 0.00 C ATOM 2363 O SER B 66 1.118 14.644 -0.778 1.00 0.00 O ATOM 2364 CB SER B 66 -1.403 12.642 0.240 1.00 0.00 C ATOM 2365 OG SER B 66 -1.328 11.826 -0.916 1.00 0.00 O ATOM 0 H SER B 66 -0.786 13.175 2.629 1.00 0.00 H new ATOM 0 HA SER B 66 0.742 12.430 0.284 1.00 0.00 H new ATOM 0 HB2 SER B 66 -1.875 12.087 1.051 1.00 0.00 H new ATOM 0 HB3 SER B 66 -2.034 13.507 0.037 1.00 0.00 H new ATOM 0 HG SER B 66 -2.229 11.540 -1.173 1.00 0.00 H new ATOM 2371 N LYS B 67 -0.448 15.508 0.573 1.00 0.00 N ATOM 2372 CA LYS B 67 -0.269 16.866 0.064 1.00 0.00 C ATOM 2373 C LYS B 67 1.110 17.434 0.400 1.00 0.00 C ATOM 2374 O LYS B 67 1.593 18.339 -0.279 1.00 0.00 O ATOM 2375 CB LYS B 67 -1.361 17.789 0.612 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.522 17.712 2.120 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.390 19.081 2.772 1.00 0.00 C ATOM 2378 CE LYS B 67 -2.472 19.311 3.816 1.00 0.00 C ATOM 2379 NZ LYS B 67 -3.146 20.627 3.635 1.00 0.00 N ATOM 0 H LYS B 67 -1.156 15.417 1.302 1.00 0.00 H new ATOM 0 HA LYS B 67 -0.347 16.813 -1.022 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.131 18.817 0.332 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.310 17.535 0.140 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.497 17.287 2.360 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.770 17.039 2.532 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.409 19.169 3.239 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.450 19.856 2.008 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -3.212 18.513 3.755 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -2.032 19.262 4.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -3.877 20.746 4.365 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -2.445 21.391 3.719 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -3.588 20.664 2.694 1.00 0.00 H new ATOM 2393 N ARG B 68 1.739 16.917 1.452 1.00 0.00 N ATOM 2394 CA ARG B 68 3.055 17.403 1.860 1.00 0.00 C ATOM 2395 C ARG B 68 4.186 16.541 1.310 1.00 0.00 C ATOM 2396 O ARG B 68 5.262 17.053 1.003 1.00 0.00 O ATOM 2397 CB ARG B 68 3.150 17.478 3.382 1.00 0.00 C ATOM 2398 CG ARG B 68 2.098 18.381 3.997 1.00 0.00 C ATOM 2399 CD ARG B 68 2.268 18.487 5.505 1.00 0.00 C ATOM 2400 NE ARG B 68 3.313 19.438 5.876 1.00 0.00 N ATOM 2401 CZ ARG B 68 3.909 19.455 7.067 1.00 0.00 C ATOM 2402 NH1 ARG B 68 3.565 18.577 8.001 1.00 0.00 N ATOM 2403 NH2 ARG B 68 4.850 20.352 7.324 1.00 0.00 N ATOM 0 H ARG B 68 1.363 16.168 2.033 1.00 0.00 H new ATOM 0 HA ARG B 68 3.169 18.402 1.440 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.048 16.475 3.797 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.140 17.839 3.662 1.00 0.00 H new ATOM 0 HG2 ARG B 68 2.163 19.374 3.552 1.00 0.00 H new ATOM 0 HG3 ARG B 68 1.105 17.994 3.768 1.00 0.00 H new ATOM 0 HD2 ARG B 68 1.324 18.793 5.955 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.511 17.505 5.912 1.00 0.00 H new ATOM 0 HE ARG B 68 3.603 20.128 5.183 1.00 0.00 H new ATOM 0 HH11 ARG B 68 2.841 17.885 7.808 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.025 18.594 8.911 1.00 0.00 H new ATOM 0 HH21 ARG B 68 5.118 21.029 6.610 1.00 0.00 H new ATOM 0 HH22 ARG B 68 5.307 20.365 8.236 1.00 0.00 H new ATOM 2417 N PHE B 69 3.949 15.239 1.177 1.00 0.00 N ATOM 2418 CA PHE B 69 4.976 14.350 0.650 1.00 0.00 C ATOM 2419 C PHE B 69 4.805 14.205 -0.856 1.00 0.00 C ATOM 2420 O PHE B 69 5.768 13.971 -1.587 1.00 0.00 O ATOM 2421 CB PHE B 69 4.944 12.992 1.365 1.00 0.00 C ATOM 2422 CG PHE B 69 5.152 13.109 2.856 1.00 0.00 C ATOM 2423 CD1 PHE B 69 4.306 13.885 3.637 1.00 0.00 C ATOM 2424 CD2 PHE B 69 6.204 12.453 3.474 1.00 0.00 C ATOM 2425 CE1 PHE B 69 4.509 14.001 5.000 1.00 0.00 C ATOM 2426 CE2 PHE B 69 6.408 12.564 4.837 1.00 0.00 C ATOM 2427 CZ PHE B 69 5.561 13.340 5.600 1.00 0.00 C ATOM 0 H PHE B 69 3.070 14.783 1.422 1.00 0.00 H new ATOM 0 HA PHE B 69 5.958 14.783 0.839 1.00 0.00 H new ATOM 0 HB2 PHE B 69 3.986 12.509 1.174 1.00 0.00 H new ATOM 0 HB3 PHE B 69 5.716 12.347 0.945 1.00 0.00 H new ATOM 0 HD1 PHE B 69 3.480 14.404 3.175 1.00 0.00 H new ATOM 0 HD2 PHE B 69 6.874 11.846 2.883 1.00 0.00 H new ATOM 0 HE1 PHE B 69 3.844 14.609 5.595 1.00 0.00 H new ATOM 0 HE2 PHE B 69 7.231 12.043 5.304 1.00 0.00 H new ATOM 0 HZ PHE B 69 5.721 13.430 6.664 1.00 0.00 H new ATOM 2437 N PHE B 70 3.573 14.401 -1.313 1.00 0.00 N ATOM 2438 CA PHE B 70 3.251 14.355 -2.731 1.00 0.00 C ATOM 2439 C PHE B 70 2.620 15.688 -3.128 1.00 0.00 C ATOM 2440 O PHE B 70 1.516 15.731 -3.670 1.00 0.00 O ATOM 2441 CB PHE B 70 2.291 13.202 -3.045 1.00 0.00 C ATOM 2442 CG PHE B 70 1.906 13.128 -4.495 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.574 13.043 -4.869 1.00 0.00 C ATOM 2444 CD2 PHE B 70 2.876 13.147 -5.484 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.217 12.978 -6.203 1.00 0.00 C ATOM 2446 CE2 PHE B 70 2.525 13.082 -6.819 1.00 0.00 C ATOM 2447 CZ PHE B 70 1.194 12.998 -7.179 1.00 0.00 C ATOM 0 H PHE B 70 2.773 14.596 -0.711 1.00 0.00 H new ATOM 0 HA PHE B 70 4.165 14.185 -3.300 1.00 0.00 H new ATOM 0 HB2 PHE B 70 2.756 12.261 -2.751 1.00 0.00 H new ATOM 0 HB3 PHE B 70 1.390 13.314 -2.442 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.194 13.027 -4.110 1.00 0.00 H new ATOM 0 HD2 PHE B 70 3.918 13.213 -5.209 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -0.824 12.912 -6.482 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.291 13.097 -7.580 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.918 12.948 -8.222 1.00 0.00 H new ATOM 2457 N PRO B 71 3.321 16.802 -2.840 1.00 0.00 N ATOM 2458 CA PRO B 71 2.837 18.152 -3.142 1.00 0.00 C ATOM 2459 C PRO B 71 2.465 18.320 -4.611 1.00 0.00 C ATOM 2460 O PRO B 71 3.128 17.779 -5.496 1.00 0.00 O ATOM 2461 CB PRO B 71 4.025 19.058 -2.779 1.00 0.00 C ATOM 2462 CG PRO B 71 5.197 18.144 -2.657 1.00 0.00 C ATOM 2463 CD PRO B 71 4.638 16.836 -2.190 1.00 0.00 C ATOM 0 HA PRO B 71 1.927 18.387 -2.590 1.00 0.00 H new ATOM 0 HB2 PRO B 71 4.193 19.812 -3.548 1.00 0.00 H new ATOM 0 HB3 PRO B 71 3.843 19.590 -1.845 1.00 0.00 H new ATOM 0 HG2 PRO B 71 5.709 18.033 -3.613 1.00 0.00 H new ATOM 0 HG3 PRO B 71 5.927 18.534 -1.948 1.00 0.00 H new ATOM 0 HD2 PRO B 71 5.262 15.996 -2.494 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.556 16.795 -1.104 1.00 0.00 H new ATOM 2471 N ALA B 72 1.400 19.074 -4.865 1.00 0.00 N ATOM 2472 CA ALA B 72 0.940 19.312 -6.226 1.00 0.00 C ATOM 2473 C ALA B 72 1.268 20.732 -6.676 1.00 0.00 C ATOM 2474 O ALA B 72 1.495 20.982 -7.860 1.00 0.00 O ATOM 2475 CB ALA B 72 -0.556 19.055 -6.330 1.00 0.00 C ATOM 0 H ALA B 72 0.840 19.530 -4.145 1.00 0.00 H new ATOM 0 HA ALA B 72 1.463 18.620 -6.886 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.886 19.237 -7.353 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -0.767 18.021 -6.059 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -1.088 19.723 -5.653 1.00 0.00 H new ATOM 2481 N LYS B 73 1.292 21.659 -5.723 1.00 0.00 N ATOM 2482 CA LYS B 73 1.593 23.055 -6.023 1.00 0.00 C ATOM 2483 C LYS B 73 2.302 23.721 -4.848 1.00 0.00 C ATOM 2484 O LYS B 73 1.896 23.471 -3.693 1.00 0.00 O ATOM 2485 CB LYS B 73 0.307 23.813 -6.361 1.00 0.00 C ATOM 2486 CG LYS B 73 0.357 24.527 -7.701 1.00 0.00 C ATOM 2487 CD LYS B 73 -0.289 23.697 -8.798 1.00 0.00 C ATOM 2488 CE LYS B 73 -1.801 23.855 -8.801 1.00 0.00 C ATOM 2489 NZ LYS B 73 -2.354 23.882 -10.183 1.00 0.00 N ATOM 2490 OXT LYS B 73 3.257 24.488 -5.092 1.00 0.00 O ATOM 0 H LYS B 73 1.107 21.469 -4.738 1.00 0.00 H new ATOM 0 HA LYS B 73 2.258 23.083 -6.886 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -0.528 23.112 -6.363 1.00 0.00 H new ATOM 0 HB3 LYS B 73 0.109 24.543 -5.577 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -0.152 25.487 -7.622 1.00 0.00 H new ATOM 0 HG3 LYS B 73 1.394 24.737 -7.964 1.00 0.00 H new ATOM 0 HD2 LYS B 73 0.111 23.998 -9.766 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -0.032 22.647 -8.660 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -2.253 23.033 -8.245 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -2.071 24.776 -8.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -3.387 23.991 -10.141 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -1.942 24.681 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -2.119 22.993 -10.668 1.00 0.00 H new TER 2504 LYS B 73