USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=37 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: A 49 GLN : amide:sc= -1.16 X(o=-1.5,f=-1.1) USER MOD Set 1.2: B 49 GLN : amide:sc= -0.341 X(o=-1.5,f=-1.7) USER MOD Set 2.1: A 45 MET CE :methyl -105:sc= -1.85 (180deg=-4.8!) USER MOD Set 2.2: B 61 LYS NZ :NH3+ -135:sc= -0.687 (180deg=-1.69!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0382) USER MOD Single : A 6 LYS NZ :NH3+ 174:sc= -0.892 (180deg=-0.946) USER MOD Single : A 9 LYS NZ :NH3+ -112:sc= -0.108 (180deg=-3.91!) 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 -129:sc= -1.08! 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= -0.181 X(o=-0.18,f=0) USER MOD Single : A 23 THR OG1 : rot -103:sc= -0.974! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 61:sc= 0.996 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 35 MET CE :methyl -174:sc= -2.17 (180deg=-2.36) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.066 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ -150:sc= -1.59 (180deg=-2.47!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.0855) USER MOD Single : A 66 SER OG : rot 72:sc= -1.33 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 173:sc=-0.00395 (180deg=-0.122) USER MOD Single : B 1 MET N :NH3+ -168:sc= 1.19 (180deg=1.12) USER MOD Single : B 4 SER OG : rot 180:sc= -0.887 USER MOD Single : B 5 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.495) USER MOD Single : B 6 LYS NZ :NH3+ 147:sc= -0.246 (180deg=-1.22!) USER MOD Single : B 9 LYS NZ :NH3+ -124:sc= 1.24 (180deg=-0.176) USER MOD Single : B 10 LYS NZ :NH3+ 162:sc= 0.184 (180deg=0.1) USER MOD Single : B 11 LYS NZ :NH3+ -161:sc= -0.0875 (180deg=-0.498) USER MOD Single : B 12 THR OG1 : rot 157:sc= 0.608 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= -0.309 X(o=-0.31,f=-0.17) USER MOD Single : B 23 THR OG1 : rot -71:sc= -1.44 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 59:sc= 1.22 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 MET CE :methyl -151:sc= -4.97! (180deg=-5.66!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0171 USER MOD Single : B 45 MET CE :methyl 138:sc= -2.13! (180deg=-4.76!) USER MOD Single : B 50 ASN : amide:sc= -0.211 X(o=-0.21,f=-0.4) USER MOD Single : B 51 LYS NZ :NH3+ 141:sc= -4.33! (180deg=-8.67!) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 59 LYS NZ :NH3+ -165:sc=-0.00915 (180deg=-0.119) USER MOD Single : B 66 SER OG : rot 102:sc= 1.16 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 5.798 22.705 -23.463 1.00 0.00 N ATOM 2 CA MET A 1 5.962 21.559 -22.529 1.00 0.00 C ATOM 3 C MET A 1 5.119 20.366 -22.966 1.00 0.00 C ATOM 4 O MET A 1 3.917 20.495 -23.200 1.00 0.00 O ATOM 5 CB MET A 1 5.551 22.011 -21.125 1.00 0.00 C ATOM 6 CG MET A 1 5.578 20.895 -20.090 1.00 0.00 C ATOM 7 SD MET A 1 6.457 21.360 -18.585 1.00 0.00 S ATOM 8 CE MET A 1 8.110 20.787 -18.968 1.00 0.00 C ATOM 0 H1 MET A 1 6.383 23.502 -23.141 1.00 0.00 H new ATOM 0 H2 MET A 1 6.097 22.420 -24.418 1.00 0.00 H new ATOM 0 H3 MET A 1 4.800 22.995 -23.485 1.00 0.00 H new ATOM 0 HA MET A 1 7.005 21.242 -22.532 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.217 22.811 -20.801 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.546 22.431 -21.168 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.555 20.616 -19.837 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.051 20.014 -20.524 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.773 21.004 -18.131 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.090 19.712 -19.147 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.474 21.296 -19.860 1.00 0.00 H new ATOM 20 N VAL A 2 5.757 19.205 -23.068 1.00 0.00 N ATOM 21 CA VAL A 2 5.063 17.988 -23.470 1.00 0.00 C ATOM 22 C VAL A 2 4.698 17.144 -22.255 1.00 0.00 C ATOM 23 O VAL A 2 4.590 15.920 -22.345 1.00 0.00 O ATOM 24 CB VAL A 2 5.920 17.143 -24.433 1.00 0.00 C ATOM 25 CG1 VAL A 2 5.094 16.018 -25.040 1.00 0.00 C ATOM 26 CG2 VAL A 2 6.524 18.020 -25.521 1.00 0.00 C ATOM 0 H VAL A 2 6.752 19.082 -22.878 1.00 0.00 H new ATOM 0 HA VAL A 2 4.153 18.295 -23.985 1.00 0.00 H new ATOM 0 HB VAL A 2 6.736 16.696 -23.865 1.00 0.00 H new ATOM 0 HG11 VAL A 2 5.717 15.433 -25.717 1.00 0.00 H new ATOM 0 HG12 VAL A 2 4.717 15.374 -24.246 1.00 0.00 H new ATOM 0 HG13 VAL A 2 4.255 16.440 -25.593 1.00 0.00 H new ATOM 0 HG21 VAL A 2 7.126 17.406 -26.191 1.00 0.00 H new ATOM 0 HG22 VAL A 2 5.725 18.499 -26.087 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.154 18.784 -25.065 1.00 0.00 H new ATOM 36 N GLU A 3 4.506 17.807 -21.117 1.00 0.00 N ATOM 37 CA GLU A 3 4.152 17.121 -19.880 1.00 0.00 C ATOM 38 C GLU A 3 2.867 16.317 -20.054 1.00 0.00 C ATOM 39 O GLU A 3 2.239 16.354 -21.112 1.00 0.00 O ATOM 40 CB GLU A 3 3.986 18.136 -18.744 1.00 0.00 C ATOM 41 CG GLU A 3 4.202 17.550 -17.359 1.00 0.00 C ATOM 42 CD GLU A 3 4.747 18.566 -16.374 1.00 0.00 C ATOM 43 OE1 GLU A 3 3.936 19.269 -15.736 1.00 0.00 O ATOM 44 OE2 GLU A 3 5.985 18.659 -16.242 1.00 0.00 O ATOM 0 H GLU A 3 4.590 18.820 -21.027 1.00 0.00 H new ATOM 0 HA GLU A 3 4.958 16.431 -19.628 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.690 18.954 -18.895 1.00 0.00 H new ATOM 0 HB3 GLU A 3 2.985 18.563 -18.795 1.00 0.00 H new ATOM 0 HG2 GLU A 3 3.257 17.156 -16.984 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.893 16.710 -17.428 1.00 0.00 H new ATOM 51 N SER A 4 2.484 15.592 -19.009 1.00 0.00 N ATOM 52 CA SER A 4 1.274 14.774 -19.038 1.00 0.00 C ATOM 53 C SER A 4 1.453 13.558 -19.943 1.00 0.00 C ATOM 54 O SER A 4 1.387 12.417 -19.486 1.00 0.00 O ATOM 55 CB SER A 4 0.077 15.604 -19.510 1.00 0.00 C ATOM 56 OG SER A 4 -1.093 15.269 -18.784 1.00 0.00 O ATOM 0 H SER A 4 2.995 15.553 -18.127 1.00 0.00 H new ATOM 0 HA SER A 4 1.085 14.423 -18.024 1.00 0.00 H new ATOM 0 HB2 SER A 4 0.294 16.665 -19.386 1.00 0.00 H new ATOM 0 HB3 SER A 4 -0.090 15.435 -20.574 1.00 0.00 H new ATOM 0 HG SER A 4 -1.843 15.814 -19.103 1.00 0.00 H new ATOM 62 N LYS A 5 1.675 13.809 -21.229 1.00 0.00 N ATOM 63 CA LYS A 5 1.858 12.736 -22.199 1.00 0.00 C ATOM 64 C LYS A 5 3.049 11.855 -21.833 1.00 0.00 C ATOM 65 O LYS A 5 2.898 10.655 -21.603 1.00 0.00 O ATOM 66 CB LYS A 5 2.054 13.317 -23.601 1.00 0.00 C ATOM 67 CG LYS A 5 1.326 12.542 -24.687 1.00 0.00 C ATOM 68 CD LYS A 5 2.235 11.519 -25.348 1.00 0.00 C ATOM 69 CE LYS A 5 2.009 11.458 -26.850 1.00 0.00 C ATOM 70 NZ LYS A 5 0.607 11.086 -27.188 1.00 0.00 N ATOM 0 H LYS A 5 1.733 14.748 -21.624 1.00 0.00 H new ATOM 0 HA LYS A 5 0.960 12.119 -22.186 1.00 0.00 H new ATOM 0 HB2 LYS A 5 1.707 14.350 -23.609 1.00 0.00 H new ATOM 0 HB3 LYS A 5 3.119 13.336 -23.832 1.00 0.00 H new ATOM 0 HG2 LYS A 5 0.461 12.037 -24.257 1.00 0.00 H new ATOM 0 HG3 LYS A 5 0.949 13.235 -25.439 1.00 0.00 H new ATOM 0 HD2 LYS A 5 3.276 11.772 -25.146 1.00 0.00 H new ATOM 0 HD3 LYS A 5 2.055 10.536 -24.912 1.00 0.00 H new ATOM 0 HE2 LYS A 5 2.244 12.426 -27.292 1.00 0.00 H new ATOM 0 HE3 LYS A 5 2.693 10.733 -27.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.521 10.956 -28.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 0.357 10.200 -26.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.037 11.842 -26.879 1.00 0.00 H new ATOM 84 N LYS A 6 4.235 12.454 -21.787 1.00 0.00 N ATOM 85 CA LYS A 6 5.450 11.717 -21.455 1.00 0.00 C ATOM 86 C LYS A 6 5.839 11.917 -19.993 1.00 0.00 C ATOM 87 O LYS A 6 6.195 10.963 -19.302 1.00 0.00 O ATOM 88 CB LYS A 6 6.603 12.147 -22.366 1.00 0.00 C ATOM 89 CG LYS A 6 6.706 13.653 -22.558 1.00 0.00 C ATOM 90 CD LYS A 6 7.944 14.028 -23.358 1.00 0.00 C ATOM 91 CE LYS A 6 8.553 15.333 -22.867 1.00 0.00 C ATOM 92 NZ LYS A 6 9.873 15.117 -22.212 1.00 0.00 N ATOM 0 H LYS A 6 4.381 13.446 -21.975 1.00 0.00 H new ATOM 0 HA LYS A 6 5.247 10.658 -21.612 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.540 11.779 -21.949 1.00 0.00 H new ATOM 0 HB3 LYS A 6 6.480 11.674 -23.340 1.00 0.00 H new ATOM 0 HG2 LYS A 6 5.816 14.018 -23.071 1.00 0.00 H new ATOM 0 HG3 LYS A 6 6.737 14.144 -21.585 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.682 13.230 -23.282 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.682 14.122 -24.412 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.672 16.017 -23.707 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.871 15.809 -22.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 10.301 16.037 -21.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.741 14.569 -21.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 10.499 14.595 -22.857 1.00 0.00 H new ATOM 106 N ILE A 7 5.773 13.159 -19.529 1.00 0.00 N ATOM 107 CA ILE A 7 6.123 13.475 -18.149 1.00 0.00 C ATOM 108 C ILE A 7 4.879 13.553 -17.271 1.00 0.00 C ATOM 109 O ILE A 7 4.244 14.603 -17.167 1.00 0.00 O ATOM 110 CB ILE A 7 6.894 14.804 -18.054 1.00 0.00 C ATOM 111 CG1 ILE A 7 8.094 14.792 -19.002 1.00 0.00 C ATOM 112 CG2 ILE A 7 7.346 15.059 -16.623 1.00 0.00 C ATOM 113 CD1 ILE A 7 8.584 16.174 -19.375 1.00 0.00 C ATOM 0 H ILE A 7 5.481 13.962 -20.086 1.00 0.00 H new ATOM 0 HA ILE A 7 6.764 12.669 -17.792 1.00 0.00 H new ATOM 0 HB ILE A 7 6.226 15.613 -18.351 1.00 0.00 H new ATOM 0 HG12 ILE A 7 8.910 14.240 -18.535 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.824 14.254 -19.910 1.00 0.00 H new ATOM 0 HG21 ILE A 7 7.889 16.003 -16.576 1.00 0.00 H new ATOM 0 HG22 ILE A 7 6.475 15.109 -15.970 1.00 0.00 H new ATOM 0 HG23 ILE A 7 7.998 14.248 -16.297 1.00 0.00 H new ATOM 0 HD11 ILE A 7 9.436 16.088 -20.049 1.00 0.00 H new ATOM 0 HD12 ILE A 7 7.783 16.723 -19.871 1.00 0.00 H new ATOM 0 HD13 ILE A 7 8.886 16.708 -18.474 1.00 0.00 H new ATOM 125 N ALA A 8 4.536 12.434 -16.640 1.00 0.00 N ATOM 126 CA ALA A 8 3.369 12.371 -15.768 1.00 0.00 C ATOM 127 C ALA A 8 3.220 10.985 -15.154 1.00 0.00 C ATOM 128 O ALA A 8 4.092 10.129 -15.302 1.00 0.00 O ATOM 129 CB ALA A 8 2.110 12.743 -16.540 1.00 0.00 C ATOM 0 H ALA A 8 5.051 11.557 -16.717 1.00 0.00 H new ATOM 0 HA ALA A 8 3.512 13.088 -14.960 1.00 0.00 H new ATOM 0 HB1 ALA A 8 1.247 12.691 -15.876 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.208 13.756 -16.929 1.00 0.00 H new ATOM 0 HB3 ALA A 8 1.972 12.048 -17.368 1.00 0.00 H new ATOM 135 N LYS A 9 2.102 10.769 -14.472 1.00 0.00 N ATOM 136 CA LYS A 9 1.818 9.488 -13.839 1.00 0.00 C ATOM 137 C LYS A 9 1.431 8.467 -14.906 1.00 0.00 C ATOM 138 O LYS A 9 0.943 8.845 -15.972 1.00 0.00 O ATOM 139 CB LYS A 9 0.699 9.671 -12.802 1.00 0.00 C ATOM 140 CG LYS A 9 -0.510 8.776 -13.013 1.00 0.00 C ATOM 141 CD LYS A 9 -1.382 9.284 -14.150 1.00 0.00 C ATOM 142 CE LYS A 9 -2.080 8.146 -14.875 1.00 0.00 C ATOM 143 NZ LYS A 9 -1.525 7.927 -16.239 1.00 0.00 N ATOM 0 H LYS A 9 1.373 11.470 -14.343 1.00 0.00 H new ATOM 0 HA LYS A 9 2.704 9.117 -13.323 1.00 0.00 H new ATOM 0 HB2 LYS A 9 1.107 9.481 -11.809 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.372 10.711 -12.819 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.180 7.760 -13.231 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.096 8.730 -12.095 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.127 9.976 -13.756 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -0.769 9.844 -14.856 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -1.980 7.230 -14.292 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -3.146 8.363 -14.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -2.238 8.189 -16.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -0.676 8.515 -16.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -1.273 6.925 -16.354 1.00 0.00 H new ATOM 157 N LYS A 10 1.651 7.176 -14.642 1.00 0.00 N ATOM 158 CA LYS A 10 1.308 6.163 -15.635 1.00 0.00 C ATOM 159 C LYS A 10 0.672 4.936 -14.991 1.00 0.00 C ATOM 160 O LYS A 10 1.107 4.481 -13.937 1.00 0.00 O ATOM 161 CB LYS A 10 2.540 5.789 -16.458 1.00 0.00 C ATOM 162 CG LYS A 10 3.472 4.799 -15.794 1.00 0.00 C ATOM 163 CD LYS A 10 4.907 5.081 -16.188 1.00 0.00 C ATOM 164 CE LYS A 10 5.651 3.809 -16.564 1.00 0.00 C ATOM 165 NZ LYS A 10 6.387 3.954 -17.852 1.00 0.00 N ATOM 0 H LYS A 10 2.053 6.818 -13.776 1.00 0.00 H new ATOM 0 HA LYS A 10 0.563 6.587 -16.308 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.211 5.374 -17.410 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.099 6.698 -16.683 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.367 4.860 -14.711 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.201 3.784 -16.084 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.923 5.774 -17.030 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.421 5.572 -15.361 1.00 0.00 H new ATOM 0 HE2 LYS A 10 6.354 3.552 -15.771 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.943 2.984 -16.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.880 3.065 -18.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.714 4.174 -18.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.081 4.724 -17.770 1.00 0.00 H new ATOM 179 N LYS A 11 -0.364 4.399 -15.629 1.00 0.00 N ATOM 180 CA LYS A 11 -1.048 3.228 -15.097 1.00 0.00 C ATOM 181 C LYS A 11 -0.091 2.054 -15.030 1.00 0.00 C ATOM 182 O LYS A 11 0.286 1.484 -16.054 1.00 0.00 O ATOM 183 CB LYS A 11 -2.257 2.867 -15.961 1.00 0.00 C ATOM 184 CG LYS A 11 -3.464 3.759 -15.725 1.00 0.00 C ATOM 185 CD LYS A 11 -3.167 5.208 -16.076 1.00 0.00 C ATOM 186 CE LYS A 11 -4.438 6.040 -16.129 1.00 0.00 C ATOM 187 NZ LYS A 11 -4.743 6.502 -17.512 1.00 0.00 N ATOM 0 H LYS A 11 -0.744 4.753 -16.507 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.400 3.462 -14.092 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.972 2.926 -17.012 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.537 1.832 -15.764 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.302 3.404 -16.324 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.768 3.692 -14.680 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -2.485 5.630 -15.338 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.661 5.254 -17.040 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.273 5.451 -15.751 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -4.334 6.904 -15.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.617 7.066 -17.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -3.957 7.085 -17.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.868 5.678 -18.134 1.00 0.00 H new ATOM 201 N THR A 12 0.312 1.702 -13.816 1.00 0.00 N ATOM 202 CA THR A 12 1.239 0.603 -13.620 1.00 0.00 C ATOM 203 C THR A 12 0.606 -0.520 -12.811 1.00 0.00 C ATOM 204 O THR A 12 -0.231 -0.277 -11.943 1.00 0.00 O ATOM 205 CB THR A 12 2.509 1.095 -12.931 1.00 0.00 C ATOM 206 OG1 THR A 12 3.047 2.209 -13.617 1.00 0.00 O ATOM 207 CG2 THR A 12 3.591 0.041 -12.845 1.00 0.00 C ATOM 0 H THR A 12 0.011 2.162 -12.957 1.00 0.00 H new ATOM 0 HA THR A 12 1.497 0.207 -14.602 1.00 0.00 H new ATOM 0 HB THR A 12 2.206 1.361 -11.919 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.999 2.057 -13.792 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.465 0.457 -12.344 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.222 -0.814 -12.279 1.00 0.00 H new ATOM 0 HG23 THR A 12 3.867 -0.280 -13.849 1.00 0.00 H new ATOM 215 N THR A 13 1.008 -1.753 -13.101 1.00 0.00 N ATOM 216 CA THR A 13 0.472 -2.908 -12.397 1.00 0.00 C ATOM 217 C THR A 13 1.445 -3.437 -11.357 1.00 0.00 C ATOM 218 O THR A 13 2.652 -3.502 -11.587 1.00 0.00 O ATOM 219 CB THR A 13 0.130 -4.036 -13.365 1.00 0.00 C ATOM 220 OG1 THR A 13 -0.163 -3.530 -14.656 1.00 0.00 O ATOM 221 CG2 THR A 13 -1.049 -4.866 -12.912 1.00 0.00 C ATOM 0 H THR A 13 1.700 -1.976 -13.816 1.00 0.00 H new ATOM 0 HA THR A 13 -0.434 -2.568 -11.896 1.00 0.00 H new ATOM 0 HB THR A 13 1.015 -4.671 -13.392 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.377 -4.273 -15.258 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.243 -5.652 -13.642 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.827 -5.316 -11.945 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.929 -4.229 -12.822 1.00 0.00 H new ATOM 229 N LEU A 14 0.892 -3.849 -10.231 1.00 0.00 N ATOM 230 CA LEU A 14 1.670 -4.420 -9.149 1.00 0.00 C ATOM 231 C LEU A 14 0.966 -5.668 -8.652 1.00 0.00 C ATOM 232 O LEU A 14 -0.248 -5.655 -8.447 1.00 0.00 O ATOM 233 CB LEU A 14 1.848 -3.414 -8.011 1.00 0.00 C ATOM 234 CG LEU A 14 2.183 -1.986 -8.452 1.00 0.00 C ATOM 235 CD1 LEU A 14 2.500 -1.119 -7.245 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.350 -1.989 -9.430 1.00 0.00 C ATOM 0 H LEU A 14 -0.109 -3.797 -10.042 1.00 0.00 H new ATOM 0 HA LEU A 14 2.664 -4.677 -9.515 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.931 -3.390 -7.422 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.641 -3.770 -7.353 1.00 0.00 H new ATOM 0 HG LEU A 14 1.313 -1.568 -8.958 1.00 0.00 H new ATOM 0 HD11 LEU A 14 2.736 -0.107 -7.576 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.637 -1.091 -6.580 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.355 -1.535 -6.712 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.574 -0.966 -9.732 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.226 -2.425 -8.950 1.00 0.00 H new ATOM 0 HD23 LEU A 14 3.087 -2.578 -10.309 1.00 0.00 H new ATOM 248 N ALA A 15 1.705 -6.756 -8.486 1.00 0.00 N ATOM 249 CA ALA A 15 1.087 -7.991 -8.045 1.00 0.00 C ATOM 250 C ALA A 15 1.017 -8.077 -6.534 1.00 0.00 C ATOM 251 O ALA A 15 1.945 -8.540 -5.877 1.00 0.00 O ATOM 252 CB ALA A 15 1.828 -9.189 -8.617 1.00 0.00 C ATOM 0 H ALA A 15 2.711 -6.807 -8.647 1.00 0.00 H new ATOM 0 HA ALA A 15 0.063 -7.999 -8.419 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.351 -10.108 -8.276 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.800 -9.148 -9.706 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.864 -9.171 -8.279 1.00 0.00 H new ATOM 258 N PHE A 16 -0.125 -7.654 -6.006 1.00 0.00 N ATOM 259 CA PHE A 16 -0.386 -7.704 -4.584 1.00 0.00 C ATOM 260 C PHE A 16 -1.863 -7.585 -4.292 1.00 0.00 C ATOM 261 O PHE A 16 -2.671 -7.338 -5.180 1.00 0.00 O ATOM 262 CB PHE A 16 0.367 -6.633 -3.809 1.00 0.00 C ATOM 263 CG PHE A 16 0.173 -5.219 -4.306 1.00 0.00 C ATOM 264 CD1 PHE A 16 0.901 -4.182 -3.746 1.00 0.00 C ATOM 265 CD2 PHE A 16 -0.730 -4.921 -5.319 1.00 0.00 C ATOM 266 CE1 PHE A 16 0.737 -2.881 -4.181 1.00 0.00 C ATOM 267 CE2 PHE A 16 -0.895 -3.621 -5.757 1.00 0.00 C ATOM 268 CZ PHE A 16 -0.161 -2.601 -5.187 1.00 0.00 C ATOM 0 H PHE A 16 -0.892 -7.268 -6.556 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.026 -8.677 -4.250 1.00 0.00 H new ATOM 0 HB2 PHE A 16 0.058 -6.679 -2.765 1.00 0.00 H new ATOM 0 HB3 PHE A 16 1.431 -6.868 -3.837 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.608 -4.394 -2.957 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -1.309 -5.714 -5.769 1.00 0.00 H new ATOM 0 HE1 PHE A 16 1.312 -2.084 -3.733 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.599 -3.403 -6.546 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.290 -1.585 -5.529 1.00 0.00 H new ATOM 278 N ASP A 17 -2.190 -7.738 -3.027 1.00 0.00 N ATOM 279 CA ASP A 17 -3.552 -7.627 -2.545 1.00 0.00 C ATOM 280 C ASP A 17 -3.697 -8.412 -1.277 1.00 0.00 C ATOM 281 O ASP A 17 -4.375 -7.995 -0.345 1.00 0.00 O ATOM 282 CB ASP A 17 -4.577 -8.112 -3.560 1.00 0.00 C ATOM 283 CG ASP A 17 -5.184 -6.975 -4.362 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.289 -7.160 -4.914 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.555 -5.899 -4.435 1.00 0.00 O ATOM 0 H ASP A 17 -1.511 -7.945 -2.295 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.747 -6.569 -2.369 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.103 -8.820 -4.240 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.370 -8.651 -3.042 1.00 0.00 H new ATOM 290 N GLU A 18 -3.045 -9.552 -1.228 1.00 0.00 N ATOM 291 CA GLU A 18 -3.120 -10.364 -0.040 1.00 0.00 C ATOM 292 C GLU A 18 -2.865 -9.493 1.188 1.00 0.00 C ATOM 293 O GLU A 18 -3.752 -9.285 2.026 1.00 0.00 O ATOM 294 CB GLU A 18 -2.106 -11.506 -0.096 1.00 0.00 C ATOM 295 CG GLU A 18 -2.609 -12.795 0.532 1.00 0.00 C ATOM 296 CD GLU A 18 -2.035 -13.031 1.916 1.00 0.00 C ATOM 297 OE1 GLU A 18 -2.271 -12.189 2.808 1.00 0.00 O ATOM 298 OE2 GLU A 18 -1.351 -14.058 2.107 1.00 0.00 O ATOM 0 H GLU A 18 -2.469 -9.930 -1.980 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.117 -10.801 0.024 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.843 -11.697 -1.136 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.193 -11.196 0.412 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.697 -12.765 0.594 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.350 -13.635 -0.113 1.00 0.00 H new ATOM 305 N ASP A 19 -1.655 -8.951 1.264 1.00 0.00 N ATOM 306 CA ASP A 19 -1.281 -8.090 2.376 1.00 0.00 C ATOM 307 C ASP A 19 -1.704 -6.652 2.133 1.00 0.00 C ATOM 308 O ASP A 19 -2.256 -6.009 3.022 1.00 0.00 O ATOM 309 CB ASP A 19 0.227 -8.161 2.622 1.00 0.00 C ATOM 310 CG ASP A 19 0.575 -8.129 4.097 1.00 0.00 C ATOM 311 OD1 ASP A 19 -0.209 -7.553 4.880 1.00 0.00 O ATOM 312 OD2 ASP A 19 1.632 -8.682 4.470 1.00 0.00 O ATOM 0 H ASP A 19 -0.920 -9.093 0.571 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.804 -8.449 3.262 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.622 -9.075 2.178 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.714 -7.326 2.119 1.00 0.00 H new ATOM 317 N VAL A 20 -1.447 -6.139 0.936 1.00 0.00 N ATOM 318 CA VAL A 20 -1.820 -4.770 0.632 1.00 0.00 C ATOM 319 C VAL A 20 -3.334 -4.597 0.683 1.00 0.00 C ATOM 320 O VAL A 20 -3.822 -3.653 1.284 1.00 0.00 O ATOM 321 CB VAL A 20 -1.274 -4.294 -0.729 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.218 -4.565 -0.824 1.00 0.00 C ATOM 323 CG2 VAL A 20 -2.011 -4.953 -1.879 1.00 0.00 C ATOM 0 H VAL A 20 -0.990 -6.642 0.175 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.362 -4.145 1.399 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.439 -3.219 -0.801 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.589 -4.224 -1.790 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.736 -4.031 -0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.401 -5.635 -0.723 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.603 -4.597 -2.825 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.891 -6.035 -1.816 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.070 -4.702 -1.824 1.00 0.00 H new ATOM 333 N TYR A 21 -4.084 -5.514 0.073 1.00 0.00 N ATOM 334 CA TYR A 21 -5.541 -5.408 0.099 1.00 0.00 C ATOM 335 C TYR A 21 -6.054 -5.526 1.527 1.00 0.00 C ATOM 336 O TYR A 21 -6.927 -4.760 1.936 1.00 0.00 O ATOM 337 CB TYR A 21 -6.217 -6.454 -0.798 1.00 0.00 C ATOM 338 CG TYR A 21 -7.557 -6.008 -1.338 1.00 0.00 C ATOM 339 CD1 TYR A 21 -8.742 -6.470 -0.777 1.00 0.00 C ATOM 340 CD2 TYR A 21 -7.637 -5.126 -2.408 1.00 0.00 C ATOM 341 CE1 TYR A 21 -9.968 -6.064 -1.267 1.00 0.00 C ATOM 342 CE2 TYR A 21 -8.861 -4.714 -2.903 1.00 0.00 C ATOM 343 CZ TYR A 21 -10.023 -5.187 -2.330 1.00 0.00 C ATOM 344 OH TYR A 21 -11.242 -4.780 -2.820 1.00 0.00 O ATOM 0 H TYR A 21 -3.718 -6.320 -0.434 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.800 -4.426 -0.298 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.556 -6.686 -1.633 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.351 -7.375 -0.231 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.703 -7.157 0.055 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -6.729 -4.756 -2.861 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -10.880 -6.432 -0.820 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -8.907 -4.026 -3.734 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.104 -4.162 -3.568 1.00 0.00 H new ATOM 354 N HIS A 22 -5.511 -6.470 2.305 1.00 0.00 N ATOM 355 CA HIS A 22 -5.951 -6.618 3.685 1.00 0.00 C ATOM 356 C HIS A 22 -5.463 -5.442 4.523 1.00 0.00 C ATOM 357 O HIS A 22 -6.209 -4.907 5.340 1.00 0.00 O ATOM 358 CB HIS A 22 -5.458 -7.938 4.276 1.00 0.00 C ATOM 359 CG HIS A 22 -5.949 -8.193 5.667 1.00 0.00 C ATOM 360 ND1 HIS A 22 -6.981 -9.063 5.954 1.00 0.00 N ATOM 361 CD2 HIS A 22 -5.545 -7.687 6.856 1.00 0.00 C ATOM 362 CE1 HIS A 22 -7.189 -9.079 7.259 1.00 0.00 C ATOM 363 NE2 HIS A 22 -6.331 -8.254 7.829 1.00 0.00 N ATOM 0 H HIS A 22 -4.786 -7.123 2.008 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.041 -6.629 3.698 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -5.777 -8.757 3.631 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -4.368 -7.941 4.278 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -4.752 -6.970 7.011 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -7.935 -9.668 7.772 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -6.263 -8.068 8.830 1.00 0.00 H new ATOM 372 N THR A 23 -4.220 -5.025 4.305 1.00 0.00 N ATOM 373 CA THR A 23 -3.678 -3.890 5.040 1.00 0.00 C ATOM 374 C THR A 23 -4.372 -2.612 4.594 1.00 0.00 C ATOM 375 O THR A 23 -4.726 -1.764 5.412 1.00 0.00 O ATOM 376 CB THR A 23 -2.175 -3.757 4.837 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.864 -3.599 3.464 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.386 -4.938 5.360 1.00 0.00 C ATOM 0 H THR A 23 -3.578 -5.449 3.635 1.00 0.00 H new ATOM 0 HA THR A 23 -3.859 -4.059 6.101 1.00 0.00 H new ATOM 0 HB THR A 23 -1.888 -2.875 5.409 1.00 0.00 H new ATOM 0 HG1 THR A 23 -1.524 -4.445 3.106 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.323 -4.774 5.181 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.561 -5.047 6.430 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.704 -5.845 4.846 1.00 0.00 H new ATOM 386 N LEU A 24 -4.590 -2.490 3.286 1.00 0.00 N ATOM 387 CA LEU A 24 -5.272 -1.327 2.738 1.00 0.00 C ATOM 388 C LEU A 24 -6.645 -1.185 3.380 1.00 0.00 C ATOM 389 O LEU A 24 -7.257 -0.121 3.332 1.00 0.00 O ATOM 390 CB LEU A 24 -5.416 -1.432 1.216 1.00 0.00 C ATOM 391 CG LEU A 24 -4.362 -0.662 0.412 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.277 0.777 0.888 1.00 0.00 C ATOM 393 CD2 LEU A 24 -3.002 -1.332 0.520 1.00 0.00 C ATOM 0 H LEU A 24 -4.305 -3.180 2.592 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.671 -0.445 2.960 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.370 -2.484 0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.404 -1.069 0.933 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.665 -0.668 -0.635 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.524 1.309 0.306 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.245 1.261 0.758 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.001 0.796 1.942 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.271 -0.767 -0.059 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.693 -1.362 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.065 -2.348 0.131 1.00 0.00 H new ATOM 405 N LYS A 25 -7.128 -2.274 3.975 1.00 0.00 N ATOM 406 CA LYS A 25 -8.429 -2.275 4.613 1.00 0.00 C ATOM 407 C LYS A 25 -8.468 -1.356 5.829 1.00 0.00 C ATOM 408 O LYS A 25 -9.401 -0.568 5.979 1.00 0.00 O ATOM 409 CB LYS A 25 -8.833 -3.694 5.015 1.00 0.00 C ATOM 410 CG LYS A 25 -10.236 -3.788 5.595 1.00 0.00 C ATOM 411 CD LYS A 25 -11.295 -3.441 4.562 1.00 0.00 C ATOM 412 CE LYS A 25 -12.472 -2.717 5.197 1.00 0.00 C ATOM 413 NZ LYS A 25 -13.383 -3.656 5.907 1.00 0.00 N ATOM 0 H LYS A 25 -6.632 -3.164 4.025 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.144 -1.893 3.884 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.766 -4.343 4.142 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.120 -4.072 5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.409 -4.797 5.968 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.324 -3.114 6.447 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.856 -2.815 3.785 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.645 -4.352 4.077 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.103 -1.969 5.899 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.029 -2.184 4.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.172 -3.124 6.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.756 -4.355 5.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.858 -4.147 6.659 1.00 0.00 H new ATOM 427 N LEU A 26 -7.461 -1.444 6.696 1.00 0.00 N ATOM 428 CA LEU A 26 -7.438 -0.586 7.876 1.00 0.00 C ATOM 429 C LEU A 26 -7.109 0.835 7.465 1.00 0.00 C ATOM 430 O LEU A 26 -7.770 1.781 7.879 1.00 0.00 O ATOM 431 CB LEU A 26 -6.443 -1.071 8.933 1.00 0.00 C ATOM 432 CG LEU A 26 -6.095 -2.552 8.878 1.00 0.00 C ATOM 433 CD1 LEU A 26 -4.954 -2.765 7.909 1.00 0.00 C ATOM 434 CD2 LEU A 26 -5.736 -3.071 10.263 1.00 0.00 C ATOM 0 H LEU A 26 -6.671 -2.083 6.608 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.429 -0.624 8.329 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.523 -0.496 8.831 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.850 -0.848 9.919 1.00 0.00 H new ATOM 0 HG LEU A 26 -6.963 -3.112 8.530 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.704 -3.825 7.869 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.251 -2.424 6.917 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.084 -2.199 8.242 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.491 -4.131 10.202 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.876 -2.521 10.646 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.584 -2.933 10.934 1.00 0.00 H new ATOM 446 N VAL A 27 -6.090 0.970 6.630 1.00 0.00 N ATOM 447 CA VAL A 27 -5.676 2.279 6.139 1.00 0.00 C ATOM 448 C VAL A 27 -6.785 2.938 5.349 1.00 0.00 C ATOM 449 O VAL A 27 -7.026 4.133 5.486 1.00 0.00 O ATOM 450 CB VAL A 27 -4.428 2.210 5.243 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.183 2.635 5.998 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.253 0.836 4.681 1.00 0.00 C ATOM 0 H VAL A 27 -5.534 0.191 6.277 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.438 2.865 7.027 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.576 2.906 4.418 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.318 2.575 5.337 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.302 3.660 6.348 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.033 1.975 6.853 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.364 0.811 4.051 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.140 0.121 5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.127 0.572 4.086 1.00 0.00 H new ATOM 462 N SER A 28 -7.455 2.171 4.503 1.00 0.00 N ATOM 463 CA SER A 28 -8.516 2.744 3.699 1.00 0.00 C ATOM 464 C SER A 28 -9.663 3.232 4.573 1.00 0.00 C ATOM 465 O SER A 28 -10.269 4.268 4.294 1.00 0.00 O ATOM 466 CB SER A 28 -9.025 1.744 2.660 1.00 0.00 C ATOM 467 OG SER A 28 -10.071 2.303 1.884 1.00 0.00 O ATOM 0 H SER A 28 -7.287 1.175 4.359 1.00 0.00 H new ATOM 0 HA SER A 28 -8.099 3.601 3.170 1.00 0.00 H new ATOM 0 HB2 SER A 28 -8.205 1.443 2.008 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.381 0.844 3.161 1.00 0.00 H new ATOM 0 HG SER A 28 -9.738 3.091 1.406 1.00 0.00 H new ATOM 473 N VAL A 29 -9.948 2.487 5.636 1.00 0.00 N ATOM 474 CA VAL A 29 -11.014 2.842 6.555 1.00 0.00 C ATOM 475 C VAL A 29 -10.544 3.928 7.516 1.00 0.00 C ATOM 476 O VAL A 29 -11.237 4.920 7.745 1.00 0.00 O ATOM 477 CB VAL A 29 -11.479 1.592 7.340 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.210 1.718 8.832 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.952 1.311 7.079 1.00 0.00 C ATOM 0 H VAL A 29 -9.451 1.630 5.880 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.857 3.228 5.982 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.892 0.747 6.979 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.553 0.817 9.341 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.140 1.844 8.999 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.744 2.583 9.226 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.259 0.428 7.640 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.547 2.167 7.395 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -13.106 1.136 6.014 1.00 0.00 H new ATOM 489 N TYR A 30 -9.361 3.721 8.076 1.00 0.00 N ATOM 490 CA TYR A 30 -8.785 4.669 9.019 1.00 0.00 C ATOM 491 C TYR A 30 -8.316 5.936 8.314 1.00 0.00 C ATOM 492 O TYR A 30 -8.244 7.000 8.929 1.00 0.00 O ATOM 493 CB TYR A 30 -7.615 4.039 9.779 1.00 0.00 C ATOM 494 CG TYR A 30 -8.032 3.280 11.019 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.147 3.925 12.244 1.00 0.00 C ATOM 496 CD2 TYR A 30 -8.308 1.919 10.966 1.00 0.00 C ATOM 497 CE1 TYR A 30 -8.525 3.236 13.381 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.687 1.223 12.098 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.795 1.886 13.302 1.00 0.00 C ATOM 500 OH TYR A 30 -9.172 1.196 14.432 1.00 0.00 O ATOM 0 H TYR A 30 -8.780 2.903 7.893 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.567 4.937 9.729 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -7.083 3.362 9.111 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.914 4.823 10.063 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -7.938 4.982 12.309 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -8.225 1.397 10.024 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -8.608 3.752 14.326 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -8.897 0.165 12.040 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.326 0.255 14.205 1.00 0.00 H new ATOM 510 N LEU A 31 -7.996 5.832 7.023 1.00 0.00 N ATOM 511 CA LEU A 31 -7.541 6.994 6.275 1.00 0.00 C ATOM 512 C LEU A 31 -8.600 7.439 5.271 1.00 0.00 C ATOM 513 O LEU A 31 -8.404 8.414 4.546 1.00 0.00 O ATOM 514 CB LEU A 31 -6.223 6.700 5.536 1.00 0.00 C ATOM 515 CG LEU A 31 -5.133 5.936 6.316 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.764 6.525 6.018 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.386 5.943 7.818 1.00 0.00 C ATOM 0 H LEU A 31 -8.044 4.967 6.485 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.368 7.796 6.992 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.459 6.129 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.801 7.650 5.208 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.166 4.898 5.983 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -3.003 5.977 6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.559 6.447 4.950 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.746 7.574 6.315 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.592 5.393 8.323 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.402 6.971 8.180 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.345 5.470 8.028 1.00 0.00 H new ATOM 529 N ASN A 32 -9.721 6.714 5.218 1.00 0.00 N ATOM 530 CA ASN A 32 -10.795 7.039 4.287 1.00 0.00 C ATOM 531 C ASN A 32 -10.221 7.258 2.894 1.00 0.00 C ATOM 532 O ASN A 32 -10.679 8.119 2.143 1.00 0.00 O ATOM 533 CB ASN A 32 -11.546 8.288 4.751 1.00 0.00 C ATOM 534 CG ASN A 32 -12.208 8.096 6.101 1.00 0.00 C ATOM 535 OD1 ASN A 32 -12.858 7.080 6.349 1.00 0.00 O ATOM 536 ND2 ASN A 32 -12.046 9.074 6.985 1.00 0.00 N ATOM 0 H ASN A 32 -9.904 5.902 5.808 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.498 6.206 4.257 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -10.852 9.127 4.806 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -12.303 8.549 4.012 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -12.468 9.000 7.911 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -11.499 9.899 6.738 1.00 0.00 H new ATOM 543 N ARG A 33 -9.194 6.479 2.572 1.00 0.00 N ATOM 544 CA ARG A 33 -8.524 6.589 1.283 1.00 0.00 C ATOM 545 C ARG A 33 -8.534 5.264 0.533 1.00 0.00 C ATOM 546 O ARG A 33 -8.294 4.208 1.116 1.00 0.00 O ATOM 547 CB ARG A 33 -7.079 7.051 1.485 1.00 0.00 C ATOM 548 CG ARG A 33 -6.963 8.476 2.003 1.00 0.00 C ATOM 549 CD ARG A 33 -5.875 9.252 1.278 1.00 0.00 C ATOM 550 NE ARG A 33 -5.345 10.342 2.093 1.00 0.00 N ATOM 551 CZ ARG A 33 -6.026 11.448 2.386 1.00 0.00 C ATOM 552 NH1 ARG A 33 -7.261 11.617 1.932 1.00 0.00 N ATOM 553 NH2 ARG A 33 -5.469 12.390 3.137 1.00 0.00 N ATOM 0 H ARG A 33 -8.807 5.764 3.188 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.068 7.322 0.687 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.585 6.377 2.185 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.545 6.973 0.538 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.918 8.987 1.879 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.747 8.458 3.071 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -5.065 8.574 1.008 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -6.276 9.656 0.348 1.00 0.00 H new ATOM 0 HE ARG A 33 -4.397 10.251 2.459 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -7.695 10.897 1.354 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -7.777 12.467 2.161 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -4.520 12.266 3.489 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.990 13.238 3.362 1.00 0.00 H new ATOM 567 N ASP A 34 -8.792 5.326 -0.769 1.00 0.00 N ATOM 568 CA ASP A 34 -8.807 4.128 -1.598 1.00 0.00 C ATOM 569 C ASP A 34 -7.466 3.412 -1.489 1.00 0.00 C ATOM 570 O ASP A 34 -6.483 3.999 -1.035 1.00 0.00 O ATOM 571 CB ASP A 34 -9.097 4.487 -3.056 1.00 0.00 C ATOM 572 CG ASP A 34 -9.613 3.304 -3.852 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.623 2.701 -3.431 1.00 0.00 O ATOM 574 OD2 ASP A 34 -9.008 2.980 -4.895 1.00 0.00 O ATOM 0 H ASP A 34 -8.993 6.191 -1.271 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.597 3.466 -1.245 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.831 5.292 -3.090 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.187 4.866 -3.522 1.00 0.00 H new ATOM 579 N MET A 35 -7.420 2.151 -1.896 1.00 0.00 N ATOM 580 CA MET A 35 -6.191 1.391 -1.825 1.00 0.00 C ATOM 581 C MET A 35 -5.114 2.035 -2.696 1.00 0.00 C ATOM 582 O MET A 35 -3.958 2.145 -2.291 1.00 0.00 O ATOM 583 CB MET A 35 -6.447 -0.058 -2.250 1.00 0.00 C ATOM 584 CG MET A 35 -5.343 -0.641 -3.104 1.00 0.00 C ATOM 585 SD MET A 35 -5.449 -2.435 -3.263 1.00 0.00 S ATOM 586 CE MET A 35 -3.729 -2.853 -3.537 1.00 0.00 C ATOM 0 H MET A 35 -8.217 1.640 -2.276 1.00 0.00 H new ATOM 0 HA MET A 35 -5.833 1.390 -0.795 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.569 -0.673 -1.359 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.386 -0.106 -2.802 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.382 -0.191 -4.096 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.378 -0.376 -2.672 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.644 -3.916 -3.760 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.343 -2.274 -4.376 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.152 -2.623 -2.642 1.00 0.00 H new ATOM 596 N THR A 36 -5.506 2.458 -3.893 1.00 0.00 N ATOM 597 CA THR A 36 -4.575 3.091 -4.818 1.00 0.00 C ATOM 598 C THR A 36 -4.095 4.426 -4.263 1.00 0.00 C ATOM 599 O THR A 36 -2.959 4.835 -4.497 1.00 0.00 O ATOM 600 CB THR A 36 -5.237 3.293 -6.188 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.368 2.454 -6.326 1.00 0.00 O ATOM 602 CG2 THR A 36 -4.318 3.020 -7.362 1.00 0.00 C ATOM 0 H THR A 36 -6.460 2.374 -4.244 1.00 0.00 H new ATOM 0 HA THR A 36 -3.712 2.436 -4.940 1.00 0.00 H new ATOM 0 HB THR A 36 -5.515 4.347 -6.212 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.777 2.598 -7.205 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.859 3.185 -8.294 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.461 3.692 -7.317 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.972 1.987 -7.321 1.00 0.00 H new ATOM 610 N GLU A 37 -4.964 5.099 -3.518 1.00 0.00 N ATOM 611 CA GLU A 37 -4.621 6.382 -2.923 1.00 0.00 C ATOM 612 C GLU A 37 -3.666 6.191 -1.750 1.00 0.00 C ATOM 613 O GLU A 37 -2.748 6.982 -1.550 1.00 0.00 O ATOM 614 CB GLU A 37 -5.887 7.106 -2.459 1.00 0.00 C ATOM 615 CG GLU A 37 -5.978 8.543 -2.949 1.00 0.00 C ATOM 616 CD GLU A 37 -6.815 8.678 -4.205 1.00 0.00 C ATOM 617 OE1 GLU A 37 -6.672 7.827 -5.109 1.00 0.00 O ATOM 618 OE2 GLU A 37 -7.615 9.634 -4.285 1.00 0.00 O ATOM 0 H GLU A 37 -5.910 4.777 -3.313 1.00 0.00 H new ATOM 0 HA GLU A 37 -4.124 6.990 -3.679 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.760 6.555 -2.809 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.921 7.099 -1.370 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.406 9.165 -2.163 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.974 8.921 -3.143 1.00 0.00 H new ATOM 625 N ILE A 38 -3.891 5.131 -0.981 1.00 0.00 N ATOM 626 CA ILE A 38 -3.058 4.824 0.178 1.00 0.00 C ATOM 627 C ILE A 38 -1.747 4.160 -0.241 1.00 0.00 C ATOM 628 O ILE A 38 -0.680 4.525 0.248 1.00 0.00 O ATOM 629 CB ILE A 38 -3.797 3.880 1.152 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.801 4.634 2.039 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.819 3.126 2.036 1.00 0.00 C ATOM 632 CD1 ILE A 38 -4.244 5.904 2.644 1.00 0.00 C ATOM 0 H ILE A 38 -4.648 4.466 -1.140 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.842 5.770 0.674 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.347 3.171 0.533 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.682 4.880 1.447 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.131 3.974 2.841 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.369 2.470 2.710 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -2.152 2.530 1.414 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.233 3.837 2.619 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -5.009 6.381 3.257 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.381 5.663 3.264 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.941 6.584 1.848 1.00 0.00 H new ATOM 644 N ILE A 39 -1.827 3.173 -1.133 1.00 0.00 N ATOM 645 CA ILE A 39 -0.632 2.467 -1.581 1.00 0.00 C ATOM 646 C ILE A 39 0.351 3.426 -2.224 1.00 0.00 C ATOM 647 O ILE A 39 1.560 3.327 -2.019 1.00 0.00 O ATOM 648 CB ILE A 39 -0.967 1.362 -2.596 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.629 1.975 -3.825 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.863 0.309 -1.969 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.659 2.288 -4.944 1.00 0.00 C ATOM 0 H ILE A 39 -2.697 2.848 -1.554 1.00 0.00 H new ATOM 0 HA ILE A 39 -0.188 2.013 -0.695 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.043 0.872 -2.902 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.391 1.290 -4.197 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.141 2.892 -3.532 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -2.087 -0.463 -2.705 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.355 -0.140 -1.116 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.791 0.773 -1.635 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.201 2.721 -5.785 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.089 2.998 -4.590 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.165 1.371 -5.265 1.00 0.00 H new ATOM 663 N GLU A 40 -0.178 4.351 -3.012 1.00 0.00 N ATOM 664 CA GLU A 40 0.656 5.320 -3.691 1.00 0.00 C ATOM 665 C GLU A 40 0.969 6.496 -2.778 1.00 0.00 C ATOM 666 O GLU A 40 1.954 7.203 -2.989 1.00 0.00 O ATOM 667 CB GLU A 40 -0.010 5.805 -4.980 1.00 0.00 C ATOM 668 CG GLU A 40 0.819 5.529 -6.224 1.00 0.00 C ATOM 669 CD GLU A 40 0.220 4.446 -7.099 1.00 0.00 C ATOM 670 OE1 GLU A 40 -1.022 4.308 -7.103 1.00 0.00 O ATOM 671 OE2 GLU A 40 0.990 3.739 -7.781 1.00 0.00 O ATOM 0 H GLU A 40 -1.177 4.447 -3.194 1.00 0.00 H new ATOM 0 HA GLU A 40 1.594 4.831 -3.955 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.981 5.321 -5.084 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.195 6.877 -4.905 1.00 0.00 H new ATOM 0 HG2 GLU A 40 0.914 6.447 -6.803 1.00 0.00 H new ATOM 0 HG3 GLU A 40 1.826 5.235 -5.927 1.00 0.00 H new ATOM 678 N GLU A 41 0.151 6.695 -1.746 1.00 0.00 N ATOM 679 CA GLU A 41 0.401 7.782 -0.810 1.00 0.00 C ATOM 680 C GLU A 41 1.403 7.329 0.241 1.00 0.00 C ATOM 681 O GLU A 41 2.226 8.114 0.718 1.00 0.00 O ATOM 682 CB GLU A 41 -0.900 8.240 -0.142 1.00 0.00 C ATOM 683 CG GLU A 41 -0.694 9.219 1.004 1.00 0.00 C ATOM 684 CD GLU A 41 -1.963 9.464 1.796 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.929 10.001 1.215 1.00 0.00 O ATOM 686 OE2 GLU A 41 -1.992 9.120 2.995 1.00 0.00 O ATOM 0 H GLU A 41 -0.673 6.130 -1.541 1.00 0.00 H new ATOM 0 HA GLU A 41 0.812 8.629 -1.360 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.538 8.705 -0.893 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.432 7.365 0.232 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.078 8.835 1.671 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.329 10.166 0.607 1.00 0.00 H new ATOM 693 N ALA A 42 1.332 6.049 0.590 1.00 0.00 N ATOM 694 CA ALA A 42 2.235 5.484 1.582 1.00 0.00 C ATOM 695 C ALA A 42 3.632 5.306 1.004 1.00 0.00 C ATOM 696 O ALA A 42 4.631 5.591 1.665 1.00 0.00 O ATOM 697 CB ALA A 42 1.698 4.156 2.094 1.00 0.00 C ATOM 0 H ALA A 42 0.661 5.387 0.202 1.00 0.00 H new ATOM 0 HA ALA A 42 2.299 6.179 2.419 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.385 3.747 2.835 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.721 4.311 2.552 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.603 3.457 1.263 1.00 0.00 H new ATOM 703 N VAL A 43 3.694 4.832 -0.236 1.00 0.00 N ATOM 704 CA VAL A 43 4.970 4.613 -0.908 1.00 0.00 C ATOM 705 C VAL A 43 5.821 5.865 -0.899 1.00 0.00 C ATOM 706 O VAL A 43 6.915 5.892 -0.338 1.00 0.00 O ATOM 707 CB VAL A 43 4.777 4.178 -2.381 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.767 5.049 -3.093 1.00 0.00 C ATOM 709 CG2 VAL A 43 6.091 4.217 -3.133 1.00 0.00 C ATOM 0 H VAL A 43 2.876 4.592 -0.796 1.00 0.00 H new ATOM 0 HA VAL A 43 5.469 3.818 -0.354 1.00 0.00 H new ATOM 0 HB VAL A 43 4.401 3.155 -2.363 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.659 4.712 -4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.805 4.979 -2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.108 6.084 -3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.929 3.907 -4.165 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.489 5.231 -3.117 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.802 3.541 -2.659 1.00 0.00 H new ATOM 719 N VAL A 44 5.307 6.894 -1.541 1.00 0.00 N ATOM 720 CA VAL A 44 6.003 8.156 -1.639 1.00 0.00 C ATOM 721 C VAL A 44 6.397 8.662 -0.263 1.00 0.00 C ATOM 722 O VAL A 44 7.568 8.915 -0.001 1.00 0.00 O ATOM 723 CB VAL A 44 5.138 9.196 -2.375 1.00 0.00 C ATOM 724 CG1 VAL A 44 5.243 10.582 -1.743 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.505 9.250 -3.850 1.00 0.00 C ATOM 0 H VAL A 44 4.400 6.878 -2.007 1.00 0.00 H new ATOM 0 HA VAL A 44 6.914 7.999 -2.216 1.00 0.00 H new ATOM 0 HB VAL A 44 4.100 8.877 -2.282 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.616 11.282 -2.295 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.909 10.536 -0.707 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.279 10.919 -1.775 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.883 9.991 -4.353 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.554 9.527 -3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.341 8.272 -4.302 1.00 0.00 H new ATOM 735 N MET A 45 5.420 8.796 0.619 1.00 0.00 N ATOM 736 CA MET A 45 5.700 9.265 1.965 1.00 0.00 C ATOM 737 C MET A 45 6.780 8.409 2.613 1.00 0.00 C ATOM 738 O MET A 45 7.554 8.896 3.437 1.00 0.00 O ATOM 739 CB MET A 45 4.440 9.265 2.829 1.00 0.00 C ATOM 740 CG MET A 45 4.659 9.864 4.210 1.00 0.00 C ATOM 741 SD MET A 45 5.425 11.497 4.153 1.00 0.00 S ATOM 742 CE MET A 45 6.219 11.555 5.757 1.00 0.00 C ATOM 0 H MET A 45 4.439 8.590 0.431 1.00 0.00 H new ATOM 0 HA MET A 45 6.058 10.292 1.890 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.657 9.825 2.318 1.00 0.00 H new ATOM 0 HB3 MET A 45 4.082 8.241 2.937 1.00 0.00 H new ATOM 0 HG2 MET A 45 3.701 9.935 4.726 1.00 0.00 H new ATOM 0 HG3 MET A 45 5.288 9.193 4.796 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.652 12.209 6.420 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.256 10.552 6.181 1.00 0.00 H new ATOM 0 HE3 MET A 45 7.233 11.940 5.647 1.00 0.00 H new ATOM 752 N TRP A 46 6.850 7.133 2.226 1.00 0.00 N ATOM 753 CA TRP A 46 7.864 6.244 2.772 1.00 0.00 C ATOM 754 C TRP A 46 9.236 6.673 2.282 1.00 0.00 C ATOM 755 O TRP A 46 10.111 7.019 3.074 1.00 0.00 O ATOM 756 CB TRP A 46 7.590 4.792 2.375 1.00 0.00 C ATOM 757 CG TRP A 46 8.450 3.807 3.105 1.00 0.00 C ATOM 758 CD1 TRP A 46 8.097 3.057 4.189 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.810 3.465 2.806 1.00 0.00 C ATOM 760 NE1 TRP A 46 9.152 2.270 4.582 1.00 0.00 N ATOM 761 CE2 TRP A 46 10.215 2.502 3.750 1.00 0.00 C ATOM 762 CE3 TRP A 46 10.725 3.878 1.833 1.00 0.00 C ATOM 763 CZ2 TRP A 46 11.492 1.948 3.749 1.00 0.00 C ATOM 764 CZ3 TRP A 46 11.993 3.327 1.834 1.00 0.00 C ATOM 765 CH2 TRP A 46 12.366 2.370 2.786 1.00 0.00 C ATOM 0 H TRP A 46 6.224 6.702 1.546 1.00 0.00 H new ATOM 0 HA TRP A 46 7.833 6.307 3.860 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.542 4.561 2.567 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.750 4.679 1.303 1.00 0.00 H new ATOM 0 HD1 TRP A 46 7.129 3.079 4.668 1.00 0.00 H new ATOM 0 HE1 TRP A 46 9.145 1.618 5.367 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.446 4.614 1.094 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.782 1.211 4.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 12.708 3.640 1.088 1.00 0.00 H new ATOM 0 HH2 TRP A 46 13.364 1.957 2.759 1.00 0.00 H new ATOM 776 N LEU A 47 9.410 6.671 0.967 1.00 0.00 N ATOM 777 CA LEU A 47 10.671 7.089 0.366 1.00 0.00 C ATOM 778 C LEU A 47 11.000 8.507 0.780 1.00 0.00 C ATOM 779 O LEU A 47 12.139 8.836 1.103 1.00 0.00 O ATOM 780 CB LEU A 47 10.598 7.053 -1.160 1.00 0.00 C ATOM 781 CG LEU A 47 9.235 7.385 -1.769 1.00 0.00 C ATOM 782 CD1 LEU A 47 9.220 8.826 -2.250 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.907 6.428 -2.906 1.00 0.00 C ATOM 0 H LEU A 47 8.696 6.385 0.297 1.00 0.00 H new ATOM 0 HA LEU A 47 11.439 6.397 0.712 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.333 7.754 -1.557 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.892 6.059 -1.496 1.00 0.00 H new ATOM 0 HG LEU A 47 8.469 7.267 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU A 47 8.246 9.055 -2.683 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.409 9.492 -1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.994 8.966 -3.005 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.933 6.681 -3.325 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.669 6.510 -3.681 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.884 5.406 -2.526 1.00 0.00 H new ATOM 795 N ILE A 48 9.985 9.346 0.739 1.00 0.00 N ATOM 796 CA ILE A 48 10.131 10.739 1.080 1.00 0.00 C ATOM 797 C ILE A 48 10.593 10.905 2.519 1.00 0.00 C ATOM 798 O ILE A 48 11.467 11.722 2.809 1.00 0.00 O ATOM 799 CB ILE A 48 8.801 11.484 0.841 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.981 12.512 -0.264 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.286 12.140 2.112 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.985 11.918 -1.655 1.00 0.00 C ATOM 0 H ILE A 48 9.039 9.078 0.468 1.00 0.00 H new ATOM 0 HA ILE A 48 10.896 11.173 0.436 1.00 0.00 H new ATOM 0 HB ILE A 48 8.052 10.754 0.533 1.00 0.00 H new ATOM 0 HG12 ILE A 48 8.181 13.249 -0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.919 13.044 -0.103 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.348 12.654 1.902 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.119 11.378 2.873 1.00 0.00 H new ATOM 0 HG23 ILE A 48 9.021 12.859 2.474 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.118 12.712 -2.389 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.803 11.202 -1.743 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.038 11.411 -1.837 1.00 0.00 H new ATOM 814 N GLN A 49 10.000 10.136 3.421 1.00 0.00 N ATOM 815 CA GLN A 49 10.361 10.222 4.822 1.00 0.00 C ATOM 816 C GLN A 49 11.596 9.376 5.135 1.00 0.00 C ATOM 817 O GLN A 49 12.291 9.625 6.120 1.00 0.00 O ATOM 818 CB GLN A 49 9.184 9.792 5.707 1.00 0.00 C ATOM 819 CG GLN A 49 9.021 8.284 5.832 1.00 0.00 C ATOM 820 CD GLN A 49 7.797 7.894 6.637 1.00 0.00 C ATOM 821 OE1 GLN A 49 7.823 7.892 7.868 1.00 0.00 O ATOM 822 NE2 GLN A 49 6.714 7.562 5.945 1.00 0.00 N ATOM 0 H GLN A 49 9.274 9.452 3.207 1.00 0.00 H new ATOM 0 HA GLN A 49 10.604 11.262 5.038 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.317 10.216 6.702 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.265 10.214 5.301 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.951 7.846 4.836 1.00 0.00 H new ATOM 0 HG3 GLN A 49 9.910 7.864 6.303 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.736 7.577 4.925 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.860 7.292 6.433 1.00 0.00 H new ATOM 831 N ASN A 50 11.854 8.363 4.309 1.00 0.00 N ATOM 832 CA ASN A 50 12.996 7.477 4.530 1.00 0.00 C ATOM 833 C ASN A 50 14.204 7.865 3.681 1.00 0.00 C ATOM 834 O ASN A 50 15.268 8.179 4.208 1.00 0.00 O ATOM 835 CB ASN A 50 12.604 6.028 4.236 1.00 0.00 C ATOM 836 CG ASN A 50 13.307 5.042 5.150 1.00 0.00 C ATOM 837 OD1 ASN A 50 14.500 4.779 4.998 1.00 0.00 O ATOM 838 ND2 ASN A 50 12.569 4.492 6.107 1.00 0.00 N ATOM 0 H ASN A 50 11.293 8.137 3.488 1.00 0.00 H new ATOM 0 HA ASN A 50 13.282 7.578 5.577 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.525 5.917 4.347 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.844 5.793 3.199 1.00 0.00 H new ATOM 0 HD21 ASN A 50 12.988 3.822 6.753 1.00 0.00 H new ATOM 0 HD22 ASN A 50 11.583 4.739 6.197 1.00 0.00 H new ATOM 845 N LYS A 51 14.030 7.823 2.368 1.00 0.00 N ATOM 846 CA LYS A 51 15.102 8.149 1.429 1.00 0.00 C ATOM 847 C LYS A 51 15.765 9.484 1.764 1.00 0.00 C ATOM 848 O LYS A 51 16.970 9.542 2.008 1.00 0.00 O ATOM 849 CB LYS A 51 14.556 8.187 0.000 1.00 0.00 C ATOM 850 CG LYS A 51 15.635 8.120 -1.069 1.00 0.00 C ATOM 851 CD LYS A 51 16.396 6.804 -1.019 1.00 0.00 C ATOM 852 CE LYS A 51 15.467 5.611 -1.190 1.00 0.00 C ATOM 853 NZ LYS A 51 15.355 4.813 0.061 1.00 0.00 N ATOM 0 H LYS A 51 13.150 7.564 1.922 1.00 0.00 H new ATOM 0 HA LYS A 51 15.859 7.369 1.512 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.868 7.353 -0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 51 13.980 9.102 -0.135 1.00 0.00 H new ATOM 0 HG2 LYS A 51 15.181 8.240 -2.052 1.00 0.00 H new ATOM 0 HG3 LYS A 51 16.331 8.948 -0.936 1.00 0.00 H new ATOM 0 HD2 LYS A 51 17.153 6.791 -1.803 1.00 0.00 H new ATOM 0 HD3 LYS A 51 16.921 6.723 -0.067 1.00 0.00 H new ATOM 0 HE2 LYS A 51 14.478 5.960 -1.488 1.00 0.00 H new ATOM 0 HE3 LYS A 51 15.836 4.975 -1.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 15.176 3.817 -0.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 16.241 4.886 0.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 14.569 5.178 0.636 1.00 0.00 H new ATOM 867 N GLU A 52 14.975 10.553 1.762 1.00 0.00 N ATOM 868 CA GLU A 52 15.489 11.891 2.053 1.00 0.00 C ATOM 869 C GLU A 52 16.399 11.888 3.281 1.00 0.00 C ATOM 870 O GLU A 52 17.319 12.698 3.384 1.00 0.00 O ATOM 871 CB GLU A 52 14.329 12.867 2.265 1.00 0.00 C ATOM 872 CG GLU A 52 14.482 14.165 1.488 1.00 0.00 C ATOM 873 CD GLU A 52 13.427 15.191 1.852 1.00 0.00 C ATOM 874 OE1 GLU A 52 13.777 16.194 2.508 1.00 0.00 O ATOM 875 OE2 GLU A 52 12.252 14.992 1.480 1.00 0.00 O ATOM 0 H GLU A 52 13.975 10.521 1.562 1.00 0.00 H new ATOM 0 HA GLU A 52 16.081 12.213 1.196 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.398 12.383 1.970 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.246 13.096 3.327 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.471 14.583 1.678 1.00 0.00 H new ATOM 0 HG3 GLU A 52 14.425 13.954 0.420 1.00 0.00 H new ATOM 882 N LYS A 53 16.132 10.975 4.207 1.00 0.00 N ATOM 883 CA LYS A 53 16.926 10.870 5.427 1.00 0.00 C ATOM 884 C LYS A 53 17.466 9.455 5.610 1.00 0.00 C ATOM 885 O LYS A 53 17.671 9.005 6.736 1.00 0.00 O ATOM 886 CB LYS A 53 16.088 11.271 6.642 1.00 0.00 C ATOM 887 CG LYS A 53 14.798 10.478 6.778 1.00 0.00 C ATOM 888 CD LYS A 53 14.503 10.139 8.230 1.00 0.00 C ATOM 889 CE LYS A 53 15.040 8.766 8.602 1.00 0.00 C ATOM 890 NZ LYS A 53 15.591 8.741 9.985 1.00 0.00 N ATOM 0 H LYS A 53 15.373 10.297 4.137 1.00 0.00 H new ATOM 0 HA LYS A 53 17.773 11.551 5.337 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.684 11.137 7.545 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.847 12.332 6.573 1.00 0.00 H new ATOM 0 HG2 LYS A 53 13.971 11.053 6.362 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.872 9.559 6.196 1.00 0.00 H new ATOM 0 HD2 LYS A 53 14.949 10.893 8.879 1.00 0.00 H new ATOM 0 HD3 LYS A 53 13.427 10.168 8.400 1.00 0.00 H new ATOM 0 HE2 LYS A 53 14.242 8.029 8.516 1.00 0.00 H new ATOM 0 HE3 LYS A 53 15.818 8.477 7.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.947 7.788 10.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 16.370 9.426 10.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.842 8.992 10.662 1.00 0.00 H new ATOM 904 N LEU A 54 17.685 8.756 4.497 1.00 0.00 N ATOM 905 CA LEU A 54 18.190 7.384 4.534 1.00 0.00 C ATOM 906 C LEU A 54 19.481 7.296 5.348 1.00 0.00 C ATOM 907 O LEU A 54 20.555 7.648 4.860 1.00 0.00 O ATOM 908 CB LEU A 54 18.439 6.878 3.110 1.00 0.00 C ATOM 909 CG LEU A 54 19.055 5.478 3.015 1.00 0.00 C ATOM 910 CD1 LEU A 54 18.264 4.607 2.051 1.00 0.00 C ATOM 911 CD2 LEU A 54 20.512 5.562 2.585 1.00 0.00 C ATOM 0 H LEU A 54 17.520 9.118 3.558 1.00 0.00 H new ATOM 0 HA LEU A 54 17.438 6.758 5.014 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.492 6.879 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.097 7.582 2.601 1.00 0.00 H new ATOM 0 HG LEU A 54 19.014 5.020 4.003 1.00 0.00 H new ATOM 0 HD11 LEU A 54 18.718 3.618 1.998 1.00 0.00 H new ATOM 0 HD12 LEU A 54 17.236 4.516 2.402 1.00 0.00 H new ATOM 0 HD13 LEU A 54 18.270 5.062 1.061 1.00 0.00 H new ATOM 0 HD21 LEU A 54 20.932 4.558 2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 54 20.576 6.043 1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 54 21.074 6.146 3.314 1.00 0.00 H new ATOM 923 N PRO A 55 19.392 6.827 6.607 1.00 0.00 N ATOM 924 CA PRO A 55 20.548 6.696 7.492 1.00 0.00 C ATOM 925 C PRO A 55 21.372 5.449 7.189 1.00 0.00 C ATOM 926 O PRO A 55 20.871 4.486 6.609 1.00 0.00 O ATOM 927 CB PRO A 55 19.927 6.596 8.898 1.00 0.00 C ATOM 928 CG PRO A 55 18.448 6.733 8.711 1.00 0.00 C ATOM 929 CD PRO A 55 18.166 6.385 7.278 1.00 0.00 C ATOM 0 HA PRO A 55 21.237 7.532 7.377 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.174 5.643 9.366 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.311 7.380 9.550 1.00 0.00 H new ATOM 0 HG2 PRO A 55 17.908 6.068 9.385 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.121 7.748 8.935 1.00 0.00 H new ATOM 0 HD2 PRO A 55 17.991 5.317 7.145 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.285 6.902 6.899 1.00 0.00 H new ATOM 937 N ASN A 56 22.638 5.473 7.591 1.00 0.00 N ATOM 938 CA ASN A 56 23.532 4.343 7.370 1.00 0.00 C ATOM 939 C ASN A 56 23.220 3.206 8.339 1.00 0.00 C ATOM 940 O ASN A 56 23.462 2.037 8.038 1.00 0.00 O ATOM 941 CB ASN A 56 24.989 4.781 7.529 1.00 0.00 C ATOM 942 CG ASN A 56 25.368 5.889 6.566 1.00 0.00 C ATOM 943 OD1 ASN A 56 25.613 7.025 6.972 1.00 0.00 O ATOM 944 ND2 ASN A 56 25.419 5.563 5.279 1.00 0.00 N ATOM 0 H ASN A 56 23.068 6.263 8.072 1.00 0.00 H new ATOM 0 HA ASN A 56 23.378 3.982 6.353 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.154 5.120 8.552 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.643 3.924 7.368 1.00 0.00 H new ATOM 0 HD21 ASN A 56 25.669 6.267 4.584 1.00 0.00 H new ATOM 0 HD22 ASN A 56 25.208 4.609 4.986 1.00 0.00 H new ATOM 951 N GLU A 57 22.684 3.558 9.505 1.00 0.00 N ATOM 952 CA GLU A 57 22.341 2.568 10.520 1.00 0.00 C ATOM 953 C GLU A 57 21.001 1.901 10.218 1.00 0.00 C ATOM 954 O GLU A 57 20.717 0.811 10.714 1.00 0.00 O ATOM 955 CB GLU A 57 22.298 3.223 11.903 1.00 0.00 C ATOM 956 CG GLU A 57 21.289 4.356 12.007 1.00 0.00 C ATOM 957 CD GLU A 57 20.081 3.988 12.846 1.00 0.00 C ATOM 958 OE1 GLU A 57 20.223 3.896 14.084 1.00 0.00 O ATOM 959 OE2 GLU A 57 18.993 3.791 12.265 1.00 0.00 O ATOM 0 H GLU A 57 22.478 4.521 9.769 1.00 0.00 H new ATOM 0 HA GLU A 57 23.112 1.798 10.509 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.059 2.464 12.648 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.289 3.606 12.146 1.00 0.00 H new ATOM 0 HG2 GLU A 57 21.774 5.231 12.440 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.960 4.637 11.007 1.00 0.00 H new ATOM 966 N LEU A 58 20.180 2.560 9.404 1.00 0.00 N ATOM 967 CA LEU A 58 18.871 2.024 9.040 1.00 0.00 C ATOM 968 C LEU A 58 18.974 1.090 7.837 1.00 0.00 C ATOM 969 O LEU A 58 18.104 0.247 7.626 1.00 0.00 O ATOM 970 CB LEU A 58 17.897 3.162 8.727 1.00 0.00 C ATOM 971 CG LEU A 58 16.862 3.456 9.817 1.00 0.00 C ATOM 972 CD1 LEU A 58 15.932 4.579 9.381 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.067 2.202 10.151 1.00 0.00 C ATOM 0 H LEU A 58 20.397 3.464 8.985 1.00 0.00 H new ATOM 0 HA LEU A 58 18.497 1.454 9.890 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.472 4.069 8.541 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.370 2.923 7.803 1.00 0.00 H new ATOM 0 HG LEU A 58 17.390 3.777 10.715 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.203 4.774 10.168 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.514 5.481 9.194 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.412 4.287 8.469 1.00 0.00 H new ATOM 0 HD21 LEU A 58 15.337 2.430 10.927 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.550 1.851 9.258 1.00 0.00 H new ATOM 0 HD23 LEU A 58 16.744 1.426 10.507 1.00 0.00 H new ATOM 985 N LYS A 59 20.038 1.254 7.050 1.00 0.00 N ATOM 986 CA LYS A 59 20.260 0.435 5.856 1.00 0.00 C ATOM 987 C LYS A 59 19.844 -1.021 6.076 1.00 0.00 C ATOM 988 O LYS A 59 19.126 -1.597 5.259 1.00 0.00 O ATOM 989 CB LYS A 59 21.731 0.495 5.439 1.00 0.00 C ATOM 990 CG LYS A 59 21.935 0.515 3.933 1.00 0.00 C ATOM 991 CD LYS A 59 23.309 -0.009 3.550 1.00 0.00 C ATOM 992 CE LYS A 59 23.494 -1.457 3.977 1.00 0.00 C ATOM 993 NZ LYS A 59 24.618 -2.112 3.252 1.00 0.00 N ATOM 0 H LYS A 59 20.764 1.951 7.219 1.00 0.00 H new ATOM 0 HA LYS A 59 19.637 0.844 5.061 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.187 1.386 5.871 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.254 -0.365 5.857 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.167 -0.091 3.453 1.00 0.00 H new ATOM 0 HG3 LYS A 59 21.816 1.533 3.562 1.00 0.00 H new ATOM 0 HD2 LYS A 59 23.443 0.073 2.471 1.00 0.00 H new ATOM 0 HD3 LYS A 59 24.077 0.609 4.014 1.00 0.00 H new ATOM 0 HE2 LYS A 59 23.682 -1.498 5.050 1.00 0.00 H new ATOM 0 HE3 LYS A 59 22.573 -2.010 3.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 24.710 -3.097 3.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 24.428 -2.097 2.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 25.502 -1.600 3.447 1.00 0.00 H new ATOM 1007 N PRO A 60 20.290 -1.640 7.181 1.00 0.00 N ATOM 1008 CA PRO A 60 19.957 -3.033 7.492 1.00 0.00 C ATOM 1009 C PRO A 60 18.473 -3.223 7.775 1.00 0.00 C ATOM 1010 O PRO A 60 17.905 -4.274 7.478 1.00 0.00 O ATOM 1011 CB PRO A 60 20.786 -3.344 8.747 1.00 0.00 C ATOM 1012 CG PRO A 60 21.795 -2.248 8.838 1.00 0.00 C ATOM 1013 CD PRO A 60 21.154 -1.045 8.210 1.00 0.00 C ATOM 0 HA PRO A 60 20.177 -3.694 6.654 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.156 -3.373 9.636 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.270 -4.318 8.667 1.00 0.00 H new ATOM 0 HG2 PRO A 60 22.064 -2.050 9.876 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.713 -2.518 8.316 1.00 0.00 H new ATOM 0 HD2 PRO A 60 20.581 -0.467 8.935 1.00 0.00 H new ATOM 0 HD3 PRO A 60 21.894 -0.371 7.778 1.00 0.00 H new ATOM 1021 N LYS A 61 17.847 -2.204 8.352 1.00 0.00 N ATOM 1022 CA LYS A 61 16.428 -2.273 8.670 1.00 0.00 C ATOM 1023 C LYS A 61 15.587 -2.309 7.400 1.00 0.00 C ATOM 1024 O LYS A 61 14.474 -2.833 7.399 1.00 0.00 O ATOM 1025 CB LYS A 61 16.006 -1.093 9.543 1.00 0.00 C ATOM 1026 CG LYS A 61 14.815 -1.405 10.437 1.00 0.00 C ATOM 1027 CD LYS A 61 13.521 -0.862 9.852 1.00 0.00 C ATOM 1028 CE LYS A 61 12.891 0.183 10.759 1.00 0.00 C ATOM 1029 NZ LYS A 61 12.439 -0.404 12.050 1.00 0.00 N ATOM 0 H LYS A 61 18.298 -1.325 8.608 1.00 0.00 H new ATOM 0 HA LYS A 61 16.258 -3.195 9.226 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.849 -0.789 10.164 1.00 0.00 H new ATOM 0 HB3 LYS A 61 15.760 -0.246 8.903 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.731 -2.484 10.569 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.978 -0.974 11.425 1.00 0.00 H new ATOM 0 HD2 LYS A 61 13.719 -0.424 8.874 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.819 -1.681 9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.612 0.977 10.954 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.042 0.641 10.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.759 0.239 12.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.983 -1.322 11.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 13.259 -0.540 12.675 1.00 0.00 H new ATOM 1043 N ILE A 62 16.123 -1.766 6.307 1.00 0.00 N ATOM 1044 CA ILE A 62 15.406 -1.770 5.040 1.00 0.00 C ATOM 1045 C ILE A 62 14.986 -3.197 4.704 1.00 0.00 C ATOM 1046 O ILE A 62 13.903 -3.434 4.167 1.00 0.00 O ATOM 1047 CB ILE A 62 16.262 -1.169 3.899 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.147 0.358 3.907 1.00 0.00 C ATOM 1049 CG2 ILE A 62 15.848 -1.723 2.541 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.321 0.971 5.279 1.00 0.00 C ATOM 0 H ILE A 62 17.041 -1.323 6.276 1.00 0.00 H new ATOM 0 HA ILE A 62 14.520 -1.143 5.140 1.00 0.00 H new ATOM 0 HB ILE A 62 17.300 -1.452 4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 62 16.897 0.774 3.235 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.172 0.643 3.512 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.469 -1.280 1.763 1.00 0.00 H new ATOM 0 HG22 ILE A 62 15.976 -2.805 2.535 1.00 0.00 H new ATOM 0 HG23 ILE A 62 14.802 -1.480 2.353 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.227 2.055 5.208 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.555 0.584 5.950 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.307 0.717 5.669 1.00 0.00 H new ATOM 1062 N ASP A 63 15.838 -4.149 5.074 1.00 0.00 N ATOM 1063 CA ASP A 63 15.542 -5.550 4.864 1.00 0.00 C ATOM 1064 C ASP A 63 14.385 -5.931 5.770 1.00 0.00 C ATOM 1065 O ASP A 63 13.481 -6.667 5.377 1.00 0.00 O ATOM 1066 CB ASP A 63 16.770 -6.412 5.167 1.00 0.00 C ATOM 1067 CG ASP A 63 17.270 -7.158 3.946 1.00 0.00 C ATOM 1068 OD1 ASP A 63 16.709 -8.230 3.635 1.00 0.00 O ATOM 1069 OD2 ASP A 63 18.219 -6.669 3.299 1.00 0.00 O ATOM 0 H ASP A 63 16.737 -3.969 5.520 1.00 0.00 H new ATOM 0 HA ASP A 63 15.271 -5.721 3.822 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.568 -5.779 5.554 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.523 -7.128 5.951 1.00 0.00 H new ATOM 1074 N GLU A 64 14.410 -5.379 6.983 1.00 0.00 N ATOM 1075 CA GLU A 64 13.357 -5.611 7.958 1.00 0.00 C ATOM 1076 C GLU A 64 12.032 -5.107 7.403 1.00 0.00 C ATOM 1077 O GLU A 64 11.022 -5.804 7.443 1.00 0.00 O ATOM 1078 CB GLU A 64 13.687 -4.909 9.278 1.00 0.00 C ATOM 1079 CG GLU A 64 14.238 -5.843 10.343 1.00 0.00 C ATOM 1080 CD GLU A 64 15.731 -5.676 10.550 1.00 0.00 C ATOM 1081 OE1 GLU A 64 16.508 -6.340 9.833 1.00 0.00 O ATOM 1082 OE2 GLU A 64 16.123 -4.882 11.430 1.00 0.00 O ATOM 0 H GLU A 64 15.156 -4.765 7.311 1.00 0.00 H new ATOM 0 HA GLU A 64 13.279 -6.681 8.153 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.414 -4.119 9.088 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.786 -4.428 9.659 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.722 -5.659 11.285 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.027 -6.874 10.061 1.00 0.00 H new ATOM 1089 N ILE A 65 12.057 -3.894 6.862 1.00 0.00 N ATOM 1090 CA ILE A 65 10.873 -3.282 6.266 1.00 0.00 C ATOM 1091 C ILE A 65 10.215 -4.233 5.269 1.00 0.00 C ATOM 1092 O ILE A 65 8.992 -4.360 5.234 1.00 0.00 O ATOM 1093 CB ILE A 65 11.244 -1.969 5.546 1.00 0.00 C ATOM 1094 CG1 ILE A 65 11.862 -0.981 6.536 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.024 -1.357 4.876 1.00 0.00 C ATOM 1096 CD1 ILE A 65 10.940 -0.640 7.684 1.00 0.00 C ATOM 0 H ILE A 65 12.892 -3.310 6.824 1.00 0.00 H new ATOM 0 HA ILE A 65 10.171 -3.066 7.071 1.00 0.00 H new ATOM 0 HB ILE A 65 11.978 -2.196 4.772 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.786 -1.402 6.932 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.130 -0.066 6.008 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.310 -0.432 4.375 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.621 -2.057 4.144 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.265 -1.142 5.628 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.436 0.065 8.352 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.026 -0.191 7.296 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.693 -1.548 8.234 1.00 0.00 H new ATOM 1108 N SER A 66 11.037 -4.890 4.455 1.00 0.00 N ATOM 1109 CA SER A 66 10.537 -5.820 3.446 1.00 0.00 C ATOM 1110 C SER A 66 10.246 -7.200 4.036 1.00 0.00 C ATOM 1111 O SER A 66 9.168 -7.756 3.824 1.00 0.00 O ATOM 1112 CB SER A 66 11.546 -5.949 2.304 1.00 0.00 C ATOM 1113 OG SER A 66 11.266 -5.022 1.269 1.00 0.00 O ATOM 0 H SER A 66 12.052 -4.796 4.474 1.00 0.00 H new ATOM 0 HA SER A 66 9.599 -5.415 3.065 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.554 -5.781 2.684 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.521 -6.963 1.905 1.00 0.00 H new ATOM 0 HG SER A 66 11.491 -4.117 1.570 1.00 0.00 H new ATOM 1119 N LYS A 67 11.210 -7.756 4.760 1.00 0.00 N ATOM 1120 CA LYS A 67 11.046 -9.079 5.356 1.00 0.00 C ATOM 1121 C LYS A 67 9.980 -9.076 6.452 1.00 0.00 C ATOM 1122 O LYS A 67 9.443 -10.126 6.804 1.00 0.00 O ATOM 1123 CB LYS A 67 12.379 -9.585 5.915 1.00 0.00 C ATOM 1124 CG LYS A 67 12.924 -8.738 7.051 1.00 0.00 C ATOM 1125 CD LYS A 67 13.174 -9.568 8.300 1.00 0.00 C ATOM 1126 CE LYS A 67 14.601 -10.092 8.344 1.00 0.00 C ATOM 1127 NZ LYS A 67 14.739 -11.386 7.621 1.00 0.00 N ATOM 0 H LYS A 67 12.110 -7.315 4.949 1.00 0.00 H new ATOM 0 HA LYS A 67 10.712 -9.754 4.568 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.251 -10.609 6.266 1.00 0.00 H new ATOM 0 HB3 LYS A 67 13.113 -9.614 5.110 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.854 -8.263 6.737 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.219 -7.939 7.280 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.980 -8.963 9.185 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.477 -10.405 8.327 1.00 0.00 H new ATOM 0 HE2 LYS A 67 15.272 -9.356 7.902 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.909 -10.221 9.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 15.726 -11.710 7.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.118 -12.096 8.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.470 -11.257 6.625 1.00 0.00 H new ATOM 1141 N ARG A 68 9.670 -7.897 6.986 1.00 0.00 N ATOM 1142 CA ARG A 68 8.661 -7.782 8.037 1.00 0.00 C ATOM 1143 C ARG A 68 7.300 -7.430 7.451 1.00 0.00 C ATOM 1144 O ARG A 68 6.266 -7.826 7.987 1.00 0.00 O ATOM 1145 CB ARG A 68 9.064 -6.729 9.071 1.00 0.00 C ATOM 1146 CG ARG A 68 10.329 -7.079 9.836 1.00 0.00 C ATOM 1147 CD ARG A 68 10.746 -5.951 10.769 1.00 0.00 C ATOM 1148 NE ARG A 68 10.436 -6.251 12.165 1.00 0.00 N ATOM 1149 CZ ARG A 68 10.546 -5.368 13.155 1.00 0.00 C ATOM 1150 NH1 ARG A 68 10.957 -4.131 12.908 1.00 0.00 N ATOM 1151 NH2 ARG A 68 10.244 -5.723 14.397 1.00 0.00 N ATOM 0 H ARG A 68 10.099 -7.013 6.711 1.00 0.00 H new ATOM 0 HA ARG A 68 8.592 -8.751 8.530 1.00 0.00 H new ATOM 0 HB2 ARG A 68 9.207 -5.773 8.567 1.00 0.00 H new ATOM 0 HB3 ARG A 68 8.246 -6.596 9.779 1.00 0.00 H new ATOM 0 HG2 ARG A 68 10.166 -7.989 10.413 1.00 0.00 H new ATOM 0 HG3 ARG A 68 11.135 -7.288 9.133 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.816 -5.772 10.666 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.240 -5.032 10.475 1.00 0.00 H new ATOM 0 HE ARG A 68 10.117 -7.192 12.394 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.191 -3.852 11.955 1.00 0.00 H new ATOM 0 HH12 ARG A 68 11.039 -3.459 13.671 1.00 0.00 H new ATOM 0 HH21 ARG A 68 9.928 -6.673 14.593 1.00 0.00 H new ATOM 0 HH22 ARG A 68 10.328 -5.046 15.156 1.00 0.00 H new ATOM 1165 N PHE A 69 7.300 -6.681 6.349 1.00 0.00 N ATOM 1166 CA PHE A 69 6.054 -6.285 5.703 1.00 0.00 C ATOM 1167 C PHE A 69 5.158 -7.502 5.482 1.00 0.00 C ATOM 1168 O PHE A 69 3.931 -7.402 5.523 1.00 0.00 O ATOM 1169 CB PHE A 69 6.348 -5.548 4.381 1.00 0.00 C ATOM 1170 CG PHE A 69 5.877 -6.256 3.134 1.00 0.00 C ATOM 1171 CD1 PHE A 69 4.523 -6.397 2.869 1.00 0.00 C ATOM 1172 CD2 PHE A 69 6.790 -6.771 2.228 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.090 -7.040 1.725 1.00 0.00 C ATOM 1174 CE2 PHE A 69 6.363 -7.415 1.083 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.011 -7.550 0.831 1.00 0.00 C ATOM 0 H PHE A 69 8.144 -6.339 5.889 1.00 0.00 H new ATOM 0 HA PHE A 69 5.519 -5.596 6.356 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.880 -4.564 4.420 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.423 -5.387 4.304 1.00 0.00 H new ATOM 0 HD1 PHE A 69 3.799 -6.000 3.565 1.00 0.00 H new ATOM 0 HD2 PHE A 69 7.848 -6.668 2.419 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.033 -7.144 1.530 1.00 0.00 H new ATOM 0 HE2 PHE A 69 7.085 -7.813 0.385 1.00 0.00 H new ATOM 0 HZ PHE A 69 4.675 -8.053 -0.063 1.00 0.00 H new ATOM 1185 N PHE A 70 5.785 -8.654 5.268 1.00 0.00 N ATOM 1186 CA PHE A 70 5.057 -9.898 5.062 1.00 0.00 C ATOM 1187 C PHE A 70 5.330 -10.858 6.218 1.00 0.00 C ATOM 1188 O PHE A 70 6.110 -11.801 6.084 1.00 0.00 O ATOM 1189 CB PHE A 70 5.461 -10.540 3.734 1.00 0.00 C ATOM 1190 CG PHE A 70 4.326 -11.229 3.031 1.00 0.00 C ATOM 1191 CD1 PHE A 70 3.975 -12.527 3.361 1.00 0.00 C ATOM 1192 CD2 PHE A 70 3.609 -10.576 2.041 1.00 0.00 C ATOM 1193 CE1 PHE A 70 2.930 -13.163 2.717 1.00 0.00 C ATOM 1194 CE2 PHE A 70 2.564 -11.206 1.393 1.00 0.00 C ATOM 1195 CZ PHE A 70 2.224 -12.501 1.731 1.00 0.00 C ATOM 0 H PHE A 70 6.800 -8.750 5.233 1.00 0.00 H new ATOM 0 HA PHE A 70 3.990 -9.678 5.028 1.00 0.00 H new ATOM 0 HB2 PHE A 70 5.871 -9.772 3.078 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.257 -11.262 3.916 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.524 -13.049 4.131 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.870 -9.563 1.773 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.666 -14.176 2.984 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.014 -10.686 0.623 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.408 -12.995 1.226 1.00 0.00 H new ATOM 1205 N PRO A 71 4.693 -10.618 7.378 1.00 0.00 N ATOM 1206 CA PRO A 71 4.874 -11.453 8.567 1.00 0.00 C ATOM 1207 C PRO A 71 4.100 -12.765 8.482 1.00 0.00 C ATOM 1208 O PRO A 71 2.959 -12.852 8.934 1.00 0.00 O ATOM 1209 CB PRO A 71 4.321 -10.576 9.688 1.00 0.00 C ATOM 1210 CG PRO A 71 3.272 -9.749 9.030 1.00 0.00 C ATOM 1211 CD PRO A 71 3.750 -9.508 7.622 1.00 0.00 C ATOM 0 HA PRO A 71 5.913 -11.751 8.707 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.904 -11.179 10.495 1.00 0.00 H new ATOM 0 HB3 PRO A 71 5.101 -9.953 10.126 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.311 -10.264 9.032 1.00 0.00 H new ATOM 0 HG3 PRO A 71 3.130 -8.807 9.560 1.00 0.00 H new ATOM 0 HD2 PRO A 71 2.924 -9.521 6.911 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.239 -8.539 7.525 1.00 0.00 H new ATOM 1219 N ALA A 72 4.728 -13.781 7.899 1.00 0.00 N ATOM 1220 CA ALA A 72 4.095 -15.087 7.757 1.00 0.00 C ATOM 1221 C ALA A 72 5.048 -16.207 8.159 1.00 0.00 C ATOM 1222 O ALA A 72 6.235 -15.974 8.386 1.00 0.00 O ATOM 1223 CB ALA A 72 3.617 -15.287 6.326 1.00 0.00 C ATOM 0 H ALA A 72 5.673 -13.725 7.518 1.00 0.00 H new ATOM 0 HA ALA A 72 3.235 -15.121 8.426 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.146 -16.266 6.233 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.895 -14.511 6.072 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.467 -15.227 5.647 1.00 0.00 H new ATOM 1229 N LYS A 73 4.520 -17.423 8.247 1.00 0.00 N ATOM 1230 CA LYS A 73 5.324 -18.580 8.624 1.00 0.00 C ATOM 1231 C LYS A 73 4.522 -19.870 8.484 1.00 0.00 C ATOM 1232 O LYS A 73 3.279 -19.805 8.585 1.00 0.00 O ATOM 1233 CB LYS A 73 5.827 -18.432 10.061 1.00 0.00 C ATOM 1234 CG LYS A 73 7.094 -19.221 10.346 1.00 0.00 C ATOM 1235 CD LYS A 73 7.782 -18.733 11.611 1.00 0.00 C ATOM 1236 CE LYS A 73 8.927 -17.782 11.295 1.00 0.00 C ATOM 1237 NZ LYS A 73 8.812 -16.506 12.052 1.00 0.00 N ATOM 1238 OXT LYS A 73 5.143 -20.932 8.273 1.00 0.00 O ATOM 0 H LYS A 73 3.539 -17.633 8.062 1.00 0.00 H new ATOM 0 HA LYS A 73 6.179 -18.631 7.950 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.012 -17.377 10.266 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.044 -18.757 10.746 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.850 -20.278 10.448 1.00 0.00 H new ATOM 0 HG3 LYS A 73 7.777 -19.132 9.501 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.056 -18.230 12.250 1.00 0.00 H new ATOM 0 HD3 LYS A 73 8.162 -19.587 12.172 1.00 0.00 H new ATOM 0 HE2 LYS A 73 9.875 -18.263 11.535 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.939 -17.570 10.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 9.610 -15.885 11.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.919 -16.034 11.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.826 -16.705 13.073 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -8.347 -18.305 -2.956 1.00 0.00 N ATOM 1254 CA MET B 1 -7.322 -18.259 -4.031 1.00 0.00 C ATOM 1255 C MET B 1 -6.552 -19.573 -4.117 1.00 0.00 C ATOM 1256 O MET B 1 -6.146 -20.133 -3.098 1.00 0.00 O ATOM 1257 CB MET B 1 -6.362 -17.104 -3.742 1.00 0.00 C ATOM 1258 CG MET B 1 -5.607 -16.617 -4.969 1.00 0.00 C ATOM 1259 SD MET B 1 -6.033 -14.925 -5.427 1.00 0.00 S ATOM 1260 CE MET B 1 -4.622 -14.482 -6.438 1.00 0.00 C ATOM 0 H1 MET B 1 -8.985 -17.489 -3.050 1.00 0.00 H new ATOM 0 H2 MET B 1 -8.895 -19.185 -3.037 1.00 0.00 H new ATOM 0 H3 MET B 1 -7.879 -18.273 -2.028 1.00 0.00 H new ATOM 0 HA MET B 1 -7.818 -18.105 -4.990 1.00 0.00 H new ATOM 0 HB2 MET B 1 -6.925 -16.272 -3.319 1.00 0.00 H new ATOM 0 HB3 MET B 1 -5.644 -17.420 -2.986 1.00 0.00 H new ATOM 0 HG2 MET B 1 -4.536 -16.678 -4.778 1.00 0.00 H new ATOM 0 HG3 MET B 1 -5.820 -17.280 -5.808 1.00 0.00 H new ATOM 0 HE1 MET B 1 -4.795 -13.509 -6.898 1.00 0.00 H new ATOM 0 HE2 MET B 1 -3.729 -14.435 -5.815 1.00 0.00 H new ATOM 0 HE3 MET B 1 -4.483 -15.232 -7.217 1.00 0.00 H new ATOM 1272 N VAL B 2 -6.356 -20.060 -5.338 1.00 0.00 N ATOM 1273 CA VAL B 2 -5.635 -21.308 -5.556 1.00 0.00 C ATOM 1274 C VAL B 2 -4.178 -21.042 -5.923 1.00 0.00 C ATOM 1275 O VAL B 2 -3.586 -21.766 -6.725 1.00 0.00 O ATOM 1276 CB VAL B 2 -6.289 -22.146 -6.670 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -7.679 -22.599 -6.252 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -6.345 -21.357 -7.969 1.00 0.00 C ATOM 0 H VAL B 2 -6.686 -19.609 -6.191 1.00 0.00 H new ATOM 0 HA VAL B 2 -5.676 -21.866 -4.621 1.00 0.00 H new ATOM 0 HB VAL B 2 -5.679 -23.033 -6.837 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -8.125 -23.190 -7.052 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -7.608 -23.206 -5.349 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -8.302 -21.727 -6.055 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -6.810 -21.965 -8.744 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -6.931 -20.450 -7.819 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -5.334 -21.089 -8.276 1.00 0.00 H new ATOM 1288 N GLU B 3 -3.605 -19.998 -5.333 1.00 0.00 N ATOM 1289 CA GLU B 3 -2.219 -19.636 -5.599 1.00 0.00 C ATOM 1290 C GLU B 3 -1.318 -20.019 -4.429 1.00 0.00 C ATOM 1291 O GLU B 3 -0.281 -20.655 -4.613 1.00 0.00 O ATOM 1292 CB GLU B 3 -2.106 -18.136 -5.875 1.00 0.00 C ATOM 1293 CG GLU B 3 -0.851 -17.751 -6.643 1.00 0.00 C ATOM 1294 CD GLU B 3 -0.881 -16.313 -7.125 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -1.244 -16.088 -8.298 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -0.541 -15.414 -6.329 1.00 0.00 O ATOM 0 H GLU B 3 -4.080 -19.388 -4.667 1.00 0.00 H new ATOM 0 HA GLU B 3 -1.890 -20.187 -6.480 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -2.981 -17.812 -6.439 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -2.121 -17.598 -4.927 1.00 0.00 H new ATOM 0 HG2 GLU B 3 0.021 -17.899 -6.005 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -0.735 -18.415 -7.499 1.00 0.00 H new ATOM 1303 N SER B 4 -1.721 -19.629 -3.223 1.00 0.00 N ATOM 1304 CA SER B 4 -0.952 -19.933 -2.026 1.00 0.00 C ATOM 1305 C SER B 4 -1.882 -20.246 -0.857 1.00 0.00 C ATOM 1306 O SER B 4 -3.045 -20.596 -1.058 1.00 0.00 O ATOM 1307 CB SER B 4 -0.037 -18.755 -1.678 1.00 0.00 C ATOM 1308 OG SER B 4 -0.757 -17.726 -1.021 1.00 0.00 O ATOM 0 H SER B 4 -2.577 -19.101 -3.051 1.00 0.00 H new ATOM 0 HA SER B 4 -0.337 -20.812 -2.220 1.00 0.00 H new ATOM 0 HB2 SER B 4 0.776 -19.099 -1.039 1.00 0.00 H new ATOM 0 HB3 SER B 4 0.417 -18.362 -2.588 1.00 0.00 H new ATOM 0 HG SER B 4 -0.150 -16.987 -0.808 1.00 0.00 H new ATOM 1314 N LYS B 5 -1.365 -20.120 0.360 1.00 0.00 N ATOM 1315 CA LYS B 5 -2.149 -20.389 1.560 1.00 0.00 C ATOM 1316 C LYS B 5 -3.467 -19.619 1.547 1.00 0.00 C ATOM 1317 O LYS B 5 -3.534 -18.479 2.009 1.00 0.00 O ATOM 1318 CB LYS B 5 -1.341 -20.011 2.799 1.00 0.00 C ATOM 1319 CG LYS B 5 -1.532 -20.963 3.968 1.00 0.00 C ATOM 1320 CD LYS B 5 -2.942 -20.880 4.531 1.00 0.00 C ATOM 1321 CE LYS B 5 -3.828 -21.983 3.976 1.00 0.00 C ATOM 1322 NZ LYS B 5 -5.182 -21.972 4.595 1.00 0.00 N ATOM 0 H LYS B 5 -0.403 -19.832 0.542 1.00 0.00 H new ATOM 0 HA LYS B 5 -2.380 -21.454 1.582 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -0.284 -19.980 2.536 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -1.621 -19.005 3.112 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -1.328 -21.984 3.644 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -0.812 -20.727 4.752 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -2.906 -20.953 5.618 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -3.374 -19.909 4.291 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -3.921 -21.865 2.896 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -3.357 -22.950 4.151 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -5.865 -22.411 3.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -5.160 -22.507 5.487 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -5.468 -20.991 4.787 1.00 0.00 H new ATOM 1336 N LYS B 6 -4.512 -20.250 1.020 1.00 0.00 N ATOM 1337 CA LYS B 6 -5.832 -19.629 0.948 1.00 0.00 C ATOM 1338 C LYS B 6 -5.822 -18.427 0.008 1.00 0.00 C ATOM 1339 O LYS B 6 -6.367 -18.486 -1.096 1.00 0.00 O ATOM 1340 CB LYS B 6 -6.299 -19.203 2.342 1.00 0.00 C ATOM 1341 CG LYS B 6 -7.747 -19.562 2.633 1.00 0.00 C ATOM 1342 CD LYS B 6 -8.707 -18.687 1.843 1.00 0.00 C ATOM 1343 CE LYS B 6 -9.219 -19.401 0.602 1.00 0.00 C ATOM 1344 NZ LYS B 6 -9.874 -20.695 0.936 1.00 0.00 N ATOM 0 H LYS B 6 -4.471 -21.194 0.635 1.00 0.00 H new ATOM 0 HA LYS B 6 -6.529 -20.367 0.552 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -5.659 -19.672 3.090 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -6.172 -18.125 2.445 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -7.920 -20.609 2.386 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -7.944 -19.449 3.699 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -9.549 -18.406 2.476 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -8.205 -17.764 1.552 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -9.929 -18.759 0.081 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -8.389 -19.580 -0.082 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -10.649 -20.875 0.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -9.176 -21.464 0.873 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -10.255 -20.652 1.903 1.00 0.00 H new ATOM 1358 N ILE B 7 -5.201 -17.338 0.448 1.00 0.00 N ATOM 1359 CA ILE B 7 -5.124 -16.125 -0.357 1.00 0.00 C ATOM 1360 C ILE B 7 -3.679 -15.782 -0.701 1.00 0.00 C ATOM 1361 O ILE B 7 -2.761 -16.077 0.065 1.00 0.00 O ATOM 1362 CB ILE B 7 -5.763 -14.926 0.368 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -7.139 -15.305 0.917 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -5.870 -13.734 -0.572 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -7.803 -14.193 1.700 1.00 0.00 C ATOM 0 H ILE B 7 -4.744 -17.271 1.357 1.00 0.00 H new ATOM 0 HA ILE B 7 -5.677 -16.323 -1.275 1.00 0.00 H new ATOM 0 HB ILE B 7 -5.125 -14.647 1.206 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -7.786 -15.591 0.088 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -7.037 -16.180 1.559 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -6.324 -12.895 -0.045 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -4.875 -13.452 -0.916 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -6.488 -14.001 -1.429 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -8.775 -14.531 2.059 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -7.176 -13.922 2.549 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -7.937 -13.324 1.056 1.00 0.00 H new ATOM 1377 N ALA B 8 -3.485 -15.157 -1.856 1.00 0.00 N ATOM 1378 CA ALA B 8 -2.152 -14.770 -2.302 1.00 0.00 C ATOM 1379 C ALA B 8 -2.158 -13.358 -2.878 1.00 0.00 C ATOM 1380 O ALA B 8 -3.130 -12.619 -2.723 1.00 0.00 O ATOM 1381 CB ALA B 8 -1.633 -15.762 -3.331 1.00 0.00 C ATOM 0 H ALA B 8 -4.234 -14.907 -2.501 1.00 0.00 H new ATOM 0 HA ALA B 8 -1.487 -14.779 -1.439 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -0.637 -15.462 -3.656 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -1.585 -16.756 -2.886 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -2.304 -15.781 -4.189 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.070 -12.990 -3.544 1.00 0.00 N ATOM 1388 CA LYS B 9 -0.950 -11.668 -4.146 1.00 0.00 C ATOM 1389 C LYS B 9 -1.803 -11.576 -5.404 1.00 0.00 C ATOM 1390 O LYS B 9 -2.013 -12.570 -6.098 1.00 0.00 O ATOM 1391 CB LYS B 9 0.512 -11.371 -4.477 1.00 0.00 C ATOM 1392 CG LYS B 9 1.151 -10.360 -3.540 1.00 0.00 C ATOM 1393 CD LYS B 9 2.239 -10.992 -2.687 1.00 0.00 C ATOM 1394 CE LYS B 9 1.692 -12.122 -1.829 1.00 0.00 C ATOM 1395 NZ LYS B 9 2.771 -13.028 -1.350 1.00 0.00 N ATOM 0 H LYS B 9 -0.257 -13.590 -3.681 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.307 -10.927 -3.431 1.00 0.00 H new ATOM 0 HB2 LYS B 9 1.081 -12.300 -4.439 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.577 -10.999 -5.499 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.575 -9.542 -4.122 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.386 -9.929 -2.894 1.00 0.00 H new ATOM 0 HD2 LYS B 9 3.031 -11.374 -3.331 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.687 -10.232 -2.047 1.00 0.00 H new ATOM 0 HE2 LYS B 9 1.162 -11.704 -0.973 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.965 -12.696 -2.404 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 2.559 -14.004 -1.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 3.680 -12.734 -1.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 2.830 -12.980 -0.313 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.311 -10.382 -5.677 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.166 -10.163 -6.838 1.00 0.00 C ATOM 1411 C LYS B 10 -2.617 -9.072 -7.754 1.00 0.00 C ATOM 1412 O LYS B 10 -2.228 -8.004 -7.293 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.552 -9.754 -6.358 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.378 -10.897 -5.790 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.252 -10.431 -4.634 1.00 0.00 C ATOM 1416 CE LYS B 10 -7.631 -11.069 -4.686 1.00 0.00 C ATOM 1417 NZ LYS B 10 -7.746 -12.222 -3.751 1.00 0.00 N ATOM 0 H LYS B 10 -2.147 -9.550 -5.111 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.206 -11.091 -7.408 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.447 -8.983 -5.595 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.095 -9.307 -7.191 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.005 -11.319 -6.575 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -4.715 -11.692 -5.449 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -5.770 -10.680 -3.689 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.350 -9.346 -4.665 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.386 -10.323 -4.437 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -7.838 -11.404 -5.702 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -8.750 -12.435 -3.584 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -7.280 -13.054 -4.167 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -7.288 -11.984 -2.848 1.00 0.00 H new ATOM 1431 N LYS B 11 -2.615 -9.325 -9.057 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.138 -8.327 -10.006 1.00 0.00 C ATOM 1433 C LYS B 11 -3.104 -7.151 -10.036 1.00 0.00 C ATOM 1434 O LYS B 11 -4.216 -7.265 -10.553 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.002 -8.927 -11.405 1.00 0.00 C ATOM 1436 CG LYS B 11 -0.805 -9.853 -11.562 1.00 0.00 C ATOM 1437 CD LYS B 11 -0.798 -10.948 -10.507 1.00 0.00 C ATOM 1438 CE LYS B 11 0.334 -11.935 -10.738 1.00 0.00 C ATOM 1439 NZ LYS B 11 0.260 -12.558 -12.090 1.00 0.00 N ATOM 0 H LYS B 11 -2.933 -10.199 -9.476 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.154 -7.984 -9.686 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.911 -9.480 -11.643 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.921 -8.118 -12.131 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -0.822 -10.304 -12.554 1.00 0.00 H new ATOM 0 HG3 LYS B 11 0.115 -9.273 -11.491 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.697 -10.501 -9.518 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -1.752 -11.476 -10.522 1.00 0.00 H new ATOM 0 HE2 LYS B 11 1.290 -11.424 -10.626 1.00 0.00 H new ATOM 0 HE3 LYS B 11 0.298 -12.714 -9.977 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 0.824 -13.431 -12.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -0.730 -12.783 -12.315 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 0.634 -11.895 -12.799 1.00 0.00 H new ATOM 1453 N THR B 12 -2.687 -6.027 -9.464 1.00 0.00 N ATOM 1454 CA THR B 12 -3.537 -4.845 -9.417 1.00 0.00 C ATOM 1455 C THR B 12 -2.884 -3.655 -10.115 1.00 0.00 C ATOM 1456 O THR B 12 -1.662 -3.519 -10.116 1.00 0.00 O ATOM 1457 CB THR B 12 -3.870 -4.488 -7.969 1.00 0.00 C ATOM 1458 OG1 THR B 12 -4.540 -5.560 -7.331 1.00 0.00 O ATOM 1459 CG2 THR B 12 -4.743 -3.258 -7.837 1.00 0.00 C ATOM 0 H THR B 12 -1.772 -5.910 -9.029 1.00 0.00 H new ATOM 0 HA THR B 12 -4.459 -5.079 -9.949 1.00 0.00 H new ATOM 0 HB THR B 12 -2.910 -4.282 -7.496 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.420 -5.490 -6.361 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.940 -3.063 -6.783 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.232 -2.401 -8.275 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.686 -3.424 -8.358 1.00 0.00 H new ATOM 1467 N THR B 13 -3.709 -2.800 -10.713 1.00 0.00 N ATOM 1468 CA THR B 13 -3.210 -1.627 -11.420 1.00 0.00 C ATOM 1469 C THR B 13 -3.334 -0.363 -10.583 1.00 0.00 C ATOM 1470 O THR B 13 -4.283 -0.192 -9.818 1.00 0.00 O ATOM 1471 CB THR B 13 -3.958 -1.423 -12.735 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.500 -2.642 -13.206 1.00 0.00 O ATOM 1473 CG2 THR B 13 -3.084 -0.849 -13.827 1.00 0.00 C ATOM 0 H THR B 13 -4.724 -2.898 -10.722 1.00 0.00 H new ATOM 0 HA THR B 13 -2.155 -1.812 -11.621 1.00 0.00 H new ATOM 0 HB THR B 13 -4.751 -0.710 -12.511 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.976 -2.485 -14.048 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.672 -0.727 -14.737 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.697 0.120 -13.512 1.00 0.00 H new ATOM 0 HG23 THR B 13 -2.252 -1.526 -14.021 1.00 0.00 H new ATOM 1481 N LEU B 14 -2.372 0.529 -10.765 1.00 0.00 N ATOM 1482 CA LEU B 14 -2.351 1.804 -10.070 1.00 0.00 C ATOM 1483 C LEU B 14 -1.833 2.879 -11.019 1.00 0.00 C ATOM 1484 O LEU B 14 -0.799 2.700 -11.663 1.00 0.00 O ATOM 1485 CB LEU B 14 -1.475 1.722 -8.814 1.00 0.00 C ATOM 1486 CG LEU B 14 -1.559 0.399 -8.043 1.00 0.00 C ATOM 1487 CD1 LEU B 14 -0.238 0.094 -7.352 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -2.699 0.430 -7.032 1.00 0.00 C ATOM 0 H LEU B 14 -1.585 0.388 -11.399 1.00 0.00 H new ATOM 0 HA LEU B 14 -3.362 2.059 -9.752 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.438 1.890 -9.103 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.754 2.534 -8.142 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.763 -0.397 -8.760 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -0.320 -0.849 -6.811 1.00 0.00 H new ATOM 0 HD12 LEU B 14 0.553 0.017 -8.098 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -0.000 0.895 -6.652 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -2.738 -0.520 -6.498 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -2.533 1.239 -6.321 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.643 0.592 -7.553 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.567 3.980 -11.136 1.00 0.00 N ATOM 1501 CA ALA B 15 -2.180 5.051 -12.048 1.00 0.00 C ATOM 1502 C ALA B 15 -1.225 6.046 -11.396 1.00 0.00 C ATOM 1503 O ALA B 15 -1.645 7.004 -10.751 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.414 5.768 -12.573 1.00 0.00 C ATOM 0 H ALA B 15 -3.427 4.154 -10.615 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.649 4.592 -12.882 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -3.111 6.565 -13.252 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -4.048 5.059 -13.106 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.969 6.195 -11.738 1.00 0.00 H new ATOM 1510 N PHE B 16 0.060 5.800 -11.604 1.00 0.00 N ATOM 1511 CA PHE B 16 1.142 6.631 -11.088 1.00 0.00 C ATOM 1512 C PHE B 16 2.452 6.046 -11.559 1.00 0.00 C ATOM 1513 O PHE B 16 2.463 5.023 -12.228 1.00 0.00 O ATOM 1514 CB PHE B 16 1.159 6.745 -9.559 1.00 0.00 C ATOM 1515 CG PHE B 16 0.199 7.766 -9.013 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.384 9.114 -9.272 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.886 7.379 -8.242 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -0.494 10.057 -8.774 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.768 8.318 -7.740 1.00 0.00 C ATOM 1520 CZ PHE B 16 -1.571 9.659 -8.006 1.00 0.00 C ATOM 0 H PHE B 16 0.388 5.001 -12.147 1.00 0.00 H new ATOM 0 HA PHE B 16 0.985 7.641 -11.467 1.00 0.00 H new ATOM 0 HB2 PHE B 16 0.922 5.772 -9.129 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.168 7.000 -9.235 1.00 0.00 H new ATOM 0 HD1 PHE B 16 1.225 9.432 -9.871 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -1.044 6.332 -8.031 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -0.339 11.105 -8.985 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -2.610 8.003 -7.141 1.00 0.00 H new ATOM 0 HZ PHE B 16 -2.258 10.395 -7.614 1.00 0.00 H new ATOM 1530 N ASP B 17 3.541 6.710 -11.239 1.00 0.00 N ATOM 1531 CA ASP B 17 4.870 6.267 -11.640 1.00 0.00 C ATOM 1532 C ASP B 17 5.771 7.452 -11.720 1.00 0.00 C ATOM 1533 O ASP B 17 6.940 7.390 -11.362 1.00 0.00 O ATOM 1534 CB ASP B 17 4.862 5.585 -12.997 1.00 0.00 C ATOM 1535 CG ASP B 17 4.828 4.073 -12.891 1.00 0.00 C ATOM 1536 OD1 ASP B 17 5.205 3.400 -13.874 1.00 0.00 O ATOM 1537 OD2 ASP B 17 4.425 3.562 -11.825 1.00 0.00 O ATOM 0 H ASP B 17 3.537 7.572 -10.694 1.00 0.00 H new ATOM 0 HA ASP B 17 5.216 5.548 -10.897 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.996 5.925 -13.565 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.748 5.886 -13.556 1.00 0.00 H new ATOM 1542 N GLU B 18 5.229 8.544 -12.198 1.00 0.00 N ATOM 1543 CA GLU B 18 6.017 9.731 -12.321 1.00 0.00 C ATOM 1544 C GLU B 18 6.864 9.904 -11.062 1.00 0.00 C ATOM 1545 O GLU B 18 8.098 9.901 -11.113 1.00 0.00 O ATOM 1546 CB GLU B 18 5.135 10.960 -12.533 1.00 0.00 C ATOM 1547 CG GLU B 18 5.793 12.043 -13.371 1.00 0.00 C ATOM 1548 CD GLU B 18 6.543 13.057 -12.528 1.00 0.00 C ATOM 1549 OE1 GLU B 18 6.020 13.443 -11.462 1.00 0.00 O ATOM 1550 OE2 GLU B 18 7.651 13.463 -12.934 1.00 0.00 O ATOM 0 H GLU B 18 4.259 8.630 -12.503 1.00 0.00 H new ATOM 0 HA GLU B 18 6.665 9.632 -13.192 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.207 10.652 -13.015 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.867 11.376 -11.562 1.00 0.00 H new ATOM 0 HG2 GLU B 18 6.483 11.582 -14.078 1.00 0.00 H new ATOM 0 HG3 GLU B 18 5.031 12.556 -13.958 1.00 0.00 H new ATOM 1557 N ASP B 19 6.182 10.007 -9.922 1.00 0.00 N ATOM 1558 CA ASP B 19 6.864 10.157 -8.644 1.00 0.00 C ATOM 1559 C ASP B 19 7.244 8.811 -8.050 1.00 0.00 C ATOM 1560 O ASP B 19 8.407 8.575 -7.726 1.00 0.00 O ATOM 1561 CB ASP B 19 5.989 10.938 -7.662 1.00 0.00 C ATOM 1562 CG ASP B 19 6.426 12.384 -7.522 1.00 0.00 C ATOM 1563 OD1 ASP B 19 7.003 12.926 -8.488 1.00 0.00 O ATOM 1564 OD2 ASP B 19 6.191 12.973 -6.446 1.00 0.00 O ATOM 0 H ASP B 19 5.164 9.989 -9.860 1.00 0.00 H new ATOM 0 HA ASP B 19 7.784 10.714 -8.825 1.00 0.00 H new ATOM 0 HB2 ASP B 19 4.953 10.905 -7.998 1.00 0.00 H new ATOM 0 HB3 ASP B 19 6.023 10.455 -6.686 1.00 0.00 H new ATOM 1569 N VAL B 20 6.264 7.931 -7.898 1.00 0.00 N ATOM 1570 CA VAL B 20 6.521 6.619 -7.328 1.00 0.00 C ATOM 1571 C VAL B 20 7.584 5.873 -8.130 1.00 0.00 C ATOM 1572 O VAL B 20 8.483 5.268 -7.555 1.00 0.00 O ATOM 1573 CB VAL B 20 5.234 5.773 -7.222 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.153 6.550 -6.489 1.00 0.00 C ATOM 1575 CG2 VAL B 20 4.742 5.343 -8.593 1.00 0.00 C ATOM 0 H VAL B 20 5.293 8.101 -8.159 1.00 0.00 H new ATOM 0 HA VAL B 20 6.895 6.779 -6.317 1.00 0.00 H new ATOM 0 HB VAL B 20 5.468 4.872 -6.654 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.251 5.942 -6.421 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.500 6.798 -5.486 1.00 0.00 H new ATOM 0 HG13 VAL B 20 3.932 7.468 -7.034 1.00 0.00 H new ATOM 0 HG21 VAL B 20 3.835 4.749 -8.484 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.528 6.225 -9.196 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.510 4.745 -9.084 1.00 0.00 H new ATOM 1585 N TYR B 21 7.500 5.936 -9.459 1.00 0.00 N ATOM 1586 CA TYR B 21 8.488 5.268 -10.304 1.00 0.00 C ATOM 1587 C TYR B 21 9.858 5.919 -10.146 1.00 0.00 C ATOM 1588 O TYR B 21 10.851 5.221 -9.945 1.00 0.00 O ATOM 1589 CB TYR B 21 8.076 5.255 -11.783 1.00 0.00 C ATOM 1590 CG TYR B 21 8.718 4.140 -12.576 1.00 0.00 C ATOM 1591 CD1 TYR B 21 9.962 4.312 -13.171 1.00 0.00 C ATOM 1592 CD2 TYR B 21 8.081 2.914 -12.728 1.00 0.00 C ATOM 1593 CE1 TYR B 21 10.552 3.295 -13.896 1.00 0.00 C ATOM 1594 CE2 TYR B 21 8.667 1.892 -13.452 1.00 0.00 C ATOM 1595 CZ TYR B 21 9.901 2.087 -14.034 1.00 0.00 C ATOM 1596 OH TYR B 21 10.486 1.072 -14.755 1.00 0.00 O ATOM 0 H TYR B 21 6.770 6.435 -9.967 1.00 0.00 H new ATOM 0 HA TYR B 21 8.542 4.232 -9.971 1.00 0.00 H new ATOM 0 HB2 TYR B 21 6.992 5.161 -11.850 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.341 6.211 -12.235 1.00 0.00 H new ATOM 0 HD1 TYR B 21 10.476 5.256 -13.065 1.00 0.00 H new ATOM 0 HD2 TYR B 21 7.114 2.757 -12.274 1.00 0.00 H new ATOM 0 HE1 TYR B 21 11.519 3.445 -14.353 1.00 0.00 H new ATOM 0 HE2 TYR B 21 8.160 0.945 -13.561 1.00 0.00 H new ATOM 0 HH TYR B 21 9.897 0.289 -14.754 1.00 0.00 H new ATOM 1606 N HIS B 22 9.929 7.256 -10.218 1.00 0.00 N ATOM 1607 CA HIS B 22 11.217 7.925 -10.056 1.00 0.00 C ATOM 1608 C HIS B 22 11.750 7.690 -8.651 1.00 0.00 C ATOM 1609 O HIS B 22 12.913 7.331 -8.471 1.00 0.00 O ATOM 1610 CB HIS B 22 11.103 9.424 -10.339 1.00 0.00 C ATOM 1611 CG HIS B 22 11.724 9.837 -11.637 1.00 0.00 C ATOM 1612 ND1 HIS B 22 11.273 10.908 -12.380 1.00 0.00 N ATOM 1613 CD2 HIS B 22 12.772 9.321 -12.324 1.00 0.00 C ATOM 1614 CE1 HIS B 22 12.014 11.031 -13.468 1.00 0.00 C ATOM 1615 NE2 HIS B 22 12.930 10.081 -13.456 1.00 0.00 N ATOM 0 H HIS B 22 9.135 7.874 -10.382 1.00 0.00 H new ATOM 0 HA HIS B 22 11.915 7.502 -10.779 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.050 9.705 -10.344 1.00 0.00 H new ATOM 0 HB3 HIS B 22 11.577 9.976 -9.527 1.00 0.00 H new ATOM 0 HD2 HIS B 22 13.371 8.470 -12.035 1.00 0.00 H new ATOM 0 HE1 HIS B 22 11.891 11.781 -14.235 1.00 0.00 H new ATOM 0 HE2 HIS B 22 13.641 9.935 -14.173 1.00 0.00 H new ATOM 1624 N THR B 23 10.890 7.873 -7.654 1.00 0.00 N ATOM 1625 CA THR B 23 11.289 7.652 -6.272 1.00 0.00 C ATOM 1626 C THR B 23 11.709 6.200 -6.084 1.00 0.00 C ATOM 1627 O THR B 23 12.694 5.904 -5.407 1.00 0.00 O ATOM 1628 CB THR B 23 10.157 7.995 -5.313 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.001 7.234 -5.609 1.00 0.00 O ATOM 1630 CG2 THR B 23 9.767 9.457 -5.339 1.00 0.00 C ATOM 0 H THR B 23 9.922 8.171 -7.777 1.00 0.00 H new ATOM 0 HA THR B 23 12.132 8.306 -6.049 1.00 0.00 H new ATOM 0 HB THR B 23 10.541 7.759 -4.320 1.00 0.00 H new ATOM 0 HG1 THR B 23 8.607 7.551 -6.449 1.00 0.00 H new ATOM 0 HG21 THR B 23 8.955 9.630 -4.632 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.626 10.068 -5.061 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.438 9.728 -6.342 1.00 0.00 H new ATOM 1638 N LEU B 24 10.969 5.293 -6.720 1.00 0.00 N ATOM 1639 CA LEU B 24 11.287 3.873 -6.652 1.00 0.00 C ATOM 1640 C LEU B 24 12.714 3.639 -7.139 1.00 0.00 C ATOM 1641 O LEU B 24 13.312 2.601 -6.864 1.00 0.00 O ATOM 1642 CB LEU B 24 10.306 3.051 -7.494 1.00 0.00 C ATOM 1643 CG LEU B 24 9.304 2.212 -6.693 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.016 1.400 -5.625 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.242 3.098 -6.061 1.00 0.00 C ATOM 0 H LEU B 24 10.150 5.517 -7.285 1.00 0.00 H new ATOM 0 HA LEU B 24 11.200 3.550 -5.615 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.751 3.729 -8.142 1.00 0.00 H new ATOM 0 HB3 LEU B 24 10.877 2.386 -8.142 1.00 0.00 H new ATOM 0 HG LEU B 24 8.814 1.524 -7.382 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.286 0.812 -5.068 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.737 0.732 -6.096 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.536 2.073 -4.943 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.542 2.481 -5.498 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.717 3.813 -5.390 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.705 3.636 -6.842 1.00 0.00 H new ATOM 1657 N LYS B 25 13.248 4.615 -7.872 1.00 0.00 N ATOM 1658 CA LYS B 25 14.594 4.517 -8.406 1.00 0.00 C ATOM 1659 C LYS B 25 15.644 4.520 -7.301 1.00 0.00 C ATOM 1660 O LYS B 25 16.542 3.677 -7.298 1.00 0.00 O ATOM 1661 CB LYS B 25 14.866 5.654 -9.392 1.00 0.00 C ATOM 1662 CG LYS B 25 16.106 5.438 -10.245 1.00 0.00 C ATOM 1663 CD LYS B 25 16.035 4.129 -11.015 1.00 0.00 C ATOM 1664 CE LYS B 25 16.963 3.078 -10.425 1.00 0.00 C ATOM 1665 NZ LYS B 25 17.806 2.431 -11.469 1.00 0.00 N ATOM 0 H LYS B 25 12.764 5.481 -8.107 1.00 0.00 H new ATOM 0 HA LYS B 25 14.665 3.564 -8.931 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.002 5.771 -10.046 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.975 6.586 -8.837 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.216 6.267 -10.945 1.00 0.00 H new ATOM 0 HG3 LYS B 25 16.991 5.439 -9.608 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.011 3.756 -11.006 1.00 0.00 H new ATOM 0 HD3 LYS B 25 16.301 4.305 -12.057 1.00 0.00 H new ATOM 0 HE2 LYS B 25 17.605 3.541 -9.675 1.00 0.00 H new ATOM 0 HE3 LYS B 25 16.372 2.318 -9.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 18.424 1.721 -11.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 17.194 1.967 -12.171 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 18.389 3.152 -11.940 1.00 0.00 H new ATOM 1679 N LEU B 26 15.541 5.457 -6.357 1.00 0.00 N ATOM 1680 CA LEU B 26 16.514 5.507 -5.269 1.00 0.00 C ATOM 1681 C LEU B 26 16.310 4.321 -4.348 1.00 0.00 C ATOM 1682 O LEU B 26 17.261 3.641 -3.977 1.00 0.00 O ATOM 1683 CB LEU B 26 16.441 6.810 -4.466 1.00 0.00 C ATOM 1684 CG LEU B 26 15.850 8.004 -5.202 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.346 7.991 -5.053 1.00 0.00 C ATOM 1686 CD2 LEU B 26 16.436 9.306 -4.673 1.00 0.00 C ATOM 0 H LEU B 26 14.815 6.172 -6.323 1.00 0.00 H new ATOM 0 HA LEU B 26 17.505 5.468 -5.721 1.00 0.00 H new ATOM 0 HB2 LEU B 26 15.849 6.630 -3.569 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.447 7.070 -4.137 1.00 0.00 H new ATOM 0 HG LEU B 26 16.103 7.933 -6.260 1.00 0.00 H new ATOM 0 HD11 LEU B 26 13.921 8.845 -5.579 1.00 0.00 H new ATOM 0 HD12 LEU B 26 13.946 7.069 -5.475 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.085 8.049 -3.996 1.00 0.00 H new ATOM 0 HD21 LEU B 26 16.000 10.147 -5.213 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.211 9.401 -3.611 1.00 0.00 H new ATOM 0 HD23 LEU B 26 17.516 9.304 -4.817 1.00 0.00 H new ATOM 1698 N VAL B 27 15.057 4.070 -3.998 1.00 0.00 N ATOM 1699 CA VAL B 27 14.722 2.949 -3.129 1.00 0.00 C ATOM 1700 C VAL B 27 15.115 1.634 -3.768 1.00 0.00 C ATOM 1701 O VAL B 27 15.640 0.747 -3.103 1.00 0.00 O ATOM 1702 CB VAL B 27 13.222 2.884 -2.793 1.00 0.00 C ATOM 1703 CG1 VAL B 27 12.958 3.368 -1.382 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.423 3.676 -3.780 1.00 0.00 C ATOM 0 H VAL B 27 14.257 4.625 -4.301 1.00 0.00 H new ATOM 0 HA VAL B 27 15.281 3.112 -2.208 1.00 0.00 H new ATOM 0 HB VAL B 27 12.910 1.842 -2.856 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.890 3.311 -1.172 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.501 2.741 -0.675 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.293 4.401 -1.283 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.365 3.616 -3.523 1.00 0.00 H new ATOM 0 HG22 VAL B 27 12.744 4.717 -3.756 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.577 3.272 -4.781 1.00 0.00 H new ATOM 1714 N SER B 28 14.845 1.495 -5.056 1.00 0.00 N ATOM 1715 CA SER B 28 15.170 0.256 -5.732 1.00 0.00 C ATOM 1716 C SER B 28 16.674 0.018 -5.748 1.00 0.00 C ATOM 1717 O SER B 28 17.134 -1.114 -5.582 1.00 0.00 O ATOM 1718 CB SER B 28 14.613 0.245 -7.157 1.00 0.00 C ATOM 1719 OG SER B 28 14.905 -0.978 -7.809 1.00 0.00 O ATOM 0 H SER B 28 14.411 2.209 -5.641 1.00 0.00 H new ATOM 0 HA SER B 28 14.702 -0.555 -5.175 1.00 0.00 H new ATOM 0 HB2 SER B 28 13.534 0.398 -7.130 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.038 1.073 -7.724 1.00 0.00 H new ATOM 0 HG SER B 28 14.511 -1.720 -7.304 1.00 0.00 H new ATOM 1725 N VAL B 29 17.434 1.089 -5.936 1.00 0.00 N ATOM 1726 CA VAL B 29 18.883 1.005 -5.966 1.00 0.00 C ATOM 1727 C VAL B 29 19.438 0.930 -4.550 1.00 0.00 C ATOM 1728 O VAL B 29 20.305 0.110 -4.245 1.00 0.00 O ATOM 1729 CB VAL B 29 19.475 2.226 -6.710 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.318 3.101 -5.795 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.278 1.778 -7.922 1.00 0.00 C ATOM 0 H VAL B 29 17.065 2.030 -6.071 1.00 0.00 H new ATOM 0 HA VAL B 29 19.168 0.099 -6.500 1.00 0.00 H new ATOM 0 HB VAL B 29 18.638 2.834 -7.052 1.00 0.00 H new ATOM 0 HG11 VAL B 29 20.712 3.945 -6.361 1.00 0.00 H new ATOM 0 HG12 VAL B 29 19.702 3.470 -4.975 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.145 2.516 -5.392 1.00 0.00 H new ATOM 0 HG21 VAL B 29 20.686 2.651 -8.431 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.095 1.132 -7.599 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.630 1.229 -8.605 1.00 0.00 H new ATOM 1741 N TYR B 30 18.928 1.803 -3.693 1.00 0.00 N ATOM 1742 CA TYR B 30 19.363 1.860 -2.305 1.00 0.00 C ATOM 1743 C TYR B 30 18.851 0.666 -1.508 1.00 0.00 C ATOM 1744 O TYR B 30 19.455 0.283 -0.507 1.00 0.00 O ATOM 1745 CB TYR B 30 18.894 3.159 -1.645 1.00 0.00 C ATOM 1746 CG TYR B 30 19.748 4.358 -1.993 1.00 0.00 C ATOM 1747 CD1 TYR B 30 19.213 5.445 -2.672 1.00 0.00 C ATOM 1748 CD2 TYR B 30 21.092 4.402 -1.640 1.00 0.00 C ATOM 1749 CE1 TYR B 30 19.992 6.541 -2.991 1.00 0.00 C ATOM 1750 CE2 TYR B 30 21.877 5.494 -1.955 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.323 6.561 -2.630 1.00 0.00 C ATOM 1752 OH TYR B 30 22.102 7.649 -2.946 1.00 0.00 O ATOM 0 H TYR B 30 18.209 2.485 -3.936 1.00 0.00 H new ATOM 0 HA TYR B 30 20.453 1.830 -2.306 1.00 0.00 H new ATOM 0 HB2 TYR B 30 17.865 3.358 -1.944 1.00 0.00 H new ATOM 0 HB3 TYR B 30 18.892 3.027 -0.563 1.00 0.00 H new ATOM 0 HD1 TYR B 30 18.171 5.434 -2.955 1.00 0.00 H new ATOM 0 HD2 TYR B 30 21.530 3.568 -1.111 1.00 0.00 H new ATOM 0 HE1 TYR B 30 19.561 7.378 -3.520 1.00 0.00 H new ATOM 0 HE2 TYR B 30 22.920 5.512 -1.674 1.00 0.00 H new ATOM 0 HH TYR B 30 23.015 7.504 -2.619 1.00 0.00 H new ATOM 1762 N LEU B 31 17.738 0.073 -1.944 1.00 0.00 N ATOM 1763 CA LEU B 31 17.184 -1.073 -1.238 1.00 0.00 C ATOM 1764 C LEU B 31 17.376 -2.352 -2.049 1.00 0.00 C ATOM 1765 O LEU B 31 17.006 -3.438 -1.601 1.00 0.00 O ATOM 1766 CB LEU B 31 15.689 -0.869 -0.940 1.00 0.00 C ATOM 1767 CG LEU B 31 15.261 0.511 -0.394 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.225 0.349 0.709 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.448 1.319 0.118 1.00 0.00 C ATOM 0 H LEU B 31 17.213 0.364 -2.769 1.00 0.00 H new ATOM 0 HA LEU B 31 17.719 -1.167 -0.293 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.133 -1.057 -1.858 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.381 -1.628 -0.220 1.00 0.00 H new ATOM 0 HG LEU B 31 14.821 1.063 -1.224 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.935 1.331 1.082 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.348 -0.162 0.312 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.649 -0.238 1.524 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.099 2.281 0.492 1.00 0.00 H new ATOM 0 HD22 LEU B 31 16.939 0.773 0.924 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.156 1.481 -0.695 1.00 0.00 H new ATOM 1781 N ASN B 32 17.946 -2.222 -3.249 1.00 0.00 N ATOM 1782 CA ASN B 32 18.166 -3.375 -4.114 1.00 0.00 C ATOM 1783 C ASN B 32 16.878 -4.173 -4.243 1.00 0.00 C ATOM 1784 O ASN B 32 16.893 -5.403 -4.298 1.00 0.00 O ATOM 1785 CB ASN B 32 19.280 -4.261 -3.552 1.00 0.00 C ATOM 1786 CG ASN B 32 20.650 -3.622 -3.680 1.00 0.00 C ATOM 1787 OD1 ASN B 32 21.321 -3.762 -4.703 1.00 0.00 O ATOM 1788 ND2 ASN B 32 21.073 -2.917 -2.638 1.00 0.00 N ATOM 0 H ASN B 32 18.261 -1.334 -3.639 1.00 0.00 H new ATOM 0 HA ASN B 32 18.470 -3.023 -5.100 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.077 -4.472 -2.502 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.278 -5.217 -4.075 1.00 0.00 H new ATOM 0 HD21 ASN B 32 21.987 -2.465 -2.665 1.00 0.00 H new ATOM 0 HD22 ASN B 32 20.484 -2.827 -1.810 1.00 0.00 H new ATOM 1795 N ARG B 33 15.761 -3.455 -4.267 1.00 0.00 N ATOM 1796 CA ARG B 33 14.449 -4.083 -4.363 1.00 0.00 C ATOM 1797 C ARG B 33 13.667 -3.571 -5.565 1.00 0.00 C ATOM 1798 O ARG B 33 13.704 -2.382 -5.882 1.00 0.00 O ATOM 1799 CB ARG B 33 13.653 -3.812 -3.084 1.00 0.00 C ATOM 1800 CG ARG B 33 14.184 -4.553 -1.868 1.00 0.00 C ATOM 1801 CD ARG B 33 13.058 -5.003 -0.951 1.00 0.00 C ATOM 1802 NE ARG B 33 13.226 -6.388 -0.516 1.00 0.00 N ATOM 1803 CZ ARG B 33 14.175 -6.790 0.326 1.00 0.00 C ATOM 1804 NH1 ARG B 33 15.039 -5.916 0.827 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.261 -8.068 0.669 1.00 0.00 N ATOM 0 H ARG B 33 15.738 -2.436 -4.221 1.00 0.00 H new ATOM 0 HA ARG B 33 14.601 -5.155 -4.490 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.663 -2.741 -2.880 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.613 -4.096 -3.246 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.759 -5.421 -2.192 1.00 0.00 H new ATOM 0 HG3 ARG B 33 14.867 -3.906 -1.317 1.00 0.00 H new ATOM 0 HD2 ARG B 33 13.019 -4.351 -0.078 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.105 -4.899 -1.469 1.00 0.00 H new ATOM 0 HE ARG B 33 12.578 -7.087 -0.879 1.00 0.00 H new ATOM 0 HH11 ARG B 33 14.977 -4.932 0.567 1.00 0.00 H new ATOM 0 HH12 ARG B 33 15.765 -6.229 1.472 1.00 0.00 H new ATOM 0 HH21 ARG B 33 13.599 -8.744 0.287 1.00 0.00 H new ATOM 0 HH22 ARG B 33 14.989 -8.375 1.314 1.00 0.00 H new ATOM 1819 N ASP B 34 12.937 -4.471 -6.216 1.00 0.00 N ATOM 1820 CA ASP B 34 12.121 -4.102 -7.365 1.00 0.00 C ATOM 1821 C ASP B 34 11.130 -3.021 -6.956 1.00 0.00 C ATOM 1822 O ASP B 34 10.899 -2.807 -5.766 1.00 0.00 O ATOM 1823 CB ASP B 34 11.377 -5.322 -7.911 1.00 0.00 C ATOM 1824 CG ASP B 34 12.315 -6.355 -8.501 1.00 0.00 C ATOM 1825 OD1 ASP B 34 12.705 -7.289 -7.769 1.00 0.00 O ATOM 1826 OD2 ASP B 34 12.659 -6.231 -9.696 1.00 0.00 O ATOM 0 H ASP B 34 12.894 -5.459 -5.967 1.00 0.00 H new ATOM 0 HA ASP B 34 12.770 -3.719 -8.153 1.00 0.00 H new ATOM 0 HB2 ASP B 34 10.796 -5.779 -7.110 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.669 -5.000 -8.675 1.00 0.00 H new ATOM 1831 N MET B 35 10.548 -2.332 -7.930 1.00 0.00 N ATOM 1832 CA MET B 35 9.600 -1.284 -7.630 1.00 0.00 C ATOM 1833 C MET B 35 8.382 -1.856 -6.906 1.00 0.00 C ATOM 1834 O MET B 35 7.892 -1.269 -5.941 1.00 0.00 O ATOM 1835 CB MET B 35 9.196 -0.559 -8.915 1.00 0.00 C ATOM 1836 CG MET B 35 7.735 -0.173 -8.963 1.00 0.00 C ATOM 1837 SD MET B 35 7.394 1.128 -10.164 1.00 0.00 S ATOM 1838 CE MET B 35 6.242 0.296 -11.253 1.00 0.00 C ATOM 0 H MET B 35 10.718 -2.483 -8.924 1.00 0.00 H new ATOM 0 HA MET B 35 10.069 -0.559 -6.965 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.804 0.340 -9.021 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.422 -1.198 -9.768 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.140 -1.052 -9.208 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.419 0.160 -7.974 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.327 0.710 -12.258 1.00 0.00 H new ATOM 0 HE2 MET B 35 6.470 -0.769 -11.279 1.00 0.00 H new ATOM 0 HE3 MET B 35 5.226 0.440 -10.886 1.00 0.00 H new ATOM 1848 N THR B 36 7.903 -3.011 -7.366 1.00 0.00 N ATOM 1849 CA THR B 36 6.751 -3.650 -6.738 1.00 0.00 C ATOM 1850 C THR B 36 7.135 -4.200 -5.371 1.00 0.00 C ATOM 1851 O THR B 36 6.317 -4.235 -4.454 1.00 0.00 O ATOM 1852 CB THR B 36 6.192 -4.779 -7.614 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.239 -5.572 -8.143 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.351 -4.297 -8.776 1.00 0.00 C ATOM 0 H THR B 36 8.290 -3.517 -8.162 1.00 0.00 H new ATOM 0 HA THR B 36 5.975 -2.894 -6.619 1.00 0.00 H new ATOM 0 HB THR B 36 5.552 -5.357 -6.947 1.00 0.00 H new ATOM 0 HG1 THR B 36 6.860 -6.287 -8.697 1.00 0.00 H new ATOM 0 HG21 THR B 36 4.993 -5.154 -9.346 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.499 -3.731 -8.399 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.954 -3.658 -9.421 1.00 0.00 H new ATOM 1862 N GLU B 37 8.389 -4.621 -5.239 1.00 0.00 N ATOM 1863 CA GLU B 37 8.883 -5.159 -3.979 1.00 0.00 C ATOM 1864 C GLU B 37 9.020 -4.047 -2.946 1.00 0.00 C ATOM 1865 O GLU B 37 8.750 -4.245 -1.761 1.00 0.00 O ATOM 1866 CB GLU B 37 10.232 -5.850 -4.185 1.00 0.00 C ATOM 1867 CG GLU B 37 10.572 -6.851 -3.094 1.00 0.00 C ATOM 1868 CD GLU B 37 9.814 -8.155 -3.244 1.00 0.00 C ATOM 1869 OE1 GLU B 37 8.612 -8.108 -3.582 1.00 0.00 O ATOM 1870 OE2 GLU B 37 10.421 -9.224 -3.023 1.00 0.00 O ATOM 0 H GLU B 37 9.080 -4.600 -5.989 1.00 0.00 H new ATOM 0 HA GLU B 37 8.165 -5.893 -3.614 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.226 -6.361 -5.148 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.016 -5.094 -4.231 1.00 0.00 H new ATOM 0 HG2 GLU B 37 11.643 -7.053 -3.112 1.00 0.00 H new ATOM 0 HG3 GLU B 37 10.347 -6.414 -2.121 1.00 0.00 H new ATOM 1877 N ILE B 38 9.434 -2.872 -3.409 1.00 0.00 N ATOM 1878 CA ILE B 38 9.602 -1.719 -2.536 1.00 0.00 C ATOM 1879 C ILE B 38 8.248 -1.121 -2.177 1.00 0.00 C ATOM 1880 O ILE B 38 7.933 -0.947 -1.002 1.00 0.00 O ATOM 1881 CB ILE B 38 10.479 -0.635 -3.200 1.00 0.00 C ATOM 1882 CG1 ILE B 38 11.973 -0.905 -2.976 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.132 0.752 -2.683 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.321 -1.240 -1.541 1.00 0.00 C ATOM 0 H ILE B 38 9.660 -2.694 -4.388 1.00 0.00 H new ATOM 0 HA ILE B 38 10.100 -2.064 -1.630 1.00 0.00 H new ATOM 0 HB ILE B 38 10.272 -0.675 -4.269 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.285 -1.729 -3.618 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.542 -0.028 -3.284 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.767 1.491 -3.170 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.087 0.971 -2.902 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.293 0.789 -1.606 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.393 -1.418 -1.459 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.041 -0.408 -0.895 1.00 0.00 H new ATOM 0 HD13 ILE B 38 11.780 -2.135 -1.235 1.00 0.00 H new ATOM 1896 N ILE B 39 7.440 -0.812 -3.190 1.00 0.00 N ATOM 1897 CA ILE B 39 6.123 -0.243 -2.943 1.00 0.00 C ATOM 1898 C ILE B 39 5.341 -1.144 -2.002 1.00 0.00 C ATOM 1899 O ILE B 39 4.492 -0.683 -1.240 1.00 0.00 O ATOM 1900 CB ILE B 39 5.323 -0.062 -4.245 1.00 0.00 C ATOM 1901 CG1 ILE B 39 5.040 -1.422 -4.874 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.080 0.833 -5.215 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.641 -1.935 -4.608 1.00 0.00 C ATOM 0 H ILE B 39 7.672 -0.945 -4.174 1.00 0.00 H new ATOM 0 HA ILE B 39 6.270 0.739 -2.494 1.00 0.00 H new ATOM 0 HB ILE B 39 4.373 0.419 -4.012 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.194 -1.354 -5.951 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.761 -2.146 -4.494 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.500 0.950 -6.130 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.240 1.810 -4.759 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.043 0.381 -5.451 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.513 -2.906 -5.086 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.489 -2.036 -3.533 1.00 0.00 H new ATOM 0 HD13 ILE B 39 2.913 -1.232 -5.013 1.00 0.00 H new ATOM 1915 N GLU B 40 5.645 -2.438 -2.064 1.00 0.00 N ATOM 1916 CA GLU B 40 4.984 -3.413 -1.218 1.00 0.00 C ATOM 1917 C GLU B 40 5.570 -3.386 0.184 1.00 0.00 C ATOM 1918 O GLU B 40 4.865 -3.640 1.161 1.00 0.00 O ATOM 1919 CB GLU B 40 5.114 -4.822 -1.805 1.00 0.00 C ATOM 1920 CG GLU B 40 3.901 -5.268 -2.601 1.00 0.00 C ATOM 1921 CD GLU B 40 3.934 -6.746 -2.935 1.00 0.00 C ATOM 1922 OE1 GLU B 40 3.115 -7.501 -2.369 1.00 0.00 O ATOM 1923 OE2 GLU B 40 4.777 -7.150 -3.763 1.00 0.00 O ATOM 0 H GLU B 40 6.346 -2.830 -2.693 1.00 0.00 H new ATOM 0 HA GLU B 40 3.927 -3.151 -1.168 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.993 -4.858 -2.449 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.285 -5.529 -0.993 1.00 0.00 H new ATOM 0 HG2 GLU B 40 2.997 -5.048 -2.033 1.00 0.00 H new ATOM 0 HG3 GLU B 40 3.845 -4.692 -3.525 1.00 0.00 H new ATOM 1930 N GLU B 41 6.857 -3.065 0.292 1.00 0.00 N ATOM 1931 CA GLU B 41 7.482 -3.000 1.606 1.00 0.00 C ATOM 1932 C GLU B 41 7.240 -1.631 2.232 1.00 0.00 C ATOM 1933 O GLU B 41 7.179 -1.496 3.455 1.00 0.00 O ATOM 1934 CB GLU B 41 8.983 -3.307 1.523 1.00 0.00 C ATOM 1935 CG GLU B 41 9.832 -2.159 0.992 1.00 0.00 C ATOM 1936 CD GLU B 41 10.833 -1.651 2.012 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.561 -2.482 2.593 1.00 0.00 O ATOM 1938 OE2 GLU B 41 10.889 -0.422 2.228 1.00 0.00 O ATOM 0 H GLU B 41 7.472 -2.851 -0.493 1.00 0.00 H new ATOM 0 HA GLU B 41 7.028 -3.760 2.241 1.00 0.00 H new ATOM 0 HB2 GLU B 41 9.341 -3.579 2.516 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.129 -4.177 0.883 1.00 0.00 H new ATOM 0 HG2 GLU B 41 10.364 -2.489 0.100 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.180 -1.340 0.690 1.00 0.00 H new ATOM 1945 N ALA B 42 7.084 -0.622 1.379 1.00 0.00 N ATOM 1946 CA ALA B 42 6.833 0.733 1.845 1.00 0.00 C ATOM 1947 C ALA B 42 5.369 0.905 2.218 1.00 0.00 C ATOM 1948 O ALA B 42 5.039 1.597 3.180 1.00 0.00 O ATOM 1949 CB ALA B 42 7.234 1.744 0.781 1.00 0.00 C ATOM 0 H ALA B 42 7.127 -0.720 0.365 1.00 0.00 H new ATOM 0 HA ALA B 42 7.438 0.910 2.734 1.00 0.00 H new ATOM 0 HB1 ALA B 42 7.040 2.753 1.146 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.296 1.637 0.559 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.654 1.568 -0.125 1.00 0.00 H new ATOM 1955 N VAL B 43 4.491 0.268 1.449 1.00 0.00 N ATOM 1956 CA VAL B 43 3.058 0.347 1.702 1.00 0.00 C ATOM 1957 C VAL B 43 2.724 -0.156 3.089 1.00 0.00 C ATOM 1958 O VAL B 43 2.209 0.580 3.932 1.00 0.00 O ATOM 1959 CB VAL B 43 2.246 -0.490 0.680 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.815 -1.879 0.518 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.794 -0.592 1.097 1.00 0.00 C ATOM 0 H VAL B 43 4.747 -0.308 0.647 1.00 0.00 H new ATOM 0 HA VAL B 43 2.787 1.398 1.606 1.00 0.00 H new ATOM 0 HB VAL B 43 2.314 0.028 -0.277 1.00 0.00 H new ATOM 0 HG11 VAL B 43 2.219 -2.434 -0.206 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.844 -1.812 0.165 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.793 -2.395 1.478 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.246 -1.184 0.364 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.729 -1.072 2.073 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.361 0.407 1.154 1.00 0.00 H new ATOM 1971 N VAL B 44 3.016 -1.418 3.305 1.00 0.00 N ATOM 1972 CA VAL B 44 2.752 -2.063 4.569 1.00 0.00 C ATOM 1973 C VAL B 44 3.480 -1.350 5.694 1.00 0.00 C ATOM 1974 O VAL B 44 2.887 -1.014 6.715 1.00 0.00 O ATOM 1975 CB VAL B 44 3.169 -3.544 4.502 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.733 -4.042 5.829 1.00 0.00 C ATOM 1977 CG2 VAL B 44 2.004 -4.408 4.049 1.00 0.00 C ATOM 0 H VAL B 44 3.444 -2.027 2.607 1.00 0.00 H new ATOM 0 HA VAL B 44 1.683 -2.011 4.773 1.00 0.00 H new ATOM 0 HB VAL B 44 3.968 -3.624 3.765 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.014 -5.091 5.734 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.612 -3.454 6.095 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.977 -3.937 6.608 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.319 -5.451 4.008 1.00 0.00 H new ATOM 0 HG22 VAL B 44 1.179 -4.305 4.754 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.677 -4.088 3.059 1.00 0.00 H new ATOM 1987 N MET B 45 4.764 -1.107 5.497 1.00 0.00 N ATOM 1988 CA MET B 45 5.550 -0.419 6.504 1.00 0.00 C ATOM 1989 C MET B 45 4.951 0.950 6.798 1.00 0.00 C ATOM 1990 O MET B 45 5.040 1.440 7.922 1.00 0.00 O ATOM 1991 CB MET B 45 7.003 -0.273 6.059 1.00 0.00 C ATOM 1992 CG MET B 45 7.881 0.428 7.087 1.00 0.00 C ATOM 1993 SD MET B 45 7.755 -0.303 8.732 1.00 0.00 S ATOM 1994 CE MET B 45 7.803 -2.049 8.335 1.00 0.00 C ATOM 0 H MET B 45 5.280 -1.373 4.658 1.00 0.00 H new ATOM 0 HA MET B 45 5.531 -1.017 7.415 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.414 -1.262 5.854 1.00 0.00 H new ATOM 0 HB3 MET B 45 7.035 0.285 5.123 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.919 0.391 6.757 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.601 1.480 7.140 1.00 0.00 H new ATOM 0 HE1 MET B 45 8.440 -2.568 9.052 1.00 0.00 H new ATOM 0 HE2 MET B 45 6.795 -2.460 8.381 1.00 0.00 H new ATOM 0 HE3 MET B 45 8.204 -2.183 7.330 1.00 0.00 H new ATOM 2004 N TRP B 46 4.324 1.563 5.790 1.00 0.00 N ATOM 2005 CA TRP B 46 3.708 2.865 5.987 1.00 0.00 C ATOM 2006 C TRP B 46 2.515 2.736 6.921 1.00 0.00 C ATOM 2007 O TRP B 46 2.466 3.374 7.972 1.00 0.00 O ATOM 2008 CB TRP B 46 3.266 3.475 4.658 1.00 0.00 C ATOM 2009 CG TRP B 46 2.820 4.898 4.789 1.00 0.00 C ATOM 2010 CD1 TRP B 46 3.558 6.015 4.519 1.00 0.00 C ATOM 2011 CD2 TRP B 46 1.540 5.360 5.234 1.00 0.00 C ATOM 2012 NE1 TRP B 46 2.812 7.142 4.766 1.00 0.00 N ATOM 2013 CE2 TRP B 46 1.572 6.766 5.206 1.00 0.00 C ATOM 2014 CE3 TRP B 46 0.368 4.722 5.652 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 0.480 7.546 5.580 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 -0.715 5.497 6.023 1.00 0.00 C ATOM 2017 CH2 TRP B 46 -0.653 6.895 5.984 1.00 0.00 C ATOM 0 H TRP B 46 4.233 1.182 4.848 1.00 0.00 H new ATOM 0 HA TRP B 46 4.449 3.528 6.433 1.00 0.00 H new ATOM 0 HB2 TRP B 46 4.091 3.422 3.948 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.451 2.881 4.245 1.00 0.00 H new ATOM 0 HD1 TRP B 46 4.578 6.013 4.164 1.00 0.00 H new ATOM 0 HE1 TRP B 46 3.131 8.103 4.642 1.00 0.00 H new ATOM 0 HE3 TRP B 46 0.310 3.644 5.684 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 0.526 8.625 5.552 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -1.625 5.015 6.349 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -1.517 7.471 6.279 1.00 0.00 H new ATOM 2028 N LEU B 47 1.563 1.891 6.540 1.00 0.00 N ATOM 2029 CA LEU B 47 0.379 1.666 7.361 1.00 0.00 C ATOM 2030 C LEU B 47 0.783 1.222 8.751 1.00 0.00 C ATOM 2031 O LEU B 47 0.243 1.683 9.756 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.528 0.586 6.765 1.00 0.00 C ATOM 2033 CG LEU B 47 0.168 -0.521 5.969 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.295 -1.772 6.822 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.599 -0.822 4.688 1.00 0.00 C ATOM 0 H LEU B 47 1.587 1.354 5.673 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.165 2.610 7.399 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.088 0.123 7.577 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.255 1.071 6.113 1.00 0.00 H new ATOM 0 HG LEU B 47 1.167 -0.181 5.695 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.791 -2.555 6.248 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.882 -1.547 7.712 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.697 -2.113 7.118 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.089 -1.611 4.136 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.609 -1.147 4.937 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.648 0.077 4.074 1.00 0.00 H new ATOM 2047 N ILE B 48 1.727 0.299 8.788 1.00 0.00 N ATOM 2048 CA ILE B 48 2.207 -0.253 10.028 1.00 0.00 C ATOM 2049 C ILE B 48 2.866 0.802 10.898 1.00 0.00 C ATOM 2050 O ILE B 48 2.625 0.861 12.104 1.00 0.00 O ATOM 2051 CB ILE B 48 3.185 -1.405 9.737 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.571 -2.720 10.182 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.534 -1.185 10.403 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.218 -3.007 9.560 1.00 0.00 C ATOM 0 H ILE B 48 2.178 -0.084 7.957 1.00 0.00 H new ATOM 0 HA ILE B 48 1.351 -0.637 10.583 1.00 0.00 H new ATOM 0 HB ILE B 48 3.363 -1.437 8.662 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.254 -3.532 9.933 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.467 -2.713 11.267 1.00 0.00 H new ATOM 0 HG21 ILE B 48 5.194 -2.021 10.172 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.976 -0.260 10.032 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.400 -1.116 11.483 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.844 -3.963 9.927 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.518 -2.216 9.830 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.318 -3.048 8.475 1.00 0.00 H new ATOM 2066 N GLN B 49 3.701 1.630 10.292 1.00 0.00 N ATOM 2067 CA GLN B 49 4.384 2.664 11.041 1.00 0.00 C ATOM 2068 C GLN B 49 3.454 3.845 11.320 1.00 0.00 C ATOM 2069 O GLN B 49 3.749 4.691 12.164 1.00 0.00 O ATOM 2070 CB GLN B 49 5.640 3.136 10.297 1.00 0.00 C ATOM 2071 CG GLN B 49 5.360 4.099 9.152 1.00 0.00 C ATOM 2072 CD GLN B 49 6.628 4.657 8.537 1.00 0.00 C ATOM 2073 OE1 GLN B 49 7.308 5.490 9.137 1.00 0.00 O ATOM 2074 NE2 GLN B 49 6.955 4.200 7.333 1.00 0.00 N ATOM 0 H GLN B 49 3.919 1.605 9.296 1.00 0.00 H new ATOM 0 HA GLN B 49 4.689 2.237 11.997 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.310 3.619 11.008 1.00 0.00 H new ATOM 0 HB3 GLN B 49 6.165 2.265 9.905 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.783 3.585 8.383 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.745 4.922 9.516 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.363 3.510 6.871 1.00 0.00 H new ATOM 0 HE22 GLN B 49 7.798 4.540 6.870 1.00 0.00 H new ATOM 2083 N ASN B 50 2.333 3.905 10.599 1.00 0.00 N ATOM 2084 CA ASN B 50 1.378 4.995 10.770 1.00 0.00 C ATOM 2085 C ASN B 50 0.245 4.609 11.716 1.00 0.00 C ATOM 2086 O ASN B 50 0.045 5.242 12.751 1.00 0.00 O ATOM 2087 CB ASN B 50 0.801 5.415 9.418 1.00 0.00 C ATOM 2088 CG ASN B 50 1.628 6.495 8.748 1.00 0.00 C ATOM 2089 OD1 ASN B 50 2.573 6.204 8.015 1.00 0.00 O ATOM 2090 ND2 ASN B 50 1.276 7.751 8.999 1.00 0.00 N ATOM 0 H ASN B 50 2.067 3.215 9.896 1.00 0.00 H new ATOM 0 HA ASN B 50 1.916 5.834 11.211 1.00 0.00 H new ATOM 0 HB2 ASN B 50 0.745 4.545 8.764 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -0.218 5.775 9.557 1.00 0.00 H new ATOM 0 HD21 ASN B 50 1.796 8.520 8.578 1.00 0.00 H new ATOM 0 HD22 ASN B 50 0.485 7.946 9.613 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.502 3.579 11.343 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.629 3.118 12.149 1.00 0.00 C ATOM 2099 C LYS B 51 -1.184 2.683 13.543 1.00 0.00 C ATOM 2100 O LYS B 51 -1.722 3.150 14.547 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.351 1.967 11.449 1.00 0.00 C ATOM 2102 CG LYS B 51 -3.794 2.287 11.095 1.00 0.00 C ATOM 2103 CD LYS B 51 -4.403 1.212 10.211 1.00 0.00 C ATOM 2104 CE LYS B 51 -3.631 1.054 8.910 1.00 0.00 C ATOM 2105 NZ LYS B 51 -3.021 -0.299 8.787 1.00 0.00 N ATOM 0 H LYS B 51 -0.350 3.045 10.487 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.315 3.957 12.261 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -1.810 1.708 10.539 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -2.329 1.088 12.094 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -4.381 2.384 12.008 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -3.839 3.249 10.584 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -4.413 0.263 10.746 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -5.440 1.465 9.991 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.300 1.229 8.067 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -2.849 1.811 8.858 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -3.098 -0.627 7.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -2.018 -0.254 9.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -3.520 -0.963 9.413 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.209 1.780 13.598 1.00 0.00 N ATOM 2120 CA GLU B 52 0.300 1.275 14.872 1.00 0.00 C ATOM 2121 C GLU B 52 0.541 2.411 15.863 1.00 0.00 C ATOM 2122 O GLU B 52 0.376 2.240 17.071 1.00 0.00 O ATOM 2123 CB GLU B 52 1.595 0.491 14.653 1.00 0.00 C ATOM 2124 CG GLU B 52 1.957 -0.420 15.815 1.00 0.00 C ATOM 2125 CD GLU B 52 1.908 -1.891 15.443 1.00 0.00 C ATOM 2126 OE1 GLU B 52 1.126 -2.636 16.069 1.00 0.00 O ATOM 2127 OE2 GLU B 52 2.652 -2.295 14.524 1.00 0.00 O ATOM 0 H GLU B 52 0.245 1.382 12.776 1.00 0.00 H new ATOM 0 HA GLU B 52 -0.455 0.611 15.293 1.00 0.00 H new ATOM 0 HB2 GLU B 52 1.498 -0.109 13.748 1.00 0.00 H new ATOM 0 HB3 GLU B 52 2.411 1.193 14.484 1.00 0.00 H new ATOM 0 HG2 GLU B 52 2.958 -0.172 16.168 1.00 0.00 H new ATOM 0 HG3 GLU B 52 1.272 -0.236 16.643 1.00 0.00 H new ATOM 2134 N LYS B 53 0.933 3.569 15.343 1.00 0.00 N ATOM 2135 CA LYS B 53 1.199 4.732 16.181 1.00 0.00 C ATOM 2136 C LYS B 53 0.391 5.941 15.719 1.00 0.00 C ATOM 2137 O LYS B 53 0.815 7.081 15.897 1.00 0.00 O ATOM 2138 CB LYS B 53 2.692 5.066 16.168 1.00 0.00 C ATOM 2139 CG LYS B 53 3.245 5.328 14.778 1.00 0.00 C ATOM 2140 CD LYS B 53 4.337 6.385 14.804 1.00 0.00 C ATOM 2141 CE LYS B 53 3.767 7.783 14.623 1.00 0.00 C ATOM 2142 NZ LYS B 53 4.095 8.348 13.285 1.00 0.00 N ATOM 0 H LYS B 53 1.074 3.727 14.345 1.00 0.00 H new ATOM 0 HA LYS B 53 0.896 4.487 17.199 1.00 0.00 H new ATOM 0 HB2 LYS B 53 2.865 5.944 16.790 1.00 0.00 H new ATOM 0 HB3 LYS B 53 3.244 4.242 16.620 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.643 4.402 14.363 1.00 0.00 H new ATOM 0 HG3 LYS B 53 2.439 5.652 14.120 1.00 0.00 H new ATOM 0 HD2 LYS B 53 4.875 6.330 15.751 1.00 0.00 H new ATOM 0 HD3 LYS B 53 5.060 6.181 14.014 1.00 0.00 H new ATOM 0 HE2 LYS B 53 2.685 7.753 14.749 1.00 0.00 H new ATOM 0 HE3 LYS B 53 4.160 8.439 15.400 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.688 9.302 13.202 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 5.128 8.401 13.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 3.698 7.737 12.543 1.00 0.00 H new ATOM 2156 N LEU B 54 -0.775 5.685 15.123 1.00 0.00 N ATOM 2157 CA LEU B 54 -1.639 6.758 14.630 1.00 0.00 C ATOM 2158 C LEU B 54 -1.940 7.768 15.737 1.00 0.00 C ATOM 2159 O LEU B 54 -2.781 7.518 16.600 1.00 0.00 O ATOM 2160 CB LEU B 54 -2.949 6.178 14.095 1.00 0.00 C ATOM 2161 CG LEU B 54 -3.961 7.215 13.598 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.840 7.398 12.094 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.376 6.803 13.974 1.00 0.00 C ATOM 0 H LEU B 54 -1.142 4.746 14.970 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.114 7.270 13.824 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -2.719 5.495 13.277 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.415 5.586 14.883 1.00 0.00 H new ATOM 0 HG LEU B 54 -3.742 8.168 14.079 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.566 8.138 11.758 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.834 7.739 11.849 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -4.033 6.448 11.595 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.081 7.552 13.613 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.607 5.839 13.521 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.456 6.723 15.058 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.254 8.926 15.731 1.00 0.00 N ATOM 2176 CA PRO B 55 -1.447 9.970 16.736 1.00 0.00 C ATOM 2177 C PRO B 55 -2.688 10.812 16.463 1.00 0.00 C ATOM 2178 O PRO B 55 -3.157 10.895 15.327 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.178 10.834 16.619 1.00 0.00 C ATOM 2180 CG PRO B 55 0.682 10.172 15.587 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.234 9.321 14.757 1.00 0.00 C ATOM 0 HA PRO B 55 -1.597 9.549 17.730 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -0.427 11.853 16.323 1.00 0.00 H new ATOM 0 HB3 PRO B 55 0.340 10.897 17.576 1.00 0.00 H new ATOM 0 HG2 PRO B 55 1.189 10.914 14.970 1.00 0.00 H new ATOM 0 HG3 PRO B 55 1.456 9.566 16.057 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -0.661 9.877 13.922 1.00 0.00 H new ATOM 0 HD3 PRO B 55 0.282 8.459 14.335 1.00 0.00 H new ATOM 2189 N ASN B 56 -3.211 11.442 17.508 1.00 0.00 N ATOM 2190 CA ASN B 56 -4.393 12.286 17.378 1.00 0.00 C ATOM 2191 C ASN B 56 -4.038 13.614 16.717 1.00 0.00 C ATOM 2192 O ASN B 56 -4.887 14.260 16.103 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.023 12.535 18.750 1.00 0.00 C ATOM 2194 CG ASN B 56 -5.546 11.262 19.385 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -4.823 10.567 20.099 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -6.812 10.949 19.128 1.00 0.00 N ATOM 0 H ASN B 56 -2.836 11.385 18.455 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.114 11.767 16.747 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -4.283 12.989 19.409 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -5.840 13.249 18.647 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -7.220 10.104 19.528 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -7.376 11.554 18.531 1.00 0.00 H new ATOM 2203 N GLU B 57 -2.777 14.017 16.848 1.00 0.00 N ATOM 2204 CA GLU B 57 -2.308 15.269 16.264 1.00 0.00 C ATOM 2205 C GLU B 57 -1.902 15.079 14.804 1.00 0.00 C ATOM 2206 O GLU B 57 -1.847 16.042 14.038 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.126 15.816 17.066 1.00 0.00 C ATOM 2208 CG GLU B 57 0.096 14.911 17.043 1.00 0.00 C ATOM 2209 CD GLU B 57 1.298 15.540 17.720 1.00 0.00 C ATOM 2210 OE1 GLU B 57 2.003 16.332 17.060 1.00 0.00 O ATOM 2211 OE2 GLU B 57 1.534 15.239 18.909 1.00 0.00 O ATOM 0 H GLU B 57 -2.062 13.494 17.354 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.129 15.985 16.300 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -0.851 16.794 16.671 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -1.437 15.966 18.100 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -0.144 13.970 17.537 1.00 0.00 H new ATOM 0 HG3 GLU B 57 0.348 14.673 16.010 1.00 0.00 H new ATOM 2218 N LEU B 58 -1.619 13.836 14.421 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.220 13.533 13.050 1.00 0.00 C ATOM 2220 C LEU B 58 -2.434 13.419 12.134 1.00 0.00 C ATOM 2221 O LEU B 58 -2.304 13.506 10.914 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.413 12.234 13.001 1.00 0.00 C ATOM 2223 CG LEU B 58 0.987 12.366 12.396 1.00 0.00 C ATOM 2224 CD1 LEU B 58 2.004 12.710 13.473 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.379 11.084 11.678 1.00 0.00 C ATOM 0 H LEU B 58 -1.659 13.025 15.039 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.598 14.356 12.698 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.319 11.843 14.014 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.973 11.497 12.426 1.00 0.00 H new ATOM 0 HG LEU B 58 0.973 13.177 11.668 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.993 12.800 13.024 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.731 13.655 13.942 1.00 0.00 H new ATOM 0 HD13 LEU B 58 2.017 11.922 14.226 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.377 11.195 11.254 1.00 0.00 H new ATOM 0 HD22 LEU B 58 1.376 10.255 12.386 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.666 10.882 10.879 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.613 13.222 12.728 1.00 0.00 N ATOM 2238 CA LYS B 59 -4.855 13.092 11.966 1.00 0.00 C ATOM 2239 C LYS B 59 -4.881 14.044 10.767 1.00 0.00 C ATOM 2240 O LYS B 59 -5.097 13.612 9.635 1.00 0.00 O ATOM 2241 CB LYS B 59 -6.064 13.347 12.870 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.400 13.242 12.149 1.00 0.00 C ATOM 2243 CD LYS B 59 -8.168 14.553 12.196 1.00 0.00 C ATOM 2244 CE LYS B 59 -9.082 14.620 13.409 1.00 0.00 C ATOM 2245 NZ LYS B 59 -10.270 13.735 13.261 1.00 0.00 N ATOM 0 H LYS B 59 -3.733 13.149 13.738 1.00 0.00 H new ATOM 0 HA LYS B 59 -4.904 12.072 11.584 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -6.048 12.632 13.693 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -5.975 14.341 13.309 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.232 12.956 11.111 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.998 12.453 12.604 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -7.466 15.386 12.222 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.759 14.662 11.287 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -8.524 14.332 14.300 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -9.412 15.648 13.558 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -10.985 13.991 13.972 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -10.672 13.850 12.309 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -9.984 12.745 13.399 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.658 15.352 10.991 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.656 16.338 9.908 1.00 0.00 C ATOM 2261 C PRO B 60 -3.454 16.179 8.985 1.00 0.00 C ATOM 2262 O PRO B 60 -3.524 16.504 7.800 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.595 17.679 10.642 1.00 0.00 C ATOM 2264 CG PRO B 60 -3.942 17.365 11.941 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.389 15.976 12.303 1.00 0.00 C ATOM 0 HA PRO B 60 -5.528 16.234 9.262 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -4.022 18.414 10.077 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.591 18.096 10.789 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -2.857 17.416 11.855 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.235 18.082 12.708 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -3.619 15.437 12.854 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.280 15.991 12.931 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.352 15.673 9.530 1.00 0.00 N ATOM 2274 CA LYS B 61 -1.146 15.471 8.738 1.00 0.00 C ATOM 2275 C LYS B 61 -1.384 14.421 7.660 1.00 0.00 C ATOM 2276 O LYS B 61 -0.732 14.433 6.617 1.00 0.00 O ATOM 2277 CB LYS B 61 0.031 15.061 9.622 1.00 0.00 C ATOM 2278 CG LYS B 61 1.384 15.304 8.969 1.00 0.00 C ATOM 2279 CD LYS B 61 1.896 14.057 8.265 1.00 0.00 C ATOM 2280 CE LYS B 61 3.000 13.377 9.061 1.00 0.00 C ATOM 2281 NZ LYS B 61 4.271 13.294 8.289 1.00 0.00 N ATOM 0 H LYS B 61 -2.270 15.398 10.509 1.00 0.00 H new ATOM 0 HA LYS B 61 -0.899 16.418 8.258 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -0.017 15.614 10.560 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.061 14.004 9.871 1.00 0.00 H new ATOM 0 HG2 LYS B 61 1.301 16.120 8.251 1.00 0.00 H new ATOM 0 HG3 LYS B 61 2.103 15.617 9.726 1.00 0.00 H new ATOM 0 HD2 LYS B 61 1.072 13.359 8.115 1.00 0.00 H new ATOM 0 HD3 LYS B 61 2.271 14.324 7.277 1.00 0.00 H new ATOM 0 HE2 LYS B 61 3.172 13.927 9.986 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.680 12.374 9.342 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 4.677 12.342 8.390 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 4.080 13.485 7.285 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.945 13.998 8.653 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.335 13.521 7.901 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.658 12.490 6.924 1.00 0.00 C ATOM 2297 C ILE B 62 -2.937 13.145 5.575 1.00 0.00 C ATOM 2298 O ILE B 62 -2.612 12.596 4.519 1.00 0.00 O ATOM 2299 CB ILE B 62 -3.867 11.635 7.379 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.387 10.457 8.231 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.674 11.129 6.188 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.442 10.861 9.341 1.00 0.00 C ATOM 0 H ILE B 62 -2.889 13.486 8.757 1.00 0.00 H new ATOM 0 HA ILE B 62 -1.805 11.817 6.832 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.520 12.270 7.978 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.252 9.957 8.665 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.890 9.732 7.587 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.514 10.533 6.545 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.048 11.977 5.615 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.037 10.514 5.552 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -2.143 9.977 9.904 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.559 11.335 8.913 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -2.943 11.563 10.008 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.501 14.349 5.627 1.00 0.00 N ATOM 2315 CA ASP B 63 -3.779 15.106 4.424 1.00 0.00 C ATOM 2316 C ASP B 63 -2.456 15.524 3.808 1.00 0.00 C ATOM 2317 O ASP B 63 -2.267 15.454 2.595 1.00 0.00 O ATOM 2318 CB ASP B 63 -4.634 16.334 4.748 1.00 0.00 C ATOM 2319 CG ASP B 63 -5.968 16.316 4.027 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.942 16.882 4.567 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -6.038 15.737 2.923 1.00 0.00 O ATOM 0 H ASP B 63 -3.772 14.816 6.493 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.339 14.491 3.719 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -4.806 16.380 5.823 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.088 17.236 4.473 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.526 15.928 4.676 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.195 16.328 4.245 1.00 0.00 C ATOM 2328 C GLU B 64 0.472 15.175 3.508 1.00 0.00 C ATOM 2329 O GLU B 64 1.059 15.358 2.446 1.00 0.00 O ATOM 2330 CB GLU B 64 0.653 16.753 5.447 1.00 0.00 C ATOM 2331 CG GLU B 64 0.672 18.255 5.676 1.00 0.00 C ATOM 2332 CD GLU B 64 1.666 18.668 6.744 1.00 0.00 C ATOM 2333 OE1 GLU B 64 2.856 18.849 6.410 1.00 0.00 O ATOM 2334 OE2 GLU B 64 1.255 18.808 7.915 1.00 0.00 O ATOM 0 H GLU B 64 -1.676 15.985 5.683 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.282 17.180 3.571 1.00 0.00 H new ATOM 0 HB2 GLU B 64 0.271 16.262 6.342 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.675 16.403 5.302 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.918 18.759 4.741 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -0.325 18.588 5.964 1.00 0.00 H new ATOM 2341 N ILE B 65 0.347 13.980 4.075 1.00 0.00 N ATOM 2342 CA ILE B 65 0.909 12.776 3.473 1.00 0.00 C ATOM 2343 C ILE B 65 0.406 12.617 2.042 1.00 0.00 C ATOM 2344 O ILE B 65 1.158 12.238 1.146 1.00 0.00 O ATOM 2345 CB ILE B 65 0.517 11.523 4.287 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.981 11.666 5.737 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.101 10.264 3.658 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.484 11.749 5.874 1.00 0.00 C ATOM 0 H ILE B 65 -0.141 13.819 4.956 1.00 0.00 H new ATOM 0 HA ILE B 65 1.994 12.877 3.471 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.569 11.432 4.277 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.533 12.561 6.169 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.616 10.817 6.314 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.812 9.395 4.248 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.722 10.155 2.642 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.188 10.340 3.633 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.748 11.849 6.927 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.937 10.843 5.471 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.852 12.615 5.323 1.00 0.00 H new ATOM 2360 N SER B 66 -0.877 12.907 1.845 1.00 0.00 N ATOM 2361 CA SER B 66 -1.500 12.794 0.531 1.00 0.00 C ATOM 2362 C SER B 66 -1.154 13.980 -0.366 1.00 0.00 C ATOM 2363 O SER B 66 -0.664 13.800 -1.481 1.00 0.00 O ATOM 2364 CB SER B 66 -3.017 12.679 0.675 1.00 0.00 C ATOM 2365 OG SER B 66 -3.563 11.837 -0.326 1.00 0.00 O ATOM 0 H SER B 66 -1.507 13.223 2.582 1.00 0.00 H new ATOM 0 HA SER B 66 -1.108 11.893 0.060 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.263 12.284 1.661 1.00 0.00 H new ATOM 0 HB3 SER B 66 -3.468 13.669 0.607 1.00 0.00 H new ATOM 0 HG SER B 66 -3.751 10.954 0.056 1.00 0.00 H new ATOM 2371 N LYS B 67 -1.418 15.193 0.114 1.00 0.00 N ATOM 2372 CA LYS B 67 -1.139 16.392 -0.670 1.00 0.00 C ATOM 2373 C LYS B 67 0.355 16.532 -0.947 1.00 0.00 C ATOM 2374 O LYS B 67 0.755 16.917 -2.046 1.00 0.00 O ATOM 2375 CB LYS B 67 -1.664 17.643 0.042 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.322 17.692 1.522 1.00 0.00 C ATOM 2377 CD LYS B 67 -0.599 18.981 1.889 1.00 0.00 C ATOM 2378 CE LYS B 67 -1.512 19.944 2.634 1.00 0.00 C ATOM 2379 NZ LYS B 67 -1.755 21.192 1.858 1.00 0.00 N ATOM 0 H LYS B 67 -1.821 15.370 1.034 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.657 16.291 -1.624 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.254 18.527 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.747 17.689 -0.073 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.236 17.607 2.110 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.696 16.837 1.780 1.00 0.00 H new ATOM 0 HD2 LYS B 67 0.268 18.749 2.508 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -0.226 19.460 0.984 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -2.464 19.455 2.842 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -1.066 20.196 3.596 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -2.381 21.821 2.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -0.850 21.673 1.681 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -2.204 20.955 0.950 1.00 0.00 H new ATOM 2393 N ARG B 68 1.178 16.209 0.045 1.00 0.00 N ATOM 2394 CA ARG B 68 2.624 16.294 -0.112 1.00 0.00 C ATOM 2395 C ARG B 68 3.137 15.141 -0.961 1.00 0.00 C ATOM 2396 O ARG B 68 4.138 15.274 -1.662 1.00 0.00 O ATOM 2397 CB ARG B 68 3.324 16.295 1.248 1.00 0.00 C ATOM 2398 CG ARG B 68 2.942 17.479 2.120 1.00 0.00 C ATOM 2399 CD ARG B 68 3.287 17.232 3.582 1.00 0.00 C ATOM 2400 NE ARG B 68 4.650 17.652 3.902 1.00 0.00 N ATOM 2401 CZ ARG B 68 5.042 18.923 3.950 1.00 0.00 C ATOM 2402 NH1 ARG B 68 4.181 19.900 3.692 1.00 0.00 N ATOM 2403 NH2 ARG B 68 6.297 19.219 4.255 1.00 0.00 N ATOM 0 H ARG B 68 0.869 15.887 0.962 1.00 0.00 H new ATOM 0 HA ARG B 68 2.851 17.233 -0.617 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.081 15.372 1.774 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.403 16.300 1.093 1.00 0.00 H new ATOM 0 HG2 ARG B 68 3.459 18.372 1.769 1.00 0.00 H new ATOM 0 HG3 ARG B 68 1.873 17.672 2.025 1.00 0.00 H new ATOM 0 HD2 ARG B 68 2.583 17.771 4.216 1.00 0.00 H new ATOM 0 HD3 ARG B 68 3.172 16.172 3.807 1.00 0.00 H new ATOM 0 HE ARG B 68 5.341 16.929 4.100 1.00 0.00 H new ATOM 0 HH11 ARG B 68 3.214 19.678 3.456 1.00 0.00 H new ATOM 0 HH12 ARG B 68 4.487 20.872 3.730 1.00 0.00 H new ATOM 0 HH21 ARG B 68 6.963 18.473 4.453 1.00 0.00 H new ATOM 0 HH22 ARG B 68 6.597 20.193 4.292 1.00 0.00 H new ATOM 2417 N PHE B 69 2.440 14.007 -0.903 1.00 0.00 N ATOM 2418 CA PHE B 69 2.828 12.837 -1.683 1.00 0.00 C ATOM 2419 C PHE B 69 2.996 13.223 -3.153 1.00 0.00 C ATOM 2420 O PHE B 69 3.819 12.653 -3.870 1.00 0.00 O ATOM 2421 CB PHE B 69 1.784 11.716 -1.511 1.00 0.00 C ATOM 2422 CG PHE B 69 1.293 11.108 -2.799 1.00 0.00 C ATOM 2423 CD1 PHE B 69 2.162 10.427 -3.637 1.00 0.00 C ATOM 2424 CD2 PHE B 69 -0.038 11.220 -3.168 1.00 0.00 C ATOM 2425 CE1 PHE B 69 1.711 9.869 -4.819 1.00 0.00 C ATOM 2426 CE2 PHE B 69 -0.493 10.664 -4.348 1.00 0.00 C ATOM 2427 CZ PHE B 69 0.383 9.987 -5.174 1.00 0.00 C ATOM 0 H PHE B 69 1.609 13.876 -0.327 1.00 0.00 H new ATOM 0 HA PHE B 69 3.785 12.461 -1.321 1.00 0.00 H new ATOM 0 HB2 PHE B 69 2.216 10.928 -0.895 1.00 0.00 H new ATOM 0 HB3 PHE B 69 0.929 12.115 -0.965 1.00 0.00 H new ATOM 0 HD1 PHE B 69 3.202 10.331 -3.364 1.00 0.00 H new ATOM 0 HD2 PHE B 69 -0.727 11.748 -2.526 1.00 0.00 H new ATOM 0 HE1 PHE B 69 2.398 9.341 -5.464 1.00 0.00 H new ATOM 0 HE2 PHE B 69 -1.533 10.759 -4.624 1.00 0.00 H new ATOM 0 HZ PHE B 69 0.029 9.551 -6.096 1.00 0.00 H new ATOM 2437 N PHE B 70 2.220 14.212 -3.584 1.00 0.00 N ATOM 2438 CA PHE B 70 2.284 14.703 -4.954 1.00 0.00 C ATOM 2439 C PHE B 70 2.764 16.151 -4.965 1.00 0.00 C ATOM 2440 O PHE B 70 1.970 17.076 -5.138 1.00 0.00 O ATOM 2441 CB PHE B 70 0.914 14.596 -5.626 1.00 0.00 C ATOM 2442 CG PHE B 70 0.983 14.556 -7.126 1.00 0.00 C ATOM 2443 CD1 PHE B 70 1.829 13.668 -7.771 1.00 0.00 C ATOM 2444 CD2 PHE B 70 0.199 15.405 -7.891 1.00 0.00 C ATOM 2445 CE1 PHE B 70 1.892 13.628 -9.151 1.00 0.00 C ATOM 2446 CE2 PHE B 70 0.260 15.370 -9.272 1.00 0.00 C ATOM 2447 CZ PHE B 70 1.107 14.480 -9.902 1.00 0.00 C ATOM 0 H PHE B 70 1.535 14.691 -2.999 1.00 0.00 H new ATOM 0 HA PHE B 70 2.991 14.090 -5.513 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.413 13.696 -5.269 1.00 0.00 H new ATOM 0 HB3 PHE B 70 0.301 15.444 -5.321 1.00 0.00 H new ATOM 0 HD1 PHE B 70 2.446 13.000 -7.189 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -0.467 16.102 -7.403 1.00 0.00 H new ATOM 0 HE1 PHE B 70 2.555 12.931 -9.642 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -0.354 16.038 -9.857 1.00 0.00 H new ATOM 0 HZ PHE B 70 1.155 14.450 -10.981 1.00 0.00 H new ATOM 2457 N PRO B 71 4.075 16.367 -4.767 1.00 0.00 N ATOM 2458 CA PRO B 71 4.661 17.707 -4.743 1.00 0.00 C ATOM 2459 C PRO B 71 4.877 18.272 -6.142 1.00 0.00 C ATOM 2460 O PRO B 71 5.906 18.021 -6.771 1.00 0.00 O ATOM 2461 CB PRO B 71 6.000 17.477 -4.045 1.00 0.00 C ATOM 2462 CG PRO B 71 6.381 16.088 -4.422 1.00 0.00 C ATOM 2463 CD PRO B 71 5.092 15.317 -4.546 1.00 0.00 C ATOM 0 HA PRO B 71 4.017 18.432 -4.246 1.00 0.00 H new ATOM 0 HB2 PRO B 71 6.749 18.198 -4.374 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.908 17.584 -2.964 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.933 16.077 -5.362 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.029 15.644 -3.667 1.00 0.00 H new ATOM 0 HD2 PRO B 71 5.126 14.611 -5.376 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.882 14.740 -3.645 1.00 0.00 H new ATOM 2471 N ALA B 72 3.902 19.033 -6.630 1.00 0.00 N ATOM 2472 CA ALA B 72 3.990 19.627 -7.958 1.00 0.00 C ATOM 2473 C ALA B 72 3.509 21.074 -7.950 1.00 0.00 C ATOM 2474 O ALA B 72 4.252 21.988 -8.308 1.00 0.00 O ATOM 2475 CB ALA B 72 3.186 18.808 -8.956 1.00 0.00 C ATOM 0 H ALA B 72 3.043 19.252 -6.126 1.00 0.00 H new ATOM 0 HA ALA B 72 5.037 19.624 -8.259 1.00 0.00 H new ATOM 0 HB1 ALA B 72 3.260 19.263 -9.944 1.00 0.00 H new ATOM 0 HB2 ALA B 72 3.579 17.792 -8.994 1.00 0.00 H new ATOM 0 HB3 ALA B 72 2.141 18.781 -8.647 1.00 0.00 H new ATOM 2481 N LYS B 73 2.260 21.276 -7.541 1.00 0.00 N ATOM 2482 CA LYS B 73 1.679 22.614 -7.488 1.00 0.00 C ATOM 2483 C LYS B 73 1.578 23.218 -8.886 1.00 0.00 C ATOM 2484 O LYS B 73 1.661 22.450 -9.868 1.00 0.00 O ATOM 2485 CB LYS B 73 2.516 23.523 -6.582 1.00 0.00 C ATOM 2486 CG LYS B 73 1.776 23.987 -5.338 1.00 0.00 C ATOM 2487 CD LYS B 73 2.719 24.648 -4.345 1.00 0.00 C ATOM 2488 CE LYS B 73 2.069 25.848 -3.674 1.00 0.00 C ATOM 2489 NZ LYS B 73 2.618 26.086 -2.311 1.00 0.00 N ATOM 2490 OXT LYS B 73 1.415 24.452 -8.987 1.00 0.00 O ATOM 0 H LYS B 73 1.631 20.531 -7.242 1.00 0.00 H new ATOM 0 HA LYS B 73 0.674 22.531 -7.075 1.00 0.00 H new ATOM 0 HB2 LYS B 73 3.418 22.991 -6.281 1.00 0.00 H new ATOM 0 HB3 LYS B 73 2.835 24.396 -7.152 1.00 0.00 H new ATOM 0 HG2 LYS B 73 0.992 24.690 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS B 73 1.286 23.136 -4.865 1.00 0.00 H new ATOM 0 HD2 LYS B 73 3.018 23.923 -3.587 1.00 0.00 H new ATOM 0 HD3 LYS B 73 3.627 24.964 -4.859 1.00 0.00 H new ATOM 0 HE2 LYS B 73 2.224 26.735 -4.288 1.00 0.00 H new ATOM 0 HE3 LYS B 73 0.993 25.689 -3.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 2.149 26.912 -1.887 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 2.448 25.249 -1.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 3.641 26.263 -2.375 1.00 0.00 H new TER 2504 LYS B 73