USER MOD reduce.3.24.130724 H: found=0, std=0, add=1240, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1238 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 Single : A 1 GLN : amide:sc= -0.425 X(o=-0.43,f=-0.03) USER MOD Single : A 1 GLN N :NH3+ 143:sc= 0.0602 (180deg=0) USER MOD Single : A 6 ASN :FLIP amide:sc= -4.73! C(o=-6.1!,f=-4.7!) USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.16 USER MOD Single : A 13 TYR OH : rot 135:sc= -1.74! USER MOD Single : A 14 ASN :FLIP amide:sc= -3.5! C(o=-5.2!,f=-3.5!) USER MOD Single : A 16 THR OG1 : rot -81:sc= -1 USER MOD Single : A 17 ASN : amide:sc= -0.408 X(o=-0.41,f=-0.067) USER MOD Single : A 19 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.0228) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 61:sc= 0.00351 USER MOD Single : A 28 TYR OH : rot 30:sc= -1.04 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.997! USER MOD Single : A 33 SER OG : rot 130:sc= -1.6! USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 149:sc= -0.82 (180deg=-2.14!) USER MOD Single : A 38 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.114) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot -89:sc= -0.383 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -0.934 K(o=-0.93,f=-4.1!) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0.41) USER MOD Single : A 63 SER OG : rot 179:sc= -0.22 USER MOD Single : A 64 MET CE :methyl 174:sc= -10.2! (180deg=-10.5!) USER MOD Single : A 66 HIS : no HE2:sc= -35.4! C(o=-35!,f=-36!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 THR OG1 : rot -50:sc= 0.836 USER MOD Single : A 72 GLN : amide:sc= -0.0104 X(o=-0.01,f=-0.27) USER MOD Single : A 73 THR OG1 : rot 180:sc= -1.37 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 50:sc= 0.517 USER MOD Single : B 1 GLN : amide:sc= -0.414 X(o=-0.41,f=-0.038) USER MOD Single : B 1 GLN N :NH3+ 133:sc= 0.108 (180deg=0) USER MOD Single : B 6 ASN :FLIP amide:sc= -4.77! C(o=-6!,f=-4.8!) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.153 USER MOD Single : B 13 TYR OH : rot 136:sc= -1.77! USER MOD Single : B 14 ASN :FLIP amide:sc= -3.53! C(o=-5.3!,f=-3.5!) USER MOD Single : B 16 THR OG1 : rot -77:sc= -0.864 USER MOD Single : B 17 ASN : amide:sc= -0.453 X(o=-0.45,f=-0.059) USER MOD Single : B 19 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0266) USER MOD Single : B 21 SER OG : rot 180:sc= 0 USER MOD Single : B 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 SER OG : rot 60:sc= 0.00367 USER MOD Single : B 28 TYR OH : rot 30:sc= -0.891 USER MOD Single : B 32 THR OG1 : rot 180:sc= -1! USER MOD Single : B 33 SER OG : rot 132:sc= -1.66! USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 150:sc= -0.783 (180deg=-2.12!) USER MOD Single : B 38 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.114) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot -89:sc= -0.385 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 GLN : amide:sc= -1.03 K(o=-1,f=-4.4!) USER MOD Single : B 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 GLN : amide:sc= 0 X(o=0,f=0.42) USER MOD Single : B 63 SER OG : rot 177:sc= -0.202 USER MOD Single : B 64 MET CE :methyl 179:sc= -10! (180deg=-10.3!) USER MOD Single : B 66 HIS : no HE2:sc= -34.8! C(o=-35!,f=-36!) USER MOD Single : B 69 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00939) USER MOD Single : B 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 71 THR OG1 : rot -50:sc= 0.851 USER MOD Single : B 72 GLN : amide:sc= -0.0154 X(o=-0.015,f=-0.3) USER MOD Single : B 73 THR OG1 : rot 180:sc= -1.39 USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 THR OG1 : rot 55:sc= 0.518 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 64.759 -23.302 -4.330 1.00 0.00 N ATOM 2 CA GLN A 1 65.517 -22.240 -3.611 1.00 0.00 C ATOM 3 C GLN A 1 64.838 -20.879 -3.840 1.00 0.00 C ATOM 4 O GLN A 1 63.949 -20.768 -4.661 1.00 0.00 O ATOM 5 CB GLN A 1 66.952 -22.189 -4.141 1.00 0.00 C ATOM 6 CG GLN A 1 67.912 -22.710 -3.068 1.00 0.00 C ATOM 7 CD GLN A 1 67.646 -24.197 -2.824 1.00 0.00 C ATOM 8 OE1 GLN A 1 68.205 -25.044 -3.494 1.00 0.00 O ATOM 9 NE2 GLN A 1 66.812 -24.553 -1.887 1.00 0.00 N ATOM 0 H1 GLN A 1 65.424 -24.001 -4.719 1.00 0.00 H new ATOM 0 H2 GLN A 1 64.109 -23.773 -3.669 1.00 0.00 H new ATOM 0 H3 GLN A 1 64.214 -22.875 -5.106 1.00 0.00 H new ATOM 0 HA GLN A 1 65.531 -22.464 -2.544 1.00 0.00 H new ATOM 0 HB2 GLN A 1 67.039 -22.792 -5.045 1.00 0.00 H new ATOM 0 HB3 GLN A 1 67.214 -21.167 -4.413 1.00 0.00 H new ATOM 0 HG2 GLN A 1 68.944 -22.562 -3.385 1.00 0.00 H new ATOM 0 HG3 GLN A 1 67.779 -22.149 -2.143 1.00 0.00 H new ATOM 0 HE21 GLN A 1 66.343 -23.843 -1.325 1.00 0.00 H new ATOM 0 HE22 GLN A 1 66.629 -25.542 -1.716 1.00 0.00 H new ATOM 20 N PRO A 2 65.279 -19.879 -3.099 1.00 0.00 N ATOM 21 CA PRO A 2 64.719 -18.533 -3.212 1.00 0.00 C ATOM 22 C PRO A 2 64.933 -17.985 -4.625 1.00 0.00 C ATOM 23 O PRO A 2 66.005 -17.529 -4.967 1.00 0.00 O ATOM 24 CB PRO A 2 65.493 -17.688 -2.185 1.00 0.00 C ATOM 25 CG PRO A 2 66.521 -18.634 -1.487 1.00 0.00 C ATOM 26 CD PRO A 2 66.353 -20.031 -2.110 1.00 0.00 C ATOM 0 HA PRO A 2 63.645 -18.519 -3.025 1.00 0.00 H new ATOM 0 HB2 PRO A 2 66.004 -16.860 -2.676 1.00 0.00 H new ATOM 0 HB3 PRO A 2 64.812 -17.253 -1.453 1.00 0.00 H new ATOM 0 HG2 PRO A 2 67.538 -18.269 -1.630 1.00 0.00 H new ATOM 0 HG3 PRO A 2 66.343 -18.669 -0.412 1.00 0.00 H new ATOM 0 HD2 PRO A 2 67.277 -20.367 -2.580 1.00 0.00 H new ATOM 0 HD3 PRO A 2 66.092 -20.771 -1.354 1.00 0.00 H new ATOM 34 N ASP A 3 63.921 -18.031 -5.447 1.00 0.00 N ATOM 35 CA ASP A 3 64.060 -17.515 -6.830 1.00 0.00 C ATOM 36 C ASP A 3 63.768 -16.012 -6.843 1.00 0.00 C ATOM 37 O ASP A 3 62.800 -15.560 -7.422 1.00 0.00 O ATOM 38 CB ASP A 3 63.072 -18.236 -7.747 1.00 0.00 C ATOM 39 CG ASP A 3 63.442 -19.717 -7.833 1.00 0.00 C ATOM 40 OD1 ASP A 3 64.621 -20.008 -7.944 1.00 0.00 O ATOM 41 OD2 ASP A 3 62.539 -20.537 -7.786 1.00 0.00 O ATOM 0 H ASP A 3 63.001 -18.406 -5.215 1.00 0.00 H new ATOM 0 HA ASP A 3 65.076 -17.692 -7.184 1.00 0.00 H new ATOM 0 HB2 ASP A 3 62.057 -18.126 -7.364 1.00 0.00 H new ATOM 0 HB3 ASP A 3 63.088 -17.788 -8.741 1.00 0.00 H new ATOM 46 N ALA A 4 64.598 -15.238 -6.203 1.00 0.00 N ATOM 47 CA ALA A 4 64.379 -13.765 -6.163 1.00 0.00 C ATOM 48 C ALA A 4 65.387 -13.147 -5.196 1.00 0.00 C ATOM 49 O ALA A 4 65.027 -12.575 -4.186 1.00 0.00 O ATOM 50 CB ALA A 4 62.957 -13.467 -5.681 1.00 0.00 C ATOM 0 H ALA A 4 65.425 -15.564 -5.702 1.00 0.00 H new ATOM 0 HA ALA A 4 64.511 -13.344 -7.160 1.00 0.00 H new ATOM 0 HB1 ALA A 4 62.801 -12.389 -5.653 1.00 0.00 H new ATOM 0 HB2 ALA A 4 62.239 -13.920 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 4 62.817 -13.880 -4.682 1.00 0.00 H new ATOM 56 N ILE A 5 66.651 -13.278 -5.487 1.00 0.00 N ATOM 57 CA ILE A 5 67.688 -12.723 -4.581 1.00 0.00 C ATOM 58 C ILE A 5 68.021 -11.287 -4.989 1.00 0.00 C ATOM 59 O ILE A 5 68.625 -10.547 -4.239 1.00 0.00 O ATOM 60 CB ILE A 5 68.941 -13.592 -4.661 1.00 0.00 C ATOM 61 CG1 ILE A 5 68.656 -14.949 -4.018 1.00 0.00 C ATOM 62 CG2 ILE A 5 70.083 -12.912 -3.921 1.00 0.00 C ATOM 63 CD1 ILE A 5 69.065 -16.059 -4.980 1.00 0.00 C ATOM 0 H ILE A 5 67.010 -13.748 -6.318 1.00 0.00 H new ATOM 0 HA ILE A 5 67.314 -12.719 -3.557 1.00 0.00 H new ATOM 0 HB ILE A 5 69.220 -13.732 -5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 5 69.206 -15.043 -3.081 1.00 0.00 H new ATOM 0 HG13 ILE A 5 67.597 -15.034 -3.776 1.00 0.00 H new ATOM 0 HG21 ILE A 5 70.976 -13.534 -3.980 1.00 0.00 H new ATOM 0 HG22 ILE A 5 70.286 -11.943 -4.376 1.00 0.00 H new ATOM 0 HG23 ILE A 5 69.807 -12.771 -2.876 1.00 0.00 H new ATOM 0 HD11 ILE A 5 68.863 -17.028 -4.524 1.00 0.00 H new ATOM 0 HD12 ILE A 5 68.495 -15.967 -5.905 1.00 0.00 H new ATOM 0 HD13 ILE A 5 70.129 -15.976 -5.200 1.00 0.00 H new ATOM 75 N ASN A 6 67.600 -10.874 -6.144 1.00 0.00 N ATOM 76 CA ASN A 6 67.853 -9.468 -6.554 1.00 0.00 C ATOM 77 C ASN A 6 66.685 -8.645 -6.061 1.00 0.00 C ATOM 78 O ASN A 6 65.936 -8.100 -6.828 1.00 0.00 O ATOM 79 CB ASN A 6 67.969 -9.318 -8.096 1.00 0.00 C ATOM 80 CG ASN A 6 67.739 -10.658 -8.816 1.00 0.00 C ATOM 81 OD1 ASN A 6 66.538 -11.173 -8.842 1.00 0.00 O flip ATOM 82 ND2 ASN A 6 68.662 -11.241 -9.349 1.00 0.00 N flip ATOM 0 H ASN A 6 67.094 -11.444 -6.822 1.00 0.00 H new ATOM 0 HA ASN A 6 68.800 -9.136 -6.128 1.00 0.00 H new ATOM 0 HB2 ASN A 6 67.241 -8.587 -8.446 1.00 0.00 H new ATOM 0 HB3 ASN A 6 68.956 -8.932 -8.351 1.00 0.00 H new ATOM 0 HD21 ASN A 6 69.599 -10.839 -9.329 1.00 0.00 H new ATOM 0 HD22 ASN A 6 68.500 -12.133 -9.817 1.00 0.00 H new ATOM 89 N ALA A 7 66.475 -8.625 -4.783 1.00 0.00 N ATOM 90 CA ALA A 7 65.306 -7.896 -4.238 1.00 0.00 C ATOM 91 C ALA A 7 65.739 -6.598 -3.549 1.00 0.00 C ATOM 92 O ALA A 7 66.642 -6.613 -2.736 1.00 0.00 O ATOM 93 CB ALA A 7 64.615 -8.770 -3.196 1.00 0.00 C ATOM 0 H ALA A 7 67.064 -9.084 -4.088 1.00 0.00 H new ATOM 0 HA ALA A 7 64.637 -7.660 -5.065 1.00 0.00 H new ATOM 0 HB1 ALA A 7 63.753 -8.240 -2.790 1.00 0.00 H new ATOM 0 HB2 ALA A 7 64.284 -9.698 -3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 7 65.313 -8.997 -2.391 1.00 0.00 H new ATOM 99 N PRO A 8 65.015 -5.518 -3.812 1.00 0.00 N ATOM 100 CA PRO A 8 65.262 -4.265 -3.126 1.00 0.00 C ATOM 101 C PRO A 8 64.947 -4.486 -1.660 1.00 0.00 C ATOM 102 O PRO A 8 63.801 -4.565 -1.265 1.00 0.00 O ATOM 103 CB PRO A 8 64.288 -3.258 -3.744 1.00 0.00 C ATOM 104 CG PRO A 8 63.469 -4.021 -4.827 1.00 0.00 C ATOM 105 CD PRO A 8 63.935 -5.486 -4.804 1.00 0.00 C ATOM 0 HA PRO A 8 66.288 -3.908 -3.217 1.00 0.00 H new ATOM 0 HB2 PRO A 8 63.628 -2.843 -2.982 1.00 0.00 H new ATOM 0 HB3 PRO A 8 64.828 -2.422 -4.187 1.00 0.00 H new ATOM 0 HG2 PRO A 8 62.401 -3.954 -4.619 1.00 0.00 H new ATOM 0 HG3 PRO A 8 63.630 -3.582 -5.811 1.00 0.00 H new ATOM 0 HD2 PRO A 8 63.122 -6.156 -4.525 1.00 0.00 H new ATOM 0 HD3 PRO A 8 64.289 -5.804 -5.785 1.00 0.00 H new ATOM 113 N VAL A 9 65.942 -4.677 -0.872 1.00 0.00 N ATOM 114 CA VAL A 9 65.706 -4.999 0.548 1.00 0.00 C ATOM 115 C VAL A 9 65.584 -3.705 1.364 1.00 0.00 C ATOM 116 O VAL A 9 66.562 -3.115 1.775 1.00 0.00 O ATOM 117 CB VAL A 9 66.888 -5.818 1.032 1.00 0.00 C ATOM 118 CG1 VAL A 9 68.145 -4.997 0.856 1.00 0.00 C ATOM 119 CG2 VAL A 9 66.703 -6.185 2.491 1.00 0.00 C ATOM 0 H VAL A 9 66.922 -4.625 -1.149 1.00 0.00 H new ATOM 0 HA VAL A 9 64.780 -5.561 0.669 1.00 0.00 H new ATOM 0 HB VAL A 9 66.964 -6.739 0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 9 69.006 -5.571 1.199 1.00 0.00 H new ATOM 0 HG12 VAL A 9 68.272 -4.748 -0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 9 68.065 -4.080 1.439 1.00 0.00 H new ATOM 0 HG21 VAL A 9 67.556 -6.773 2.829 1.00 0.00 H new ATOM 0 HG22 VAL A 9 66.629 -5.276 3.088 1.00 0.00 H new ATOM 0 HG23 VAL A 9 65.791 -6.770 2.606 1.00 0.00 H new ATOM 129 N THR A 10 64.385 -3.256 1.591 1.00 0.00 N ATOM 130 CA THR A 10 64.197 -2.001 2.363 1.00 0.00 C ATOM 131 C THR A 10 64.787 -2.159 3.765 1.00 0.00 C ATOM 132 O THR A 10 64.243 -2.850 4.604 1.00 0.00 O ATOM 133 CB THR A 10 62.705 -1.688 2.472 1.00 0.00 C ATOM 134 OG1 THR A 10 62.074 -1.956 1.228 1.00 0.00 O ATOM 135 CG2 THR A 10 62.522 -0.216 2.832 1.00 0.00 C ATOM 0 H THR A 10 63.525 -3.705 1.275 1.00 0.00 H new ATOM 0 HA THR A 10 64.706 -1.185 1.849 1.00 0.00 H new ATOM 0 HB THR A 10 62.256 -2.310 3.247 1.00 0.00 H new ATOM 0 HG1 THR A 10 61.117 -1.757 1.297 1.00 0.00 H new ATOM 0 HG21 THR A 10 61.459 0.010 2.910 1.00 0.00 H new ATOM 0 HG22 THR A 10 63.008 -0.012 3.786 1.00 0.00 H new ATOM 0 HG23 THR A 10 62.969 0.406 2.057 1.00 0.00 H new ATOM 143 N CYS A 11 65.888 -1.508 4.033 1.00 0.00 N ATOM 144 CA CYS A 11 66.498 -1.609 5.393 1.00 0.00 C ATOM 145 C CYS A 11 66.750 -0.203 5.940 1.00 0.00 C ATOM 146 O CYS A 11 66.234 0.773 5.434 1.00 0.00 O ATOM 147 CB CYS A 11 67.823 -2.371 5.322 1.00 0.00 C ATOM 148 SG CYS A 11 67.606 -3.872 4.340 1.00 0.00 S ATOM 0 H CYS A 11 66.390 -0.913 3.373 1.00 0.00 H new ATOM 0 HA CYS A 11 65.815 -2.146 6.051 1.00 0.00 H new ATOM 0 HB2 CYS A 11 68.593 -1.741 4.877 1.00 0.00 H new ATOM 0 HB3 CYS A 11 68.161 -2.627 6.326 1.00 0.00 H new ATOM 153 N CYS A 12 67.536 -0.093 6.975 1.00 0.00 N ATOM 154 CA CYS A 12 67.817 1.252 7.560 1.00 0.00 C ATOM 155 C CYS A 12 69.315 1.381 7.852 1.00 0.00 C ATOM 156 O CYS A 12 70.102 0.521 7.514 1.00 0.00 O ATOM 157 CB CYS A 12 67.049 1.412 8.875 1.00 0.00 C ATOM 158 SG CYS A 12 65.356 0.821 8.673 1.00 0.00 S ATOM 0 H CYS A 12 67.996 -0.874 7.442 1.00 0.00 H new ATOM 0 HA CYS A 12 67.506 2.019 6.851 1.00 0.00 H new ATOM 0 HB2 CYS A 12 67.547 0.853 9.667 1.00 0.00 H new ATOM 0 HB3 CYS A 12 67.044 2.459 9.178 1.00 0.00 H new ATOM 163 N TYR A 13 69.702 2.436 8.516 1.00 0.00 N ATOM 164 CA TYR A 13 71.140 2.616 8.878 1.00 0.00 C ATOM 165 C TYR A 13 71.225 3.221 10.281 1.00 0.00 C ATOM 166 O TYR A 13 72.030 2.818 11.097 1.00 0.00 O ATOM 167 CB TYR A 13 71.822 3.549 7.876 1.00 0.00 C ATOM 168 CG TYR A 13 71.990 2.836 6.554 1.00 0.00 C ATOM 169 CD1 TYR A 13 72.404 1.492 6.531 1.00 0.00 C ATOM 170 CD2 TYR A 13 71.748 3.520 5.337 1.00 0.00 C ATOM 171 CE1 TYR A 13 72.571 0.826 5.299 1.00 0.00 C ATOM 172 CE2 TYR A 13 71.921 2.854 4.107 1.00 0.00 C ATOM 173 CZ TYR A 13 72.333 1.506 4.088 1.00 0.00 C ATOM 174 OH TYR A 13 72.500 0.853 2.884 1.00 0.00 O ATOM 0 H TYR A 13 69.083 3.185 8.825 1.00 0.00 H new ATOM 0 HA TYR A 13 71.644 1.650 8.857 1.00 0.00 H new ATOM 0 HB2 TYR A 13 71.227 4.452 7.741 1.00 0.00 H new ATOM 0 HB3 TYR A 13 72.794 3.862 8.258 1.00 0.00 H new ATOM 0 HD1 TYR A 13 72.594 0.970 7.457 1.00 0.00 H new ATOM 0 HD2 TYR A 13 71.431 4.552 5.352 1.00 0.00 H new ATOM 0 HE1 TYR A 13 72.882 -0.208 5.284 1.00 0.00 H new ATOM 0 HE2 TYR A 13 71.738 3.376 3.179 1.00 0.00 H new ATOM 0 HH TYR A 13 71.739 1.048 2.298 1.00 0.00 H new ATOM 184 N ASN A 14 70.376 4.170 10.575 1.00 0.00 N ATOM 185 CA ASN A 14 70.377 4.787 11.928 1.00 0.00 C ATOM 186 C ASN A 14 69.003 4.577 12.558 1.00 0.00 C ATOM 187 O ASN A 14 68.179 3.856 12.031 1.00 0.00 O ATOM 188 CB ASN A 14 70.669 6.283 11.811 1.00 0.00 C ATOM 189 CG ASN A 14 72.046 6.484 11.182 1.00 0.00 C ATOM 190 OD1 ASN A 14 72.131 6.831 9.929 1.00 0.00 O flip ATOM 191 ND2 ASN A 14 73.056 6.324 11.838 1.00 0.00 N flip ATOM 0 H ASN A 14 69.679 4.544 9.931 1.00 0.00 H new ATOM 0 HA ASN A 14 71.145 4.326 12.549 1.00 0.00 H new ATOM 0 HB2 ASN A 14 69.905 6.767 11.203 1.00 0.00 H new ATOM 0 HB3 ASN A 14 70.635 6.749 12.796 1.00 0.00 H new ATOM 0 HD21 ASN A 14 72.989 6.052 12.819 1.00 0.00 H new ATOM 0 HD22 ASN A 14 73.971 6.461 11.408 1.00 0.00 H new ATOM 198 N PHE A 15 68.745 5.183 13.681 1.00 0.00 N ATOM 199 CA PHE A 15 67.417 4.986 14.325 1.00 0.00 C ATOM 200 C PHE A 15 67.038 6.214 15.156 1.00 0.00 C ATOM 201 O PHE A 15 67.703 6.550 16.116 1.00 0.00 O ATOM 202 CB PHE A 15 67.473 3.762 15.244 1.00 0.00 C ATOM 203 CG PHE A 15 67.898 2.546 14.454 1.00 0.00 C ATOM 204 CD1 PHE A 15 69.270 2.258 14.285 1.00 0.00 C ATOM 205 CD2 PHE A 15 66.922 1.702 13.877 1.00 0.00 C ATOM 206 CE1 PHE A 15 69.667 1.127 13.540 1.00 0.00 C ATOM 207 CE2 PHE A 15 67.319 0.571 13.130 1.00 0.00 C ATOM 208 CZ PHE A 15 68.693 0.283 12.962 1.00 0.00 C ATOM 0 H PHE A 15 69.388 5.800 14.177 1.00 0.00 H new ATOM 0 HA PHE A 15 66.670 4.837 13.545 1.00 0.00 H new ATOM 0 HB2 PHE A 15 68.174 3.940 16.059 1.00 0.00 H new ATOM 0 HB3 PHE A 15 66.496 3.590 15.695 1.00 0.00 H new ATOM 0 HD1 PHE A 15 70.016 2.903 14.726 1.00 0.00 H new ATOM 0 HD2 PHE A 15 65.873 1.922 14.007 1.00 0.00 H new ATOM 0 HE1 PHE A 15 70.716 0.907 13.412 1.00 0.00 H new ATOM 0 HE2 PHE A 15 66.574 -0.073 12.688 1.00 0.00 H new ATOM 0 HZ PHE A 15 68.998 -0.582 12.392 1.00 0.00 H new ATOM 218 N THR A 16 65.940 6.861 14.827 1.00 0.00 N ATOM 219 CA THR A 16 65.490 8.040 15.650 1.00 0.00 C ATOM 220 C THR A 16 65.472 7.618 17.120 1.00 0.00 C ATOM 221 O THR A 16 64.542 6.994 17.579 1.00 0.00 O ATOM 222 CB THR A 16 64.064 8.488 15.233 1.00 0.00 C ATOM 223 OG1 THR A 16 63.406 9.069 16.353 1.00 0.00 O ATOM 224 CG2 THR A 16 63.257 7.287 14.742 1.00 0.00 C ATOM 0 H THR A 16 65.341 6.629 14.035 1.00 0.00 H new ATOM 0 HA THR A 16 66.174 8.874 15.492 1.00 0.00 H new ATOM 0 HB THR A 16 64.143 9.219 14.428 1.00 0.00 H new ATOM 0 HG1 THR A 16 63.043 8.360 16.923 1.00 0.00 H new ATOM 0 HG21 THR A 16 62.258 7.614 14.452 1.00 0.00 H new ATOM 0 HG22 THR A 16 63.756 6.840 13.882 1.00 0.00 H new ATOM 0 HG23 THR A 16 63.180 6.549 15.541 1.00 0.00 H new ATOM 232 N ASN A 17 66.506 7.914 17.853 1.00 0.00 N ATOM 233 CA ASN A 17 66.541 7.481 19.275 1.00 0.00 C ATOM 234 C ASN A 17 65.902 8.545 20.165 1.00 0.00 C ATOM 235 O ASN A 17 65.861 8.410 21.372 1.00 0.00 O ATOM 236 CB ASN A 17 67.991 7.255 19.703 1.00 0.00 C ATOM 237 CG ASN A 17 68.076 6.008 20.586 1.00 0.00 C ATOM 238 OD1 ASN A 17 69.070 5.309 20.575 1.00 0.00 O ATOM 239 ND2 ASN A 17 67.068 5.695 21.353 1.00 0.00 N ATOM 0 H ASN A 17 67.323 8.433 17.532 1.00 0.00 H new ATOM 0 HA ASN A 17 65.981 6.552 19.379 1.00 0.00 H new ATOM 0 HB2 ASN A 17 68.626 7.135 18.825 1.00 0.00 H new ATOM 0 HB3 ASN A 17 68.360 8.124 20.247 1.00 0.00 H new ATOM 0 HD21 ASN A 17 67.115 4.864 21.943 1.00 0.00 H new ATOM 0 HD22 ASN A 17 66.233 6.281 21.363 1.00 0.00 H new ATOM 246 N ARG A 18 65.369 9.584 19.588 1.00 0.00 N ATOM 247 CA ARG A 18 64.700 10.618 20.415 1.00 0.00 C ATOM 248 C ARG A 18 63.235 10.231 20.567 1.00 0.00 C ATOM 249 O ARG A 18 62.576 9.892 19.607 1.00 0.00 O ATOM 250 CB ARG A 18 64.804 11.979 19.726 1.00 0.00 C ATOM 251 CG ARG A 18 66.161 12.610 20.046 1.00 0.00 C ATOM 252 CD ARG A 18 66.917 12.886 18.744 1.00 0.00 C ATOM 253 NE ARG A 18 67.809 14.070 18.929 1.00 0.00 N ATOM 254 CZ ARG A 18 68.337 14.678 17.888 1.00 0.00 C ATOM 255 NH1 ARG A 18 68.093 14.254 16.672 1.00 0.00 N ATOM 256 NH2 ARG A 18 69.112 15.712 18.069 1.00 0.00 N ATOM 0 H ARG A 18 65.369 9.760 18.583 1.00 0.00 H new ATOM 0 HA ARG A 18 65.177 10.684 21.393 1.00 0.00 H new ATOM 0 HB2 ARG A 18 64.690 11.863 18.648 1.00 0.00 H new ATOM 0 HB3 ARG A 18 63.999 12.632 20.063 1.00 0.00 H new ATOM 0 HG2 ARG A 18 66.021 13.538 20.601 1.00 0.00 H new ATOM 0 HG3 ARG A 18 66.743 11.943 20.682 1.00 0.00 H new ATOM 0 HD2 ARG A 18 67.506 12.014 18.461 1.00 0.00 H new ATOM 0 HD3 ARG A 18 66.212 13.071 17.934 1.00 0.00 H new ATOM 0 HE ARG A 18 68.010 14.410 19.869 1.00 0.00 H new ATOM 0 HH11 ARG A 18 67.489 13.445 16.525 1.00 0.00 H new ATOM 0 HH12 ARG A 18 68.507 14.733 15.872 1.00 0.00 H new ATOM 0 HH21 ARG A 18 69.306 16.045 19.013 1.00 0.00 H new ATOM 0 HH22 ARG A 18 69.524 16.187 17.266 1.00 0.00 H new ATOM 270 N LYS A 19 62.722 10.255 21.765 1.00 0.00 N ATOM 271 CA LYS A 19 61.297 9.862 21.971 1.00 0.00 C ATOM 272 C LYS A 19 60.406 10.665 21.025 1.00 0.00 C ATOM 273 O LYS A 19 59.987 11.765 21.327 1.00 0.00 O ATOM 274 CB LYS A 19 60.892 10.137 23.420 1.00 0.00 C ATOM 275 CG LYS A 19 61.871 9.436 24.365 1.00 0.00 C ATOM 276 CD LYS A 19 61.235 9.300 25.749 1.00 0.00 C ATOM 277 CE LYS A 19 62.303 8.888 26.764 1.00 0.00 C ATOM 278 NZ LYS A 19 63.082 10.088 27.180 1.00 0.00 N ATOM 0 H LYS A 19 63.225 10.529 22.609 1.00 0.00 H new ATOM 0 HA LYS A 19 61.180 8.799 21.762 1.00 0.00 H new ATOM 0 HB2 LYS A 19 60.891 11.210 23.611 1.00 0.00 H new ATOM 0 HB3 LYS A 19 59.878 9.780 23.599 1.00 0.00 H new ATOM 0 HG2 LYS A 19 62.129 8.452 23.974 1.00 0.00 H new ATOM 0 HG3 LYS A 19 62.798 10.005 24.433 1.00 0.00 H new ATOM 0 HD2 LYS A 19 60.781 10.245 26.047 1.00 0.00 H new ATOM 0 HD3 LYS A 19 60.437 8.557 25.723 1.00 0.00 H new ATOM 0 HE2 LYS A 19 61.835 8.426 27.633 1.00 0.00 H new ATOM 0 HE3 LYS A 19 62.968 8.143 26.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 64.069 9.816 27.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 63.052 10.801 26.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 62.669 10.486 28.048 1.00 0.00 H new ATOM 292 N ILE A 20 60.127 10.122 19.876 1.00 0.00 N ATOM 293 CA ILE A 20 59.286 10.836 18.899 1.00 0.00 C ATOM 294 C ILE A 20 57.827 10.746 19.328 1.00 0.00 C ATOM 295 O ILE A 20 57.256 9.681 19.449 1.00 0.00 O ATOM 296 CB ILE A 20 59.482 10.217 17.511 1.00 0.00 C ATOM 297 CG1 ILE A 20 60.874 10.629 16.983 1.00 0.00 C ATOM 298 CG2 ILE A 20 58.384 10.714 16.555 1.00 0.00 C ATOM 299 CD1 ILE A 20 60.863 10.698 15.456 1.00 0.00 C ATOM 0 H ILE A 20 60.453 9.203 19.575 1.00 0.00 H new ATOM 0 HA ILE A 20 59.573 11.887 18.856 1.00 0.00 H new ATOM 0 HB ILE A 20 59.417 9.131 17.574 1.00 0.00 H new ATOM 0 HG12 ILE A 20 61.155 11.598 17.396 1.00 0.00 H new ATOM 0 HG13 ILE A 20 61.624 9.911 17.316 1.00 0.00 H new ATOM 0 HG21 ILE A 20 58.530 10.270 15.571 1.00 0.00 H new ATOM 0 HG22 ILE A 20 57.407 10.425 16.942 1.00 0.00 H new ATOM 0 HG23 ILE A 20 58.436 11.800 16.474 1.00 0.00 H new ATOM 0 HD11 ILE A 20 61.850 10.989 15.098 1.00 0.00 H new ATOM 0 HD12 ILE A 20 60.604 9.721 15.049 1.00 0.00 H new ATOM 0 HD13 ILE A 20 60.127 11.433 15.130 1.00 0.00 H new ATOM 311 N SER A 21 57.239 11.865 19.564 1.00 0.00 N ATOM 312 CA SER A 21 55.821 11.914 20.000 1.00 0.00 C ATOM 313 C SER A 21 54.944 11.006 19.125 1.00 0.00 C ATOM 314 O SER A 21 54.973 11.078 17.913 1.00 0.00 O ATOM 315 CB SER A 21 55.332 13.349 19.867 1.00 0.00 C ATOM 316 OG SER A 21 54.404 13.633 20.906 1.00 0.00 O ATOM 0 H SER A 21 57.687 12.777 19.473 1.00 0.00 H new ATOM 0 HA SER A 21 55.753 11.568 21.031 1.00 0.00 H new ATOM 0 HB2 SER A 21 56.175 14.038 19.920 1.00 0.00 H new ATOM 0 HB3 SER A 21 54.861 13.495 18.895 1.00 0.00 H new ATOM 0 HG SER A 21 54.091 14.558 20.821 1.00 0.00 H new ATOM 322 N VAL A 22 54.135 10.180 19.740 1.00 0.00 N ATOM 323 CA VAL A 22 53.217 9.302 18.964 1.00 0.00 C ATOM 324 C VAL A 22 52.404 10.158 17.975 1.00 0.00 C ATOM 325 O VAL A 22 51.887 9.663 16.994 1.00 0.00 O ATOM 326 CB VAL A 22 52.264 8.566 19.949 1.00 0.00 C ATOM 327 CG1 VAL A 22 51.902 9.486 21.115 1.00 0.00 C ATOM 328 CG2 VAL A 22 50.958 8.152 19.236 1.00 0.00 C ATOM 0 H VAL A 22 54.073 10.078 20.753 1.00 0.00 H new ATOM 0 HA VAL A 22 53.791 8.565 18.403 1.00 0.00 H new ATOM 0 HB VAL A 22 52.781 7.679 20.314 1.00 0.00 H new ATOM 0 HG11 VAL A 22 51.235 8.961 21.799 1.00 0.00 H new ATOM 0 HG12 VAL A 22 52.809 9.776 21.645 1.00 0.00 H new ATOM 0 HG13 VAL A 22 51.404 10.377 20.734 1.00 0.00 H new ATOM 0 HG21 VAL A 22 50.305 7.639 19.942 1.00 0.00 H new ATOM 0 HG22 VAL A 22 50.454 9.040 18.855 1.00 0.00 H new ATOM 0 HG23 VAL A 22 51.192 7.484 18.407 1.00 0.00 H new ATOM 338 N GLN A 23 52.287 11.431 18.230 1.00 0.00 N ATOM 339 CA GLN A 23 51.520 12.297 17.325 1.00 0.00 C ATOM 340 C GLN A 23 52.277 12.418 16.007 1.00 0.00 C ATOM 341 O GLN A 23 51.713 12.305 14.937 1.00 0.00 O ATOM 342 CB GLN A 23 51.333 13.682 17.997 1.00 0.00 C ATOM 343 CG GLN A 23 51.971 14.806 17.159 1.00 0.00 C ATOM 344 CD GLN A 23 51.599 16.165 17.757 1.00 0.00 C ATOM 345 OE1 GLN A 23 52.368 16.747 18.495 1.00 0.00 O ATOM 346 NE2 GLN A 23 50.444 16.697 17.467 1.00 0.00 N ATOM 0 H GLN A 23 52.697 11.902 19.036 1.00 0.00 H new ATOM 0 HA GLN A 23 50.535 11.877 17.122 1.00 0.00 H new ATOM 0 HB2 GLN A 23 50.270 13.883 18.129 1.00 0.00 H new ATOM 0 HB3 GLN A 23 51.780 13.669 18.991 1.00 0.00 H new ATOM 0 HG2 GLN A 23 53.055 14.690 17.141 1.00 0.00 H new ATOM 0 HG3 GLN A 23 51.626 14.745 16.127 1.00 0.00 H new ATOM 0 HE21 GLN A 23 49.798 16.208 16.847 1.00 0.00 H new ATOM 0 HE22 GLN A 23 50.186 17.602 17.860 1.00 0.00 H new ATOM 355 N ARG A 24 53.551 12.657 16.083 1.00 0.00 N ATOM 356 CA ARG A 24 54.345 12.798 14.849 1.00 0.00 C ATOM 357 C ARG A 24 54.306 11.504 14.067 1.00 0.00 C ATOM 358 O ARG A 24 54.466 11.486 12.867 1.00 0.00 O ATOM 359 CB ARG A 24 55.794 13.124 15.198 1.00 0.00 C ATOM 360 CG ARG A 24 55.840 14.398 16.027 1.00 0.00 C ATOM 361 CD ARG A 24 55.860 15.607 15.096 1.00 0.00 C ATOM 362 NE ARG A 24 56.912 16.577 15.549 1.00 0.00 N ATOM 363 CZ ARG A 24 58.141 16.180 15.783 1.00 0.00 C ATOM 364 NH1 ARG A 24 58.546 14.994 15.398 1.00 0.00 N ATOM 365 NH2 ARG A 24 58.989 17.002 16.339 1.00 0.00 N ATOM 0 H ARG A 24 54.075 12.760 16.952 1.00 0.00 H new ATOM 0 HA ARG A 24 53.924 13.604 14.249 1.00 0.00 H new ATOM 0 HB2 ARG A 24 56.240 12.299 15.754 1.00 0.00 H new ATOM 0 HB3 ARG A 24 56.380 13.248 14.287 1.00 0.00 H new ATOM 0 HG2 ARG A 24 54.974 14.447 16.687 1.00 0.00 H new ATOM 0 HG3 ARG A 24 56.725 14.400 16.663 1.00 0.00 H new ATOM 0 HD2 ARG A 24 56.062 15.288 14.074 1.00 0.00 H new ATOM 0 HD3 ARG A 24 54.883 16.091 15.091 1.00 0.00 H new ATOM 0 HE ARG A 24 56.668 17.559 15.677 1.00 0.00 H new ATOM 0 HH11 ARG A 24 57.904 14.369 14.911 1.00 0.00 H new ATOM 0 HH12 ARG A 24 59.503 14.696 15.585 1.00 0.00 H new ATOM 0 HH21 ARG A 24 58.695 17.946 16.589 1.00 0.00 H new ATOM 0 HH22 ARG A 24 59.946 16.700 16.524 1.00 0.00 H new ATOM 379 N LEU A 25 54.130 10.417 14.741 1.00 0.00 N ATOM 380 CA LEU A 25 54.129 9.111 14.054 1.00 0.00 C ATOM 381 C LEU A 25 52.807 8.885 13.336 1.00 0.00 C ATOM 382 O LEU A 25 51.816 8.513 13.930 1.00 0.00 O ATOM 383 CB LEU A 25 54.363 8.010 15.077 1.00 0.00 C ATOM 384 CG LEU A 25 55.682 8.283 15.809 1.00 0.00 C ATOM 385 CD1 LEU A 25 56.019 7.108 16.714 1.00 0.00 C ATOM 386 CD2 LEU A 25 56.806 8.474 14.787 1.00 0.00 C ATOM 0 H LEU A 25 53.985 10.376 15.750 1.00 0.00 H new ATOM 0 HA LEU A 25 54.926 9.097 13.311 1.00 0.00 H new ATOM 0 HB2 LEU A 25 53.538 7.975 15.788 1.00 0.00 H new ATOM 0 HB3 LEU A 25 54.400 7.039 14.583 1.00 0.00 H new ATOM 0 HG LEU A 25 55.578 9.186 16.410 1.00 0.00 H new ATOM 0 HD11 LEU A 25 56.957 7.306 17.233 1.00 0.00 H new ATOM 0 HD12 LEU A 25 55.222 6.971 17.445 1.00 0.00 H new ATOM 0 HD13 LEU A 25 56.120 6.204 16.114 1.00 0.00 H new ATOM 0 HD21 LEU A 25 57.743 8.668 15.309 1.00 0.00 H new ATOM 0 HD22 LEU A 25 56.907 7.572 14.184 1.00 0.00 H new ATOM 0 HD23 LEU A 25 56.570 9.319 14.140 1.00 0.00 H new ATOM 398 N ALA A 26 52.792 9.103 12.055 1.00 0.00 N ATOM 399 CA ALA A 26 51.547 8.900 11.278 1.00 0.00 C ATOM 400 C ALA A 26 51.348 7.407 10.987 1.00 0.00 C ATOM 401 O ALA A 26 50.258 6.963 10.689 1.00 0.00 O ATOM 402 CB ALA A 26 51.647 9.651 9.954 1.00 0.00 C ATOM 0 H ALA A 26 53.596 9.415 11.510 1.00 0.00 H new ATOM 0 HA ALA A 26 50.703 9.274 11.858 1.00 0.00 H new ATOM 0 HB1 ALA A 26 50.732 9.502 9.381 1.00 0.00 H new ATOM 0 HB2 ALA A 26 51.785 10.715 10.149 1.00 0.00 H new ATOM 0 HB3 ALA A 26 52.496 9.273 9.385 1.00 0.00 H new ATOM 408 N SER A 27 52.398 6.637 11.052 1.00 0.00 N ATOM 409 CA SER A 27 52.276 5.176 10.757 1.00 0.00 C ATOM 410 C SER A 27 53.596 4.475 11.088 1.00 0.00 C ATOM 411 O SER A 27 54.535 5.093 11.550 1.00 0.00 O ATOM 412 CB SER A 27 51.954 4.981 9.275 1.00 0.00 C ATOM 413 OG SER A 27 50.691 4.342 9.148 1.00 0.00 O ATOM 0 H SER A 27 53.337 6.953 11.296 1.00 0.00 H new ATOM 0 HA SER A 27 51.477 4.749 11.363 1.00 0.00 H new ATOM 0 HB2 SER A 27 51.940 5.944 8.765 1.00 0.00 H new ATOM 0 HB3 SER A 27 52.728 4.379 8.799 1.00 0.00 H new ATOM 0 HG SER A 27 49.998 4.904 9.552 1.00 0.00 H new ATOM 419 N TYR A 28 53.674 3.185 10.876 1.00 0.00 N ATOM 420 CA TYR A 28 54.932 2.458 11.204 1.00 0.00 C ATOM 421 C TYR A 28 55.079 1.223 10.285 1.00 0.00 C ATOM 422 O TYR A 28 54.106 0.610 9.892 1.00 0.00 O ATOM 423 CB TYR A 28 54.884 2.060 12.705 1.00 0.00 C ATOM 424 CG TYR A 28 54.994 0.564 12.904 1.00 0.00 C ATOM 425 CD1 TYR A 28 53.936 -0.280 12.508 1.00 0.00 C ATOM 426 CD2 TYR A 28 56.143 0.021 13.515 1.00 0.00 C ATOM 427 CE1 TYR A 28 54.029 -1.671 12.717 1.00 0.00 C ATOM 428 CE2 TYR A 28 56.237 -1.369 13.729 1.00 0.00 C ATOM 429 CZ TYR A 28 55.180 -2.218 13.330 1.00 0.00 C ATOM 430 OH TYR A 28 55.271 -3.579 13.539 1.00 0.00 O ATOM 0 H TYR A 28 52.924 2.609 10.492 1.00 0.00 H new ATOM 0 HA TYR A 28 55.803 3.091 11.035 1.00 0.00 H new ATOM 0 HB2 TYR A 28 55.696 2.556 13.237 1.00 0.00 H new ATOM 0 HB3 TYR A 28 53.952 2.415 13.144 1.00 0.00 H new ATOM 0 HD1 TYR A 28 53.055 0.139 12.045 1.00 0.00 H new ATOM 0 HD2 TYR A 28 56.951 0.670 13.819 1.00 0.00 H new ATOM 0 HE1 TYR A 28 53.221 -2.319 12.409 1.00 0.00 H new ATOM 0 HE2 TYR A 28 57.117 -1.785 14.198 1.00 0.00 H new ATOM 0 HH TYR A 28 54.767 -4.051 12.844 1.00 0.00 H new ATOM 440 N ARG A 29 56.293 0.858 9.953 1.00 0.00 N ATOM 441 CA ARG A 29 56.508 -0.333 9.073 1.00 0.00 C ATOM 442 C ARG A 29 57.715 -1.129 9.582 1.00 0.00 C ATOM 443 O ARG A 29 58.815 -0.997 9.085 1.00 0.00 O ATOM 444 CB ARG A 29 56.771 0.129 7.641 1.00 0.00 C ATOM 445 CG ARG A 29 55.679 -0.418 6.720 1.00 0.00 C ATOM 446 CD ARG A 29 55.345 0.621 5.649 1.00 0.00 C ATOM 447 NE ARG A 29 54.083 0.230 4.952 1.00 0.00 N ATOM 448 CZ ARG A 29 53.746 0.795 3.813 1.00 0.00 C ATOM 449 NH1 ARG A 29 54.511 1.710 3.268 1.00 0.00 N ATOM 450 NH2 ARG A 29 52.640 0.441 3.218 1.00 0.00 N ATOM 0 H ARG A 29 57.144 1.333 10.253 1.00 0.00 H new ATOM 0 HA ARG A 29 55.619 -0.964 9.092 1.00 0.00 H new ATOM 0 HB2 ARG A 29 56.788 1.218 7.596 1.00 0.00 H new ATOM 0 HB3 ARG A 29 57.749 -0.219 7.309 1.00 0.00 H new ATOM 0 HG2 ARG A 29 56.014 -1.343 6.252 1.00 0.00 H new ATOM 0 HG3 ARG A 29 54.787 -0.658 7.299 1.00 0.00 H new ATOM 0 HD2 ARG A 29 55.232 1.605 6.104 1.00 0.00 H new ATOM 0 HD3 ARG A 29 56.162 0.694 4.931 1.00 0.00 H new ATOM 0 HE ARG A 29 53.478 -0.481 5.363 1.00 0.00 H new ATOM 0 HH11 ARG A 29 55.377 1.990 3.728 1.00 0.00 H new ATOM 0 HH12 ARG A 29 54.240 2.141 2.384 1.00 0.00 H new ATOM 0 HH21 ARG A 29 52.041 -0.271 3.636 1.00 0.00 H new ATOM 0 HH22 ARG A 29 52.374 0.876 2.335 1.00 0.00 H new ATOM 464 N ARG A 30 57.515 -1.944 10.579 1.00 0.00 N ATOM 465 CA ARG A 30 58.645 -2.741 11.147 1.00 0.00 C ATOM 466 C ARG A 30 59.429 -3.441 10.029 1.00 0.00 C ATOM 467 O ARG A 30 59.035 -4.483 9.542 1.00 0.00 O ATOM 468 CB ARG A 30 58.087 -3.794 12.107 1.00 0.00 C ATOM 469 CG ARG A 30 59.187 -4.238 13.072 1.00 0.00 C ATOM 470 CD ARG A 30 58.592 -5.167 14.131 1.00 0.00 C ATOM 471 NE ARG A 30 59.176 -6.533 13.979 1.00 0.00 N ATOM 472 CZ ARG A 30 58.622 -7.567 14.573 1.00 0.00 C ATOM 473 NH1 ARG A 30 57.546 -7.417 15.308 1.00 0.00 N ATOM 474 NH2 ARG A 30 59.145 -8.754 14.428 1.00 0.00 N ATOM 0 H ARG A 30 56.613 -2.095 11.030 1.00 0.00 H new ATOM 0 HA ARG A 30 59.317 -2.067 11.678 1.00 0.00 H new ATOM 0 HB2 ARG A 30 57.244 -3.384 12.663 1.00 0.00 H new ATOM 0 HB3 ARG A 30 57.713 -4.651 11.546 1.00 0.00 H new ATOM 0 HG2 ARG A 30 59.979 -4.751 12.526 1.00 0.00 H new ATOM 0 HG3 ARG A 30 59.640 -3.369 13.549 1.00 0.00 H new ATOM 0 HD2 ARG A 30 58.800 -4.780 15.128 1.00 0.00 H new ATOM 0 HD3 ARG A 30 57.508 -5.209 14.025 1.00 0.00 H new ATOM 0 HE ARG A 30 60.012 -6.665 13.409 1.00 0.00 H new ATOM 0 HH11 ARG A 30 57.132 -6.492 15.423 1.00 0.00 H new ATOM 0 HH12 ARG A 30 57.124 -8.225 15.765 1.00 0.00 H new ATOM 0 HH21 ARG A 30 59.980 -8.877 13.856 1.00 0.00 H new ATOM 0 HH22 ARG A 30 58.718 -9.559 14.887 1.00 0.00 H new ATOM 488 N ILE A 31 60.555 -2.894 9.644 1.00 0.00 N ATOM 489 CA ILE A 31 61.379 -3.550 8.590 1.00 0.00 C ATOM 490 C ILE A 31 61.914 -4.880 9.136 1.00 0.00 C ATOM 491 O ILE A 31 61.974 -5.091 10.328 1.00 0.00 O ATOM 492 CB ILE A 31 62.564 -2.627 8.204 1.00 0.00 C ATOM 493 CG1 ILE A 31 62.100 -1.618 7.154 1.00 0.00 C ATOM 494 CG2 ILE A 31 63.727 -3.455 7.623 1.00 0.00 C ATOM 495 CD1 ILE A 31 63.180 -0.550 6.959 1.00 0.00 C ATOM 0 H ILE A 31 60.936 -2.024 10.015 1.00 0.00 H new ATOM 0 HA ILE A 31 60.770 -3.733 7.705 1.00 0.00 H new ATOM 0 HB ILE A 31 62.908 -2.109 9.099 1.00 0.00 H new ATOM 0 HG12 ILE A 31 61.901 -2.125 6.210 1.00 0.00 H new ATOM 0 HG13 ILE A 31 61.166 -1.153 7.469 1.00 0.00 H new ATOM 0 HG21 ILE A 31 64.550 -2.791 7.358 1.00 0.00 H new ATOM 0 HG22 ILE A 31 64.068 -4.176 8.367 1.00 0.00 H new ATOM 0 HG23 ILE A 31 63.387 -3.985 6.733 1.00 0.00 H new ATOM 0 HD11 ILE A 31 62.849 0.170 6.210 1.00 0.00 H new ATOM 0 HD12 ILE A 31 63.357 -0.035 7.903 1.00 0.00 H new ATOM 0 HD13 ILE A 31 64.103 -1.023 6.625 1.00 0.00 H new ATOM 507 N THR A 32 62.322 -5.758 8.265 1.00 0.00 N ATOM 508 CA THR A 32 62.880 -7.068 8.710 1.00 0.00 C ATOM 509 C THR A 32 63.075 -7.963 7.485 1.00 0.00 C ATOM 510 O THR A 32 62.825 -9.151 7.524 1.00 0.00 O ATOM 511 CB THR A 32 61.920 -7.745 9.691 1.00 0.00 C ATOM 512 OG1 THR A 32 60.623 -7.180 9.553 1.00 0.00 O ATOM 513 CG2 THR A 32 62.420 -7.548 11.123 1.00 0.00 C ATOM 0 H THR A 32 62.293 -5.625 7.254 1.00 0.00 H new ATOM 0 HA THR A 32 63.834 -6.905 9.210 1.00 0.00 H new ATOM 0 HB THR A 32 61.874 -8.812 9.473 1.00 0.00 H new ATOM 0 HG1 THR A 32 60.008 -7.615 10.180 1.00 0.00 H new ATOM 0 HG21 THR A 32 61.733 -8.032 11.818 1.00 0.00 H new ATOM 0 HG22 THR A 32 63.411 -7.989 11.226 1.00 0.00 H new ATOM 0 HG23 THR A 32 62.472 -6.483 11.347 1.00 0.00 H new ATOM 521 N SER A 33 63.517 -7.396 6.393 1.00 0.00 N ATOM 522 CA SER A 33 63.722 -8.207 5.161 1.00 0.00 C ATOM 523 C SER A 33 64.637 -9.390 5.476 1.00 0.00 C ATOM 524 O SER A 33 65.044 -9.590 6.603 1.00 0.00 O ATOM 525 CB SER A 33 64.362 -7.335 4.079 1.00 0.00 C ATOM 526 OG SER A 33 64.258 -7.991 2.821 1.00 0.00 O ATOM 0 H SER A 33 63.744 -6.406 6.303 1.00 0.00 H new ATOM 0 HA SER A 33 62.761 -8.579 4.805 1.00 0.00 H new ATOM 0 HB2 SER A 33 63.866 -6.365 4.038 1.00 0.00 H new ATOM 0 HB3 SER A 33 65.409 -7.148 4.319 1.00 0.00 H new ATOM 0 HG SER A 33 63.888 -7.371 2.158 1.00 0.00 H new ATOM 532 N SER A 34 64.960 -10.179 4.490 1.00 0.00 N ATOM 533 CA SER A 34 65.842 -11.353 4.736 1.00 0.00 C ATOM 534 C SER A 34 67.310 -10.957 4.531 1.00 0.00 C ATOM 535 O SER A 34 68.209 -11.723 4.816 1.00 0.00 O ATOM 536 CB SER A 34 65.477 -12.475 3.765 1.00 0.00 C ATOM 537 OG SER A 34 64.148 -12.910 4.024 1.00 0.00 O ATOM 0 H SER A 34 64.651 -10.062 3.525 1.00 0.00 H new ATOM 0 HA SER A 34 65.704 -11.696 5.761 1.00 0.00 H new ATOM 0 HB2 SER A 34 65.562 -12.123 2.737 1.00 0.00 H new ATOM 0 HB3 SER A 34 66.172 -13.307 3.876 1.00 0.00 H new ATOM 0 HG SER A 34 63.912 -13.629 3.401 1.00 0.00 H new ATOM 543 N LYS A 35 67.566 -9.771 4.041 1.00 0.00 N ATOM 544 CA LYS A 35 68.978 -9.352 3.826 1.00 0.00 C ATOM 545 C LYS A 35 69.300 -8.112 4.675 1.00 0.00 C ATOM 546 O LYS A 35 70.435 -7.689 4.755 1.00 0.00 O ATOM 547 CB LYS A 35 69.202 -9.020 2.349 1.00 0.00 C ATOM 548 CG LYS A 35 68.859 -10.225 1.472 1.00 0.00 C ATOM 549 CD LYS A 35 69.652 -11.446 1.937 1.00 0.00 C ATOM 550 CE LYS A 35 71.150 -11.141 1.868 1.00 0.00 C ATOM 551 NZ LYS A 35 71.711 -11.093 3.248 1.00 0.00 N ATOM 0 H LYS A 35 66.861 -9.080 3.783 1.00 0.00 H new ATOM 0 HA LYS A 35 69.633 -10.172 4.122 1.00 0.00 H new ATOM 0 HB2 LYS A 35 68.585 -8.168 2.064 1.00 0.00 H new ATOM 0 HB3 LYS A 35 70.240 -8.730 2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 35 67.790 -10.432 1.525 1.00 0.00 H new ATOM 0 HG3 LYS A 35 69.090 -10.005 0.430 1.00 0.00 H new ATOM 0 HD2 LYS A 35 69.371 -11.708 2.957 1.00 0.00 H new ATOM 0 HD3 LYS A 35 69.416 -12.306 1.310 1.00 0.00 H new ATOM 0 HE2 LYS A 35 71.661 -11.905 1.283 1.00 0.00 H new ATOM 0 HE3 LYS A 35 71.315 -10.189 1.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 72.702 -11.408 3.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 71.664 -10.119 3.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 71.159 -11.719 3.869 1.00 0.00 H new ATOM 565 N CYS A 36 68.316 -7.521 5.309 1.00 0.00 N ATOM 566 CA CYS A 36 68.596 -6.309 6.139 1.00 0.00 C ATOM 567 C CYS A 36 69.539 -6.683 7.291 1.00 0.00 C ATOM 568 O CYS A 36 69.239 -7.572 8.063 1.00 0.00 O ATOM 569 CB CYS A 36 67.289 -5.757 6.720 1.00 0.00 C ATOM 570 SG CYS A 36 66.296 -4.986 5.410 1.00 0.00 S ATOM 0 H CYS A 36 67.342 -7.822 5.288 1.00 0.00 H new ATOM 0 HA CYS A 36 69.061 -5.550 5.511 1.00 0.00 H new ATOM 0 HB2 CYS A 36 66.723 -6.562 7.189 1.00 0.00 H new ATOM 0 HB3 CYS A 36 67.509 -5.026 7.498 1.00 0.00 H new ATOM 575 N PRO A 37 70.655 -5.979 7.385 1.00 0.00 N ATOM 576 CA PRO A 37 71.625 -6.225 8.442 1.00 0.00 C ATOM 577 C PRO A 37 70.990 -5.979 9.808 1.00 0.00 C ATOM 578 O PRO A 37 71.450 -6.473 10.818 1.00 0.00 O ATOM 579 CB PRO A 37 72.751 -5.210 8.195 1.00 0.00 C ATOM 580 CG PRO A 37 72.363 -4.375 6.938 1.00 0.00 C ATOM 581 CD PRO A 37 71.013 -4.906 6.443 1.00 0.00 C ATOM 0 HA PRO A 37 71.987 -7.253 8.434 1.00 0.00 H new ATOM 0 HB2 PRO A 37 72.879 -4.561 9.061 1.00 0.00 H new ATOM 0 HB3 PRO A 37 73.700 -5.722 8.037 1.00 0.00 H new ATOM 0 HG2 PRO A 37 72.293 -3.316 7.186 1.00 0.00 H new ATOM 0 HG3 PRO A 37 73.123 -4.471 6.162 1.00 0.00 H new ATOM 0 HD2 PRO A 37 70.258 -4.119 6.436 1.00 0.00 H new ATOM 0 HD3 PRO A 37 71.088 -5.285 5.424 1.00 0.00 H new ATOM 589 N LYS A 38 69.949 -5.202 9.849 1.00 0.00 N ATOM 590 CA LYS A 38 69.299 -4.903 11.144 1.00 0.00 C ATOM 591 C LYS A 38 67.810 -4.611 10.936 1.00 0.00 C ATOM 592 O LYS A 38 67.433 -3.847 10.069 1.00 0.00 O ATOM 593 CB LYS A 38 69.965 -3.675 11.764 1.00 0.00 C ATOM 594 CG LYS A 38 71.236 -4.096 12.502 1.00 0.00 C ATOM 595 CD LYS A 38 71.279 -3.417 13.872 1.00 0.00 C ATOM 596 CE LYS A 38 72.444 -3.980 14.686 1.00 0.00 C ATOM 597 NZ LYS A 38 73.732 -3.523 14.092 1.00 0.00 N ATOM 0 H LYS A 38 69.520 -4.760 9.036 1.00 0.00 H new ATOM 0 HA LYS A 38 69.405 -5.765 11.803 1.00 0.00 H new ATOM 0 HB2 LYS A 38 70.207 -2.950 10.987 1.00 0.00 H new ATOM 0 HB3 LYS A 38 69.277 -3.186 12.454 1.00 0.00 H new ATOM 0 HG2 LYS A 38 71.259 -5.179 12.620 1.00 0.00 H new ATOM 0 HG3 LYS A 38 72.115 -3.820 11.920 1.00 0.00 H new ATOM 0 HD2 LYS A 38 71.393 -2.340 13.752 1.00 0.00 H new ATOM 0 HD3 LYS A 38 70.340 -3.581 14.400 1.00 0.00 H new ATOM 0 HE2 LYS A 38 72.371 -3.649 15.722 1.00 0.00 H new ATOM 0 HE3 LYS A 38 72.402 -5.069 14.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 74.516 -3.776 14.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 73.871 -3.983 13.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 73.709 -2.491 13.964 1.00 0.00 H new ATOM 611 N GLU A 39 66.962 -5.177 11.756 1.00 0.00 N ATOM 612 CA GLU A 39 65.505 -4.885 11.634 1.00 0.00 C ATOM 613 C GLU A 39 65.286 -3.406 11.957 1.00 0.00 C ATOM 614 O GLU A 39 66.229 -2.667 12.156 1.00 0.00 O ATOM 615 CB GLU A 39 64.721 -5.752 12.622 1.00 0.00 C ATOM 616 CG GLU A 39 65.173 -5.438 14.049 1.00 0.00 C ATOM 617 CD GLU A 39 65.844 -6.672 14.656 1.00 0.00 C ATOM 618 OE1 GLU A 39 66.451 -7.419 13.908 1.00 0.00 O ATOM 619 OE2 GLU A 39 65.741 -6.845 15.859 1.00 0.00 O ATOM 0 H GLU A 39 67.215 -5.826 12.501 1.00 0.00 H new ATOM 0 HA GLU A 39 65.159 -5.105 10.624 1.00 0.00 H new ATOM 0 HB2 GLU A 39 63.652 -5.564 12.518 1.00 0.00 H new ATOM 0 HB3 GLU A 39 64.882 -6.808 12.403 1.00 0.00 H new ATOM 0 HG2 GLU A 39 65.868 -4.598 14.045 1.00 0.00 H new ATOM 0 HG3 GLU A 39 64.317 -5.141 14.656 1.00 0.00 H new ATOM 626 N ALA A 40 64.061 -2.958 12.010 1.00 0.00 N ATOM 627 CA ALA A 40 63.822 -1.516 12.319 1.00 0.00 C ATOM 628 C ALA A 40 62.327 -1.217 12.316 1.00 0.00 C ATOM 629 O ALA A 40 61.503 -2.084 12.113 1.00 0.00 O ATOM 630 CB ALA A 40 64.494 -0.655 11.246 1.00 0.00 C ATOM 0 H ALA A 40 63.223 -3.519 11.855 1.00 0.00 H new ATOM 0 HA ALA A 40 64.235 -1.292 13.303 1.00 0.00 H new ATOM 0 HB1 ALA A 40 64.323 0.399 11.466 1.00 0.00 H new ATOM 0 HB2 ALA A 40 65.565 -0.855 11.237 1.00 0.00 H new ATOM 0 HB3 ALA A 40 64.072 -0.895 10.270 1.00 0.00 H new ATOM 636 N VAL A 41 61.981 0.025 12.499 1.00 0.00 N ATOM 637 CA VAL A 41 60.553 0.428 12.456 1.00 0.00 C ATOM 638 C VAL A 41 60.443 1.672 11.614 1.00 0.00 C ATOM 639 O VAL A 41 60.906 2.726 11.992 1.00 0.00 O ATOM 640 CB VAL A 41 60.028 0.720 13.877 1.00 0.00 C ATOM 641 CG1 VAL A 41 59.034 1.899 13.851 1.00 0.00 C ATOM 642 CG2 VAL A 41 59.310 -0.506 14.402 1.00 0.00 C ATOM 0 H VAL A 41 62.636 0.786 12.679 1.00 0.00 H new ATOM 0 HA VAL A 41 59.957 -0.380 12.031 1.00 0.00 H new ATOM 0 HB VAL A 41 60.872 0.974 14.518 1.00 0.00 H new ATOM 0 HG11 VAL A 41 58.673 2.093 14.861 1.00 0.00 H new ATOM 0 HG12 VAL A 41 59.534 2.788 13.468 1.00 0.00 H new ATOM 0 HG13 VAL A 41 58.191 1.650 13.206 1.00 0.00 H new ATOM 0 HG21 VAL A 41 58.936 -0.307 15.406 1.00 0.00 H new ATOM 0 HG22 VAL A 41 58.474 -0.747 13.745 1.00 0.00 H new ATOM 0 HG23 VAL A 41 60.002 -1.348 14.433 1.00 0.00 H new ATOM 652 N ILE A 42 59.817 1.579 10.504 1.00 0.00 N ATOM 653 CA ILE A 42 59.676 2.766 9.671 1.00 0.00 C ATOM 654 C ILE A 42 58.528 3.615 10.192 1.00 0.00 C ATOM 655 O ILE A 42 57.415 3.542 9.717 1.00 0.00 O ATOM 656 CB ILE A 42 59.435 2.352 8.243 1.00 0.00 C ATOM 657 CG1 ILE A 42 60.662 1.543 7.772 1.00 0.00 C ATOM 658 CG2 ILE A 42 59.248 3.607 7.402 1.00 0.00 C ATOM 659 CD1 ILE A 42 60.745 1.517 6.249 1.00 0.00 C ATOM 0 H ILE A 42 59.394 0.727 10.135 1.00 0.00 H new ATOM 0 HA ILE A 42 60.590 3.359 9.708 1.00 0.00 H new ATOM 0 HB ILE A 42 58.542 1.735 8.146 1.00 0.00 H new ATOM 0 HG12 ILE A 42 61.571 1.982 8.182 1.00 0.00 H new ATOM 0 HG13 ILE A 42 60.599 0.524 8.154 1.00 0.00 H new ATOM 0 HG21 ILE A 42 59.072 3.326 6.364 1.00 0.00 H new ATOM 0 HG22 ILE A 42 58.393 4.171 7.775 1.00 0.00 H new ATOM 0 HG23 ILE A 42 60.145 4.224 7.464 1.00 0.00 H new ATOM 0 HD11 ILE A 42 61.618 0.941 5.942 1.00 0.00 H new ATOM 0 HD12 ILE A 42 59.845 1.056 5.843 1.00 0.00 H new ATOM 0 HD13 ILE A 42 60.832 2.536 5.872 1.00 0.00 H new ATOM 671 N PHE A 43 58.806 4.421 11.172 1.00 0.00 N ATOM 672 CA PHE A 43 57.762 5.295 11.759 1.00 0.00 C ATOM 673 C PHE A 43 57.400 6.400 10.759 1.00 0.00 C ATOM 674 O PHE A 43 57.908 7.501 10.836 1.00 0.00 O ATOM 675 CB PHE A 43 58.310 5.947 13.033 1.00 0.00 C ATOM 676 CG PHE A 43 58.142 5.020 14.220 1.00 0.00 C ATOM 677 CD1 PHE A 43 56.932 4.311 14.413 1.00 0.00 C ATOM 678 CD2 PHE A 43 59.195 4.879 15.152 1.00 0.00 C ATOM 679 CE1 PHE A 43 56.783 3.463 15.537 1.00 0.00 C ATOM 680 CE2 PHE A 43 59.041 4.034 16.274 1.00 0.00 C ATOM 681 CZ PHE A 43 57.836 3.327 16.464 1.00 0.00 C ATOM 0 H PHE A 43 59.728 4.512 11.598 1.00 0.00 H new ATOM 0 HA PHE A 43 56.879 4.700 11.991 1.00 0.00 H new ATOM 0 HB2 PHE A 43 59.364 6.189 12.900 1.00 0.00 H new ATOM 0 HB3 PHE A 43 57.789 6.886 13.221 1.00 0.00 H new ATOM 0 HD1 PHE A 43 56.124 4.417 13.704 1.00 0.00 H new ATOM 0 HD2 PHE A 43 60.119 5.418 15.006 1.00 0.00 H new ATOM 0 HE1 PHE A 43 55.861 2.920 15.684 1.00 0.00 H new ATOM 0 HE2 PHE A 43 59.846 3.930 16.986 1.00 0.00 H new ATOM 0 HZ PHE A 43 57.720 2.680 17.321 1.00 0.00 H new ATOM 691 N LYS A 44 56.525 6.130 9.828 1.00 0.00 N ATOM 692 CA LYS A 44 56.146 7.189 8.849 1.00 0.00 C ATOM 693 C LYS A 44 55.574 8.371 9.614 1.00 0.00 C ATOM 694 O LYS A 44 54.430 8.360 10.010 1.00 0.00 O ATOM 695 CB LYS A 44 55.083 6.653 7.886 1.00 0.00 C ATOM 696 CG LYS A 44 55.629 6.672 6.457 1.00 0.00 C ATOM 697 CD LYS A 44 54.554 7.198 5.506 1.00 0.00 C ATOM 698 CE LYS A 44 54.849 6.713 4.085 1.00 0.00 C ATOM 699 NZ LYS A 44 53.767 5.791 3.639 1.00 0.00 N ATOM 0 H LYS A 44 56.060 5.231 9.703 1.00 0.00 H new ATOM 0 HA LYS A 44 57.024 7.493 8.278 1.00 0.00 H new ATOM 0 HB2 LYS A 44 54.803 5.637 8.166 1.00 0.00 H new ATOM 0 HB3 LYS A 44 54.181 7.261 7.949 1.00 0.00 H new ATOM 0 HG2 LYS A 44 56.516 7.303 6.404 1.00 0.00 H new ATOM 0 HG3 LYS A 44 55.933 5.668 6.159 1.00 0.00 H new ATOM 0 HD2 LYS A 44 53.571 6.851 5.824 1.00 0.00 H new ATOM 0 HD3 LYS A 44 54.531 8.287 5.533 1.00 0.00 H new ATOM 0 HE2 LYS A 44 54.919 7.563 3.407 1.00 0.00 H new ATOM 0 HE3 LYS A 44 55.811 6.202 4.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 53.968 5.462 2.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 53.721 4.974 4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 52.856 6.293 3.651 1.00 0.00 H new ATOM 713 N THR A 45 56.365 9.379 9.853 1.00 0.00 N ATOM 714 CA THR A 45 55.867 10.549 10.627 1.00 0.00 C ATOM 715 C THR A 45 54.665 11.187 9.896 1.00 0.00 C ATOM 716 O THR A 45 53.991 10.541 9.124 1.00 0.00 O ATOM 717 CB THR A 45 57.000 11.562 10.791 1.00 0.00 C ATOM 718 OG1 THR A 45 57.713 11.681 9.571 1.00 0.00 O ATOM 719 CG2 THR A 45 57.942 11.075 11.891 1.00 0.00 C ATOM 0 H THR A 45 57.335 9.443 9.546 1.00 0.00 H new ATOM 0 HA THR A 45 55.535 10.226 11.614 1.00 0.00 H new ATOM 0 HB THR A 45 56.590 12.535 11.060 1.00 0.00 H new ATOM 0 HG1 THR A 45 58.440 11.024 9.552 1.00 0.00 H new ATOM 0 HG21 THR A 45 58.755 11.790 12.017 1.00 0.00 H new ATOM 0 HG22 THR A 45 57.391 10.983 12.827 1.00 0.00 H new ATOM 0 HG23 THR A 45 58.353 10.104 11.615 1.00 0.00 H new ATOM 727 N ILE A 46 54.392 12.447 10.135 1.00 0.00 N ATOM 728 CA ILE A 46 53.230 13.097 9.459 1.00 0.00 C ATOM 729 C ILE A 46 53.688 13.722 8.181 1.00 0.00 C ATOM 730 O ILE A 46 52.940 13.844 7.229 1.00 0.00 O ATOM 731 CB ILE A 46 52.644 14.199 10.347 1.00 0.00 C ATOM 732 CG1 ILE A 46 53.783 15.118 10.869 1.00 0.00 C ATOM 733 CG2 ILE A 46 51.868 13.572 11.521 1.00 0.00 C ATOM 734 CD1 ILE A 46 54.299 14.637 12.233 1.00 0.00 C ATOM 0 H ILE A 46 54.921 13.049 10.766 1.00 0.00 H new ATOM 0 HA ILE A 46 52.471 12.338 9.267 1.00 0.00 H new ATOM 0 HB ILE A 46 51.952 14.804 9.761 1.00 0.00 H new ATOM 0 HG12 ILE A 46 54.603 15.131 10.150 1.00 0.00 H new ATOM 0 HG13 ILE A 46 53.418 16.142 10.955 1.00 0.00 H new ATOM 0 HG21 ILE A 46 51.455 14.362 12.147 1.00 0.00 H new ATOM 0 HG22 ILE A 46 51.057 12.955 11.133 1.00 0.00 H new ATOM 0 HG23 ILE A 46 52.542 12.954 12.114 1.00 0.00 H new ATOM 0 HD11 ILE A 46 55.095 15.298 12.575 1.00 0.00 H new ATOM 0 HD12 ILE A 46 53.483 14.649 12.955 1.00 0.00 H new ATOM 0 HD13 ILE A 46 54.685 13.622 12.139 1.00 0.00 H new ATOM 746 N VAL A 47 54.907 14.114 8.135 1.00 0.00 N ATOM 747 CA VAL A 47 55.424 14.724 6.919 1.00 0.00 C ATOM 748 C VAL A 47 55.980 13.624 6.017 1.00 0.00 C ATOM 749 O VAL A 47 56.722 13.880 5.089 1.00 0.00 O ATOM 750 CB VAL A 47 56.504 15.723 7.302 1.00 0.00 C ATOM 751 CG1 VAL A 47 57.783 14.995 7.721 1.00 0.00 C ATOM 752 CG2 VAL A 47 56.783 16.620 6.120 1.00 0.00 C ATOM 0 H VAL A 47 55.575 14.035 8.902 1.00 0.00 H new ATOM 0 HA VAL A 47 54.639 15.250 6.376 1.00 0.00 H new ATOM 0 HB VAL A 47 56.160 16.321 8.146 1.00 0.00 H new ATOM 0 HG11 VAL A 47 58.545 15.725 7.992 1.00 0.00 H new ATOM 0 HG12 VAL A 47 57.573 14.355 8.578 1.00 0.00 H new ATOM 0 HG13 VAL A 47 58.143 14.385 6.892 1.00 0.00 H new ATOM 0 HG21 VAL A 47 57.557 17.341 6.385 1.00 0.00 H new ATOM 0 HG22 VAL A 47 57.122 16.017 5.278 1.00 0.00 H new ATOM 0 HG23 VAL A 47 55.872 17.151 5.843 1.00 0.00 H new ATOM 762 N ALA A 48 55.609 12.391 6.279 1.00 0.00 N ATOM 763 CA ALA A 48 56.088 11.273 5.446 1.00 0.00 C ATOM 764 C ALA A 48 57.580 11.054 5.684 1.00 0.00 C ATOM 765 O ALA A 48 58.249 10.394 4.915 1.00 0.00 O ATOM 766 CB ALA A 48 55.837 11.602 3.985 1.00 0.00 C ATOM 0 H ALA A 48 54.989 12.123 7.044 1.00 0.00 H new ATOM 0 HA ALA A 48 55.554 10.361 5.711 1.00 0.00 H new ATOM 0 HB1 ALA A 48 56.188 10.780 3.361 1.00 0.00 H new ATOM 0 HB2 ALA A 48 54.769 11.749 3.823 1.00 0.00 H new ATOM 0 HB3 ALA A 48 56.373 12.513 3.720 1.00 0.00 H new ATOM 772 N LYS A 49 58.105 11.579 6.760 1.00 0.00 N ATOM 773 CA LYS A 49 59.545 11.371 7.059 1.00 0.00 C ATOM 774 C LYS A 49 59.729 9.973 7.639 1.00 0.00 C ATOM 775 O LYS A 49 59.778 9.787 8.839 1.00 0.00 O ATOM 776 CB LYS A 49 60.019 12.414 8.066 1.00 0.00 C ATOM 777 CG LYS A 49 61.162 13.231 7.459 1.00 0.00 C ATOM 778 CD LYS A 49 61.306 14.550 8.217 1.00 0.00 C ATOM 779 CE LYS A 49 61.829 14.274 9.627 1.00 0.00 C ATOM 780 NZ LYS A 49 61.940 15.557 10.377 1.00 0.00 N ATOM 0 H LYS A 49 57.596 12.142 7.442 1.00 0.00 H new ATOM 0 HA LYS A 49 60.131 11.472 6.145 1.00 0.00 H new ATOM 0 HB2 LYS A 49 59.194 13.072 8.340 1.00 0.00 H new ATOM 0 HB3 LYS A 49 60.354 11.925 8.981 1.00 0.00 H new ATOM 0 HG2 LYS A 49 62.093 12.667 7.510 1.00 0.00 H new ATOM 0 HG3 LYS A 49 60.964 13.425 6.405 1.00 0.00 H new ATOM 0 HD2 LYS A 49 61.990 15.213 7.687 1.00 0.00 H new ATOM 0 HD3 LYS A 49 60.344 15.059 8.268 1.00 0.00 H new ATOM 0 HE2 LYS A 49 61.157 13.593 10.149 1.00 0.00 H new ATOM 0 HE3 LYS A 49 62.802 13.785 9.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 62.296 15.369 11.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 62.598 16.193 9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 61.004 16.006 10.437 1.00 0.00 H new ATOM 794 N GLU A 50 59.815 8.986 6.795 1.00 0.00 N ATOM 795 CA GLU A 50 59.979 7.593 7.286 1.00 0.00 C ATOM 796 C GLU A 50 61.178 7.524 8.232 1.00 0.00 C ATOM 797 O GLU A 50 62.308 7.716 7.826 1.00 0.00 O ATOM 798 CB GLU A 50 60.212 6.670 6.089 1.00 0.00 C ATOM 799 CG GLU A 50 59.090 6.864 5.066 1.00 0.00 C ATOM 800 CD GLU A 50 59.692 6.963 3.663 1.00 0.00 C ATOM 801 OE1 GLU A 50 60.697 6.314 3.423 1.00 0.00 O ATOM 802 OE2 GLU A 50 59.136 7.685 2.851 1.00 0.00 O ATOM 0 H GLU A 50 59.778 9.085 5.780 1.00 0.00 H new ATOM 0 HA GLU A 50 59.083 7.280 7.822 1.00 0.00 H new ATOM 0 HB2 GLU A 50 61.177 6.888 5.631 1.00 0.00 H new ATOM 0 HB3 GLU A 50 60.242 5.631 6.418 1.00 0.00 H new ATOM 0 HG2 GLU A 50 58.390 6.030 5.115 1.00 0.00 H new ATOM 0 HG3 GLU A 50 58.526 7.768 5.296 1.00 0.00 H new ATOM 809 N ILE A 51 60.949 7.272 9.496 1.00 0.00 N ATOM 810 CA ILE A 51 62.099 7.221 10.453 1.00 0.00 C ATOM 811 C ILE A 51 62.286 5.819 10.998 1.00 0.00 C ATOM 812 O ILE A 51 61.575 5.390 11.881 1.00 0.00 O ATOM 813 CB ILE A 51 61.879 8.144 11.648 1.00 0.00 C ATOM 814 CG1 ILE A 51 60.760 9.135 11.384 1.00 0.00 C ATOM 815 CG2 ILE A 51 63.163 8.911 11.929 1.00 0.00 C ATOM 816 CD1 ILE A 51 60.491 9.889 12.673 1.00 0.00 C ATOM 0 H ILE A 51 60.030 7.101 9.904 1.00 0.00 H new ATOM 0 HA ILE A 51 62.978 7.540 9.892 1.00 0.00 H new ATOM 0 HB ILE A 51 61.601 7.531 12.505 1.00 0.00 H new ATOM 0 HG12 ILE A 51 61.042 9.826 10.590 1.00 0.00 H new ATOM 0 HG13 ILE A 51 59.861 8.616 11.051 1.00 0.00 H new ATOM 0 HG21 ILE A 51 63.012 9.573 12.782 1.00 0.00 H new ATOM 0 HG22 ILE A 51 63.965 8.208 12.152 1.00 0.00 H new ATOM 0 HG23 ILE A 51 63.432 9.503 11.054 1.00 0.00 H new ATOM 0 HD11 ILE A 51 59.689 10.610 12.512 1.00 0.00 H new ATOM 0 HD12 ILE A 51 60.196 9.185 13.451 1.00 0.00 H new ATOM 0 HD13 ILE A 51 61.395 10.414 12.983 1.00 0.00 H new ATOM 828 N CYS A 52 63.291 5.140 10.560 1.00 0.00 N ATOM 829 CA CYS A 52 63.577 3.812 11.134 1.00 0.00 C ATOM 830 C CYS A 52 63.882 4.004 12.615 1.00 0.00 C ATOM 831 O CYS A 52 64.631 4.876 12.988 1.00 0.00 O ATOM 832 CB CYS A 52 64.779 3.208 10.433 1.00 0.00 C ATOM 833 SG CYS A 52 64.236 2.482 8.870 1.00 0.00 S ATOM 0 H CYS A 52 63.930 5.447 9.827 1.00 0.00 H new ATOM 0 HA CYS A 52 62.726 3.143 11.006 1.00 0.00 H new ATOM 0 HB2 CYS A 52 65.534 3.973 10.252 1.00 0.00 H new ATOM 0 HB3 CYS A 52 65.240 2.447 11.063 1.00 0.00 H new ATOM 838 N ALA A 53 63.284 3.231 13.463 1.00 0.00 N ATOM 839 CA ALA A 53 63.524 3.411 14.918 1.00 0.00 C ATOM 840 C ALA A 53 63.849 2.056 15.552 1.00 0.00 C ATOM 841 O ALA A 53 63.324 1.035 15.159 1.00 0.00 O ATOM 842 CB ALA A 53 62.271 4.007 15.569 1.00 0.00 C ATOM 0 H ALA A 53 62.638 2.481 13.216 1.00 0.00 H new ATOM 0 HA ALA A 53 64.364 4.088 15.072 1.00 0.00 H new ATOM 0 HB1 ALA A 53 62.444 4.140 16.637 1.00 0.00 H new ATOM 0 HB2 ALA A 53 62.049 4.972 15.114 1.00 0.00 H new ATOM 0 HB3 ALA A 53 61.428 3.333 15.420 1.00 0.00 H new ATOM 848 N ASP A 54 64.725 2.039 16.518 1.00 0.00 N ATOM 849 CA ASP A 54 65.103 0.750 17.165 1.00 0.00 C ATOM 850 C ASP A 54 63.876 0.147 17.884 1.00 0.00 C ATOM 851 O ASP A 54 63.400 0.711 18.847 1.00 0.00 O ATOM 852 CB ASP A 54 66.211 1.006 18.187 1.00 0.00 C ATOM 853 CG ASP A 54 66.601 -0.311 18.859 1.00 0.00 C ATOM 854 OD1 ASP A 54 66.563 -1.330 18.189 1.00 0.00 O ATOM 855 OD2 ASP A 54 66.930 -0.280 20.034 1.00 0.00 O ATOM 0 H ASP A 54 65.197 2.864 16.889 1.00 0.00 H new ATOM 0 HA ASP A 54 65.454 0.053 16.404 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.079 1.446 17.696 1.00 0.00 H new ATOM 0 HB3 ASP A 54 65.871 1.722 18.936 1.00 0.00 H new ATOM 860 N PRO A 55 63.400 -0.993 17.398 1.00 0.00 N ATOM 861 CA PRO A 55 62.248 -1.661 18.007 1.00 0.00 C ATOM 862 C PRO A 55 62.596 -2.122 19.426 1.00 0.00 C ATOM 863 O PRO A 55 61.727 -2.385 20.235 1.00 0.00 O ATOM 864 CB PRO A 55 61.966 -2.877 17.106 1.00 0.00 C ATOM 865 CG PRO A 55 63.061 -2.895 15.993 1.00 0.00 C ATOM 866 CD PRO A 55 63.969 -1.674 16.224 1.00 0.00 C ATOM 0 HA PRO A 55 61.384 -1.001 18.085 1.00 0.00 H new ATOM 0 HB2 PRO A 55 61.993 -3.799 17.686 1.00 0.00 H new ATOM 0 HB3 PRO A 55 60.972 -2.806 16.665 1.00 0.00 H new ATOM 0 HG2 PRO A 55 63.639 -3.818 16.038 1.00 0.00 H new ATOM 0 HG3 PRO A 55 62.604 -2.853 15.004 1.00 0.00 H new ATOM 0 HD2 PRO A 55 65.000 -1.978 16.405 1.00 0.00 H new ATOM 0 HD3 PRO A 55 63.978 -1.018 15.353 1.00 0.00 H new ATOM 874 N LYS A 56 63.862 -2.231 19.732 1.00 0.00 N ATOM 875 CA LYS A 56 64.266 -2.684 21.085 1.00 0.00 C ATOM 876 C LYS A 56 64.382 -1.480 22.029 1.00 0.00 C ATOM 877 O LYS A 56 64.954 -1.574 23.098 1.00 0.00 O ATOM 878 CB LYS A 56 65.619 -3.394 21.001 1.00 0.00 C ATOM 879 CG LYS A 56 65.399 -4.908 20.945 1.00 0.00 C ATOM 880 CD LYS A 56 65.379 -5.368 19.485 1.00 0.00 C ATOM 881 CE LYS A 56 66.639 -6.186 19.192 1.00 0.00 C ATOM 882 NZ LYS A 56 66.280 -7.629 19.083 1.00 0.00 N ATOM 0 H LYS A 56 64.633 -2.024 19.097 1.00 0.00 H new ATOM 0 HA LYS A 56 63.512 -3.371 21.471 1.00 0.00 H new ATOM 0 HB2 LYS A 56 66.162 -3.062 20.116 1.00 0.00 H new ATOM 0 HB3 LYS A 56 66.231 -3.137 21.865 1.00 0.00 H new ATOM 0 HG2 LYS A 56 66.192 -5.422 21.488 1.00 0.00 H new ATOM 0 HG3 LYS A 56 64.459 -5.168 21.432 1.00 0.00 H new ATOM 0 HD2 LYS A 56 64.490 -5.968 19.294 1.00 0.00 H new ATOM 0 HD3 LYS A 56 65.330 -4.505 18.821 1.00 0.00 H new ATOM 0 HE2 LYS A 56 67.100 -5.844 18.266 1.00 0.00 H new ATOM 0 HE3 LYS A 56 67.372 -6.041 19.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 67.136 -8.186 18.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 65.858 -7.950 19.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 65.595 -7.759 18.311 1.00 0.00 H new ATOM 896 N GLN A 57 63.842 -0.351 21.652 1.00 0.00 N ATOM 897 CA GLN A 57 63.924 0.843 22.539 1.00 0.00 C ATOM 898 C GLN A 57 62.717 0.860 23.476 1.00 0.00 C ATOM 899 O GLN A 57 61.762 0.133 23.285 1.00 0.00 O ATOM 900 CB GLN A 57 63.927 2.116 21.689 1.00 0.00 C ATOM 901 CG GLN A 57 65.254 2.855 21.880 1.00 0.00 C ATOM 902 CD GLN A 57 65.436 3.204 23.359 1.00 0.00 C ATOM 903 OE1 GLN A 57 64.707 4.013 23.898 1.00 0.00 O ATOM 904 NE2 GLN A 57 66.383 2.622 24.043 1.00 0.00 N ATOM 0 H GLN A 57 63.349 -0.206 20.771 1.00 0.00 H new ATOM 0 HA GLN A 57 64.842 0.798 23.125 1.00 0.00 H new ATOM 0 HB2 GLN A 57 63.787 1.864 20.638 1.00 0.00 H new ATOM 0 HB3 GLN A 57 63.096 2.760 21.976 1.00 0.00 H new ATOM 0 HG2 GLN A 57 66.081 2.233 21.538 1.00 0.00 H new ATOM 0 HG3 GLN A 57 65.267 3.763 21.277 1.00 0.00 H new ATOM 0 HE21 GLN A 57 66.995 1.943 23.591 1.00 0.00 H new ATOM 0 HE22 GLN A 57 66.511 2.846 25.030 1.00 0.00 H new ATOM 913 N LYS A 58 62.753 1.675 24.492 1.00 0.00 N ATOM 914 CA LYS A 58 61.608 1.726 25.442 1.00 0.00 C ATOM 915 C LYS A 58 60.624 2.820 25.011 1.00 0.00 C ATOM 916 O LYS A 58 59.510 2.883 25.491 1.00 0.00 O ATOM 917 CB LYS A 58 62.130 2.022 26.858 1.00 0.00 C ATOM 918 CG LYS A 58 60.958 2.367 27.803 1.00 0.00 C ATOM 919 CD LYS A 58 59.860 1.299 27.695 1.00 0.00 C ATOM 920 CE LYS A 58 59.538 0.754 29.087 1.00 0.00 C ATOM 921 NZ LYS A 58 59.251 -0.705 28.995 1.00 0.00 N ATOM 0 H LYS A 58 63.524 2.307 24.706 1.00 0.00 H new ATOM 0 HA LYS A 58 61.093 0.765 25.440 1.00 0.00 H new ATOM 0 HB2 LYS A 58 62.672 1.157 27.241 1.00 0.00 H new ATOM 0 HB3 LYS A 58 62.836 2.852 26.826 1.00 0.00 H new ATOM 0 HG2 LYS A 58 61.316 2.429 28.831 1.00 0.00 H new ATOM 0 HG3 LYS A 58 60.551 3.345 27.548 1.00 0.00 H new ATOM 0 HD2 LYS A 58 58.965 1.727 27.245 1.00 0.00 H new ATOM 0 HD3 LYS A 58 60.188 0.489 27.043 1.00 0.00 H new ATOM 0 HE2 LYS A 58 60.377 0.929 29.761 1.00 0.00 H new ATOM 0 HE3 LYS A 58 58.679 1.279 29.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 59.032 -1.076 29.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 58.438 -0.860 28.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 60.083 -1.199 28.613 1.00 0.00 H new ATOM 935 N TRP A 59 61.012 3.671 24.102 1.00 0.00 N ATOM 936 CA TRP A 59 60.078 4.731 23.651 1.00 0.00 C ATOM 937 C TRP A 59 59.371 4.243 22.391 1.00 0.00 C ATOM 938 O TRP A 59 58.233 4.579 22.133 1.00 0.00 O ATOM 939 CB TRP A 59 60.855 6.040 23.388 1.00 0.00 C ATOM 940 CG TRP A 59 61.526 6.006 22.047 1.00 0.00 C ATOM 941 CD1 TRP A 59 62.804 5.615 21.821 1.00 0.00 C ATOM 942 CD2 TRP A 59 60.981 6.392 20.757 1.00 0.00 C ATOM 943 NE1 TRP A 59 63.080 5.741 20.468 1.00 0.00 N ATOM 944 CE2 TRP A 59 61.987 6.216 19.768 1.00 0.00 C ATOM 945 CE3 TRP A 59 59.712 6.877 20.344 1.00 0.00 C ATOM 946 CZ2 TRP A 59 61.749 6.514 18.414 1.00 0.00 C ATOM 947 CZ3 TRP A 59 59.472 7.178 18.981 1.00 0.00 C ATOM 948 CH2 TRP A 59 60.495 6.995 18.022 1.00 0.00 C ATOM 0 H TRP A 59 61.930 3.676 23.657 1.00 0.00 H new ATOM 0 HA TRP A 59 59.334 4.939 24.420 1.00 0.00 H new ATOM 0 HB2 TRP A 59 60.172 6.888 23.436 1.00 0.00 H new ATOM 0 HB3 TRP A 59 61.601 6.187 24.169 1.00 0.00 H new ATOM 0 HD1 TRP A 59 63.495 5.263 22.573 1.00 0.00 H new ATOM 0 HE1 TRP A 59 63.978 5.512 20.042 1.00 0.00 H new ATOM 0 HE3 TRP A 59 58.927 7.017 21.072 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 62.530 6.372 17.681 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 58.505 7.548 18.673 1.00 0.00 H new ATOM 0 HH2 TRP A 59 60.308 7.227 16.984 1.00 0.00 H new ATOM 959 N VAL A 60 60.021 3.407 21.633 1.00 0.00 N ATOM 960 CA VAL A 60 59.377 2.846 20.426 1.00 0.00 C ATOM 961 C VAL A 60 58.412 1.732 20.859 1.00 0.00 C ATOM 962 O VAL A 60 57.561 1.313 20.114 1.00 0.00 O ATOM 963 CB VAL A 60 60.452 2.287 19.489 1.00 0.00 C ATOM 964 CG1 VAL A 60 59.799 1.544 18.326 1.00 0.00 C ATOM 965 CG2 VAL A 60 61.284 3.443 18.940 1.00 0.00 C ATOM 0 H VAL A 60 60.975 3.089 21.803 1.00 0.00 H new ATOM 0 HA VAL A 60 58.822 3.620 19.896 1.00 0.00 H new ATOM 0 HB VAL A 60 61.087 1.596 20.043 1.00 0.00 H new ATOM 0 HG11 VAL A 60 60.572 1.151 17.666 1.00 0.00 H new ATOM 0 HG12 VAL A 60 59.198 0.721 18.712 1.00 0.00 H new ATOM 0 HG13 VAL A 60 59.160 2.230 17.769 1.00 0.00 H new ATOM 0 HG21 VAL A 60 62.052 3.053 18.272 1.00 0.00 H new ATOM 0 HG22 VAL A 60 60.638 4.127 18.390 1.00 0.00 H new ATOM 0 HG23 VAL A 60 61.757 3.975 19.765 1.00 0.00 H new ATOM 975 N GLN A 61 58.510 1.282 22.080 1.00 0.00 N ATOM 976 CA GLN A 61 57.565 0.244 22.562 1.00 0.00 C ATOM 977 C GLN A 61 56.241 0.924 22.895 1.00 0.00 C ATOM 978 O GLN A 61 55.184 0.332 22.803 1.00 0.00 O ATOM 979 CB GLN A 61 58.130 -0.428 23.816 1.00 0.00 C ATOM 980 CG GLN A 61 59.111 -1.528 23.408 1.00 0.00 C ATOM 981 CD GLN A 61 59.696 -2.181 24.662 1.00 0.00 C ATOM 982 OE1 GLN A 61 60.890 -2.140 24.883 1.00 0.00 O ATOM 983 NE2 GLN A 61 58.898 -2.786 25.500 1.00 0.00 N ATOM 0 H GLN A 61 59.204 1.590 22.761 1.00 0.00 H new ATOM 0 HA GLN A 61 57.417 -0.516 21.795 1.00 0.00 H new ATOM 0 HB2 GLN A 61 58.634 0.309 24.441 1.00 0.00 H new ATOM 0 HB3 GLN A 61 57.320 -0.851 24.411 1.00 0.00 H new ATOM 0 HG2 GLN A 61 58.603 -2.276 22.799 1.00 0.00 H new ATOM 0 HG3 GLN A 61 59.910 -1.109 22.797 1.00 0.00 H new ATOM 0 HE21 GLN A 61 57.896 -2.821 25.315 1.00 0.00 H new ATOM 0 HE22 GLN A 61 59.277 -3.224 26.340 1.00 0.00 H new ATOM 992 N ASP A 62 56.294 2.177 23.261 1.00 0.00 N ATOM 993 CA ASP A 62 55.053 2.914 23.577 1.00 0.00 C ATOM 994 C ASP A 62 54.453 3.460 22.278 1.00 0.00 C ATOM 995 O ASP A 62 53.253 3.479 22.092 1.00 0.00 O ATOM 996 CB ASP A 62 55.373 4.074 24.521 1.00 0.00 C ATOM 997 CG ASP A 62 56.038 3.534 25.788 1.00 0.00 C ATOM 998 OD1 ASP A 62 55.573 2.526 26.294 1.00 0.00 O ATOM 999 OD2 ASP A 62 57.000 4.137 26.233 1.00 0.00 O ATOM 0 H ASP A 62 57.153 2.719 23.353 1.00 0.00 H new ATOM 0 HA ASP A 62 54.340 2.246 24.060 1.00 0.00 H new ATOM 0 HB2 ASP A 62 56.033 4.787 24.027 1.00 0.00 H new ATOM 0 HB3 ASP A 62 54.459 4.610 24.778 1.00 0.00 H new ATOM 1004 N SER A 63 55.286 3.912 21.383 1.00 0.00 N ATOM 1005 CA SER A 63 54.787 4.462 20.111 1.00 0.00 C ATOM 1006 C SER A 63 54.303 3.325 19.200 1.00 0.00 C ATOM 1007 O SER A 63 53.194 3.333 18.706 1.00 0.00 O ATOM 1008 CB SER A 63 55.919 5.187 19.409 1.00 0.00 C ATOM 1009 OG SER A 63 56.913 5.554 20.357 1.00 0.00 O ATOM 0 H SER A 63 56.301 3.920 21.488 1.00 0.00 H new ATOM 0 HA SER A 63 53.962 5.144 20.318 1.00 0.00 H new ATOM 0 HB2 SER A 63 56.353 4.546 18.641 1.00 0.00 H new ATOM 0 HB3 SER A 63 55.538 6.075 18.905 1.00 0.00 H new ATOM 0 HG SER A 63 57.652 6.004 19.898 1.00 0.00 H new ATOM 1015 N MET A 64 55.164 2.383 18.932 1.00 0.00 N ATOM 1016 CA MET A 64 54.813 1.265 18.007 1.00 0.00 C ATOM 1017 C MET A 64 53.497 0.599 18.422 1.00 0.00 C ATOM 1018 O MET A 64 52.866 -0.062 17.631 1.00 0.00 O ATOM 1019 CB MET A 64 55.956 0.215 18.005 1.00 0.00 C ATOM 1020 CG MET A 64 55.832 -0.738 19.219 1.00 0.00 C ATOM 1021 SD MET A 64 56.990 -2.118 19.029 1.00 0.00 S ATOM 1022 CE MET A 64 58.506 -1.139 18.944 1.00 0.00 C ATOM 0 H MET A 64 56.107 2.338 19.318 1.00 0.00 H new ATOM 0 HA MET A 64 54.686 1.674 17.004 1.00 0.00 H new ATOM 0 HB2 MET A 64 55.924 -0.361 17.080 1.00 0.00 H new ATOM 0 HB3 MET A 64 56.921 0.722 18.032 1.00 0.00 H new ATOM 0 HG2 MET A 64 56.043 -0.197 20.142 1.00 0.00 H new ATOM 0 HG3 MET A 64 54.812 -1.114 19.296 1.00 0.00 H new ATOM 0 HE1 MET A 64 59.369 -1.805 18.932 1.00 0.00 H new ATOM 0 HE2 MET A 64 58.500 -0.537 18.036 1.00 0.00 H new ATOM 0 HE3 MET A 64 58.565 -0.484 19.813 1.00 0.00 H new ATOM 1032 N ASP A 65 53.101 0.724 19.660 1.00 0.00 N ATOM 1033 CA ASP A 65 51.852 0.049 20.098 1.00 0.00 C ATOM 1034 C ASP A 65 50.648 0.893 19.719 1.00 0.00 C ATOM 1035 O ASP A 65 49.602 0.371 19.387 1.00 0.00 O ATOM 1036 CB ASP A 65 51.880 -0.198 21.619 1.00 0.00 C ATOM 1037 CG ASP A 65 51.721 1.121 22.385 1.00 0.00 C ATOM 1038 OD1 ASP A 65 50.721 1.780 22.177 1.00 0.00 O ATOM 1039 OD2 ASP A 65 52.614 1.460 23.143 1.00 0.00 O ATOM 0 H ASP A 65 53.586 1.260 20.380 1.00 0.00 H new ATOM 0 HA ASP A 65 51.777 -0.916 19.596 1.00 0.00 H new ATOM 0 HB2 ASP A 65 51.079 -0.884 21.896 1.00 0.00 H new ATOM 0 HB3 ASP A 65 52.819 -0.675 21.898 1.00 0.00 H new ATOM 1044 N HIS A 66 50.779 2.188 19.732 1.00 0.00 N ATOM 1045 CA HIS A 66 49.627 3.022 19.332 1.00 0.00 C ATOM 1046 C HIS A 66 49.472 2.913 17.823 1.00 0.00 C ATOM 1047 O HIS A 66 48.378 2.919 17.297 1.00 0.00 O ATOM 1048 CB HIS A 66 49.822 4.484 19.764 1.00 0.00 C ATOM 1049 CG HIS A 66 50.871 5.138 18.926 1.00 0.00 C ATOM 1050 ND1 HIS A 66 52.056 5.578 19.462 1.00 0.00 N ATOM 1051 CD2 HIS A 66 50.920 5.442 17.596 1.00 0.00 C ATOM 1052 CE1 HIS A 66 52.782 6.113 18.462 1.00 0.00 C ATOM 1053 NE2 HIS A 66 52.133 6.059 17.303 1.00 0.00 N ATOM 0 H HIS A 66 51.623 2.695 19.999 1.00 0.00 H new ATOM 0 HA HIS A 66 48.723 2.668 19.827 1.00 0.00 H new ATOM 0 HB2 HIS A 66 48.881 5.027 19.670 1.00 0.00 H new ATOM 0 HB3 HIS A 66 50.109 4.524 20.815 1.00 0.00 H new ATOM 0 HD1 HIS A 66 52.336 5.512 20.441 1.00 0.00 H new ATOM 0 HD2 HIS A 66 50.138 5.235 16.881 1.00 0.00 H new ATOM 0 HE1 HIS A 66 53.769 6.534 18.586 1.00 0.00 H new ATOM 1061 N LEU A 67 50.563 2.724 17.124 1.00 0.00 N ATOM 1062 CA LEU A 67 50.462 2.514 15.664 1.00 0.00 C ATOM 1063 C LEU A 67 49.932 1.111 15.450 1.00 0.00 C ATOM 1064 O LEU A 67 49.157 0.847 14.551 1.00 0.00 O ATOM 1065 CB LEU A 67 51.844 2.640 15.008 1.00 0.00 C ATOM 1066 CG LEU A 67 52.458 3.987 15.364 1.00 0.00 C ATOM 1067 CD1 LEU A 67 53.868 4.076 14.799 1.00 0.00 C ATOM 1068 CD2 LEU A 67 51.608 5.096 14.765 1.00 0.00 C ATOM 0 H LEU A 67 51.509 2.707 17.505 1.00 0.00 H new ATOM 0 HA LEU A 67 49.804 3.260 15.219 1.00 0.00 H new ATOM 0 HB2 LEU A 67 52.493 1.832 15.346 1.00 0.00 H new ATOM 0 HB3 LEU A 67 51.754 2.545 13.926 1.00 0.00 H new ATOM 0 HG LEU A 67 52.497 4.092 16.448 1.00 0.00 H new ATOM 0 HD11 LEU A 67 54.303 5.042 15.057 1.00 0.00 H new ATOM 0 HD12 LEU A 67 54.480 3.279 15.221 1.00 0.00 H new ATOM 0 HD13 LEU A 67 53.833 3.972 13.715 1.00 0.00 H new ATOM 0 HD21 LEU A 67 52.042 6.064 15.016 1.00 0.00 H new ATOM 0 HD22 LEU A 67 51.575 4.984 13.681 1.00 0.00 H new ATOM 0 HD23 LEU A 67 50.597 5.037 15.167 1.00 0.00 H new ATOM 1080 N ASP A 68 50.313 0.215 16.317 1.00 0.00 N ATOM 1081 CA ASP A 68 49.814 -1.166 16.240 1.00 0.00 C ATOM 1082 C ASP A 68 48.309 -1.159 16.500 1.00 0.00 C ATOM 1083 O ASP A 68 47.621 -2.125 16.239 1.00 0.00 O ATOM 1084 CB ASP A 68 50.525 -2.017 17.299 1.00 0.00 C ATOM 1085 CG ASP A 68 51.234 -3.190 16.620 1.00 0.00 C ATOM 1086 OD1 ASP A 68 50.558 -4.142 16.268 1.00 0.00 O ATOM 1087 OD2 ASP A 68 52.443 -3.118 16.464 1.00 0.00 O ATOM 0 H ASP A 68 50.960 0.394 17.085 1.00 0.00 H new ATOM 0 HA ASP A 68 50.011 -1.586 15.254 1.00 0.00 H new ATOM 0 HB2 ASP A 68 51.246 -1.409 17.845 1.00 0.00 H new ATOM 0 HB3 ASP A 68 49.804 -2.387 18.028 1.00 0.00 H new ATOM 1092 N LYS A 69 47.787 -0.064 16.999 1.00 0.00 N ATOM 1093 CA LYS A 69 46.340 0.010 17.250 1.00 0.00 C ATOM 1094 C LYS A 69 45.816 1.366 16.804 1.00 0.00 C ATOM 1095 O LYS A 69 44.949 1.949 17.424 1.00 0.00 O ATOM 1096 CB LYS A 69 46.057 -0.194 18.740 1.00 0.00 C ATOM 1097 CG LYS A 69 46.735 0.915 19.546 1.00 0.00 C ATOM 1098 CD LYS A 69 47.109 0.384 20.931 1.00 0.00 C ATOM 1099 CE LYS A 69 46.285 1.111 21.995 1.00 0.00 C ATOM 1100 NZ LYS A 69 44.867 0.658 21.920 1.00 0.00 N ATOM 0 H LYS A 69 48.314 0.776 17.239 1.00 0.00 H new ATOM 0 HA LYS A 69 45.836 -0.775 16.685 1.00 0.00 H new ATOM 0 HB2 LYS A 69 44.982 -0.184 18.921 1.00 0.00 H new ATOM 0 HB3 LYS A 69 46.426 -1.168 19.061 1.00 0.00 H new ATOM 0 HG2 LYS A 69 47.627 1.264 19.026 1.00 0.00 H new ATOM 0 HG3 LYS A 69 46.066 1.771 19.641 1.00 0.00 H new ATOM 0 HD2 LYS A 69 46.924 -0.689 20.983 1.00 0.00 H new ATOM 0 HD3 LYS A 69 48.173 0.534 21.115 1.00 0.00 H new ATOM 0 HE2 LYS A 69 46.691 0.908 22.986 1.00 0.00 H new ATOM 0 HE3 LYS A 69 46.342 2.189 21.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 44.306 1.152 22.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 44.483 0.873 20.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 44.821 -0.367 22.087 1.00 0.00 H new ATOM 1114 N GLN A 70 46.330 1.867 15.723 1.00 0.00 N ATOM 1115 CA GLN A 70 45.870 3.170 15.215 1.00 0.00 C ATOM 1116 C GLN A 70 44.729 2.959 14.210 1.00 0.00 C ATOM 1117 O GLN A 70 44.310 3.878 13.534 1.00 0.00 O ATOM 1118 CB GLN A 70 47.033 3.887 14.523 1.00 0.00 C ATOM 1119 CG GLN A 70 47.583 4.974 15.448 1.00 0.00 C ATOM 1120 CD GLN A 70 46.880 6.300 15.149 1.00 0.00 C ATOM 1121 OE1 GLN A 70 47.348 7.081 14.345 1.00 0.00 O ATOM 1122 NE2 GLN A 70 45.769 6.589 15.769 1.00 0.00 N ATOM 0 H GLN A 70 47.058 1.420 15.166 1.00 0.00 H new ATOM 0 HA GLN A 70 45.511 3.776 16.047 1.00 0.00 H new ATOM 0 HB2 GLN A 70 47.819 3.173 14.275 1.00 0.00 H new ATOM 0 HB3 GLN A 70 46.696 4.329 13.585 1.00 0.00 H new ATOM 0 HG2 GLN A 70 47.427 4.694 16.490 1.00 0.00 H new ATOM 0 HG3 GLN A 70 48.658 5.079 15.304 1.00 0.00 H new ATOM 0 HE21 GLN A 70 45.376 5.933 16.444 1.00 0.00 H new ATOM 0 HE22 GLN A 70 45.293 7.471 15.579 1.00 0.00 H new ATOM 1131 N THR A 71 44.226 1.756 14.104 1.00 0.00 N ATOM 1132 CA THR A 71 43.126 1.493 13.149 1.00 0.00 C ATOM 1133 C THR A 71 42.251 0.354 13.678 1.00 0.00 C ATOM 1134 O THR A 71 41.807 -0.499 12.934 1.00 0.00 O ATOM 1135 CB THR A 71 43.714 1.098 11.793 1.00 0.00 C ATOM 1136 OG1 THR A 71 42.661 0.880 10.865 1.00 0.00 O ATOM 1137 CG2 THR A 71 44.535 -0.183 11.947 1.00 0.00 C ATOM 0 H THR A 71 44.535 0.947 14.642 1.00 0.00 H new ATOM 0 HA THR A 71 42.520 2.392 13.035 1.00 0.00 H new ATOM 0 HB THR A 71 44.357 1.899 11.428 1.00 0.00 H new ATOM 0 HG1 THR A 71 41.994 0.281 11.262 1.00 0.00 H new ATOM 0 HG21 THR A 71 44.954 -0.465 10.981 1.00 0.00 H new ATOM 0 HG22 THR A 71 45.344 -0.014 12.658 1.00 0.00 H new ATOM 0 HG23 THR A 71 43.893 -0.985 12.312 1.00 0.00 H new ATOM 1145 N GLN A 72 42.000 0.333 14.957 1.00 0.00 N ATOM 1146 CA GLN A 72 41.158 -0.742 15.531 1.00 0.00 C ATOM 1147 C GLN A 72 40.410 -0.208 16.753 1.00 0.00 C ATOM 1148 O GLN A 72 40.449 -0.789 17.820 1.00 0.00 O ATOM 1149 CB GLN A 72 42.044 -1.920 15.946 1.00 0.00 C ATOM 1150 CG GLN A 72 43.110 -1.433 16.930 1.00 0.00 C ATOM 1151 CD GLN A 72 43.854 -2.636 17.513 1.00 0.00 C ATOM 1152 OE1 GLN A 72 44.821 -3.101 16.943 1.00 0.00 O ATOM 1153 NE2 GLN A 72 43.442 -3.163 18.633 1.00 0.00 N ATOM 0 H GLN A 72 42.345 1.019 15.629 1.00 0.00 H new ATOM 0 HA GLN A 72 40.438 -1.077 14.784 1.00 0.00 H new ATOM 0 HB2 GLN A 72 41.438 -2.700 16.406 1.00 0.00 H new ATOM 0 HB3 GLN A 72 42.517 -2.360 15.068 1.00 0.00 H new ATOM 0 HG2 GLN A 72 43.811 -0.769 16.424 1.00 0.00 H new ATOM 0 HG3 GLN A 72 42.645 -0.857 17.730 1.00 0.00 H new ATOM 0 HE21 GLN A 72 42.630 -2.773 19.112 1.00 0.00 H new ATOM 0 HE22 GLN A 72 43.932 -3.965 19.030 1.00 0.00 H new ATOM 1162 N THR A 73 39.726 0.893 16.607 1.00 0.00 N ATOM 1163 CA THR A 73 38.975 1.463 17.759 1.00 0.00 C ATOM 1164 C THR A 73 37.952 0.429 18.264 1.00 0.00 C ATOM 1165 O THR A 73 37.438 -0.353 17.489 1.00 0.00 O ATOM 1166 CB THR A 73 38.242 2.729 17.309 1.00 0.00 C ATOM 1167 OG1 THR A 73 37.297 3.108 18.301 1.00 0.00 O ATOM 1168 CG2 THR A 73 37.517 2.459 15.990 1.00 0.00 C ATOM 0 H THR A 73 39.655 1.423 15.738 1.00 0.00 H new ATOM 0 HA THR A 73 39.669 1.710 18.563 1.00 0.00 H new ATOM 0 HB THR A 73 38.963 3.534 17.168 1.00 0.00 H new ATOM 0 HG1 THR A 73 36.829 3.920 18.014 1.00 0.00 H new ATOM 0 HG21 THR A 73 36.995 3.361 15.670 1.00 0.00 H new ATOM 0 HG22 THR A 73 38.242 2.170 15.229 1.00 0.00 H new ATOM 0 HG23 THR A 73 36.796 1.653 16.129 1.00 0.00 H new ATOM 1176 N PRO A 74 37.681 0.454 19.561 1.00 0.00 N ATOM 1177 CA PRO A 74 36.725 -0.477 20.165 1.00 0.00 C ATOM 1178 C PRO A 74 35.336 -0.285 19.548 1.00 0.00 C ATOM 1179 O PRO A 74 34.833 0.818 19.461 1.00 0.00 O ATOM 1180 CB PRO A 74 36.704 -0.115 21.661 1.00 0.00 C ATOM 1181 CG PRO A 74 37.704 1.066 21.869 1.00 0.00 C ATOM 1182 CD PRO A 74 38.308 1.403 20.493 1.00 0.00 C ATOM 0 HA PRO A 74 37.005 -1.518 20.001 1.00 0.00 H new ATOM 0 HB2 PRO A 74 35.700 0.173 21.972 1.00 0.00 H new ATOM 0 HB3 PRO A 74 36.992 -0.973 22.268 1.00 0.00 H new ATOM 0 HG2 PRO A 74 37.193 1.933 22.287 1.00 0.00 H new ATOM 0 HG3 PRO A 74 38.487 0.787 22.574 1.00 0.00 H new ATOM 0 HD2 PRO A 74 38.095 2.434 20.210 1.00 0.00 H new ATOM 0 HD3 PRO A 74 39.392 1.292 20.500 1.00 0.00 H new ATOM 1190 N LYS A 75 34.716 -1.349 19.119 1.00 0.00 N ATOM 1191 CA LYS A 75 33.362 -1.226 18.508 1.00 0.00 C ATOM 1192 C LYS A 75 32.327 -0.970 19.605 1.00 0.00 C ATOM 1193 O LYS A 75 32.156 -1.765 20.509 1.00 0.00 O ATOM 1194 CB LYS A 75 33.015 -2.523 17.773 1.00 0.00 C ATOM 1195 CG LYS A 75 32.151 -2.202 16.552 1.00 0.00 C ATOM 1196 CD LYS A 75 30.694 -2.561 16.850 1.00 0.00 C ATOM 1197 CE LYS A 75 29.901 -2.600 15.542 1.00 0.00 C ATOM 1198 NZ LYS A 75 28.449 -2.753 15.846 1.00 0.00 N ATOM 0 H LYS A 75 35.088 -2.298 19.165 1.00 0.00 H new ATOM 0 HA LYS A 75 33.356 -0.395 17.803 1.00 0.00 H new ATOM 0 HB2 LYS A 75 33.927 -3.033 17.463 1.00 0.00 H new ATOM 0 HB3 LYS A 75 32.483 -3.201 18.441 1.00 0.00 H new ATOM 0 HG2 LYS A 75 32.233 -1.144 16.303 1.00 0.00 H new ATOM 0 HG3 LYS A 75 32.505 -2.761 15.686 1.00 0.00 H new ATOM 0 HD2 LYS A 75 30.641 -3.529 17.349 1.00 0.00 H new ATOM 0 HD3 LYS A 75 30.259 -1.828 17.530 1.00 0.00 H new ATOM 0 HE2 LYS A 75 30.070 -1.685 14.974 1.00 0.00 H new ATOM 0 HE3 LYS A 75 30.243 -3.428 14.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 27.909 -2.780 14.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 28.296 -3.638 16.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 28.128 -1.949 16.422 1.00 0.00 H new ATOM 1212 N THR A 76 31.636 0.135 19.536 1.00 0.00 N ATOM 1213 CA THR A 76 30.612 0.440 20.576 1.00 0.00 C ATOM 1214 C THR A 76 29.470 1.240 19.947 1.00 0.00 C ATOM 1215 O THR A 76 28.579 0.624 19.387 1.00 0.00 O ATOM 1216 CB THR A 76 31.254 1.261 21.696 1.00 0.00 C ATOM 1217 OG1 THR A 76 31.980 2.345 21.133 1.00 0.00 O ATOM 1218 CG2 THR A 76 32.204 0.374 22.501 1.00 0.00 C ATOM 1219 OXT THR A 76 29.506 2.457 20.035 1.00 0.00 O ATOM 0 H THR A 76 31.736 0.839 18.805 1.00 0.00 H new ATOM 0 HA THR A 76 30.220 -0.491 20.986 1.00 0.00 H new ATOM 0 HB THR A 76 30.475 1.648 22.353 1.00 0.00 H new ATOM 0 HG1 THR A 76 31.410 2.825 20.496 1.00 0.00 H new ATOM 0 HG21 THR A 76 32.661 0.960 23.299 1.00 0.00 H new ATOM 0 HG22 THR A 76 31.647 -0.457 22.934 1.00 0.00 H new ATOM 0 HG23 THR A 76 32.983 -0.015 21.845 1.00 0.00 H new TER 1227 THR A 76 ATOM 1228 N GLN B 1 71.366 21.148 8.730 1.00 0.00 N ATOM 1229 CA GLN B 1 71.871 19.806 8.327 1.00 0.00 C ATOM 1230 C GLN B 1 70.682 18.862 8.087 1.00 0.00 C ATOM 1231 O GLN B 1 69.557 19.197 8.404 1.00 0.00 O ATOM 1232 CB GLN B 1 72.756 19.240 9.439 1.00 0.00 C ATOM 1233 CG GLN B 1 74.214 19.223 8.974 1.00 0.00 C ATOM 1234 CD GLN B 1 74.707 20.659 8.788 1.00 0.00 C ATOM 1235 OE1 GLN B 1 75.189 21.274 9.717 1.00 0.00 O ATOM 1236 NE2 GLN B 1 74.607 21.223 7.614 1.00 0.00 N ATOM 0 H1 GLN B 1 71.896 21.484 9.559 1.00 0.00 H new ATOM 0 H2 GLN B 1 71.492 21.817 7.944 1.00 0.00 H new ATOM 0 H3 GLN B 1 70.356 21.081 8.969 1.00 0.00 H new ATOM 0 HA GLN B 1 72.453 19.897 7.410 1.00 0.00 H new ATOM 0 HB2 GLN B 1 72.658 19.846 10.340 1.00 0.00 H new ATOM 0 HB3 GLN B 1 72.434 18.231 9.696 1.00 0.00 H new ATOM 0 HG2 GLN B 1 74.834 18.706 9.706 1.00 0.00 H new ATOM 0 HG3 GLN B 1 74.302 18.673 8.037 1.00 0.00 H new ATOM 0 HE21 GLN B 1 74.202 20.707 6.833 1.00 0.00 H new ATOM 0 HE22 GLN B 1 74.934 22.180 7.478 1.00 0.00 H new ATOM 1247 N PRO B 2 70.967 17.699 7.529 1.00 0.00 N ATOM 1248 CA PRO B 2 69.932 16.707 7.241 1.00 0.00 C ATOM 1249 C PRO B 2 69.247 16.264 8.536 1.00 0.00 C ATOM 1250 O PRO B 2 69.765 15.455 9.278 1.00 0.00 O ATOM 1251 CB PRO B 2 70.675 15.525 6.596 1.00 0.00 C ATOM 1252 CG PRO B 2 72.189 15.905 6.535 1.00 0.00 C ATOM 1253 CD PRO B 2 72.331 17.308 7.152 1.00 0.00 C ATOM 0 HA PRO B 2 69.154 17.104 6.589 1.00 0.00 H new ATOM 0 HB2 PRO B 2 70.530 14.616 7.180 1.00 0.00 H new ATOM 0 HB3 PRO B 2 70.288 15.327 5.596 1.00 0.00 H new ATOM 0 HG2 PRO B 2 72.790 15.180 7.084 1.00 0.00 H new ATOM 0 HG3 PRO B 2 72.546 15.900 5.505 1.00 0.00 H new ATOM 0 HD2 PRO B 2 72.991 17.292 8.020 1.00 0.00 H new ATOM 0 HD3 PRO B 2 72.760 18.011 6.438 1.00 0.00 H new ATOM 1261 N ASP B 3 68.086 16.795 8.813 1.00 0.00 N ATOM 1262 CA ASP B 3 67.367 16.407 10.050 1.00 0.00 C ATOM 1263 C ASP B 3 66.528 15.156 9.779 1.00 0.00 C ATOM 1264 O ASP B 3 65.313 15.189 9.809 1.00 0.00 O ATOM 1265 CB ASP B 3 66.453 17.550 10.490 1.00 0.00 C ATOM 1266 CG ASP B 3 67.301 18.761 10.882 1.00 0.00 C ATOM 1267 OD1 ASP B 3 68.309 18.566 11.541 1.00 0.00 O ATOM 1268 OD2 ASP B 3 66.930 19.864 10.515 1.00 0.00 O ATOM 0 H ASP B 3 67.607 17.482 8.231 1.00 0.00 H new ATOM 0 HA ASP B 3 68.089 16.197 10.840 1.00 0.00 H new ATOM 0 HB2 ASP B 3 65.772 17.816 9.682 1.00 0.00 H new ATOM 0 HB3 ASP B 3 65.839 17.234 11.334 1.00 0.00 H new ATOM 1273 N ALA B 4 67.169 14.054 9.508 1.00 0.00 N ATOM 1274 CA ALA B 4 66.423 12.795 9.226 1.00 0.00 C ATOM 1275 C ALA B 4 67.417 11.733 8.761 1.00 0.00 C ATOM 1276 O ALA B 4 67.356 11.253 7.646 1.00 0.00 O ATOM 1277 CB ALA B 4 65.387 13.044 8.126 1.00 0.00 C ATOM 0 H ALA B 4 68.185 13.970 9.469 1.00 0.00 H new ATOM 0 HA ALA B 4 65.910 12.458 10.127 1.00 0.00 H new ATOM 0 HB1 ALA B 4 64.844 12.121 7.922 1.00 0.00 H new ATOM 0 HB2 ALA B 4 64.687 13.813 8.453 1.00 0.00 H new ATOM 0 HB3 ALA B 4 65.892 13.375 7.219 1.00 0.00 H new ATOM 1283 N ILE B 5 68.345 11.376 9.603 1.00 0.00 N ATOM 1284 CA ILE B 5 69.360 10.365 9.212 1.00 0.00 C ATOM 1285 C ILE B 5 68.868 8.965 9.580 1.00 0.00 C ATOM 1286 O ILE B 5 69.392 7.973 9.113 1.00 0.00 O ATOM 1287 CB ILE B 5 70.671 10.663 9.936 1.00 0.00 C ATOM 1288 CG1 ILE B 5 71.277 11.949 9.374 1.00 0.00 C ATOM 1289 CG2 ILE B 5 71.645 9.512 9.727 1.00 0.00 C ATOM 1290 CD1 ILE B 5 71.613 12.894 10.522 1.00 0.00 C ATOM 0 H ILE B 5 68.443 11.744 10.549 1.00 0.00 H new ATOM 0 HA ILE B 5 69.522 10.409 8.135 1.00 0.00 H new ATOM 0 HB ILE B 5 70.478 10.783 11.002 1.00 0.00 H new ATOM 0 HG12 ILE B 5 72.176 11.721 8.801 1.00 0.00 H new ATOM 0 HG13 ILE B 5 70.576 12.426 8.689 1.00 0.00 H new ATOM 0 HG21 ILE B 5 72.580 9.728 10.245 1.00 0.00 H new ATOM 0 HG22 ILE B 5 71.213 8.593 10.125 1.00 0.00 H new ATOM 0 HG23 ILE B 5 71.840 9.390 8.662 1.00 0.00 H new ATOM 0 HD11 ILE B 5 72.045 13.812 10.123 1.00 0.00 H new ATOM 0 HD12 ILE B 5 70.705 13.131 11.076 1.00 0.00 H new ATOM 0 HD13 ILE B 5 72.330 12.415 11.189 1.00 0.00 H new ATOM 1302 N ASN B 6 67.846 8.873 10.373 1.00 0.00 N ATOM 1303 CA ASN B 6 67.301 7.531 10.710 1.00 0.00 C ATOM 1304 C ASN B 6 66.261 7.199 9.662 1.00 0.00 C ATOM 1305 O ASN B 6 65.100 7.078 9.949 1.00 0.00 O ATOM 1306 CB ASN B 6 66.637 7.503 12.114 1.00 0.00 C ATOM 1307 CG ASN B 6 66.664 8.888 12.782 1.00 0.00 C ATOM 1308 OD1 ASN B 6 65.900 9.840 12.316 1.00 0.00 O flip ATOM 1309 ND2 ASN B 6 67.393 9.104 13.731 1.00 0.00 N flip ATOM 0 H ASN B 6 67.364 9.663 10.802 1.00 0.00 H new ATOM 0 HA ASN B 6 68.116 6.807 10.727 1.00 0.00 H new ATOM 0 HB2 ASN B 6 65.605 7.163 12.022 1.00 0.00 H new ATOM 0 HB3 ASN B 6 67.155 6.783 12.748 1.00 0.00 H new ATOM 0 HD21 ASN B 6 67.990 8.361 14.095 1.00 0.00 H new ATOM 0 HD22 ASN B 6 67.408 10.028 14.163 1.00 0.00 H new ATOM 1316 N ALA B 7 66.662 7.136 8.432 1.00 0.00 N ATOM 1317 CA ALA B 7 65.684 6.885 7.349 1.00 0.00 C ATOM 1318 C ALA B 7 65.823 5.459 6.803 1.00 0.00 C ATOM 1319 O ALA B 7 66.916 5.031 6.491 1.00 0.00 O ATOM 1320 CB ALA B 7 65.954 7.853 6.200 1.00 0.00 C ATOM 0 H ALA B 7 67.629 7.248 8.128 1.00 0.00 H new ATOM 0 HA ALA B 7 64.682 7.021 7.756 1.00 0.00 H new ATOM 0 HB1 ALA B 7 65.238 7.675 5.398 1.00 0.00 H new ATOM 0 HB2 ALA B 7 65.852 8.878 6.556 1.00 0.00 H new ATOM 0 HB3 ALA B 7 66.965 7.698 5.824 1.00 0.00 H new ATOM 1326 N PRO B 8 64.694 4.792 6.602 1.00 0.00 N ATOM 1327 CA PRO B 8 64.700 3.482 5.977 1.00 0.00 C ATOM 1328 C PRO B 8 65.198 3.664 4.559 1.00 0.00 C ATOM 1329 O PRO B 8 64.493 4.153 3.699 1.00 0.00 O ATOM 1330 CB PRO B 8 63.241 3.016 5.985 1.00 0.00 C ATOM 1331 CG PRO B 8 62.405 4.148 6.653 1.00 0.00 C ATOM 1332 CD PRO B 8 63.372 5.294 6.990 1.00 0.00 C ATOM 0 HA PRO B 8 65.335 2.755 6.484 1.00 0.00 H new ATOM 0 HB2 PRO B 8 62.891 2.826 4.970 1.00 0.00 H new ATOM 0 HB3 PRO B 8 63.137 2.082 6.538 1.00 0.00 H new ATOM 0 HG2 PRO B 8 61.620 4.493 5.981 1.00 0.00 H new ATOM 0 HG3 PRO B 8 61.914 3.782 7.555 1.00 0.00 H new ATOM 0 HD2 PRO B 8 63.117 6.201 6.443 1.00 0.00 H new ATOM 0 HD3 PRO B 8 63.338 5.542 8.051 1.00 0.00 H new ATOM 1340 N VAL B 9 66.424 3.360 4.327 1.00 0.00 N ATOM 1341 CA VAL B 9 67.005 3.605 2.995 1.00 0.00 C ATOM 1342 C VAL B 9 66.758 2.392 2.086 1.00 0.00 C ATOM 1343 O VAL B 9 67.489 1.423 2.103 1.00 0.00 O ATOM 1344 CB VAL B 9 68.494 3.830 3.181 1.00 0.00 C ATOM 1345 CG1 VAL B 9 69.090 2.597 3.823 1.00 0.00 C ATOM 1346 CG2 VAL B 9 69.152 4.092 1.840 1.00 0.00 C ATOM 0 H VAL B 9 67.060 2.947 5.009 1.00 0.00 H new ATOM 0 HA VAL B 9 66.546 4.476 2.527 1.00 0.00 H new ATOM 0 HB VAL B 9 68.662 4.697 3.820 1.00 0.00 H new ATOM 0 HG11 VAL B 9 70.161 2.742 3.964 1.00 0.00 H new ATOM 0 HG12 VAL B 9 68.617 2.425 4.790 1.00 0.00 H new ATOM 0 HG13 VAL B 9 68.922 1.734 3.179 1.00 0.00 H new ATOM 0 HG21 VAL B 9 70.220 4.252 1.984 1.00 0.00 H new ATOM 0 HG22 VAL B 9 68.999 3.234 1.186 1.00 0.00 H new ATOM 0 HG23 VAL B 9 68.710 4.979 1.385 1.00 0.00 H new ATOM 1356 N THR B 10 65.725 2.441 1.299 1.00 0.00 N ATOM 1357 CA THR B 10 65.422 1.294 0.403 1.00 0.00 C ATOM 1358 C THR B 10 66.589 1.062 -0.558 1.00 0.00 C ATOM 1359 O THR B 10 66.810 1.826 -1.477 1.00 0.00 O ATOM 1360 CB THR B 10 64.157 1.595 -0.397 1.00 0.00 C ATOM 1361 OG1 THR B 10 63.198 2.216 0.448 1.00 0.00 O ATOM 1362 CG2 THR B 10 63.584 0.291 -0.947 1.00 0.00 C ATOM 0 H THR B 10 65.076 3.226 1.236 1.00 0.00 H new ATOM 0 HA THR B 10 65.270 0.398 1.006 1.00 0.00 H new ATOM 0 HB THR B 10 64.398 2.264 -1.223 1.00 0.00 H new ATOM 0 HG1 THR B 10 62.387 2.411 -0.066 1.00 0.00 H new ATOM 0 HG21 THR B 10 62.681 0.503 -1.519 1.00 0.00 H new ATOM 0 HG22 THR B 10 64.320 -0.185 -1.595 1.00 0.00 H new ATOM 0 HG23 THR B 10 63.342 -0.377 -0.121 1.00 0.00 H new ATOM 1370 N CYS B 11 67.329 0.003 -0.364 1.00 0.00 N ATOM 1371 CA CYS B 11 68.468 -0.286 -1.285 1.00 0.00 C ATOM 1372 C CYS B 11 68.354 -1.723 -1.798 1.00 0.00 C ATOM 1373 O CYS B 11 67.324 -2.356 -1.679 1.00 0.00 O ATOM 1374 CB CYS B 11 69.797 -0.115 -0.546 1.00 0.00 C ATOM 1375 SG CYS B 11 69.782 1.438 0.376 1.00 0.00 S ATOM 0 H CYS B 11 67.195 -0.672 0.389 1.00 0.00 H new ATOM 0 HA CYS B 11 68.434 0.409 -2.124 1.00 0.00 H new ATOM 0 HB2 CYS B 11 69.957 -0.952 0.134 1.00 0.00 H new ATOM 0 HB3 CYS B 11 70.623 -0.120 -1.257 1.00 0.00 H new ATOM 1380 N CYS B 12 69.404 -2.242 -2.372 1.00 0.00 N ATOM 1381 CA CYS B 12 69.355 -3.638 -2.899 1.00 0.00 C ATOM 1382 C CYS B 12 70.630 -4.384 -2.495 1.00 0.00 C ATOM 1383 O CYS B 12 71.450 -3.880 -1.752 1.00 0.00 O ATOM 1384 CB CYS B 12 69.272 -3.609 -4.427 1.00 0.00 C ATOM 1385 SG CYS B 12 68.066 -2.373 -4.953 1.00 0.00 S ATOM 0 H CYS B 12 70.294 -1.761 -2.500 1.00 0.00 H new ATOM 0 HA CYS B 12 68.480 -4.142 -2.488 1.00 0.00 H new ATOM 0 HB2 CYS B 12 70.250 -3.378 -4.849 1.00 0.00 H new ATOM 0 HB3 CYS B 12 68.987 -4.591 -4.803 1.00 0.00 H new ATOM 1390 N TYR B 13 70.817 -5.567 -3.013 1.00 0.00 N ATOM 1391 CA TYR B 13 72.056 -6.341 -2.705 1.00 0.00 C ATOM 1392 C TYR B 13 72.514 -7.067 -3.971 1.00 0.00 C ATOM 1393 O TYR B 13 73.686 -7.104 -4.291 1.00 0.00 O ATOM 1394 CB TYR B 13 71.775 -7.364 -1.601 1.00 0.00 C ATOM 1395 CG TYR B 13 71.596 -6.648 -0.281 1.00 0.00 C ATOM 1396 CD1 TYR B 13 72.453 -5.587 0.060 1.00 0.00 C ATOM 1397 CD2 TYR B 13 70.581 -7.052 0.619 1.00 0.00 C ATOM 1398 CE1 TYR B 13 72.297 -4.922 1.295 1.00 0.00 C ATOM 1399 CE2 TYR B 13 70.429 -6.390 1.854 1.00 0.00 C ATOM 1400 CZ TYR B 13 71.287 -5.325 2.193 1.00 0.00 C ATOM 1401 OH TYR B 13 71.138 -4.678 3.401 1.00 0.00 O ATOM 0 H TYR B 13 70.162 -6.034 -3.640 1.00 0.00 H new ATOM 0 HA TYR B 13 72.835 -5.660 -2.363 1.00 0.00 H new ATOM 0 HB2 TYR B 13 70.879 -7.936 -1.841 1.00 0.00 H new ATOM 0 HB3 TYR B 13 72.598 -8.075 -1.532 1.00 0.00 H new ATOM 0 HD1 TYR B 13 73.231 -5.281 -0.623 1.00 0.00 H new ATOM 0 HD2 TYR B 13 69.923 -7.868 0.359 1.00 0.00 H new ATOM 0 HE1 TYR B 13 72.952 -4.103 1.553 1.00 0.00 H new ATOM 0 HE2 TYR B 13 69.655 -6.699 2.541 1.00 0.00 H new ATOM 0 HH TYR B 13 70.187 -4.506 3.565 1.00 0.00 H new ATOM 1411 N ASN B 14 71.590 -7.622 -4.710 1.00 0.00 N ATOM 1412 CA ASN B 14 71.955 -8.320 -5.971 1.00 0.00 C ATOM 1413 C ASN B 14 71.228 -7.643 -7.128 1.00 0.00 C ATOM 1414 O ASN B 14 70.620 -6.603 -6.961 1.00 0.00 O ATOM 1415 CB ASN B 14 71.537 -9.788 -5.885 1.00 0.00 C ATOM 1416 CG ASN B 14 72.272 -10.459 -4.726 1.00 0.00 C ATOM 1417 OD1 ASN B 14 71.635 -10.683 -3.612 1.00 0.00 O flip ATOM 1418 ND2 ASN B 14 73.438 -10.783 -4.836 1.00 0.00 N flip ATOM 0 H ASN B 14 70.594 -7.620 -4.491 1.00 0.00 H new ATOM 0 HA ASN B 14 73.032 -8.269 -6.129 1.00 0.00 H new ATOM 0 HB2 ASN B 14 70.459 -9.863 -5.738 1.00 0.00 H new ATOM 0 HB3 ASN B 14 71.767 -10.298 -6.820 1.00 0.00 H new ATOM 0 HD21 ASN B 14 73.936 -10.607 -5.709 1.00 0.00 H new ATOM 0 HD22 ASN B 14 73.919 -11.231 -4.056 1.00 0.00 H new ATOM 1425 N PHE B 15 71.286 -8.204 -8.301 1.00 0.00 N ATOM 1426 CA PHE B 15 70.596 -7.559 -9.451 1.00 0.00 C ATOM 1427 C PHE B 15 70.178 -8.610 -10.484 1.00 0.00 C ATOM 1428 O PHE B 15 71.006 -9.278 -11.068 1.00 0.00 O ATOM 1429 CB PHE B 15 71.545 -6.558 -10.119 1.00 0.00 C ATOM 1430 CG PHE B 15 72.013 -5.541 -9.105 1.00 0.00 C ATOM 1431 CD1 PHE B 15 73.147 -5.811 -8.307 1.00 0.00 C ATOM 1432 CD2 PHE B 15 71.312 -4.325 -8.948 1.00 0.00 C ATOM 1433 CE1 PHE B 15 73.580 -4.863 -7.355 1.00 0.00 C ATOM 1434 CE2 PHE B 15 71.745 -3.377 -7.995 1.00 0.00 C ATOM 1435 CZ PHE B 15 72.879 -3.646 -7.198 1.00 0.00 C ATOM 0 H PHE B 15 71.776 -9.073 -8.513 1.00 0.00 H new ATOM 0 HA PHE B 15 69.708 -7.047 -9.081 1.00 0.00 H new ATOM 0 HB2 PHE B 15 72.401 -7.082 -10.543 1.00 0.00 H new ATOM 0 HB3 PHE B 15 71.038 -6.056 -10.943 1.00 0.00 H new ATOM 0 HD1 PHE B 15 73.682 -6.742 -8.425 1.00 0.00 H new ATOM 0 HD2 PHE B 15 70.444 -4.120 -9.557 1.00 0.00 H new ATOM 0 HE1 PHE B 15 74.448 -5.068 -6.746 1.00 0.00 H new ATOM 0 HE2 PHE B 15 71.209 -2.447 -7.876 1.00 0.00 H new ATOM 0 HZ PHE B 15 73.211 -2.922 -6.469 1.00 0.00 H new ATOM 1445 N THR B 16 68.894 -8.727 -10.751 1.00 0.00 N ATOM 1446 CA THR B 16 68.434 -9.704 -11.803 1.00 0.00 C ATOM 1447 C THR B 16 69.253 -9.460 -13.072 1.00 0.00 C ATOM 1448 O THR B 16 68.968 -8.566 -13.837 1.00 0.00 O ATOM 1449 CB THR B 16 66.930 -9.500 -12.121 1.00 0.00 C ATOM 1450 OG1 THR B 16 66.678 -9.878 -13.470 1.00 0.00 O ATOM 1451 CG2 THR B 16 66.544 -8.034 -11.930 1.00 0.00 C ATOM 0 H THR B 16 68.152 -8.197 -10.294 1.00 0.00 H new ATOM 0 HA THR B 16 68.574 -10.722 -11.438 1.00 0.00 H new ATOM 0 HB THR B 16 66.338 -10.116 -11.444 1.00 0.00 H new ATOM 0 HG1 THR B 16 66.988 -9.169 -14.072 1.00 0.00 H new ATOM 0 HG21 THR B 16 65.486 -7.904 -12.156 1.00 0.00 H new ATOM 0 HG22 THR B 16 66.733 -7.739 -10.898 1.00 0.00 H new ATOM 0 HG23 THR B 16 67.137 -7.411 -12.599 1.00 0.00 H new ATOM 1459 N ASN B 17 70.290 -10.216 -13.286 1.00 0.00 N ATOM 1460 CA ASN B 17 71.133 -9.979 -14.487 1.00 0.00 C ATOM 1461 C ASN B 17 70.600 -10.782 -15.672 1.00 0.00 C ATOM 1462 O ASN B 17 71.166 -10.764 -16.747 1.00 0.00 O ATOM 1463 CB ASN B 17 72.573 -10.396 -14.190 1.00 0.00 C ATOM 1464 CG ASN B 17 73.537 -9.381 -14.809 1.00 0.00 C ATOM 1465 OD1 ASN B 17 74.606 -9.141 -14.281 1.00 0.00 O ATOM 1466 ND2 ASN B 17 73.204 -8.771 -15.913 1.00 0.00 N ATOM 0 H ASN B 17 70.589 -10.984 -12.685 1.00 0.00 H new ATOM 0 HA ASN B 17 71.104 -8.919 -14.738 1.00 0.00 H new ATOM 0 HB2 ASN B 17 72.731 -10.454 -13.113 1.00 0.00 H new ATOM 0 HB3 ASN B 17 72.766 -11.390 -14.594 1.00 0.00 H new ATOM 0 HD21 ASN B 17 73.840 -8.093 -16.333 1.00 0.00 H new ATOM 0 HD22 ASN B 17 72.308 -8.972 -16.356 1.00 0.00 H new ATOM 1473 N ARG B 18 69.497 -11.457 -15.505 1.00 0.00 N ATOM 1474 CA ARG B 18 68.924 -12.215 -16.642 1.00 0.00 C ATOM 1475 C ARG B 18 67.978 -11.292 -17.401 1.00 0.00 C ATOM 1476 O ARG B 18 67.156 -10.623 -16.812 1.00 0.00 O ATOM 1477 CB ARG B 18 68.153 -13.427 -16.122 1.00 0.00 C ATOM 1478 CG ARG B 18 69.127 -14.578 -15.857 1.00 0.00 C ATOM 1479 CD ARG B 18 69.032 -15.000 -14.390 1.00 0.00 C ATOM 1480 NE ARG B 18 69.354 -16.454 -14.269 1.00 0.00 N ATOM 1481 CZ ARG B 18 69.063 -17.114 -13.169 1.00 0.00 C ATOM 1482 NH1 ARG B 18 68.488 -16.508 -12.158 1.00 0.00 N ATOM 1483 NH2 ARG B 18 69.349 -18.385 -13.083 1.00 0.00 N ATOM 0 H ARG B 18 68.972 -11.514 -14.632 1.00 0.00 H new ATOM 0 HA ARG B 18 69.720 -12.564 -17.299 1.00 0.00 H new ATOM 0 HB2 ARG B 18 67.622 -13.168 -15.206 1.00 0.00 H new ATOM 0 HB3 ARG B 18 67.402 -13.733 -16.850 1.00 0.00 H new ATOM 0 HG2 ARG B 18 68.893 -15.423 -16.505 1.00 0.00 H new ATOM 0 HG3 ARG B 18 70.145 -14.268 -16.092 1.00 0.00 H new ATOM 0 HD2 ARG B 18 69.723 -14.412 -13.786 1.00 0.00 H new ATOM 0 HD3 ARG B 18 68.030 -14.805 -14.009 1.00 0.00 H new ATOM 0 HE ARG B 18 69.803 -16.939 -15.046 1.00 0.00 H new ATOM 0 HH11 ARG B 18 68.262 -15.515 -12.220 1.00 0.00 H new ATOM 0 HH12 ARG B 18 68.267 -17.029 -11.310 1.00 0.00 H new ATOM 0 HH21 ARG B 18 69.796 -18.861 -13.866 1.00 0.00 H new ATOM 0 HH22 ARG B 18 69.126 -18.902 -12.232 1.00 0.00 H new ATOM 1497 N LYS B 19 68.101 -11.228 -18.697 1.00 0.00 N ATOM 1498 CA LYS B 19 67.214 -10.322 -19.483 1.00 0.00 C ATOM 1499 C LYS B 19 65.756 -10.602 -19.127 1.00 0.00 C ATOM 1500 O LYS B 19 65.118 -11.468 -19.694 1.00 0.00 O ATOM 1501 CB LYS B 19 67.435 -10.556 -20.978 1.00 0.00 C ATOM 1502 CG LYS B 19 68.922 -10.403 -21.304 1.00 0.00 C ATOM 1503 CD LYS B 19 69.094 -10.164 -22.805 1.00 0.00 C ATOM 1504 CE LYS B 19 70.569 -10.318 -23.182 1.00 0.00 C ATOM 1505 NZ LYS B 19 70.898 -11.764 -23.319 1.00 0.00 N ATOM 0 H LYS B 19 68.775 -11.762 -19.246 1.00 0.00 H new ATOM 0 HA LYS B 19 67.451 -9.285 -19.244 1.00 0.00 H new ATOM 0 HB2 LYS B 19 67.092 -11.553 -21.256 1.00 0.00 H new ATOM 0 HB3 LYS B 19 66.849 -9.844 -21.559 1.00 0.00 H new ATOM 0 HG2 LYS B 19 69.345 -9.570 -20.742 1.00 0.00 H new ATOM 0 HG3 LYS B 19 69.465 -11.299 -21.003 1.00 0.00 H new ATOM 0 HD2 LYS B 19 68.488 -10.873 -23.369 1.00 0.00 H new ATOM 0 HD3 LYS B 19 68.743 -9.166 -23.067 1.00 0.00 H new ATOM 0 HE2 LYS B 19 70.772 -9.798 -24.118 1.00 0.00 H new ATOM 0 HE3 LYS B 19 71.200 -9.861 -22.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 71.870 -11.932 -22.990 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 70.237 -12.326 -22.746 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 70.817 -12.045 -24.317 1.00 0.00 H new ATOM 1519 N ILE B 20 65.231 -9.881 -18.179 1.00 0.00 N ATOM 1520 CA ILE B 20 63.833 -10.097 -17.764 1.00 0.00 C ATOM 1521 C ILE B 20 62.899 -9.475 -18.793 1.00 0.00 C ATOM 1522 O ILE B 20 62.925 -8.288 -19.052 1.00 0.00 O ATOM 1523 CB ILE B 20 63.611 -9.472 -16.383 1.00 0.00 C ATOM 1524 CG1 ILE B 20 64.319 -10.350 -15.329 1.00 0.00 C ATOM 1525 CG2 ILE B 20 62.106 -9.389 -16.080 1.00 0.00 C ATOM 1526 CD1 ILE B 20 63.593 -10.256 -13.986 1.00 0.00 C ATOM 0 H ILE B 20 65.722 -9.144 -17.672 1.00 0.00 H new ATOM 0 HA ILE B 20 63.622 -11.165 -17.702 1.00 0.00 H new ATOM 0 HB ILE B 20 64.022 -8.463 -16.359 1.00 0.00 H new ATOM 0 HG12 ILE B 20 64.343 -11.386 -15.666 1.00 0.00 H new ATOM 0 HG13 ILE B 20 65.354 -10.029 -15.214 1.00 0.00 H new ATOM 0 HG21 ILE B 20 61.957 -8.944 -15.096 1.00 0.00 H new ATOM 0 HG22 ILE B 20 61.616 -8.774 -16.835 1.00 0.00 H new ATOM 0 HG23 ILE B 20 61.676 -10.391 -16.094 1.00 0.00 H new ATOM 0 HD11 ILE B 20 64.103 -10.880 -13.252 1.00 0.00 H new ATOM 0 HD12 ILE B 20 63.592 -9.221 -13.644 1.00 0.00 H new ATOM 0 HD13 ILE B 20 62.565 -10.600 -14.103 1.00 0.00 H new ATOM 1538 N SER B 21 62.090 -10.283 -19.380 1.00 0.00 N ATOM 1539 CA SER B 21 61.135 -9.805 -20.412 1.00 0.00 C ATOM 1540 C SER B 21 60.404 -8.540 -19.941 1.00 0.00 C ATOM 1541 O SER B 21 59.852 -8.495 -18.860 1.00 0.00 O ATOM 1542 CB SER B 21 60.111 -10.903 -20.659 1.00 0.00 C ATOM 1543 OG SER B 21 59.726 -10.896 -22.027 1.00 0.00 O ATOM 0 H SER B 21 62.042 -11.284 -19.189 1.00 0.00 H new ATOM 0 HA SER B 21 61.684 -9.567 -21.323 1.00 0.00 H new ATOM 0 HB2 SER B 21 60.532 -11.873 -20.394 1.00 0.00 H new ATOM 0 HB3 SER B 21 59.238 -10.750 -20.024 1.00 0.00 H new ATOM 0 HG SER B 21 59.068 -11.605 -22.185 1.00 0.00 H new ATOM 1549 N VAL B 22 60.365 -7.524 -20.768 1.00 0.00 N ATOM 1550 CA VAL B 22 59.635 -6.280 -20.406 1.00 0.00 C ATOM 1551 C VAL B 22 58.197 -6.635 -19.982 1.00 0.00 C ATOM 1552 O VAL B 22 57.539 -5.879 -19.296 1.00 0.00 O ATOM 1553 CB VAL B 22 59.613 -5.327 -21.637 1.00 0.00 C ATOM 1554 CG1 VAL B 22 59.482 -6.137 -22.926 1.00 0.00 C ATOM 1555 CG2 VAL B 22 58.415 -4.356 -21.551 1.00 0.00 C ATOM 0 H VAL B 22 60.813 -7.508 -21.684 1.00 0.00 H new ATOM 0 HA VAL B 22 60.135 -5.782 -19.575 1.00 0.00 H new ATOM 0 HB VAL B 22 60.545 -4.762 -21.640 1.00 0.00 H new ATOM 0 HG11 VAL B 22 59.468 -5.461 -23.781 1.00 0.00 H new ATOM 0 HG12 VAL B 22 60.329 -6.817 -23.016 1.00 0.00 H new ATOM 0 HG13 VAL B 22 58.556 -6.711 -22.902 1.00 0.00 H new ATOM 0 HG21 VAL B 22 58.417 -3.698 -22.420 1.00 0.00 H new ATOM 0 HG22 VAL B 22 57.486 -4.926 -21.529 1.00 0.00 H new ATOM 0 HG23 VAL B 22 58.496 -3.758 -20.643 1.00 0.00 H new ATOM 1565 N GLN B 23 57.709 -7.774 -20.389 1.00 0.00 N ATOM 1566 CA GLN B 23 56.343 -8.165 -20.019 1.00 0.00 C ATOM 1567 C GLN B 23 56.304 -8.445 -18.522 1.00 0.00 C ATOM 1568 O GLN B 23 55.417 -8.009 -17.816 1.00 0.00 O ATOM 1569 CB GLN B 23 55.944 -9.420 -20.839 1.00 0.00 C ATOM 1570 CG GLN B 23 55.625 -10.615 -19.921 1.00 0.00 C ATOM 1571 CD GLN B 23 55.055 -11.763 -20.755 1.00 0.00 C ATOM 1572 OE1 GLN B 23 55.769 -12.676 -21.121 1.00 0.00 O ATOM 1573 NE2 GLN B 23 53.790 -11.757 -21.073 1.00 0.00 N ATOM 0 H GLN B 23 58.211 -8.448 -20.966 1.00 0.00 H new ATOM 0 HA GLN B 23 55.633 -7.368 -20.241 1.00 0.00 H new ATOM 0 HB2 GLN B 23 55.075 -9.192 -21.456 1.00 0.00 H new ATOM 0 HB3 GLN B 23 56.755 -9.686 -21.517 1.00 0.00 H new ATOM 0 HG2 GLN B 23 56.528 -10.941 -19.404 1.00 0.00 H new ATOM 0 HG3 GLN B 23 54.909 -10.318 -19.155 1.00 0.00 H new ATOM 0 HE21 GLN B 23 53.191 -10.991 -20.766 1.00 0.00 H new ATOM 0 HE22 GLN B 23 53.400 -12.518 -21.629 1.00 0.00 H new ATOM 1582 N ARG B 24 57.259 -9.181 -18.037 1.00 0.00 N ATOM 1583 CA ARG B 24 57.279 -9.502 -16.599 1.00 0.00 C ATOM 1584 C ARG B 24 57.413 -8.229 -15.794 1.00 0.00 C ATOM 1585 O ARG B 24 57.006 -8.157 -14.656 1.00 0.00 O ATOM 1586 CB ARG B 24 58.463 -10.414 -16.288 1.00 0.00 C ATOM 1587 CG ARG B 24 58.364 -11.677 -17.130 1.00 0.00 C ATOM 1588 CD ARG B 24 57.476 -12.692 -16.418 1.00 0.00 C ATOM 1589 NE ARG B 24 58.132 -14.042 -16.441 1.00 0.00 N ATOM 1590 CZ ARG B 24 59.377 -14.195 -16.054 1.00 0.00 C ATOM 1591 NH1 ARG B 24 60.000 -13.238 -15.410 1.00 0.00 N ATOM 1592 NH2 ARG B 24 59.976 -15.340 -16.246 1.00 0.00 N ATOM 0 H ARG B 24 58.027 -9.573 -18.581 1.00 0.00 H new ATOM 0 HA ARG B 24 56.349 -10.007 -16.337 1.00 0.00 H new ATOM 0 HB2 ARG B 24 59.399 -9.897 -16.498 1.00 0.00 H new ATOM 0 HB3 ARG B 24 58.470 -10.670 -15.228 1.00 0.00 H new ATOM 0 HG2 ARG B 24 57.952 -11.442 -18.111 1.00 0.00 H new ATOM 0 HG3 ARG B 24 59.356 -12.097 -17.294 1.00 0.00 H new ATOM 0 HD2 ARG B 24 57.302 -12.379 -15.388 1.00 0.00 H new ATOM 0 HD3 ARG B 24 56.502 -12.742 -16.905 1.00 0.00 H new ATOM 0 HE ARG B 24 57.602 -14.852 -16.762 1.00 0.00 H new ATOM 0 HH11 ARG B 24 59.517 -12.363 -15.205 1.00 0.00 H new ATOM 0 HH12 ARG B 24 60.967 -13.368 -15.114 1.00 0.00 H new ATOM 0 HH21 ARG B 24 59.476 -16.108 -16.694 1.00 0.00 H new ATOM 0 HH22 ARG B 24 60.943 -15.466 -15.948 1.00 0.00 H new ATOM 1606 N LEU B 25 58.011 -7.237 -16.362 1.00 0.00 N ATOM 1607 CA LEU B 25 58.223 -5.977 -15.622 1.00 0.00 C ATOM 1608 C LEU B 25 56.935 -5.171 -15.559 1.00 0.00 C ATOM 1609 O LEU B 25 56.561 -4.495 -16.497 1.00 0.00 O ATOM 1610 CB LEU B 25 59.311 -5.170 -16.314 1.00 0.00 C ATOM 1611 CG LEU B 25 60.585 -6.020 -16.395 1.00 0.00 C ATOM 1612 CD1 LEU B 25 61.732 -5.174 -16.927 1.00 0.00 C ATOM 1613 CD2 LEU B 25 60.944 -6.541 -15.000 1.00 0.00 C ATOM 0 H LEU B 25 58.367 -7.243 -17.318 1.00 0.00 H new ATOM 0 HA LEU B 25 58.530 -6.208 -14.602 1.00 0.00 H new ATOM 0 HB2 LEU B 25 58.987 -4.880 -17.314 1.00 0.00 H new ATOM 0 HB3 LEU B 25 59.506 -4.250 -15.763 1.00 0.00 H new ATOM 0 HG LEU B 25 60.413 -6.862 -17.066 1.00 0.00 H new ATOM 0 HD11 LEU B 25 62.636 -5.781 -16.983 1.00 0.00 H new ATOM 0 HD12 LEU B 25 61.481 -4.804 -17.921 1.00 0.00 H new ATOM 0 HD13 LEU B 25 61.902 -4.330 -16.258 1.00 0.00 H new ATOM 0 HD21 LEU B 25 61.850 -7.145 -15.059 1.00 0.00 H new ATOM 0 HD22 LEU B 25 61.113 -5.699 -14.329 1.00 0.00 H new ATOM 0 HD23 LEU B 25 60.126 -7.151 -14.618 1.00 0.00 H new ATOM 1625 N ALA B 26 56.257 -5.234 -14.452 1.00 0.00 N ATOM 1626 CA ALA B 26 54.995 -4.474 -14.305 1.00 0.00 C ATOM 1627 C ALA B 26 55.302 -3.006 -13.987 1.00 0.00 C ATOM 1628 O ALA B 26 54.475 -2.135 -14.170 1.00 0.00 O ATOM 1629 CB ALA B 26 54.176 -5.066 -13.161 1.00 0.00 C ATOM 0 H ALA B 26 56.527 -5.785 -13.637 1.00 0.00 H new ATOM 0 HA ALA B 26 54.434 -4.535 -15.237 1.00 0.00 H new ATOM 0 HB1 ALA B 26 53.247 -4.507 -13.052 1.00 0.00 H new ATOM 0 HB2 ALA B 26 53.949 -6.110 -13.378 1.00 0.00 H new ATOM 0 HB3 ALA B 26 54.747 -5.005 -12.235 1.00 0.00 H new ATOM 1635 N SER B 27 56.476 -2.730 -13.492 1.00 0.00 N ATOM 1636 CA SER B 27 56.829 -1.321 -13.140 1.00 0.00 C ATOM 1637 C SER B 27 58.313 -1.243 -12.768 1.00 0.00 C ATOM 1638 O SER B 27 59.023 -2.228 -12.815 1.00 0.00 O ATOM 1639 CB SER B 27 55.982 -0.865 -11.951 1.00 0.00 C ATOM 1640 OG SER B 27 55.172 0.235 -12.344 1.00 0.00 O ATOM 0 H SER B 27 57.208 -3.417 -13.315 1.00 0.00 H new ATOM 0 HA SER B 27 56.634 -0.674 -13.995 1.00 0.00 H new ATOM 0 HB2 SER B 27 55.356 -1.685 -11.600 1.00 0.00 H new ATOM 0 HB3 SER B 27 56.626 -0.578 -11.120 1.00 0.00 H new ATOM 0 HG SER B 27 54.588 -0.036 -13.083 1.00 0.00 H new ATOM 1646 N TYR B 28 58.794 -0.077 -12.414 1.00 0.00 N ATOM 1647 CA TYR B 28 60.237 0.049 -12.065 1.00 0.00 C ATOM 1648 C TYR B 28 60.434 1.208 -11.060 1.00 0.00 C ATOM 1649 O TYR B 28 59.724 2.195 -11.089 1.00 0.00 O ATOM 1650 CB TYR B 28 61.036 0.281 -13.378 1.00 0.00 C ATOM 1651 CG TYR B 28 61.810 1.580 -13.355 1.00 0.00 C ATOM 1652 CD1 TYR B 28 61.126 2.812 -13.396 1.00 0.00 C ATOM 1653 CD2 TYR B 28 63.221 1.554 -13.323 1.00 0.00 C ATOM 1654 CE1 TYR B 28 61.850 4.020 -13.400 1.00 0.00 C ATOM 1655 CE2 TYR B 28 63.947 2.760 -13.331 1.00 0.00 C ATOM 1656 CZ TYR B 28 63.264 3.997 -13.369 1.00 0.00 C ATOM 1657 OH TYR B 28 63.975 5.180 -13.377 1.00 0.00 O ATOM 0 H TYR B 28 58.252 0.785 -12.353 1.00 0.00 H new ATOM 0 HA TYR B 28 60.602 -0.860 -11.586 1.00 0.00 H new ATOM 0 HB2 TYR B 28 61.726 -0.548 -13.532 1.00 0.00 H new ATOM 0 HB3 TYR B 28 60.348 0.285 -14.224 1.00 0.00 H new ATOM 0 HD1 TYR B 28 60.047 2.829 -13.424 1.00 0.00 H new ATOM 0 HD2 TYR B 28 63.743 0.609 -13.292 1.00 0.00 H new ATOM 0 HE1 TYR B 28 61.326 4.964 -13.427 1.00 0.00 H new ATOM 0 HE2 TYR B 28 65.027 2.740 -13.308 1.00 0.00 H new ATOM 0 HH TYR B 28 63.448 5.882 -12.941 1.00 0.00 H new ATOM 1667 N ARG B 29 61.399 1.088 -10.181 1.00 0.00 N ATOM 1668 CA ARG B 29 61.649 2.175 -9.184 1.00 0.00 C ATOM 1669 C ARG B 29 63.160 2.367 -9.011 1.00 0.00 C ATOM 1670 O ARG B 29 63.760 1.857 -8.086 1.00 0.00 O ATOM 1671 CB ARG B 29 61.027 1.793 -7.842 1.00 0.00 C ATOM 1672 CG ARG B 29 59.960 2.821 -7.462 1.00 0.00 C ATOM 1673 CD ARG B 29 58.795 2.115 -6.768 1.00 0.00 C ATOM 1674 NE ARG B 29 57.629 3.046 -6.680 1.00 0.00 N ATOM 1675 CZ ARG B 29 56.621 2.781 -5.880 1.00 0.00 C ATOM 1676 NH1 ARG B 29 56.619 1.695 -5.144 1.00 0.00 N ATOM 1677 NH2 ARG B 29 55.611 3.605 -5.816 1.00 0.00 N ATOM 0 H ARG B 29 62.024 0.285 -10.111 1.00 0.00 H new ATOM 0 HA ARG B 29 61.200 3.103 -9.538 1.00 0.00 H new ATOM 0 HB2 ARG B 29 60.584 0.799 -7.905 1.00 0.00 H new ATOM 0 HB3 ARG B 29 61.797 1.751 -7.071 1.00 0.00 H new ATOM 0 HG2 ARG B 29 60.386 3.576 -6.802 1.00 0.00 H new ATOM 0 HG3 ARG B 29 59.606 3.340 -8.353 1.00 0.00 H new ATOM 0 HD2 ARG B 29 58.517 1.218 -7.322 1.00 0.00 H new ATOM 0 HD3 ARG B 29 59.093 1.793 -5.770 1.00 0.00 H new ATOM 0 HE ARG B 29 57.616 3.894 -7.246 1.00 0.00 H new ATOM 0 HH11 ARG B 29 57.405 1.047 -5.189 1.00 0.00 H new ATOM 0 HH12 ARG B 29 55.831 1.499 -4.526 1.00 0.00 H new ATOM 0 HH21 ARG B 29 55.606 4.451 -6.386 1.00 0.00 H new ATOM 0 HH22 ARG B 29 54.826 3.403 -5.196 1.00 0.00 H new ATOM 1691 N ARG B 30 63.775 3.090 -9.903 1.00 0.00 N ATOM 1692 CA ARG B 30 65.253 3.307 -9.817 1.00 0.00 C ATOM 1693 C ARG B 30 65.653 3.744 -8.403 1.00 0.00 C ATOM 1694 O ARG B 30 65.537 4.899 -8.043 1.00 0.00 O ATOM 1695 CB ARG B 30 65.662 4.393 -10.814 1.00 0.00 C ATOM 1696 CG ARG B 30 67.152 4.260 -11.130 1.00 0.00 C ATOM 1697 CD ARG B 30 67.527 5.240 -12.244 1.00 0.00 C ATOM 1698 NE ARG B 30 68.470 6.265 -11.708 1.00 0.00 N ATOM 1699 CZ ARG B 30 68.709 7.370 -12.381 1.00 0.00 C ATOM 1700 NH1 ARG B 30 68.122 7.590 -13.534 1.00 0.00 N ATOM 1701 NH2 ARG B 30 69.535 8.256 -11.897 1.00 0.00 N ATOM 0 H ARG B 30 63.319 3.544 -10.694 1.00 0.00 H new ATOM 0 HA ARG B 30 65.759 2.371 -10.052 1.00 0.00 H new ATOM 0 HB2 ARG B 30 65.076 4.302 -11.728 1.00 0.00 H new ATOM 0 HB3 ARG B 30 65.454 5.379 -10.399 1.00 0.00 H new ATOM 0 HG2 ARG B 30 67.744 4.464 -10.237 1.00 0.00 H new ATOM 0 HG3 ARG B 30 67.380 3.239 -11.437 1.00 0.00 H new ATOM 0 HD2 ARG B 30 67.988 4.705 -13.074 1.00 0.00 H new ATOM 0 HD3 ARG B 30 66.631 5.723 -12.635 1.00 0.00 H new ATOM 0 HE ARG B 30 68.933 6.108 -10.813 1.00 0.00 H new ATOM 0 HH11 ARG B 30 67.474 6.901 -13.916 1.00 0.00 H new ATOM 0 HH12 ARG B 30 68.314 8.450 -14.048 1.00 0.00 H new ATOM 0 HH21 ARG B 30 69.992 8.091 -11.000 1.00 0.00 H new ATOM 0 HH22 ARG B 30 69.723 9.114 -12.415 1.00 0.00 H new ATOM 1715 N ILE B 31 66.159 2.833 -7.607 1.00 0.00 N ATOM 1716 CA ILE B 31 66.604 3.208 -6.234 1.00 0.00 C ATOM 1717 C ILE B 31 67.808 4.151 -6.345 1.00 0.00 C ATOM 1718 O ILE B 31 68.478 4.199 -7.353 1.00 0.00 O ATOM 1719 CB ILE B 31 67.005 1.931 -5.451 1.00 0.00 C ATOM 1720 CG1 ILE B 31 65.757 1.304 -4.830 1.00 0.00 C ATOM 1721 CG2 ILE B 31 68.002 2.280 -4.327 1.00 0.00 C ATOM 1722 CD1 ILE B 31 66.104 -0.081 -4.277 1.00 0.00 C ATOM 0 H ILE B 31 66.282 1.850 -7.850 1.00 0.00 H new ATOM 0 HA ILE B 31 65.794 3.708 -5.703 1.00 0.00 H new ATOM 0 HB ILE B 31 67.475 1.230 -6.141 1.00 0.00 H new ATOM 0 HG12 ILE B 31 65.375 1.941 -4.032 1.00 0.00 H new ATOM 0 HG13 ILE B 31 64.968 1.222 -5.577 1.00 0.00 H new ATOM 0 HG21 ILE B 31 68.274 1.373 -3.787 1.00 0.00 H new ATOM 0 HG22 ILE B 31 68.897 2.726 -4.760 1.00 0.00 H new ATOM 0 HG23 ILE B 31 67.541 2.988 -3.638 1.00 0.00 H new ATOM 0 HD11 ILE B 31 65.215 -0.529 -3.834 1.00 0.00 H new ATOM 0 HD12 ILE B 31 66.465 -0.716 -5.086 1.00 0.00 H new ATOM 0 HD13 ILE B 31 66.879 0.015 -3.517 1.00 0.00 H new ATOM 1734 N THR B 32 68.092 4.875 -5.300 1.00 0.00 N ATOM 1735 CA THR B 32 69.262 5.800 -5.310 1.00 0.00 C ATOM 1736 C THR B 32 69.222 6.661 -4.047 1.00 0.00 C ATOM 1737 O THR B 32 69.515 7.840 -4.076 1.00 0.00 O ATOM 1738 CB THR B 32 69.208 6.704 -6.545 1.00 0.00 C ATOM 1739 OG1 THR B 32 67.886 6.720 -7.066 1.00 0.00 O ATOM 1740 CG2 THR B 32 70.175 6.180 -7.610 1.00 0.00 C ATOM 0 H THR B 32 67.559 4.866 -4.430 1.00 0.00 H new ATOM 0 HA THR B 32 70.184 5.219 -5.339 1.00 0.00 H new ATOM 0 HB THR B 32 69.498 7.717 -6.264 1.00 0.00 H new ATOM 0 HG1 THR B 32 67.852 7.300 -7.855 1.00 0.00 H new ATOM 0 HG21 THR B 32 70.134 6.825 -8.488 1.00 0.00 H new ATOM 0 HG22 THR B 32 71.189 6.175 -7.210 1.00 0.00 H new ATOM 0 HG23 THR B 32 69.891 5.166 -7.892 1.00 0.00 H new ATOM 1748 N SER B 33 68.855 6.079 -2.936 1.00 0.00 N ATOM 1749 CA SER B 33 68.787 6.859 -1.670 1.00 0.00 C ATOM 1750 C SER B 33 70.132 7.539 -1.416 1.00 0.00 C ATOM 1751 O SER B 33 71.045 7.445 -2.213 1.00 0.00 O ATOM 1752 CB SER B 33 68.460 5.916 -0.508 1.00 0.00 C ATOM 1753 OG SER B 33 68.072 6.681 0.625 1.00 0.00 O ATOM 0 H SER B 33 68.599 5.095 -2.853 1.00 0.00 H new ATOM 0 HA SER B 33 68.009 7.618 -1.751 1.00 0.00 H new ATOM 0 HB2 SER B 33 67.658 5.235 -0.793 1.00 0.00 H new ATOM 0 HB3 SER B 33 69.329 5.303 -0.267 1.00 0.00 H new ATOM 0 HG SER B 33 67.247 6.311 1.003 1.00 0.00 H new ATOM 1759 N SER B 34 70.261 8.228 -0.318 1.00 0.00 N ATOM 1760 CA SER B 34 71.545 8.920 -0.020 1.00 0.00 C ATOM 1761 C SER B 34 72.465 7.993 0.784 1.00 0.00 C ATOM 1762 O SER B 34 73.617 8.302 1.014 1.00 0.00 O ATOM 1763 CB SER B 34 71.264 10.186 0.790 1.00 0.00 C ATOM 1764 OG SER B 34 70.495 11.087 0.003 1.00 0.00 O ATOM 0 H SER B 34 69.532 8.342 0.387 1.00 0.00 H new ATOM 0 HA SER B 34 72.035 9.185 -0.957 1.00 0.00 H new ATOM 0 HB2 SER B 34 70.727 9.935 1.705 1.00 0.00 H new ATOM 0 HB3 SER B 34 72.201 10.655 1.089 1.00 0.00 H new ATOM 0 HG SER B 34 70.312 11.899 0.520 1.00 0.00 H new ATOM 1770 N LYS B 35 71.973 6.860 1.215 1.00 0.00 N ATOM 1771 CA LYS B 35 72.836 5.934 2.002 1.00 0.00 C ATOM 1772 C LYS B 35 72.980 4.591 1.268 1.00 0.00 C ATOM 1773 O LYS B 35 73.752 3.742 1.668 1.00 0.00 O ATOM 1774 CB LYS B 35 72.215 5.690 3.380 1.00 0.00 C ATOM 1775 CG LYS B 35 72.027 7.012 4.123 1.00 0.00 C ATOM 1776 CD LYS B 35 73.358 7.762 4.190 1.00 0.00 C ATOM 1777 CE LYS B 35 74.401 6.892 4.897 1.00 0.00 C ATOM 1778 NZ LYS B 35 75.451 6.485 3.922 1.00 0.00 N ATOM 0 H LYS B 35 71.018 6.539 1.057 1.00 0.00 H new ATOM 0 HA LYS B 35 73.820 6.389 2.118 1.00 0.00 H new ATOM 0 HB2 LYS B 35 71.254 5.189 3.269 1.00 0.00 H new ATOM 0 HB3 LYS B 35 72.855 5.027 3.962 1.00 0.00 H new ATOM 0 HG2 LYS B 35 71.280 7.622 3.615 1.00 0.00 H new ATOM 0 HG3 LYS B 35 71.654 6.824 5.130 1.00 0.00 H new ATOM 0 HD2 LYS B 35 73.698 8.011 3.185 1.00 0.00 H new ATOM 0 HD3 LYS B 35 73.231 8.703 4.726 1.00 0.00 H new ATOM 0 HE2 LYS B 35 74.851 7.443 5.723 1.00 0.00 H new ATOM 0 HE3 LYS B 35 73.925 6.010 5.324 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 76.357 6.361 4.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 75.178 5.588 3.472 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 75.553 7.221 3.194 1.00 0.00 H new ATOM 1792 N CYS B 36 72.245 4.381 0.205 1.00 0.00 N ATOM 1793 CA CYS B 36 72.358 3.082 -0.527 1.00 0.00 C ATOM 1794 C CYS B 36 73.779 2.931 -1.086 1.00 0.00 C ATOM 1795 O CYS B 36 74.244 3.782 -1.816 1.00 0.00 O ATOM 1796 CB CYS B 36 71.356 3.044 -1.688 1.00 0.00 C ATOM 1797 SG CYS B 36 69.665 2.870 -1.052 1.00 0.00 S ATOM 0 H CYS B 36 71.577 5.046 -0.185 1.00 0.00 H new ATOM 0 HA CYS B 36 72.142 2.267 0.164 1.00 0.00 H new ATOM 0 HB2 CYS B 36 71.438 3.956 -2.279 1.00 0.00 H new ATOM 0 HB3 CYS B 36 71.590 2.212 -2.352 1.00 0.00 H new ATOM 1802 N PRO B 37 74.431 1.833 -0.736 1.00 0.00 N ATOM 1803 CA PRO B 37 75.781 1.563 -1.212 1.00 0.00 C ATOM 1804 C PRO B 37 75.791 1.456 -2.734 1.00 0.00 C ATOM 1805 O PRO B 37 76.812 1.621 -3.372 1.00 0.00 O ATOM 1806 CB PRO B 37 76.161 0.213 -0.585 1.00 0.00 C ATOM 1807 CG PRO B 37 74.951 -0.266 0.271 1.00 0.00 C ATOM 1808 CD PRO B 37 73.863 0.807 0.153 1.00 0.00 C ATOM 0 HA PRO B 37 76.479 2.355 -0.940 1.00 0.00 H new ATOM 0 HB2 PRO B 37 76.395 -0.517 -1.360 1.00 0.00 H new ATOM 0 HB3 PRO B 37 77.052 0.316 0.035 1.00 0.00 H new ATOM 0 HG2 PRO B 37 74.584 -1.228 -0.086 1.00 0.00 H new ATOM 0 HG3 PRO B 37 75.245 -0.403 1.311 1.00 0.00 H new ATOM 0 HD2 PRO B 37 72.944 0.392 -0.260 1.00 0.00 H new ATOM 0 HD3 PRO B 37 73.614 1.225 1.128 1.00 0.00 H new ATOM 1816 N LYS B 38 74.669 1.160 -3.317 1.00 0.00 N ATOM 1817 CA LYS B 38 74.615 1.018 -4.790 1.00 0.00 C ATOM 1818 C LYS B 38 73.217 1.368 -5.306 1.00 0.00 C ATOM 1819 O LYS B 38 72.220 0.910 -4.784 1.00 0.00 O ATOM 1820 CB LYS B 38 74.936 -0.430 -5.162 1.00 0.00 C ATOM 1821 CG LYS B 38 76.451 -0.628 -5.201 1.00 0.00 C ATOM 1822 CD LYS B 38 76.831 -1.401 -6.465 1.00 0.00 C ATOM 1823 CE LYS B 38 78.355 -1.435 -6.603 1.00 0.00 C ATOM 1824 NZ LYS B 38 78.930 -2.309 -5.542 1.00 0.00 N ATOM 0 H LYS B 38 73.784 1.010 -2.833 1.00 0.00 H new ATOM 0 HA LYS B 38 75.341 1.695 -5.241 1.00 0.00 H new ATOM 0 HB2 LYS B 38 74.489 -1.110 -4.436 1.00 0.00 H new ATOM 0 HB3 LYS B 38 74.503 -0.671 -6.133 1.00 0.00 H new ATOM 0 HG2 LYS B 38 76.955 0.338 -5.187 1.00 0.00 H new ATOM 0 HG3 LYS B 38 76.780 -1.172 -4.316 1.00 0.00 H new ATOM 0 HD2 LYS B 38 76.437 -2.416 -6.416 1.00 0.00 H new ATOM 0 HD3 LYS B 38 76.386 -0.928 -7.341 1.00 0.00 H new ATOM 0 HE2 LYS B 38 78.633 -1.809 -7.588 1.00 0.00 H new ATOM 0 HE3 LYS B 38 78.761 -0.427 -6.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 79.943 -2.456 -5.725 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 78.807 -1.855 -4.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 78.441 -3.227 -5.546 1.00 0.00 H new ATOM 1838 N GLU B 39 73.136 2.141 -6.359 1.00 0.00 N ATOM 1839 CA GLU B 39 71.802 2.469 -6.938 1.00 0.00 C ATOM 1840 C GLU B 39 71.182 1.176 -7.472 1.00 0.00 C ATOM 1841 O GLU B 39 71.728 0.105 -7.297 1.00 0.00 O ATOM 1842 CB GLU B 39 71.970 3.473 -8.081 1.00 0.00 C ATOM 1843 CG GLU B 39 72.848 2.862 -9.173 1.00 0.00 C ATOM 1844 CD GLU B 39 74.150 3.658 -9.285 1.00 0.00 C ATOM 1845 OE1 GLU B 39 74.595 4.174 -8.272 1.00 0.00 O ATOM 1846 OE2 GLU B 39 74.681 3.740 -10.380 1.00 0.00 O ATOM 0 H GLU B 39 73.934 2.557 -6.840 1.00 0.00 H new ATOM 0 HA GLU B 39 71.157 2.909 -6.177 1.00 0.00 H new ATOM 0 HB2 GLU B 39 70.996 3.740 -8.490 1.00 0.00 H new ATOM 0 HB3 GLU B 39 72.422 4.392 -7.708 1.00 0.00 H new ATOM 0 HG2 GLU B 39 73.065 1.820 -8.939 1.00 0.00 H new ATOM 0 HG3 GLU B 39 72.320 2.871 -10.127 1.00 0.00 H new ATOM 1853 N ALA B 40 70.050 1.253 -8.117 1.00 0.00 N ATOM 1854 CA ALA B 40 69.421 0.005 -8.643 1.00 0.00 C ATOM 1855 C ALA B 40 68.108 0.329 -9.346 1.00 0.00 C ATOM 1856 O ALA B 40 67.706 1.469 -9.451 1.00 0.00 O ATOM 1857 CB ALA B 40 69.130 -0.942 -7.475 1.00 0.00 C ATOM 0 H ALA B 40 69.537 2.115 -8.302 1.00 0.00 H new ATOM 0 HA ALA B 40 70.105 -0.462 -9.352 1.00 0.00 H new ATOM 0 HB1 ALA B 40 68.670 -1.855 -7.853 1.00 0.00 H new ATOM 0 HB2 ALA B 40 70.062 -1.188 -6.966 1.00 0.00 H new ATOM 0 HB3 ALA B 40 68.450 -0.457 -6.774 1.00 0.00 H new ATOM 1863 N VAL B 41 67.418 -0.683 -9.788 1.00 0.00 N ATOM 1864 CA VAL B 41 66.098 -0.474 -10.435 1.00 0.00 C ATOM 1865 C VAL B 41 65.133 -1.479 -9.863 1.00 0.00 C ATOM 1866 O VAL B 41 65.252 -2.663 -10.094 1.00 0.00 O ATOM 1867 CB VAL B 41 66.204 -0.673 -11.961 1.00 0.00 C ATOM 1868 CG1 VAL B 41 64.927 -1.348 -12.505 1.00 0.00 C ATOM 1869 CG2 VAL B 41 66.358 0.679 -12.628 1.00 0.00 C ATOM 0 H VAL B 41 67.717 -1.656 -9.727 1.00 0.00 H new ATOM 0 HA VAL B 41 65.754 0.543 -10.246 1.00 0.00 H new ATOM 0 HB VAL B 41 67.065 -1.306 -12.174 1.00 0.00 H new ATOM 0 HG11 VAL B 41 65.017 -1.482 -13.583 1.00 0.00 H new ATOM 0 HG12 VAL B 41 64.798 -2.320 -12.028 1.00 0.00 H new ATOM 0 HG13 VAL B 41 64.063 -0.720 -12.288 1.00 0.00 H new ATOM 0 HG21 VAL B 41 66.434 0.546 -13.707 1.00 0.00 H new ATOM 0 HG22 VAL B 41 65.491 1.299 -12.399 1.00 0.00 H new ATOM 0 HG23 VAL B 41 67.260 1.166 -12.259 1.00 0.00 H new ATOM 1879 N ILE B 42 64.170 -1.033 -9.151 1.00 0.00 N ATOM 1880 CA ILE B 42 63.207 -1.974 -8.596 1.00 0.00 C ATOM 1881 C ILE B 42 62.186 -2.341 -9.661 1.00 0.00 C ATOM 1882 O ILE B 42 61.113 -1.782 -9.734 1.00 0.00 O ATOM 1883 CB ILE B 42 62.536 -1.356 -7.397 1.00 0.00 C ATOM 1884 CG1 ILE B 42 63.625 -1.065 -6.344 1.00 0.00 C ATOM 1885 CG2 ILE B 42 61.504 -2.341 -6.861 1.00 0.00 C ATOM 1886 CD1 ILE B 42 63.016 -0.920 -4.954 1.00 0.00 C ATOM 0 H ILE B 42 64.007 -0.051 -8.928 1.00 0.00 H new ATOM 0 HA ILE B 42 63.716 -2.884 -8.277 1.00 0.00 H new ATOM 0 HB ILE B 42 62.028 -0.426 -7.653 1.00 0.00 H new ATOM 0 HG12 ILE B 42 64.358 -1.872 -6.341 1.00 0.00 H new ATOM 0 HG13 ILE B 42 64.157 -0.151 -6.609 1.00 0.00 H new ATOM 0 HG21 ILE B 42 61.007 -1.910 -5.992 1.00 0.00 H new ATOM 0 HG22 ILE B 42 60.765 -2.551 -7.634 1.00 0.00 H new ATOM 0 HG23 ILE B 42 62.001 -3.268 -6.573 1.00 0.00 H new ATOM 0 HD11 ILE B 42 63.805 -0.715 -4.231 1.00 0.00 H new ATOM 0 HD12 ILE B 42 62.301 -0.097 -4.954 1.00 0.00 H new ATOM 0 HD13 ILE B 42 62.505 -1.844 -4.682 1.00 0.00 H new ATOM 1898 N PHE B 43 62.529 -3.285 -10.485 1.00 0.00 N ATOM 1899 CA PHE B 43 61.611 -3.722 -11.564 1.00 0.00 C ATOM 1900 C PHE B 43 60.429 -4.484 -10.952 1.00 0.00 C ATOM 1901 O PHE B 43 60.428 -5.698 -10.902 1.00 0.00 O ATOM 1902 CB PHE B 43 62.364 -4.663 -12.512 1.00 0.00 C ATOM 1903 CG PHE B 43 63.134 -3.871 -13.548 1.00 0.00 C ATOM 1904 CD1 PHE B 43 62.539 -2.761 -14.194 1.00 0.00 C ATOM 1905 CD2 PHE B 43 64.452 -4.257 -13.885 1.00 0.00 C ATOM 1906 CE1 PHE B 43 63.268 -2.041 -15.171 1.00 0.00 C ATOM 1907 CE2 PHE B 43 65.172 -3.538 -14.864 1.00 0.00 C ATOM 1908 CZ PHE B 43 64.579 -2.431 -15.506 1.00 0.00 C ATOM 0 H PHE B 43 63.421 -3.779 -10.455 1.00 0.00 H new ATOM 0 HA PHE B 43 61.248 -2.850 -12.108 1.00 0.00 H new ATOM 0 HB2 PHE B 43 63.050 -5.290 -11.942 1.00 0.00 H new ATOM 0 HB3 PHE B 43 61.659 -5.330 -13.007 1.00 0.00 H new ATOM 0 HD1 PHE B 43 61.532 -2.464 -13.942 1.00 0.00 H new ATOM 0 HD2 PHE B 43 64.909 -5.103 -13.393 1.00 0.00 H new ATOM 0 HE1 PHE B 43 62.817 -1.190 -15.661 1.00 0.00 H new ATOM 0 HE2 PHE B 43 66.178 -3.836 -15.121 1.00 0.00 H new ATOM 0 HZ PHE B 43 65.131 -1.882 -16.255 1.00 0.00 H new ATOM 1918 N LYS B 44 59.418 -3.795 -10.494 1.00 0.00 N ATOM 1919 CA LYS B 44 58.251 -4.510 -9.904 1.00 0.00 C ATOM 1920 C LYS B 44 57.667 -5.435 -10.959 1.00 0.00 C ATOM 1921 O LYS B 44 56.937 -5.008 -11.825 1.00 0.00 O ATOM 1922 CB LYS B 44 57.183 -3.499 -9.476 1.00 0.00 C ATOM 1923 CG LYS B 44 56.967 -3.592 -7.965 1.00 0.00 C ATOM 1924 CD LYS B 44 55.469 -3.546 -7.658 1.00 0.00 C ATOM 1925 CE LYS B 44 55.257 -3.080 -6.217 1.00 0.00 C ATOM 1926 NZ LYS B 44 54.561 -1.761 -6.218 1.00 0.00 N ATOM 0 H LYS B 44 59.350 -2.777 -10.503 1.00 0.00 H new ATOM 0 HA LYS B 44 58.572 -5.081 -9.033 1.00 0.00 H new ATOM 0 HB2 LYS B 44 57.493 -2.490 -9.748 1.00 0.00 H new ATOM 0 HB3 LYS B 44 56.248 -3.698 -10.000 1.00 0.00 H new ATOM 0 HG2 LYS B 44 57.399 -4.516 -7.582 1.00 0.00 H new ATOM 0 HG3 LYS B 44 57.477 -2.770 -7.463 1.00 0.00 H new ATOM 0 HD2 LYS B 44 54.966 -2.868 -8.348 1.00 0.00 H new ATOM 0 HD3 LYS B 44 55.027 -4.532 -7.801 1.00 0.00 H new ATOM 0 HE2 LYS B 44 54.666 -3.814 -5.669 1.00 0.00 H new ATOM 0 HE3 LYS B 44 56.216 -2.997 -5.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 54.417 -1.444 -5.238 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 55.141 -1.063 -6.726 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 53.639 -1.855 -6.691 1.00 0.00 H new ATOM 1940 N THR B 45 58.004 -6.693 -10.915 1.00 0.00 N ATOM 1941 CA THR B 45 57.488 -7.637 -11.943 1.00 0.00 C ATOM 1942 C THR B 45 55.944 -7.665 -11.902 1.00 0.00 C ATOM 1943 O THR B 45 55.315 -6.730 -11.456 1.00 0.00 O ATOM 1944 CB THR B 45 58.062 -9.031 -11.679 1.00 0.00 C ATOM 1945 OG1 THR B 45 58.032 -9.302 -10.288 1.00 0.00 O ATOM 1946 CG2 THR B 45 59.504 -9.074 -12.180 1.00 0.00 C ATOM 0 H THR B 45 58.615 -7.108 -10.211 1.00 0.00 H new ATOM 0 HA THR B 45 57.798 -7.309 -12.935 1.00 0.00 H new ATOM 0 HB THR B 45 57.467 -9.781 -12.201 1.00 0.00 H new ATOM 0 HG1 THR B 45 58.866 -8.992 -9.876 1.00 0.00 H new ATOM 0 HG21 THR B 45 59.923 -10.063 -11.997 1.00 0.00 H new ATOM 0 HG22 THR B 45 59.524 -8.864 -13.249 1.00 0.00 H new ATOM 0 HG23 THR B 45 60.095 -8.326 -11.652 1.00 0.00 H new ATOM 1954 N ILE B 46 55.331 -8.728 -12.362 1.00 0.00 N ATOM 1955 CA ILE B 46 53.838 -8.790 -12.354 1.00 0.00 C ATOM 1956 C ILE B 46 53.377 -9.412 -11.076 1.00 0.00 C ATOM 1957 O ILE B 46 52.302 -9.130 -10.582 1.00 0.00 O ATOM 1958 CB ILE B 46 53.331 -9.647 -13.516 1.00 0.00 C ATOM 1959 CG1 ILE B 46 54.108 -10.993 -13.558 1.00 0.00 C ATOM 1960 CG2 ILE B 46 53.492 -8.883 -14.844 1.00 0.00 C ATOM 1961 CD1 ILE B 46 55.327 -10.897 -14.486 1.00 0.00 C ATOM 0 H ILE B 46 55.798 -9.552 -12.741 1.00 0.00 H new ATOM 0 HA ILE B 46 53.449 -7.777 -12.452 1.00 0.00 H new ATOM 0 HB ILE B 46 52.273 -9.862 -13.369 1.00 0.00 H new ATOM 0 HG12 ILE B 46 54.432 -11.261 -12.553 1.00 0.00 H new ATOM 0 HG13 ILE B 46 53.447 -11.788 -13.902 1.00 0.00 H new ATOM 0 HG21 ILE B 46 53.129 -9.501 -15.665 1.00 0.00 H new ATOM 0 HG22 ILE B 46 52.917 -7.958 -14.804 1.00 0.00 H new ATOM 0 HG23 ILE B 46 54.545 -8.649 -15.004 1.00 0.00 H new ATOM 0 HD11 ILE B 46 55.852 -11.852 -14.497 1.00 0.00 H new ATOM 0 HD12 ILE B 46 54.997 -10.653 -15.496 1.00 0.00 H new ATOM 0 HD13 ILE B 46 55.998 -10.118 -14.125 1.00 0.00 H new ATOM 1973 N VAL B 47 54.171 -10.253 -10.525 1.00 0.00 N ATOM 1974 CA VAL B 47 53.791 -10.893 -9.275 1.00 0.00 C ATOM 1975 C VAL B 47 54.269 -10.023 -8.112 1.00 0.00 C ATOM 1976 O VAL B 47 54.338 -10.459 -6.980 1.00 0.00 O ATOM 1977 CB VAL B 47 54.426 -12.273 -9.227 1.00 0.00 C ATOM 1978 CG1 VAL B 47 55.928 -12.163 -8.948 1.00 0.00 C ATOM 1979 CG2 VAL B 47 53.757 -13.084 -8.143 1.00 0.00 C ATOM 0 H VAL B 47 55.081 -10.526 -10.896 1.00 0.00 H new ATOM 0 HA VAL B 47 52.709 -11.003 -9.202 1.00 0.00 H new ATOM 0 HB VAL B 47 54.293 -12.764 -10.191 1.00 0.00 H new ATOM 0 HG11 VAL B 47 56.366 -13.161 -8.917 1.00 0.00 H new ATOM 0 HG12 VAL B 47 56.403 -11.582 -9.738 1.00 0.00 H new ATOM 0 HG13 VAL B 47 56.085 -11.668 -7.990 1.00 0.00 H new ATOM 0 HG21 VAL B 47 54.206 -14.076 -8.101 1.00 0.00 H new ATOM 0 HG22 VAL B 47 53.888 -12.586 -7.182 1.00 0.00 H new ATOM 0 HG23 VAL B 47 52.693 -13.176 -8.362 1.00 0.00 H new ATOM 1989 N ALA B 48 54.584 -8.778 -8.389 1.00 0.00 N ATOM 1990 CA ALA B 48 55.036 -7.866 -7.322 1.00 0.00 C ATOM 1991 C ALA B 48 56.423 -8.287 -6.838 1.00 0.00 C ATOM 1992 O ALA B 48 56.872 -7.876 -5.788 1.00 0.00 O ATOM 1993 CB ALA B 48 54.046 -7.919 -6.173 1.00 0.00 C ATOM 0 H ALA B 48 54.542 -8.364 -9.320 1.00 0.00 H new ATOM 0 HA ALA B 48 55.092 -6.847 -7.706 1.00 0.00 H new ATOM 0 HB1 ALA B 48 54.373 -7.247 -5.380 1.00 0.00 H new ATOM 0 HB2 ALA B 48 53.062 -7.611 -6.526 1.00 0.00 H new ATOM 0 HB3 ALA B 48 53.991 -8.937 -5.787 1.00 0.00 H new ATOM 1999 N LYS B 49 57.116 -9.084 -7.607 1.00 0.00 N ATOM 2000 CA LYS B 49 58.484 -9.500 -7.202 1.00 0.00 C ATOM 2001 C LYS B 49 59.451 -8.358 -7.494 1.00 0.00 C ATOM 2002 O LYS B 49 60.106 -8.329 -8.516 1.00 0.00 O ATOM 2003 CB LYS B 49 58.899 -10.741 -7.986 1.00 0.00 C ATOM 2004 CG LYS B 49 59.210 -11.880 -7.013 1.00 0.00 C ATOM 2005 CD LYS B 49 59.140 -13.217 -7.754 1.00 0.00 C ATOM 2006 CE LYS B 49 60.304 -13.315 -8.740 1.00 0.00 C ATOM 2007 NZ LYS B 49 60.218 -14.604 -9.484 1.00 0.00 N ATOM 0 H LYS B 49 56.792 -9.463 -8.497 1.00 0.00 H new ATOM 0 HA LYS B 49 58.499 -9.734 -6.138 1.00 0.00 H new ATOM 0 HB2 LYS B 49 58.101 -11.038 -8.667 1.00 0.00 H new ATOM 0 HB3 LYS B 49 59.774 -10.522 -8.597 1.00 0.00 H new ATOM 0 HG2 LYS B 49 60.201 -11.743 -6.581 1.00 0.00 H new ATOM 0 HG3 LYS B 49 58.498 -11.872 -6.187 1.00 0.00 H new ATOM 0 HD2 LYS B 49 59.182 -14.042 -7.043 1.00 0.00 H new ATOM 0 HD3 LYS B 49 58.192 -13.302 -8.285 1.00 0.00 H new ATOM 0 HE2 LYS B 49 60.275 -12.478 -9.437 1.00 0.00 H new ATOM 0 HE3 LYS B 49 61.253 -13.253 -8.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 61.010 -14.671 -10.155 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 60.265 -15.396 -8.812 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 59.319 -14.645 -10.005 1.00 0.00 H new ATOM 2021 N GLU B 50 59.533 -7.408 -6.607 1.00 0.00 N ATOM 2022 CA GLU B 50 60.442 -6.253 -6.828 1.00 0.00 C ATOM 2023 C GLU B 50 61.853 -6.765 -7.119 1.00 0.00 C ATOM 2024 O GLU B 50 62.495 -7.350 -6.269 1.00 0.00 O ATOM 2025 CB GLU B 50 60.457 -5.386 -5.570 1.00 0.00 C ATOM 2026 CG GLU B 50 59.024 -5.011 -5.188 1.00 0.00 C ATOM 2027 CD GLU B 50 58.830 -5.202 -3.682 1.00 0.00 C ATOM 2028 OE1 GLU B 50 59.783 -4.990 -2.950 1.00 0.00 O ATOM 2029 OE2 GLU B 50 57.731 -5.558 -3.286 1.00 0.00 O ATOM 0 H GLU B 50 59.006 -7.383 -5.734 1.00 0.00 H new ATOM 0 HA GLU B 50 60.094 -5.663 -7.676 1.00 0.00 H new ATOM 0 HB2 GLU B 50 60.933 -5.924 -4.751 1.00 0.00 H new ATOM 0 HB3 GLU B 50 61.045 -4.485 -5.744 1.00 0.00 H new ATOM 0 HG2 GLU B 50 58.822 -3.976 -5.463 1.00 0.00 H new ATOM 0 HG3 GLU B 50 58.316 -5.631 -5.738 1.00 0.00 H new ATOM 2036 N ILE B 51 62.341 -6.571 -8.319 1.00 0.00 N ATOM 2037 CA ILE B 51 63.712 -7.080 -8.642 1.00 0.00 C ATOM 2038 C ILE B 51 64.668 -5.932 -8.900 1.00 0.00 C ATOM 2039 O ILE B 51 64.671 -5.347 -9.962 1.00 0.00 O ATOM 2040 CB ILE B 51 63.706 -7.953 -9.895 1.00 0.00 C ATOM 2041 CG1 ILE B 51 62.298 -8.381 -10.266 1.00 0.00 C ATOM 2042 CG2 ILE B 51 64.551 -9.194 -9.641 1.00 0.00 C ATOM 2043 CD1 ILE B 51 62.365 -9.091 -11.605 1.00 0.00 C ATOM 0 H ILE B 51 61.860 -6.090 -9.079 1.00 0.00 H new ATOM 0 HA ILE B 51 64.033 -7.665 -7.780 1.00 0.00 H new ATOM 0 HB ILE B 51 64.116 -7.370 -10.720 1.00 0.00 H new ATOM 0 HG12 ILE B 51 61.887 -9.042 -9.503 1.00 0.00 H new ATOM 0 HG13 ILE B 51 61.639 -7.515 -10.326 1.00 0.00 H new ATOM 0 HG21 ILE B 51 64.551 -9.822 -10.532 1.00 0.00 H new ATOM 0 HG22 ILE B 51 65.573 -8.897 -9.406 1.00 0.00 H new ATOM 0 HG23 ILE B 51 64.134 -9.753 -8.803 1.00 0.00 H new ATOM 0 HD11 ILE B 51 61.365 -9.411 -11.898 1.00 0.00 H new ATOM 0 HD12 ILE B 51 62.763 -8.411 -12.358 1.00 0.00 H new ATOM 0 HD13 ILE B 51 63.015 -9.962 -11.523 1.00 0.00 H new ATOM 2055 N CYS B 52 65.542 -5.672 -7.991 1.00 0.00 N ATOM 2056 CA CYS B 52 66.561 -4.634 -8.238 1.00 0.00 C ATOM 2057 C CYS B 52 67.397 -5.079 -9.433 1.00 0.00 C ATOM 2058 O CYS B 52 67.813 -6.211 -9.512 1.00 0.00 O ATOM 2059 CB CYS B 52 67.446 -4.494 -7.012 1.00 0.00 C ATOM 2060 SG CYS B 52 66.597 -3.458 -5.799 1.00 0.00 S ATOM 0 H CYS B 52 65.598 -6.133 -7.083 1.00 0.00 H new ATOM 0 HA CYS B 52 66.092 -3.672 -8.442 1.00 0.00 H new ATOM 0 HB2 CYS B 52 67.661 -5.475 -6.587 1.00 0.00 H new ATOM 0 HB3 CYS B 52 68.403 -4.049 -7.285 1.00 0.00 H new ATOM 2065 N ALA B 53 67.611 -4.221 -10.377 1.00 0.00 N ATOM 2066 CA ALA B 53 68.388 -4.627 -11.577 1.00 0.00 C ATOM 2067 C ALA B 53 69.473 -3.586 -11.856 1.00 0.00 C ATOM 2068 O ALA B 53 69.285 -2.406 -11.643 1.00 0.00 O ATOM 2069 CB ALA B 53 67.442 -4.735 -12.779 1.00 0.00 C ATOM 0 H ALA B 53 67.284 -3.255 -10.375 1.00 0.00 H new ATOM 0 HA ALA B 53 68.859 -5.594 -11.403 1.00 0.00 H new ATOM 0 HB1 ALA B 53 68.008 -5.033 -13.662 1.00 0.00 H new ATOM 0 HB2 ALA B 53 66.674 -5.480 -12.572 1.00 0.00 H new ATOM 0 HB3 ALA B 53 66.971 -3.769 -12.959 1.00 0.00 H new ATOM 2075 N ASP B 54 70.616 -4.018 -12.316 1.00 0.00 N ATOM 2076 CA ASP B 54 71.724 -3.059 -12.589 1.00 0.00 C ATOM 2077 C ASP B 54 71.311 -2.092 -13.720 1.00 0.00 C ATOM 2078 O ASP B 54 71.140 -2.511 -14.846 1.00 0.00 O ATOM 2079 CB ASP B 54 72.968 -3.839 -13.021 1.00 0.00 C ATOM 2080 CG ASP B 54 74.108 -2.861 -13.309 1.00 0.00 C ATOM 2081 OD1 ASP B 54 74.181 -1.849 -12.630 1.00 0.00 O ATOM 2082 OD2 ASP B 54 74.888 -3.138 -14.204 1.00 0.00 O ATOM 0 H ASP B 54 70.830 -4.995 -12.515 1.00 0.00 H new ATOM 0 HA ASP B 54 71.939 -2.487 -11.686 1.00 0.00 H new ATOM 0 HB2 ASP B 54 73.263 -4.537 -12.238 1.00 0.00 H new ATOM 0 HB3 ASP B 54 72.749 -4.431 -13.910 1.00 0.00 H new ATOM 2087 N PRO B 55 71.168 -0.814 -13.389 1.00 0.00 N ATOM 2088 CA PRO B 55 70.790 0.195 -14.382 1.00 0.00 C ATOM 2089 C PRO B 55 71.892 0.332 -15.438 1.00 0.00 C ATOM 2090 O PRO B 55 71.670 0.839 -16.521 1.00 0.00 O ATOM 2091 CB PRO B 55 70.645 1.505 -13.589 1.00 0.00 C ATOM 2092 CG PRO B 55 71.024 1.196 -12.106 1.00 0.00 C ATOM 2093 CD PRO B 55 71.365 -0.303 -12.024 1.00 0.00 C ATOM 0 HA PRO B 55 69.871 -0.068 -14.907 1.00 0.00 H new ATOM 0 HB2 PRO B 55 71.297 2.276 -13.999 1.00 0.00 H new ATOM 0 HB3 PRO B 55 69.624 1.882 -13.654 1.00 0.00 H new ATOM 0 HG2 PRO B 55 71.875 1.801 -11.793 1.00 0.00 H new ATOM 0 HG3 PRO B 55 70.197 1.439 -11.439 1.00 0.00 H new ATOM 0 HD2 PRO B 55 72.391 -0.457 -11.689 1.00 0.00 H new ATOM 0 HD3 PRO B 55 70.718 -0.817 -11.313 1.00 0.00 H new ATOM 2101 N LYS B 56 73.085 -0.105 -15.126 1.00 0.00 N ATOM 2102 CA LYS B 56 74.198 0.010 -16.098 1.00 0.00 C ATOM 2103 C LYS B 56 74.236 -1.227 -17.004 1.00 0.00 C ATOM 2104 O LYS B 56 75.212 -1.477 -17.684 1.00 0.00 O ATOM 2105 CB LYS B 56 75.524 0.125 -15.342 1.00 0.00 C ATOM 2106 CG LYS B 56 75.928 1.597 -15.240 1.00 0.00 C ATOM 2107 CD LYS B 56 75.438 2.172 -13.909 1.00 0.00 C ATOM 2108 CE LYS B 56 76.637 2.442 -12.997 1.00 0.00 C ATOM 2109 NZ LYS B 56 76.879 3.911 -12.919 1.00 0.00 N ATOM 0 H LYS B 56 73.331 -0.537 -14.235 1.00 0.00 H new ATOM 0 HA LYS B 56 74.044 0.898 -16.711 1.00 0.00 H new ATOM 0 HB2 LYS B 56 75.425 -0.306 -14.346 1.00 0.00 H new ATOM 0 HB3 LYS B 56 76.299 -0.441 -15.858 1.00 0.00 H new ATOM 0 HG2 LYS B 56 77.011 1.693 -15.313 1.00 0.00 H new ATOM 0 HG3 LYS B 56 75.502 2.160 -16.070 1.00 0.00 H new ATOM 0 HD2 LYS B 56 74.884 3.095 -14.081 1.00 0.00 H new ATOM 0 HD3 LYS B 56 74.753 1.473 -13.429 1.00 0.00 H new ATOM 0 HE2 LYS B 56 76.449 2.040 -12.002 1.00 0.00 H new ATOM 0 HE3 LYS B 56 77.522 1.936 -13.383 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 77.694 4.096 -12.300 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 77.076 4.281 -13.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 76.036 4.382 -12.532 1.00 0.00 H new ATOM 2123 N GLN B 57 73.183 -2.002 -17.026 1.00 0.00 N ATOM 2124 CA GLN B 57 73.172 -3.212 -17.895 1.00 0.00 C ATOM 2125 C GLN B 57 72.626 -2.839 -19.273 1.00 0.00 C ATOM 2126 O GLN B 57 72.068 -1.776 -19.462 1.00 0.00 O ATOM 2127 CB GLN B 57 72.282 -4.287 -17.268 1.00 0.00 C ATOM 2128 CG GLN B 57 73.132 -5.510 -16.914 1.00 0.00 C ATOM 2129 CD GLN B 57 73.804 -6.049 -18.178 1.00 0.00 C ATOM 2130 OE1 GLN B 57 73.142 -6.549 -19.066 1.00 0.00 O ATOM 2131 NE2 GLN B 57 75.101 -5.967 -18.299 1.00 0.00 N ATOM 0 H GLN B 57 72.334 -1.849 -16.481 1.00 0.00 H new ATOM 0 HA GLN B 57 74.187 -3.597 -17.995 1.00 0.00 H new ATOM 0 HB2 GLN B 57 71.797 -3.896 -16.373 1.00 0.00 H new ATOM 0 HB3 GLN B 57 71.490 -4.569 -17.962 1.00 0.00 H new ATOM 0 HG2 GLN B 57 73.887 -5.240 -16.175 1.00 0.00 H new ATOM 0 HG3 GLN B 57 72.508 -6.282 -16.464 1.00 0.00 H new ATOM 0 HE21 GLN B 57 75.657 -5.547 -17.554 1.00 0.00 H new ATOM 0 HE22 GLN B 57 75.558 -6.322 -19.139 1.00 0.00 H new ATOM 2140 N LYS B 58 72.786 -3.699 -20.240 1.00 0.00 N ATOM 2141 CA LYS B 58 72.280 -3.382 -21.604 1.00 0.00 C ATOM 2142 C LYS B 58 70.864 -3.942 -21.775 1.00 0.00 C ATOM 2143 O LYS B 58 70.167 -3.602 -22.711 1.00 0.00 O ATOM 2144 CB LYS B 58 73.218 -4.003 -22.654 1.00 0.00 C ATOM 2145 CG LYS B 58 72.571 -3.943 -24.055 1.00 0.00 C ATOM 2146 CD LYS B 58 72.073 -2.521 -24.347 1.00 0.00 C ATOM 2147 CE LYS B 58 72.664 -2.035 -25.672 1.00 0.00 C ATOM 2148 NZ LYS B 58 72.976 -0.581 -25.574 1.00 0.00 N ATOM 0 H LYS B 58 73.244 -4.605 -20.145 1.00 0.00 H new ATOM 0 HA LYS B 58 72.252 -2.301 -21.738 1.00 0.00 H new ATOM 0 HB2 LYS B 58 74.169 -3.470 -22.662 1.00 0.00 H new ATOM 0 HB3 LYS B 58 73.435 -5.038 -22.390 1.00 0.00 H new ATOM 0 HG2 LYS B 58 73.295 -4.245 -24.811 1.00 0.00 H new ATOM 0 HG3 LYS B 58 71.740 -4.646 -24.110 1.00 0.00 H new ATOM 0 HD2 LYS B 58 70.984 -2.509 -24.396 1.00 0.00 H new ATOM 0 HD3 LYS B 58 72.363 -1.849 -23.539 1.00 0.00 H new ATOM 0 HE2 LYS B 58 73.568 -2.597 -25.907 1.00 0.00 H new ATOM 0 HE3 LYS B 58 71.959 -2.212 -26.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 73.378 -0.251 -26.475 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 72.104 -0.052 -25.369 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 73.664 -0.424 -24.810 1.00 0.00 H new ATOM 2162 N TRP B 59 70.424 -4.781 -20.880 1.00 0.00 N ATOM 2163 CA TRP B 59 69.051 -5.328 -21.008 1.00 0.00 C ATOM 2164 C TRP B 59 68.113 -4.474 -20.160 1.00 0.00 C ATOM 2165 O TRP B 59 66.954 -4.299 -20.479 1.00 0.00 O ATOM 2166 CB TRP B 59 69.028 -6.805 -20.556 1.00 0.00 C ATOM 2167 CG TRP B 59 68.973 -6.908 -19.060 1.00 0.00 C ATOM 2168 CD1 TRP B 59 70.047 -7.040 -18.245 1.00 0.00 C ATOM 2169 CD2 TRP B 59 67.801 -6.912 -18.201 1.00 0.00 C ATOM 2170 NE1 TRP B 59 69.605 -7.128 -16.932 1.00 0.00 N ATOM 2171 CE2 TRP B 59 68.228 -7.055 -16.851 1.00 0.00 C ATOM 2172 CE3 TRP B 59 66.409 -6.806 -18.456 1.00 0.00 C ATOM 2173 CZ2 TRP B 59 67.308 -7.096 -15.789 1.00 0.00 C ATOM 2174 CZ3 TRP B 59 65.482 -6.846 -17.386 1.00 0.00 C ATOM 2175 CH2 TRP B 59 65.939 -6.993 -16.055 1.00 0.00 C ATOM 0 H TRP B 59 70.953 -5.108 -20.072 1.00 0.00 H new ATOM 0 HA TRP B 59 68.722 -5.297 -22.047 1.00 0.00 H new ATOM 0 HB2 TRP B 59 68.165 -7.309 -20.991 1.00 0.00 H new ATOM 0 HB3 TRP B 59 69.916 -7.317 -20.927 1.00 0.00 H new ATOM 0 HD1 TRP B 59 71.078 -7.072 -18.564 1.00 0.00 H new ATOM 0 HE1 TRP B 59 70.221 -7.234 -16.126 1.00 0.00 H new ATOM 0 HE3 TRP B 59 66.055 -6.694 -19.470 1.00 0.00 H new ATOM 0 HZ2 TRP B 59 67.657 -7.206 -14.773 1.00 0.00 H new ATOM 0 HZ3 TRP B 59 64.424 -6.764 -17.586 1.00 0.00 H new ATOM 0 HH2 TRP B 59 65.229 -7.026 -15.242 1.00 0.00 H new ATOM 2186 N VAL B 60 68.624 -3.898 -19.111 1.00 0.00 N ATOM 2187 CA VAL B 60 67.790 -3.006 -18.275 1.00 0.00 C ATOM 2188 C VAL B 60 67.660 -1.650 -18.983 1.00 0.00 C ATOM 2189 O VAL B 60 66.813 -0.853 -18.664 1.00 0.00 O ATOM 2190 CB VAL B 60 68.448 -2.833 -16.903 1.00 0.00 C ATOM 2191 CG1 VAL B 60 67.699 -1.779 -16.093 1.00 0.00 C ATOM 2192 CG2 VAL B 60 68.402 -4.165 -16.157 1.00 0.00 C ATOM 0 H VAL B 60 69.588 -4.009 -18.798 1.00 0.00 H new ATOM 0 HA VAL B 60 66.798 -3.435 -18.133 1.00 0.00 H new ATOM 0 HB VAL B 60 69.481 -2.513 -17.037 1.00 0.00 H new ATOM 0 HG11 VAL B 60 68.174 -1.663 -15.119 1.00 0.00 H new ATOM 0 HG12 VAL B 60 67.723 -0.827 -16.624 1.00 0.00 H new ATOM 0 HG13 VAL B 60 66.664 -2.093 -15.957 1.00 0.00 H new ATOM 0 HG21 VAL B 60 68.869 -4.050 -15.179 1.00 0.00 H new ATOM 0 HG22 VAL B 60 67.365 -4.475 -16.030 1.00 0.00 H new ATOM 0 HG23 VAL B 60 68.940 -4.921 -16.729 1.00 0.00 H new ATOM 2202 N GLN B 61 68.471 -1.402 -19.977 1.00 0.00 N ATOM 2203 CA GLN B 61 68.349 -0.126 -20.726 1.00 0.00 C ATOM 2204 C GLN B 61 67.171 -0.249 -21.686 1.00 0.00 C ATOM 2205 O GLN B 61 66.522 0.721 -22.023 1.00 0.00 O ATOM 2206 CB GLN B 61 69.633 0.134 -21.516 1.00 0.00 C ATOM 2207 CG GLN B 61 70.673 0.785 -20.601 1.00 0.00 C ATOM 2208 CD GLN B 61 71.965 1.020 -21.384 1.00 0.00 C ATOM 2209 OE1 GLN B 61 73.001 0.484 -21.044 1.00 0.00 O ATOM 2210 NE2 GLN B 61 71.949 1.805 -22.426 1.00 0.00 N ATOM 0 H GLN B 61 69.209 -2.028 -20.299 1.00 0.00 H new ATOM 0 HA GLN B 61 68.189 0.702 -20.036 1.00 0.00 H new ATOM 0 HB2 GLN B 61 70.021 -0.802 -21.917 1.00 0.00 H new ATOM 0 HB3 GLN B 61 69.424 0.783 -22.366 1.00 0.00 H new ATOM 0 HG2 GLN B 61 70.292 1.730 -20.215 1.00 0.00 H new ATOM 0 HG3 GLN B 61 70.868 0.145 -19.741 1.00 0.00 H new ATOM 0 HE21 GLN B 61 71.080 2.255 -22.712 1.00 0.00 H new ATOM 0 HE22 GLN B 61 72.806 1.968 -22.955 1.00 0.00 H new ATOM 2219 N ASP B 62 66.877 -1.450 -22.113 1.00 0.00 N ATOM 2220 CA ASP B 62 65.735 -1.655 -23.027 1.00 0.00 C ATOM 2221 C ASP B 62 64.452 -1.783 -22.201 1.00 0.00 C ATOM 2222 O ASP B 62 63.402 -1.301 -22.579 1.00 0.00 O ATOM 2223 CB ASP B 62 65.952 -2.937 -23.836 1.00 0.00 C ATOM 2224 CG ASP B 62 67.271 -2.837 -24.606 1.00 0.00 C ATOM 2225 OD1 ASP B 62 67.531 -1.783 -25.163 1.00 0.00 O ATOM 2226 OD2 ASP B 62 67.998 -3.816 -24.626 1.00 0.00 O ATOM 0 H ASP B 62 67.387 -2.297 -21.861 1.00 0.00 H new ATOM 0 HA ASP B 62 65.652 -0.809 -23.709 1.00 0.00 H new ATOM 0 HB2 ASP B 62 65.971 -3.800 -23.171 1.00 0.00 H new ATOM 0 HB3 ASP B 62 65.124 -3.087 -24.529 1.00 0.00 H new ATOM 2231 N SER B 63 64.531 -2.439 -21.077 1.00 0.00 N ATOM 2232 CA SER B 63 63.339 -2.612 -20.229 1.00 0.00 C ATOM 2233 C SER B 63 62.997 -1.292 -19.527 1.00 0.00 C ATOM 2234 O SER B 63 61.887 -0.807 -19.589 1.00 0.00 O ATOM 2235 CB SER B 63 63.636 -3.655 -19.170 1.00 0.00 C ATOM 2236 OG SER B 63 64.710 -4.482 -19.598 1.00 0.00 O ATOM 0 H SER B 63 65.384 -2.864 -20.713 1.00 0.00 H new ATOM 0 HA SER B 63 62.500 -2.923 -20.852 1.00 0.00 H new ATOM 0 HB2 SER B 63 63.892 -3.168 -18.229 1.00 0.00 H new ATOM 0 HB3 SER B 63 62.749 -4.261 -18.985 1.00 0.00 H new ATOM 0 HG SER B 63 64.933 -5.121 -18.889 1.00 0.00 H new ATOM 2242 N MET B 64 63.940 -0.751 -18.806 1.00 0.00 N ATOM 2243 CA MET B 64 63.689 0.502 -18.031 1.00 0.00 C ATOM 2244 C MET B 64 63.093 1.592 -18.926 1.00 0.00 C ATOM 2245 O MET B 64 62.497 2.526 -18.443 1.00 0.00 O ATOM 2246 CB MET B 64 65.021 1.001 -17.409 1.00 0.00 C ATOM 2247 CG MET B 64 65.849 1.797 -18.445 1.00 0.00 C ATOM 2248 SD MET B 64 67.240 2.610 -17.616 1.00 0.00 S ATOM 2249 CE MET B 64 68.020 1.121 -16.955 1.00 0.00 C ATOM 0 H MET B 64 64.885 -1.126 -18.718 1.00 0.00 H new ATOM 0 HA MET B 64 62.972 0.282 -17.240 1.00 0.00 H new ATOM 0 HB2 MET B 64 64.810 1.631 -16.545 1.00 0.00 H new ATOM 0 HB3 MET B 64 65.601 0.151 -17.050 1.00 0.00 H new ATOM 0 HG2 MET B 64 66.217 1.128 -19.223 1.00 0.00 H new ATOM 0 HG3 MET B 64 65.220 2.540 -18.935 1.00 0.00 H new ATOM 0 HE1 MET B 64 68.924 1.395 -16.412 1.00 0.00 H new ATOM 0 HE2 MET B 64 67.329 0.618 -16.279 1.00 0.00 H new ATOM 0 HE3 MET B 64 68.278 0.451 -17.775 1.00 0.00 H new ATOM 2259 N ASP B 65 63.285 1.513 -20.216 1.00 0.00 N ATOM 2260 CA ASP B 65 62.756 2.583 -21.099 1.00 0.00 C ATOM 2261 C ASP B 65 61.287 2.334 -21.392 1.00 0.00 C ATOM 2262 O ASP B 65 60.511 3.261 -21.517 1.00 0.00 O ATOM 2263 CB ASP B 65 63.564 2.644 -22.412 1.00 0.00 C ATOM 2264 CG ASP B 65 63.256 1.429 -23.294 1.00 0.00 C ATOM 2265 OD1 ASP B 65 62.103 1.247 -23.627 1.00 0.00 O ATOM 2266 OD2 ASP B 65 64.176 0.686 -23.595 1.00 0.00 O ATOM 0 H ASP B 65 63.782 0.759 -20.690 1.00 0.00 H new ATOM 0 HA ASP B 65 62.855 3.541 -20.590 1.00 0.00 H new ATOM 0 HB2 ASP B 65 63.324 3.561 -22.950 1.00 0.00 H new ATOM 0 HB3 ASP B 65 64.630 2.676 -22.188 1.00 0.00 H new ATOM 2271 N HIS B 66 60.880 1.100 -21.473 1.00 0.00 N ATOM 2272 CA HIS B 66 59.447 0.841 -21.723 1.00 0.00 C ATOM 2273 C HIS B 66 58.687 1.154 -20.443 1.00 0.00 C ATOM 2274 O HIS B 66 57.572 1.639 -20.472 1.00 0.00 O ATOM 2275 CB HIS B 66 59.213 -0.612 -22.165 1.00 0.00 C ATOM 2276 CG HIS B 66 59.410 -1.544 -21.014 1.00 0.00 C ATOM 2277 ND1 HIS B 66 60.422 -2.473 -20.998 1.00 0.00 N ATOM 2278 CD2 HIS B 66 58.728 -1.708 -19.843 1.00 0.00 C ATOM 2279 CE1 HIS B 66 60.335 -3.150 -19.837 1.00 0.00 C ATOM 2280 NE2 HIS B 66 59.315 -2.724 -19.098 1.00 0.00 N ATOM 0 H HIS B 66 61.471 0.274 -21.378 1.00 0.00 H new ATOM 0 HA HIS B 66 59.090 1.475 -22.535 1.00 0.00 H new ATOM 0 HB2 HIS B 66 58.203 -0.720 -22.560 1.00 0.00 H new ATOM 0 HB3 HIS B 66 59.900 -0.869 -22.971 1.00 0.00 H new ATOM 0 HD1 HIS B 66 61.114 -2.623 -21.732 1.00 0.00 H new ATOM 0 HD2 HIS B 66 57.864 -1.135 -19.541 1.00 0.00 H new ATOM 0 HE1 HIS B 66 61.010 -3.940 -19.543 1.00 0.00 H new ATOM 2288 N LEU B 67 59.316 0.960 -19.313 1.00 0.00 N ATOM 2289 CA LEU B 67 58.662 1.338 -18.042 1.00 0.00 C ATOM 2290 C LEU B 67 58.703 2.850 -17.951 1.00 0.00 C ATOM 2291 O LEU B 67 57.784 3.490 -17.478 1.00 0.00 O ATOM 2292 CB LEU B 67 59.418 0.735 -16.850 1.00 0.00 C ATOM 2293 CG LEU B 67 59.529 -0.771 -17.023 1.00 0.00 C ATOM 2294 CD1 LEU B 67 60.363 -1.361 -15.895 1.00 0.00 C ATOM 2295 CD2 LEU B 67 58.137 -1.382 -16.987 1.00 0.00 C ATOM 0 H LEU B 67 60.249 0.558 -19.223 1.00 0.00 H new ATOM 0 HA LEU B 67 57.638 0.966 -18.018 1.00 0.00 H new ATOM 0 HB2 LEU B 67 60.412 1.177 -16.776 1.00 0.00 H new ATOM 0 HB3 LEU B 67 58.897 0.967 -15.921 1.00 0.00 H new ATOM 0 HG LEU B 67 60.007 -0.990 -17.978 1.00 0.00 H new ATOM 0 HD11 LEU B 67 60.439 -2.441 -16.025 1.00 0.00 H new ATOM 0 HD12 LEU B 67 61.361 -0.923 -15.912 1.00 0.00 H new ATOM 0 HD13 LEU B 67 59.888 -1.143 -14.939 1.00 0.00 H new ATOM 0 HD21 LEU B 67 58.211 -2.462 -17.111 1.00 0.00 H new ATOM 0 HD22 LEU B 67 57.666 -1.158 -16.030 1.00 0.00 H new ATOM 0 HD23 LEU B 67 57.535 -0.965 -17.794 1.00 0.00 H new ATOM 2307 N ASP B 68 59.756 3.426 -18.459 1.00 0.00 N ATOM 2308 CA ASP B 68 59.874 4.891 -18.476 1.00 0.00 C ATOM 2309 C ASP B 68 58.790 5.461 -19.387 1.00 0.00 C ATOM 2310 O ASP B 68 58.509 6.643 -19.370 1.00 0.00 O ATOM 2311 CB ASP B 68 61.261 5.276 -19.009 1.00 0.00 C ATOM 2312 CG ASP B 68 61.989 6.131 -17.969 1.00 0.00 C ATOM 2313 OD1 ASP B 68 61.671 7.303 -17.868 1.00 0.00 O ATOM 2314 OD2 ASP B 68 62.853 5.597 -17.294 1.00 0.00 O ATOM 0 H ASP B 68 60.547 2.927 -18.867 1.00 0.00 H new ATOM 0 HA ASP B 68 59.752 5.293 -17.470 1.00 0.00 H new ATOM 0 HB2 ASP B 68 61.840 4.379 -19.227 1.00 0.00 H new ATOM 0 HB3 ASP B 68 61.163 5.827 -19.944 1.00 0.00 H new ATOM 2319 N LYS B 69 58.159 4.622 -20.174 1.00 0.00 N ATOM 2320 CA LYS B 69 57.090 5.109 -21.058 1.00 0.00 C ATOM 2321 C LYS B 69 55.927 4.127 -21.035 1.00 0.00 C ATOM 2322 O LYS B 69 55.282 3.880 -22.034 1.00 0.00 O ATOM 2323 CB LYS B 69 57.618 5.257 -22.486 1.00 0.00 C ATOM 2324 CG LYS B 69 58.079 3.895 -23.006 1.00 0.00 C ATOM 2325 CD LYS B 69 59.215 4.090 -24.012 1.00 0.00 C ATOM 2326 CE LYS B 69 58.747 3.652 -25.401 1.00 0.00 C ATOM 2327 NZ LYS B 69 57.763 4.638 -25.929 1.00 0.00 N ATOM 0 H LYS B 69 58.349 3.622 -20.232 1.00 0.00 H new ATOM 0 HA LYS B 69 56.749 6.083 -20.707 1.00 0.00 H new ATOM 0 HB2 LYS B 69 56.839 5.660 -23.133 1.00 0.00 H new ATOM 0 HB3 LYS B 69 58.447 5.965 -22.507 1.00 0.00 H new ATOM 0 HG2 LYS B 69 58.416 3.273 -22.177 1.00 0.00 H new ATOM 0 HG3 LYS B 69 57.246 3.373 -23.478 1.00 0.00 H new ATOM 0 HD2 LYS B 69 59.521 5.136 -24.033 1.00 0.00 H new ATOM 0 HD3 LYS B 69 60.086 3.509 -23.710 1.00 0.00 H new ATOM 0 HE2 LYS B 69 59.599 3.576 -26.076 1.00 0.00 H new ATOM 0 HE3 LYS B 69 58.293 2.662 -25.348 1.00 0.00 H new ATOM 0 HZ1 LYS B 69 57.471 4.358 -26.887 1.00 0.00 H new ATOM 0 HZ2 LYS B 69 56.930 4.664 -25.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 69 58.200 5.581 -25.962 1.00 0.00 H new ATOM 2341 N GLN B 70 55.651 3.573 -19.895 1.00 0.00 N ATOM 2342 CA GLN B 70 54.533 2.620 -19.782 1.00 0.00 C ATOM 2343 C GLN B 70 53.253 3.369 -19.385 1.00 0.00 C ATOM 2344 O GLN B 70 52.246 2.768 -19.067 1.00 0.00 O ATOM 2345 CB GLN B 70 54.861 1.573 -18.717 1.00 0.00 C ATOM 2346 CG GLN B 70 55.283 0.270 -19.397 1.00 0.00 C ATOM 2347 CD GLN B 70 54.058 -0.628 -19.583 1.00 0.00 C ATOM 2348 OE1 GLN B 70 53.756 -1.446 -18.736 1.00 0.00 O ATOM 2349 NE2 GLN B 70 53.335 -0.509 -20.663 1.00 0.00 N ATOM 0 H GLN B 70 56.161 3.745 -19.029 1.00 0.00 H new ATOM 0 HA GLN B 70 54.380 2.128 -20.743 1.00 0.00 H new ATOM 0 HB2 GLN B 70 55.661 1.934 -18.071 1.00 0.00 H new ATOM 0 HB3 GLN B 70 53.992 1.400 -18.082 1.00 0.00 H new ATOM 0 HG2 GLN B 70 55.741 0.483 -20.363 1.00 0.00 H new ATOM 0 HG3 GLN B 70 56.034 -0.241 -18.794 1.00 0.00 H new ATOM 0 HE21 GLN B 70 53.589 0.177 -21.373 1.00 0.00 H new ATOM 0 HE22 GLN B 70 52.516 -1.102 -20.797 1.00 0.00 H new ATOM 2358 N THR B 71 53.284 4.679 -19.397 1.00 0.00 N ATOM 2359 CA THR B 71 52.081 5.454 -19.021 1.00 0.00 C ATOM 2360 C THR B 71 52.078 6.788 -19.770 1.00 0.00 C ATOM 2361 O THR B 71 51.729 7.817 -19.226 1.00 0.00 O ATOM 2362 CB THR B 71 52.097 5.713 -17.514 1.00 0.00 C ATOM 2363 OG1 THR B 71 50.924 6.426 -17.144 1.00 0.00 O ATOM 2364 CG2 THR B 71 53.334 6.538 -17.150 1.00 0.00 C ATOM 0 H THR B 71 54.097 5.239 -19.653 1.00 0.00 H new ATOM 0 HA THR B 71 51.186 4.890 -19.284 1.00 0.00 H new ATOM 0 HB THR B 71 52.127 4.762 -16.982 1.00 0.00 H new ATOM 0 HG1 THR B 71 50.810 7.198 -17.736 1.00 0.00 H new ATOM 0 HG21 THR B 71 53.345 6.722 -16.076 1.00 0.00 H new ATOM 0 HG22 THR B 71 54.233 5.990 -17.433 1.00 0.00 H new ATOM 0 HG23 THR B 71 53.306 7.489 -17.681 1.00 0.00 H new ATOM 2372 N GLN B 72 52.463 6.780 -21.016 1.00 0.00 N ATOM 2373 CA GLN B 72 52.480 8.038 -21.796 1.00 0.00 C ATOM 2374 C GLN B 72 52.221 7.728 -23.272 1.00 0.00 C ATOM 2375 O GLN B 72 52.966 8.134 -24.142 1.00 0.00 O ATOM 2376 CB GLN B 72 53.845 8.714 -21.647 1.00 0.00 C ATOM 2377 CG GLN B 72 54.945 7.745 -22.087 1.00 0.00 C ATOM 2378 CD GLN B 72 56.283 8.485 -22.147 1.00 0.00 C ATOM 2379 OE1 GLN B 72 56.983 8.579 -21.158 1.00 0.00 O ATOM 2380 NE2 GLN B 72 56.670 9.019 -23.273 1.00 0.00 N ATOM 0 H GLN B 72 52.767 5.950 -21.525 1.00 0.00 H new ATOM 0 HA GLN B 72 51.703 8.706 -21.424 1.00 0.00 H new ATOM 0 HB2 GLN B 72 53.882 9.621 -22.251 1.00 0.00 H new ATOM 0 HB3 GLN B 72 54.003 9.014 -20.611 1.00 0.00 H new ATOM 0 HG2 GLN B 72 55.010 6.910 -21.389 1.00 0.00 H new ATOM 0 HG3 GLN B 72 54.705 7.325 -23.064 1.00 0.00 H new ATOM 0 HE21 GLN B 72 56.083 8.940 -24.103 1.00 0.00 H new ATOM 0 HE22 GLN B 72 57.560 9.515 -23.323 1.00 0.00 H new ATOM 2389 N THR B 73 51.169 7.013 -23.561 1.00 0.00 N ATOM 2390 CA THR B 73 50.862 6.678 -24.978 1.00 0.00 C ATOM 2391 C THR B 73 50.687 7.978 -25.785 1.00 0.00 C ATOM 2392 O THR B 73 50.240 8.974 -25.250 1.00 0.00 O ATOM 2393 CB THR B 73 49.568 5.862 -25.038 1.00 0.00 C ATOM 2394 OG1 THR B 73 49.111 5.796 -26.381 1.00 0.00 O ATOM 2395 CG2 THR B 73 48.503 6.530 -24.167 1.00 0.00 C ATOM 0 H THR B 73 50.509 6.646 -22.876 1.00 0.00 H new ATOM 0 HA THR B 73 51.680 6.095 -25.401 1.00 0.00 H new ATOM 0 HB THR B 73 49.757 4.854 -24.670 1.00 0.00 H new ATOM 0 HG1 THR B 73 48.284 5.272 -26.420 1.00 0.00 H new ATOM 0 HG21 THR B 73 47.582 5.949 -24.209 1.00 0.00 H new ATOM 0 HG22 THR B 73 48.854 6.579 -23.136 1.00 0.00 H new ATOM 0 HG23 THR B 73 48.313 7.539 -24.534 1.00 0.00 H new ATOM 2403 N PRO B 74 51.046 7.933 -27.059 1.00 0.00 N ATOM 2404 CA PRO B 74 50.928 9.103 -27.933 1.00 0.00 C ATOM 2405 C PRO B 74 49.465 9.545 -28.032 1.00 0.00 C ATOM 2406 O PRO B 74 48.583 8.751 -28.293 1.00 0.00 O ATOM 2407 CB PRO B 74 51.442 8.632 -29.305 1.00 0.00 C ATOM 2408 CG PRO B 74 51.862 7.135 -29.156 1.00 0.00 C ATOM 2409 CD PRO B 74 51.587 6.725 -27.699 1.00 0.00 C ATOM 0 HA PRO B 74 51.493 9.956 -27.557 1.00 0.00 H new ATOM 0 HB2 PRO B 74 50.666 8.740 -30.063 1.00 0.00 H new ATOM 0 HB3 PRO B 74 52.289 9.238 -29.627 1.00 0.00 H new ATOM 0 HG2 PRO B 74 51.297 6.507 -29.845 1.00 0.00 H new ATOM 0 HG3 PRO B 74 52.917 7.006 -29.399 1.00 0.00 H new ATOM 0 HD2 PRO B 74 50.877 5.900 -27.649 1.00 0.00 H new ATOM 0 HD3 PRO B 74 52.499 6.391 -27.204 1.00 0.00 H new ATOM 2417 N LYS B 75 49.202 10.806 -27.825 1.00 0.00 N ATOM 2418 CA LYS B 75 47.797 11.297 -27.906 1.00 0.00 C ATOM 2419 C LYS B 75 47.365 11.366 -29.372 1.00 0.00 C ATOM 2420 O LYS B 75 47.953 12.069 -30.169 1.00 0.00 O ATOM 2421 CB LYS B 75 47.707 12.691 -27.281 1.00 0.00 C ATOM 2422 CG LYS B 75 46.339 12.866 -26.620 1.00 0.00 C ATOM 2423 CD LYS B 75 45.453 13.746 -27.506 1.00 0.00 C ATOM 2424 CE LYS B 75 44.246 14.231 -26.700 1.00 0.00 C ATOM 2425 NZ LYS B 75 43.287 14.919 -27.608 1.00 0.00 N ATOM 0 H LYS B 75 49.899 11.517 -27.603 1.00 0.00 H new ATOM 0 HA LYS B 75 47.141 10.614 -27.366 1.00 0.00 H new ATOM 0 HB2 LYS B 75 48.499 12.822 -26.543 1.00 0.00 H new ATOM 0 HB3 LYS B 75 47.854 13.454 -28.045 1.00 0.00 H new ATOM 0 HG2 LYS B 75 45.869 11.894 -26.469 1.00 0.00 H new ATOM 0 HG3 LYS B 75 46.454 13.321 -25.636 1.00 0.00 H new ATOM 0 HD2 LYS B 75 46.023 14.598 -27.876 1.00 0.00 H new ATOM 0 HD3 LYS B 75 45.119 13.183 -28.378 1.00 0.00 H new ATOM 0 HE2 LYS B 75 43.759 13.387 -26.211 1.00 0.00 H new ATOM 0 HE3 LYS B 75 44.570 14.912 -25.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 42.466 15.249 -27.061 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 43.755 15.733 -28.055 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 42.969 14.256 -28.343 1.00 0.00 H new ATOM 2439 N THR B 76 46.340 10.644 -29.733 1.00 0.00 N ATOM 2440 CA THR B 76 45.870 10.670 -31.147 1.00 0.00 C ATOM 2441 C THR B 76 44.355 10.460 -31.186 1.00 0.00 C ATOM 2442 O THR B 76 43.638 11.435 -31.030 1.00 0.00 O ATOM 2443 CB THR B 76 46.560 9.553 -31.934 1.00 0.00 C ATOM 2444 OG1 THR B 76 46.451 8.331 -31.215 1.00 0.00 O ATOM 2445 CG2 THR B 76 48.035 9.901 -32.130 1.00 0.00 C ATOM 2446 OXT THR B 76 43.938 9.330 -31.370 1.00 0.00 O ATOM 0 H THR B 76 45.807 10.037 -29.110 1.00 0.00 H new ATOM 0 HA THR B 76 46.114 11.634 -31.593 1.00 0.00 H new ATOM 0 HB THR B 76 46.082 9.446 -32.908 1.00 0.00 H new ATOM 0 HG1 THR B 76 45.507 8.146 -31.025 1.00 0.00 H new ATOM 0 HG21 THR B 76 48.525 9.105 -32.690 1.00 0.00 H new ATOM 0 HG22 THR B 76 48.118 10.837 -32.682 1.00 0.00 H new ATOM 0 HG23 THR B 76 48.516 10.009 -31.158 1.00 0.00 H new TER 2454 THR B 76