USER MOD reduce.3.24.130724 H: found=0, std=0, add=1164, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1155 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 12 CYS SG : rot -145:sc= -5.57! USER MOD Set 1.2: C 15 CYS SG : rot 94:sc= -2.32! USER MOD Set 1.3: C 26 CYS SG : rot 163:sc= -5.52! USER MOD Set 1.4: C 29 CYS SG : rot 29:sc= -1.92! USER MOD Set 2.1: B 12 CYS SG : rot -127:sc= -6.65! USER MOD Set 2.2: B 15 CYS SG : rot 117:sc= -3.48! USER MOD Set 2.3: B 26 CYS SG : rot 170:sc= -5.76! USER MOD Set 2.4: B 29 CYS SG : rot -35:sc= -1.76! USER MOD Set 3.1: A 12 CYS SG : rot 150:sc= -5.66! USER MOD Set 3.2: A 15 CYS SG : rot -136:sc= -1.21! USER MOD Set 3.3: A 26 CYS SG : rot -167:sc= 0.746! USER MOD Set 3.4: A 29 CYS SG : rot -27:sc= -1.24! USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0043 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= -2.86! USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 175:sc= 0.501 (180deg=0.2) USER MOD Single : A 37 THR OG1 : rot 176:sc= -0.796 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 67:sc= 0.485 USER MOD Single : A 48 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.71) USER MOD Single : A 49 LYS NZ :NH3+ 146:sc= 2.01 (180deg=1.11) USER MOD Single : A 50 HIS : no HD1:sc= -1.35 K(o=-1.1,f=-8.1!) USER MOD Single : A 52 ASN : amide:sc= -1.93 K(o=-1.9,f=-0.69) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 5 THR OG1 : rot 180:sc=-5.71e-05 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= -2.57! USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 177:sc= 0.37 (180deg=0.32) USER MOD Single : B 37 THR OG1 : rot 170:sc= -1.08 USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : B 41 TYR OH : rot 180:sc= 0 USER MOD Single : B 42 THR OG1 : rot -165:sc= 0.244 USER MOD Single : B 48 GLN : amide:sc= -0.136 K(o=-0.14,f=-0.7) USER MOD Single : B 49 LYS NZ :NH3+ 158:sc= 2.23 (180deg=0.972) USER MOD Single : B 50 HIS : no HD1:sc= -1.56 K(o=-1.4,f=-8.1!) USER MOD Single : B 52 ASN : amide:sc= -2.39 K(o=-2.4,f=-1.2) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0 USER MOD Single : C 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 50:sc= -2.8! USER MOD Single : C 30 SER OG : rot 180:sc= 0 USER MOD Single : C 32 LYS NZ :NH3+ 168:sc= 0.619 (180deg=0.374) USER MOD Single : C 37 THR OG1 : rot 170:sc= -0.842 USER MOD Single : C 39 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : C 41 TYR OH : rot 180:sc= 0 USER MOD Single : C 42 THR OG1 : rot 70:sc= 0.653 USER MOD Single : C 48 GLN : amide:sc= -0.158 K(o=-0.16,f=-0.81) USER MOD Single : C 49 LYS NZ :NH3+ 156:sc= 2.23 (180deg=1.09) USER MOD Single : C 50 HIS : no HD1:sc= -1.3 K(o=-1.1,f=-8.1!) USER MOD Single : C 52 ASN : amide:sc= -1.98 K(o=-2,f=-0.64) USER MOD Single : C 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N VAL A 2 -0.308 -8.937 13.701 1.00 0.00 N ATOM 22 CA VAL A 2 -1.126 -8.095 14.566 1.00 0.00 C ATOM 23 C VAL A 2 -2.270 -7.460 13.773 1.00 0.00 C ATOM 24 O VAL A 2 -3.156 -6.810 14.329 1.00 0.00 O ATOM 25 CB VAL A 2 -0.260 -6.993 15.228 1.00 0.00 C ATOM 26 CG1 VAL A 2 0.256 -6.004 14.189 1.00 0.00 C ATOM 27 CG2 VAL A 2 -1.026 -6.274 16.327 1.00 0.00 C ATOM 0 HA VAL A 2 -1.552 -8.723 15.349 1.00 0.00 H new ATOM 0 HB VAL A 2 0.600 -7.481 15.686 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.860 -5.242 14.681 1.00 0.00 H new ATOM 0 HG12 VAL A 2 0.865 -6.532 13.455 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -0.588 -5.530 13.687 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -0.391 -5.507 16.771 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.916 -5.808 15.905 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -1.320 -6.990 17.094 1.00 0.00 H new ATOM 37 N ILE A 3 -2.260 -7.683 12.470 1.00 0.00 N ATOM 38 CA ILE A 3 -3.259 -7.096 11.596 1.00 0.00 C ATOM 39 C ILE A 3 -3.894 -8.163 10.714 1.00 0.00 C ATOM 40 O ILE A 3 -3.211 -9.061 10.221 1.00 0.00 O ATOM 41 CB ILE A 3 -2.657 -5.967 10.718 1.00 0.00 C ATOM 42 CG1 ILE A 3 -3.754 -5.288 9.891 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.555 -6.507 9.811 1.00 0.00 C ATOM 44 CD1 ILE A 3 -3.262 -4.110 9.079 1.00 0.00 C ATOM 0 H ILE A 3 -1.571 -8.266 11.995 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.029 -6.655 12.230 1.00 0.00 H new ATOM 0 HB ILE A 3 -2.213 -5.224 11.380 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -4.197 -6.022 9.218 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -4.546 -4.951 10.560 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -1.151 -5.695 9.207 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.760 -6.936 10.421 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -1.966 -7.276 9.157 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -4.094 -3.681 8.520 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -2.846 -3.356 9.747 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.492 -4.444 8.384 1.00 0.00 H new ATOM 56 N ALA A 4 -5.207 -8.088 10.570 1.00 0.00 N ATOM 57 CA ALA A 4 -5.931 -8.951 9.658 1.00 0.00 C ATOM 58 C ALA A 4 -6.766 -8.103 8.710 1.00 0.00 C ATOM 59 O ALA A 4 -7.238 -7.025 9.073 1.00 0.00 O ATOM 60 CB ALA A 4 -6.810 -9.924 10.430 1.00 0.00 C ATOM 0 H ALA A 4 -5.796 -7.430 11.080 1.00 0.00 H new ATOM 0 HA ALA A 4 -5.219 -9.534 9.075 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -7.346 -10.564 9.730 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -6.188 -10.539 11.080 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.526 -9.367 11.034 1.00 0.00 H new ATOM 66 N THR A 5 -6.932 -8.598 7.489 1.00 0.00 N ATOM 67 CA THR A 5 -7.628 -7.870 6.436 1.00 0.00 C ATOM 68 C THR A 5 -9.085 -7.592 6.814 1.00 0.00 C ATOM 69 O THR A 5 -9.711 -6.682 6.278 1.00 0.00 O ATOM 70 CB THR A 5 -7.582 -8.666 5.116 1.00 0.00 C ATOM 71 OG1 THR A 5 -6.251 -9.155 4.897 1.00 0.00 O ATOM 72 CG2 THR A 5 -8.001 -7.805 3.932 1.00 0.00 C ATOM 0 H THR A 5 -6.588 -9.514 7.202 1.00 0.00 H new ATOM 0 HA THR A 5 -7.119 -6.915 6.306 1.00 0.00 H new ATOM 0 HB THR A 5 -8.281 -9.498 5.199 1.00 0.00 H new ATOM 0 HG1 THR A 5 -6.223 -9.662 4.059 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.957 -8.397 3.018 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.019 -7.448 4.084 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.327 -6.953 3.845 1.00 0.00 H new ATOM 80 N ASP A 6 -9.595 -8.343 7.783 1.00 0.00 N ATOM 81 CA ASP A 6 -11.004 -8.270 8.152 1.00 0.00 C ATOM 82 C ASP A 6 -11.264 -7.114 9.110 1.00 0.00 C ATOM 83 O ASP A 6 -12.405 -6.871 9.502 1.00 0.00 O ATOM 84 CB ASP A 6 -11.454 -9.583 8.796 1.00 0.00 C ATOM 85 CG ASP A 6 -11.256 -10.781 7.890 1.00 0.00 C ATOM 86 OD1 ASP A 6 -10.121 -11.296 7.821 1.00 0.00 O ATOM 87 OD2 ASP A 6 -12.234 -11.224 7.246 1.00 0.00 O ATOM 0 H ASP A 6 -9.052 -9.012 8.329 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.577 -8.099 7.241 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -10.899 -9.737 9.721 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.507 -9.508 9.066 1.00 0.00 H new ATOM 92 N ASP A 7 -10.211 -6.400 9.495 1.00 0.00 N ATOM 93 CA ASP A 7 -10.372 -5.236 10.359 1.00 0.00 C ATOM 94 C ASP A 7 -10.294 -3.956 9.543 1.00 0.00 C ATOM 95 O ASP A 7 -10.794 -2.908 9.959 1.00 0.00 O ATOM 96 CB ASP A 7 -9.276 -5.192 11.434 1.00 0.00 C ATOM 97 CG ASP A 7 -9.214 -6.438 12.294 1.00 0.00 C ATOM 98 OD1 ASP A 7 -10.104 -6.623 13.150 1.00 0.00 O ATOM 99 OD2 ASP A 7 -8.258 -7.225 12.134 1.00 0.00 O ATOM 0 H ASP A 7 -9.248 -6.603 9.226 1.00 0.00 H new ATOM 0 HA ASP A 7 -11.348 -5.317 10.838 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -8.310 -5.048 10.950 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -9.443 -4.327 12.075 1.00 0.00 H new ATOM 104 N LEU A 8 -9.687 -4.043 8.369 1.00 0.00 N ATOM 105 CA LEU A 8 -9.533 -2.875 7.514 1.00 0.00 C ATOM 106 C LEU A 8 -10.445 -2.974 6.305 1.00 0.00 C ATOM 107 O LEU A 8 -10.627 -2.007 5.564 1.00 0.00 O ATOM 108 CB LEU A 8 -8.080 -2.703 7.076 1.00 0.00 C ATOM 109 CG LEU A 8 -7.136 -2.145 8.140 1.00 0.00 C ATOM 110 CD1 LEU A 8 -6.803 -3.194 9.188 1.00 0.00 C ATOM 111 CD2 LEU A 8 -5.869 -1.616 7.495 1.00 0.00 C ATOM 0 H LEU A 8 -9.295 -4.904 7.988 1.00 0.00 H new ATOM 0 HA LEU A 8 -9.818 -1.996 8.092 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.700 -3.671 6.749 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.055 -2.042 6.210 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.644 -1.322 8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.130 -2.766 9.930 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.720 -3.524 9.677 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -6.320 -4.046 8.709 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -5.206 -1.222 8.265 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -5.367 -2.424 6.963 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.122 -0.822 6.793 1.00 0.00 H new ATOM 123 N GLU A 9 -11.026 -4.147 6.131 1.00 0.00 N ATOM 124 CA GLU A 9 -12.008 -4.378 5.094 1.00 0.00 C ATOM 125 C GLU A 9 -13.105 -5.272 5.627 1.00 0.00 C ATOM 126 O GLU A 9 -12.861 -6.185 6.415 1.00 0.00 O ATOM 127 CB GLU A 9 -11.385 -4.996 3.839 1.00 0.00 C ATOM 128 CG GLU A 9 -10.661 -3.986 2.965 1.00 0.00 C ATOM 129 CD GLU A 9 -10.164 -4.586 1.670 1.00 0.00 C ATOM 130 OE1 GLU A 9 -9.430 -5.592 1.722 1.00 0.00 O ATOM 131 OE2 GLU A 9 -10.495 -4.041 0.592 1.00 0.00 O ATOM 0 H GLU A 9 -10.828 -4.966 6.707 1.00 0.00 H new ATOM 0 HA GLU A 9 -12.424 -3.413 4.805 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -10.684 -5.776 4.137 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -12.168 -5.477 3.253 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -11.333 -3.157 2.742 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.817 -3.573 3.517 1.00 0.00 H new ATOM 138 N VAL A 10 -14.310 -4.988 5.201 1.00 0.00 N ATOM 139 CA VAL A 10 -15.474 -5.723 5.630 1.00 0.00 C ATOM 140 C VAL A 10 -16.239 -6.188 4.403 1.00 0.00 C ATOM 141 O VAL A 10 -16.293 -5.485 3.393 1.00 0.00 O ATOM 142 CB VAL A 10 -16.379 -4.852 6.536 1.00 0.00 C ATOM 143 CG1 VAL A 10 -16.805 -3.575 5.822 1.00 0.00 C ATOM 144 CG2 VAL A 10 -17.594 -5.637 7.008 1.00 0.00 C ATOM 0 H VAL A 10 -14.513 -4.236 4.543 1.00 0.00 H new ATOM 0 HA VAL A 10 -15.158 -6.586 6.216 1.00 0.00 H new ATOM 0 HB VAL A 10 -15.797 -4.569 7.413 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -17.439 -2.983 6.482 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -15.921 -2.996 5.553 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -17.359 -3.831 4.919 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -18.213 -5.003 7.642 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -18.174 -5.963 6.145 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -17.266 -6.508 7.575 1.00 0.00 H new ATOM 154 N ALA A 11 -16.796 -7.386 4.472 1.00 0.00 N ATOM 155 CA ALA A 11 -17.557 -7.927 3.363 1.00 0.00 C ATOM 156 C ALA A 11 -18.791 -7.081 3.113 1.00 0.00 C ATOM 157 O ALA A 11 -19.525 -6.741 4.040 1.00 0.00 O ATOM 158 CB ALA A 11 -17.930 -9.371 3.659 1.00 0.00 C ATOM 0 H ALA A 11 -16.734 -8.000 5.284 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.949 -7.906 2.458 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -18.502 -9.777 2.825 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -17.023 -9.960 3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -18.532 -9.413 4.567 1.00 0.00 H new ATOM 164 N CYS A 12 -18.994 -6.730 1.844 1.00 0.00 N ATOM 165 CA CYS A 12 -19.979 -5.741 1.439 1.00 0.00 C ATOM 166 C CYS A 12 -21.411 -6.170 1.787 1.00 0.00 C ATOM 167 O CYS A 12 -21.673 -7.364 1.882 1.00 0.00 O ATOM 168 CB CYS A 12 -19.834 -5.538 -0.073 1.00 0.00 C ATOM 169 SG CYS A 12 -20.843 -4.222 -0.786 1.00 0.00 S ATOM 0 H CYS A 12 -18.472 -7.131 1.065 1.00 0.00 H new ATOM 0 HA CYS A 12 -19.799 -4.812 1.979 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -18.787 -5.329 -0.294 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -20.084 -6.474 -0.572 1.00 0.00 H new ATOM 0 HG CYS A 12 -20.236 -3.722 -1.821 1.00 0.00 H new ATOM 174 N PRO A 13 -22.351 -5.219 1.981 1.00 0.00 N ATOM 175 CA PRO A 13 -23.751 -5.516 2.318 1.00 0.00 C ATOM 176 C PRO A 13 -24.340 -6.739 1.602 1.00 0.00 C ATOM 177 O PRO A 13 -25.098 -7.509 2.191 1.00 0.00 O ATOM 178 CB PRO A 13 -24.466 -4.254 1.843 1.00 0.00 C ATOM 179 CG PRO A 13 -23.500 -3.153 2.104 1.00 0.00 C ATOM 180 CD PRO A 13 -22.122 -3.756 1.929 1.00 0.00 C ATOM 0 HA PRO A 13 -23.856 -5.760 3.375 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.719 -4.317 0.785 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -25.399 -4.099 2.385 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.655 -2.326 1.411 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -23.626 -2.754 3.110 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.675 -3.457 0.981 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -21.443 -3.432 2.718 1.00 0.00 H new ATOM 188 N LYS A 14 -23.951 -6.940 0.345 1.00 0.00 N ATOM 189 CA LYS A 14 -24.664 -7.885 -0.508 1.00 0.00 C ATOM 190 C LYS A 14 -23.765 -8.672 -1.472 1.00 0.00 C ATOM 191 O LYS A 14 -24.083 -9.812 -1.814 1.00 0.00 O ATOM 192 CB LYS A 14 -25.739 -7.126 -1.293 1.00 0.00 C ATOM 193 CG LYS A 14 -26.494 -7.980 -2.298 1.00 0.00 C ATOM 194 CD LYS A 14 -27.498 -7.146 -3.078 1.00 0.00 C ATOM 195 CE LYS A 14 -28.076 -7.912 -4.260 1.00 0.00 C ATOM 196 NZ LYS A 14 -28.881 -9.085 -3.832 1.00 0.00 N ATOM 0 H LYS A 14 -23.161 -6.471 -0.098 1.00 0.00 H new ATOM 0 HA LYS A 14 -25.106 -8.632 0.151 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -26.452 -6.697 -0.589 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.270 -6.294 -1.819 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.789 -8.445 -2.987 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -27.012 -8.787 -1.779 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -28.306 -6.837 -2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -27.015 -6.237 -3.436 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -28.699 -7.243 -4.854 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -27.264 -8.247 -4.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -29.254 -9.575 -4.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.281 -9.738 -3.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -29.672 -8.765 -3.238 1.00 0.00 H new ATOM 210 N CYS A 15 -22.652 -8.104 -1.931 1.00 0.00 N ATOM 211 CA CYS A 15 -21.923 -8.752 -3.027 1.00 0.00 C ATOM 212 C CYS A 15 -20.514 -9.213 -2.677 1.00 0.00 C ATOM 213 O CYS A 15 -19.594 -9.065 -3.486 1.00 0.00 O ATOM 214 CB CYS A 15 -21.792 -7.757 -4.170 1.00 0.00 C ATOM 215 SG CYS A 15 -21.028 -6.201 -3.665 1.00 0.00 S ATOM 0 H CYS A 15 -22.246 -7.235 -1.583 1.00 0.00 H new ATOM 0 HA CYS A 15 -22.500 -9.642 -3.280 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -21.199 -8.204 -4.968 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -22.780 -7.553 -4.583 1.00 0.00 H new ATOM 0 HG CYS A 15 -21.691 -5.206 -4.176 1.00 0.00 H new ATOM 220 N GLU A 16 -20.369 -9.878 -1.556 1.00 0.00 N ATOM 221 CA GLU A 16 -19.070 -10.327 -1.080 1.00 0.00 C ATOM 222 C GLU A 16 -18.796 -11.718 -1.605 1.00 0.00 C ATOM 223 O GLU A 16 -18.070 -12.499 -0.994 1.00 0.00 O ATOM 224 CB GLU A 16 -19.075 -10.392 0.451 1.00 0.00 C ATOM 225 CG GLU A 16 -20.313 -9.809 1.111 1.00 0.00 C ATOM 226 CD GLU A 16 -21.467 -10.796 1.134 1.00 0.00 C ATOM 227 OE1 GLU A 16 -22.132 -10.959 0.095 1.00 0.00 O ATOM 228 OE2 GLU A 16 -21.697 -11.432 2.189 1.00 0.00 O ATOM 0 H GLU A 16 -21.145 -10.126 -0.943 1.00 0.00 H new ATOM 0 HA GLU A 16 -18.307 -9.630 -1.426 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -18.974 -11.433 0.756 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -18.198 -9.864 0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -20.072 -9.510 2.131 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.617 -8.908 0.578 1.00 0.00 H new ATOM 235 N ARG A 17 -19.385 -12.024 -2.746 1.00 0.00 N ATOM 236 CA ARG A 17 -19.493 -13.383 -3.206 1.00 0.00 C ATOM 237 C ARG A 17 -19.458 -13.361 -4.734 1.00 0.00 C ATOM 238 O ARG A 17 -19.035 -14.317 -5.381 1.00 0.00 O ATOM 239 CB ARG A 17 -20.798 -14.003 -2.692 1.00 0.00 C ATOM 240 CG ARG A 17 -22.050 -13.258 -3.141 1.00 0.00 C ATOM 241 CD ARG A 17 -23.268 -13.676 -2.336 1.00 0.00 C ATOM 242 NE ARG A 17 -23.168 -13.245 -0.942 1.00 0.00 N ATOM 243 CZ ARG A 17 -23.638 -13.938 0.093 1.00 0.00 C ATOM 244 NH1 ARG A 17 -24.284 -15.083 -0.102 1.00 0.00 N ATOM 245 NH2 ARG A 17 -23.465 -13.476 1.325 1.00 0.00 N ATOM 0 H ARG A 17 -19.799 -11.335 -3.374 1.00 0.00 H new ATOM 0 HA ARG A 17 -18.670 -13.990 -2.829 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -20.858 -15.036 -3.034 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.773 -14.029 -1.603 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.893 -12.185 -3.034 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -22.229 -13.450 -4.199 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -24.165 -13.250 -2.785 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -23.376 -14.760 -2.375 1.00 0.00 H new ATOM 0 HE ARG A 17 -22.708 -12.355 -0.750 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -24.422 -15.436 -1.049 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -24.642 -15.609 0.695 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.974 -12.594 1.475 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.823 -14.002 2.122 1.00 0.00 H new ATOM 259 N ALA A 18 -19.898 -12.224 -5.299 1.00 0.00 N ATOM 260 CA ALA A 18 -20.125 -12.142 -6.741 1.00 0.00 C ATOM 261 C ALA A 18 -19.333 -11.022 -7.404 1.00 0.00 C ATOM 262 O ALA A 18 -18.809 -11.190 -8.503 1.00 0.00 O ATOM 263 CB ALA A 18 -21.610 -11.977 -7.030 1.00 0.00 C ATOM 0 H ALA A 18 -20.099 -11.366 -4.785 1.00 0.00 H new ATOM 0 HA ALA A 18 -19.768 -13.078 -7.170 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -21.767 -11.917 -8.107 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -22.156 -12.832 -6.631 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -21.973 -11.063 -6.559 1.00 0.00 H new ATOM 269 N GLY A 19 -19.250 -9.882 -6.739 1.00 0.00 N ATOM 270 CA GLY A 19 -18.566 -8.748 -7.324 1.00 0.00 C ATOM 271 C GLY A 19 -19.522 -7.819 -8.043 1.00 0.00 C ATOM 272 O GLY A 19 -19.103 -6.918 -8.763 1.00 0.00 O ATOM 0 H GLY A 19 -19.641 -9.721 -5.811 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -18.044 -8.197 -6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.809 -9.102 -8.024 1.00 0.00 H new ATOM 276 N GLU A 20 -20.803 -8.006 -7.784 1.00 0.00 N ATOM 277 CA GLU A 20 -21.853 -7.229 -8.428 1.00 0.00 C ATOM 278 C GLU A 20 -23.058 -7.169 -7.523 1.00 0.00 C ATOM 279 O GLU A 20 -23.178 -7.947 -6.582 1.00 0.00 O ATOM 280 CB GLU A 20 -22.287 -7.829 -9.773 1.00 0.00 C ATOM 281 CG GLU A 20 -22.326 -9.349 -9.781 1.00 0.00 C ATOM 282 CD GLU A 20 -22.961 -9.920 -11.031 1.00 0.00 C ATOM 283 OE1 GLU A 20 -24.208 -10.009 -11.082 1.00 0.00 O ATOM 284 OE2 GLU A 20 -22.220 -10.301 -11.957 1.00 0.00 O ATOM 0 H GLU A 20 -21.148 -8.700 -7.121 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.448 -6.235 -8.615 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -23.276 -7.448 -10.029 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -21.603 -7.488 -10.550 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -21.310 -9.733 -9.689 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -22.879 -9.697 -8.908 1.00 0.00 H new ATOM 291 N ILE A 21 -23.948 -6.260 -7.820 1.00 0.00 N ATOM 292 CA ILE A 21 -25.214 -6.196 -7.136 1.00 0.00 C ATOM 293 C ILE A 21 -26.285 -6.049 -8.174 1.00 0.00 C ATOM 294 O ILE A 21 -26.253 -5.116 -8.974 1.00 0.00 O ATOM 295 CB ILE A 21 -25.320 -5.043 -6.110 1.00 0.00 C ATOM 296 CG1 ILE A 21 -24.397 -5.315 -4.910 1.00 0.00 C ATOM 297 CG2 ILE A 21 -26.765 -4.868 -5.655 1.00 0.00 C ATOM 298 CD1 ILE A 21 -24.572 -4.355 -3.747 1.00 0.00 C ATOM 0 H ILE A 21 -23.818 -5.547 -8.538 1.00 0.00 H new ATOM 0 HA ILE A 21 -25.324 -7.113 -6.557 1.00 0.00 H new ATOM 0 HB ILE A 21 -25.000 -4.116 -6.587 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -24.574 -6.330 -4.555 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -23.362 -5.271 -5.248 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -26.823 -4.053 -4.933 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -27.392 -4.636 -6.516 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -27.114 -5.790 -5.190 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.881 -4.623 -2.947 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -24.365 -3.338 -4.080 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -25.596 -4.414 -3.377 1.00 0.00 H new ATOM 310 N GLU A 22 -27.207 -6.990 -8.177 1.00 0.00 N ATOM 311 CA GLU A 22 -28.292 -6.974 -9.131 1.00 0.00 C ATOM 312 C GLU A 22 -27.753 -6.904 -10.567 1.00 0.00 C ATOM 313 O GLU A 22 -28.251 -6.141 -11.392 1.00 0.00 O ATOM 314 CB GLU A 22 -29.183 -5.771 -8.821 1.00 0.00 C ATOM 315 CG GLU A 22 -30.661 -6.048 -9.001 1.00 0.00 C ATOM 316 CD GLU A 22 -31.159 -7.072 -8.002 1.00 0.00 C ATOM 317 OE1 GLU A 22 -30.953 -8.285 -8.229 1.00 0.00 O ATOM 318 OE2 GLU A 22 -31.741 -6.666 -6.973 1.00 0.00 O ATOM 0 H GLU A 22 -27.225 -7.776 -7.527 1.00 0.00 H new ATOM 0 HA GLU A 22 -28.873 -7.893 -9.050 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -29.004 -5.452 -7.794 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -28.896 -4.941 -9.467 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -31.223 -5.121 -8.885 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -30.844 -6.407 -10.014 1.00 0.00 H new ATOM 325 N GLY A 23 -26.700 -7.671 -10.844 1.00 0.00 N ATOM 326 CA GLY A 23 -26.140 -7.726 -12.188 1.00 0.00 C ATOM 327 C GLY A 23 -25.327 -6.496 -12.564 1.00 0.00 C ATOM 328 O GLY A 23 -24.748 -6.435 -13.650 1.00 0.00 O ATOM 0 H GLY A 23 -26.222 -8.258 -10.160 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -25.506 -8.609 -12.272 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -26.952 -7.847 -12.905 1.00 0.00 H new ATOM 332 N THR A 24 -25.273 -5.524 -11.671 1.00 0.00 N ATOM 333 CA THR A 24 -24.640 -4.248 -11.975 1.00 0.00 C ATOM 334 C THR A 24 -23.453 -3.967 -11.035 1.00 0.00 C ATOM 335 O THR A 24 -23.335 -4.588 -9.973 1.00 0.00 O ATOM 336 CB THR A 24 -25.706 -3.133 -11.867 1.00 0.00 C ATOM 337 OG1 THR A 24 -25.505 -2.134 -12.876 1.00 0.00 O ATOM 338 CG2 THR A 24 -25.706 -2.470 -10.495 1.00 0.00 C ATOM 0 H THR A 24 -25.659 -5.591 -10.729 1.00 0.00 H new ATOM 0 HA THR A 24 -24.238 -4.279 -12.988 1.00 0.00 H new ATOM 0 HB THR A 24 -26.674 -3.612 -12.015 1.00 0.00 H new ATOM 0 HG1 THR A 24 -26.191 -1.440 -12.790 1.00 0.00 H new ATOM 0 HG21 THR A 24 -26.471 -1.694 -10.466 1.00 0.00 H new ATOM 0 HG22 THR A 24 -25.918 -3.217 -9.730 1.00 0.00 H new ATOM 0 HG23 THR A 24 -24.729 -2.024 -10.306 1.00 0.00 H new ATOM 346 N PRO A 25 -22.543 -3.046 -11.431 1.00 0.00 N ATOM 347 CA PRO A 25 -21.413 -2.625 -10.592 1.00 0.00 C ATOM 348 C PRO A 25 -21.879 -2.080 -9.245 1.00 0.00 C ATOM 349 O PRO A 25 -22.850 -1.329 -9.161 1.00 0.00 O ATOM 350 CB PRO A 25 -20.726 -1.526 -11.417 1.00 0.00 C ATOM 351 CG PRO A 25 -21.748 -1.103 -12.415 1.00 0.00 C ATOM 352 CD PRO A 25 -22.535 -2.343 -12.724 1.00 0.00 C ATOM 0 HA PRO A 25 -20.749 -3.456 -10.354 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -20.420 -0.691 -10.786 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -19.828 -1.902 -11.906 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -22.390 -0.319 -12.013 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -21.279 -0.701 -13.313 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -23.544 -2.109 -13.065 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -22.064 -2.938 -13.506 1.00 0.00 H new ATOM 360 N CYS A 26 -21.178 -2.466 -8.195 1.00 0.00 N ATOM 361 CA CYS A 26 -21.607 -2.177 -6.839 1.00 0.00 C ATOM 362 C CYS A 26 -21.041 -0.854 -6.310 1.00 0.00 C ATOM 363 O CYS A 26 -19.877 -0.537 -6.542 1.00 0.00 O ATOM 364 CB CYS A 26 -21.181 -3.329 -5.940 1.00 0.00 C ATOM 365 SG CYS A 26 -21.530 -3.076 -4.169 1.00 0.00 S ATOM 0 H CYS A 26 -20.302 -2.985 -8.257 1.00 0.00 H new ATOM 0 HA CYS A 26 -22.692 -2.070 -6.841 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -21.686 -4.237 -6.271 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -20.111 -3.495 -6.066 1.00 0.00 H new ATOM 0 HG CYS A 26 -20.898 -3.972 -3.470 1.00 0.00 H new ATOM 370 N PRO A 27 -21.886 -0.106 -5.555 1.00 0.00 N ATOM 371 CA PRO A 27 -21.593 1.210 -4.965 1.00 0.00 C ATOM 372 C PRO A 27 -20.122 1.512 -4.648 1.00 0.00 C ATOM 373 O PRO A 27 -19.590 2.536 -5.073 1.00 0.00 O ATOM 374 CB PRO A 27 -22.387 1.137 -3.664 1.00 0.00 C ATOM 375 CG PRO A 27 -23.599 0.319 -3.982 1.00 0.00 C ATOM 376 CD PRO A 27 -23.279 -0.483 -5.233 1.00 0.00 C ATOM 0 HA PRO A 27 -21.848 2.004 -5.667 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -21.799 0.676 -2.871 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -22.665 2.132 -3.317 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -23.846 -0.343 -3.152 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -24.465 0.960 -4.146 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -23.371 -1.554 -5.054 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -23.958 -0.236 -6.049 1.00 0.00 H new ATOM 384 N ALA A 28 -19.470 0.619 -3.911 1.00 0.00 N ATOM 385 CA ALA A 28 -18.165 0.932 -3.334 1.00 0.00 C ATOM 386 C ALA A 28 -17.145 -0.178 -3.565 1.00 0.00 C ATOM 387 O ALA A 28 -15.978 -0.040 -3.216 1.00 0.00 O ATOM 388 CB ALA A 28 -18.311 1.198 -1.844 1.00 0.00 C ATOM 0 H ALA A 28 -19.817 -0.317 -3.700 1.00 0.00 H new ATOM 0 HA ALA A 28 -17.792 1.824 -3.838 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.335 1.431 -1.419 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.985 2.041 -1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -18.718 0.313 -1.355 1.00 0.00 H new ATOM 394 N CYS A 29 -17.586 -1.282 -4.138 1.00 0.00 N ATOM 395 CA CYS A 29 -16.693 -2.401 -4.395 1.00 0.00 C ATOM 396 C CYS A 29 -16.886 -2.905 -5.822 1.00 0.00 C ATOM 397 O CYS A 29 -17.832 -3.647 -6.107 1.00 0.00 O ATOM 398 CB CYS A 29 -16.944 -3.521 -3.370 1.00 0.00 C ATOM 399 SG CYS A 29 -18.609 -4.222 -3.436 1.00 0.00 S ATOM 0 H CYS A 29 -18.551 -1.430 -4.434 1.00 0.00 H new ATOM 0 HA CYS A 29 -15.660 -2.071 -4.289 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -16.219 -4.318 -3.534 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -16.766 -3.129 -2.369 1.00 0.00 H new ATOM 0 HG CYS A 29 -19.436 -3.333 -3.900 1.00 0.00 H new ATOM 404 N SER A 30 -15.998 -2.490 -6.717 1.00 0.00 N ATOM 405 CA SER A 30 -16.113 -2.815 -8.131 1.00 0.00 C ATOM 406 C SER A 30 -15.663 -4.248 -8.430 1.00 0.00 C ATOM 407 O SER A 30 -14.766 -4.471 -9.245 1.00 0.00 O ATOM 408 CB SER A 30 -15.283 -1.825 -8.952 1.00 0.00 C ATOM 409 OG SER A 30 -15.584 -0.484 -8.591 1.00 0.00 O ATOM 0 H SER A 30 -15.183 -1.922 -6.484 1.00 0.00 H new ATOM 0 HA SER A 30 -17.165 -2.740 -8.407 1.00 0.00 H new ATOM 0 HB2 SER A 30 -14.222 -2.018 -8.796 1.00 0.00 H new ATOM 0 HB3 SER A 30 -15.481 -1.972 -10.014 1.00 0.00 H new ATOM 0 HG SER A 30 -15.040 0.129 -9.128 1.00 0.00 H new ATOM 415 N GLY A 31 -16.269 -5.215 -7.753 1.00 0.00 N ATOM 416 CA GLY A 31 -15.997 -6.604 -8.056 1.00 0.00 C ATOM 417 C GLY A 31 -14.832 -7.124 -7.260 1.00 0.00 C ATOM 418 O GLY A 31 -13.937 -7.781 -7.791 1.00 0.00 O ATOM 0 H GLY A 31 -16.942 -5.062 -7.002 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.882 -7.204 -7.842 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.788 -6.711 -9.120 1.00 0.00 H new ATOM 422 N LYS A 32 -14.855 -6.839 -5.972 1.00 0.00 N ATOM 423 CA LYS A 32 -13.735 -7.129 -5.100 1.00 0.00 C ATOM 424 C LYS A 32 -14.176 -8.097 -4.014 1.00 0.00 C ATOM 425 O LYS A 32 -13.422 -8.970 -3.600 1.00 0.00 O ATOM 426 CB LYS A 32 -13.259 -5.821 -4.475 1.00 0.00 C ATOM 427 CG LYS A 32 -13.239 -4.677 -5.475 1.00 0.00 C ATOM 428 CD LYS A 32 -13.278 -3.323 -4.793 1.00 0.00 C ATOM 429 CE LYS A 32 -11.977 -3.013 -4.092 1.00 0.00 C ATOM 430 NZ LYS A 32 -10.836 -3.018 -5.046 1.00 0.00 N ATOM 0 H LYS A 32 -15.648 -6.401 -5.503 1.00 0.00 H new ATOM 0 HA LYS A 32 -12.922 -7.584 -5.665 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -13.912 -5.561 -3.642 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.259 -5.960 -4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.341 -4.748 -6.088 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -14.092 -4.769 -6.147 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -13.487 -2.549 -5.532 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -14.094 -3.303 -4.071 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.045 -2.039 -3.608 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.800 -3.748 -3.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -9.970 -2.719 -4.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.705 -3.977 -5.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.034 -2.361 -5.827 1.00 0.00 H new ATOM 444 N GLY A 33 -15.411 -7.913 -3.545 1.00 0.00 N ATOM 445 CA GLY A 33 -15.961 -8.762 -2.526 1.00 0.00 C ATOM 446 C GLY A 33 -16.155 -7.994 -1.241 1.00 0.00 C ATOM 447 O GLY A 33 -17.181 -8.121 -0.577 1.00 0.00 O ATOM 0 H GLY A 33 -16.039 -7.176 -3.866 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.915 -9.169 -2.860 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.297 -9.609 -2.353 1.00 0.00 H new ATOM 451 N VAL A 34 -15.201 -7.131 -0.923 1.00 0.00 N ATOM 452 CA VAL A 34 -15.239 -6.394 0.332 1.00 0.00 C ATOM 453 C VAL A 34 -15.135 -4.886 0.113 1.00 0.00 C ATOM 454 O VAL A 34 -14.873 -4.420 -1.001 1.00 0.00 O ATOM 455 CB VAL A 34 -14.088 -6.840 1.263 1.00 0.00 C ATOM 456 CG1 VAL A 34 -14.247 -8.297 1.673 1.00 0.00 C ATOM 457 CG2 VAL A 34 -12.742 -6.632 0.586 1.00 0.00 C ATOM 0 H VAL A 34 -14.395 -6.924 -1.513 1.00 0.00 H new ATOM 0 HA VAL A 34 -16.201 -6.615 0.795 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.130 -6.225 2.162 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.423 -8.583 2.327 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.192 -8.425 2.201 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.240 -8.928 0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -11.944 -6.952 1.257 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.702 -7.219 -0.332 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.614 -5.576 0.347 1.00 0.00 H new ATOM 467 N ILE A 35 -15.385 -4.143 1.183 1.00 0.00 N ATOM 468 CA ILE A 35 -15.196 -2.697 1.208 1.00 0.00 C ATOM 469 C ILE A 35 -14.361 -2.304 2.426 1.00 0.00 C ATOM 470 O ILE A 35 -14.260 -3.066 3.382 1.00 0.00 O ATOM 471 CB ILE A 35 -16.545 -1.943 1.245 1.00 0.00 C ATOM 472 CG1 ILE A 35 -17.467 -2.553 2.304 1.00 0.00 C ATOM 473 CG2 ILE A 35 -17.207 -1.967 -0.123 1.00 0.00 C ATOM 474 CD1 ILE A 35 -18.760 -1.791 2.504 1.00 0.00 C ATOM 0 H ILE A 35 -15.727 -4.528 2.064 1.00 0.00 H new ATOM 0 HA ILE A 35 -14.677 -2.416 0.292 1.00 0.00 H new ATOM 0 HB ILE A 35 -16.355 -0.904 1.513 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -17.701 -3.579 2.020 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -16.933 -2.599 3.253 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -18.155 -1.432 -0.078 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -16.554 -1.487 -0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -17.387 -3.000 -0.422 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -19.359 -2.285 3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -18.537 -0.772 2.820 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -19.317 -1.767 1.567 1.00 0.00 H new ATOM 486 N LEU A 36 -13.781 -1.113 2.392 1.00 0.00 N ATOM 487 CA LEU A 36 -12.805 -0.704 3.406 1.00 0.00 C ATOM 488 C LEU A 36 -13.445 -0.062 4.632 1.00 0.00 C ATOM 489 O LEU A 36 -14.606 0.348 4.612 1.00 0.00 O ATOM 490 CB LEU A 36 -11.798 0.286 2.810 1.00 0.00 C ATOM 491 CG LEU A 36 -11.039 -0.207 1.579 1.00 0.00 C ATOM 492 CD1 LEU A 36 -11.785 0.145 0.299 1.00 0.00 C ATOM 493 CD2 LEU A 36 -9.639 0.370 1.564 1.00 0.00 C ATOM 0 H LEU A 36 -13.965 -0.410 1.676 1.00 0.00 H new ATOM 0 HA LEU A 36 -12.307 -1.619 3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -12.328 1.201 2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.073 0.548 3.581 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.967 -1.293 1.631 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.223 -0.218 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -12.770 -0.322 0.312 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.897 1.227 0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -9.107 0.012 0.682 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -9.694 1.458 1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -9.106 0.056 2.462 1.00 0.00 H new ATOM 505 N THR A 37 -12.646 0.022 5.693 1.00 0.00 N ATOM 506 CA THR A 37 -13.017 0.725 6.913 1.00 0.00 C ATOM 507 C THR A 37 -12.232 2.033 6.972 1.00 0.00 C ATOM 508 O THR A 37 -11.415 2.278 6.093 1.00 0.00 O ATOM 509 CB THR A 37 -12.689 -0.118 8.168 1.00 0.00 C ATOM 510 OG1 THR A 37 -11.267 -0.270 8.305 1.00 0.00 O ATOM 511 CG2 THR A 37 -13.322 -1.498 8.081 1.00 0.00 C ATOM 0 H THR A 37 -11.718 -0.399 5.728 1.00 0.00 H new ATOM 0 HA THR A 37 -14.091 0.912 6.900 1.00 0.00 H new ATOM 0 HB THR A 37 -13.094 0.406 9.034 1.00 0.00 H new ATOM 0 HG1 THR A 37 -11.068 -0.749 9.137 1.00 0.00 H new ATOM 0 HG21 THR A 37 -13.075 -2.069 8.976 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.404 -1.397 8.002 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.941 -2.018 7.202 1.00 0.00 H new ATOM 519 N ALA A 38 -12.453 2.859 7.990 1.00 0.00 N ATOM 520 CA ALA A 38 -11.766 4.152 8.088 1.00 0.00 C ATOM 521 C ALA A 38 -10.250 3.990 8.043 1.00 0.00 C ATOM 522 O ALA A 38 -9.568 4.704 7.307 1.00 0.00 O ATOM 523 CB ALA A 38 -12.186 4.888 9.346 1.00 0.00 C ATOM 0 H ALA A 38 -13.097 2.662 8.756 1.00 0.00 H new ATOM 0 HA ALA A 38 -12.060 4.745 7.222 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -11.665 5.844 9.399 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -13.262 5.062 9.324 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -11.933 4.288 10.220 1.00 0.00 H new ATOM 529 N GLN A 39 -9.721 3.051 8.820 1.00 0.00 N ATOM 530 CA GLN A 39 -8.290 2.766 8.790 1.00 0.00 C ATOM 531 C GLN A 39 -7.858 2.305 7.401 1.00 0.00 C ATOM 532 O GLN A 39 -6.809 2.715 6.900 1.00 0.00 O ATOM 533 CB GLN A 39 -7.920 1.712 9.837 1.00 0.00 C ATOM 534 CG GLN A 39 -6.478 1.240 9.727 1.00 0.00 C ATOM 535 CD GLN A 39 -6.061 0.340 10.867 1.00 0.00 C ATOM 536 OE1 GLN A 39 -6.882 -0.351 11.465 1.00 0.00 O ATOM 537 NE2 GLN A 39 -4.771 0.330 11.162 1.00 0.00 N ATOM 0 H GLN A 39 -10.256 2.478 9.473 1.00 0.00 H new ATOM 0 HA GLN A 39 -7.761 3.689 9.029 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -8.086 2.124 10.832 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -8.585 0.855 9.732 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -6.347 0.708 8.785 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -5.819 2.108 9.697 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -4.124 0.920 10.639 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -4.424 -0.268 11.912 1.00 0.00 H new ATOM 546 N GLY A 40 -8.677 1.471 6.772 1.00 0.00 N ATOM 547 CA GLY A 40 -8.382 1.008 5.438 1.00 0.00 C ATOM 548 C GLY A 40 -8.486 2.127 4.425 1.00 0.00 C ATOM 549 O GLY A 40 -7.769 2.146 3.430 1.00 0.00 O ATOM 0 H GLY A 40 -9.544 1.108 7.168 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -7.378 0.585 5.413 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.071 0.208 5.169 1.00 0.00 H new ATOM 553 N TYR A 41 -9.374 3.070 4.698 1.00 0.00 N ATOM 554 CA TYR A 41 -9.540 4.240 3.856 1.00 0.00 C ATOM 555 C TYR A 41 -8.337 5.162 3.965 1.00 0.00 C ATOM 556 O TYR A 41 -7.948 5.797 2.985 1.00 0.00 O ATOM 557 CB TYR A 41 -10.815 4.989 4.263 1.00 0.00 C ATOM 558 CG TYR A 41 -12.046 4.611 3.467 1.00 0.00 C ATOM 559 CD1 TYR A 41 -12.329 5.230 2.257 1.00 0.00 C ATOM 560 CD2 TYR A 41 -12.931 3.645 3.929 1.00 0.00 C ATOM 561 CE1 TYR A 41 -13.454 4.893 1.530 1.00 0.00 C ATOM 562 CE2 TYR A 41 -14.056 3.303 3.207 1.00 0.00 C ATOM 563 CZ TYR A 41 -14.313 3.930 2.009 1.00 0.00 C ATOM 564 OH TYR A 41 -15.435 3.594 1.286 1.00 0.00 O ATOM 0 H TYR A 41 -9.996 3.045 5.506 1.00 0.00 H new ATOM 0 HA TYR A 41 -9.624 3.914 2.819 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -11.009 4.803 5.319 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -10.642 6.060 4.155 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -11.659 5.987 1.878 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -12.735 3.153 4.870 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -13.659 5.383 0.590 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -14.731 2.547 3.580 1.00 0.00 H new ATOM 0 HH TYR A 41 -15.934 2.898 1.762 1.00 0.00 H new ATOM 574 N THR A 42 -7.725 5.211 5.137 1.00 0.00 N ATOM 575 CA THR A 42 -6.488 5.956 5.308 1.00 0.00 C ATOM 576 C THR A 42 -5.339 5.262 4.578 1.00 0.00 C ATOM 577 O THR A 42 -4.438 5.911 4.035 1.00 0.00 O ATOM 578 CB THR A 42 -6.131 6.076 6.795 1.00 0.00 C ATOM 579 OG1 THR A 42 -7.295 6.438 7.541 1.00 0.00 O ATOM 580 CG2 THR A 42 -5.040 7.112 7.011 1.00 0.00 C ATOM 0 H THR A 42 -8.062 4.746 5.980 1.00 0.00 H new ATOM 0 HA THR A 42 -6.638 6.951 4.889 1.00 0.00 H new ATOM 0 HB THR A 42 -5.760 5.111 7.139 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.943 5.703 7.513 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.806 7.177 8.073 1.00 0.00 H new ATOM 0 HG22 THR A 42 -4.146 6.820 6.460 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.385 8.083 6.655 1.00 0.00 H new ATOM 588 N LEU A 43 -5.406 3.939 4.522 1.00 0.00 N ATOM 589 CA LEU A 43 -4.352 3.152 3.904 1.00 0.00 C ATOM 590 C LEU A 43 -4.585 3.022 2.406 1.00 0.00 C ATOM 591 O LEU A 43 -3.675 2.648 1.679 1.00 0.00 O ATOM 592 CB LEU A 43 -4.250 1.751 4.542 1.00 0.00 C ATOM 593 CG LEU A 43 -3.122 1.553 5.579 1.00 0.00 C ATOM 594 CD1 LEU A 43 -3.211 2.595 6.681 1.00 0.00 C ATOM 595 CD2 LEU A 43 -3.201 0.158 6.175 1.00 0.00 C ATOM 0 H LEU A 43 -6.179 3.390 4.897 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.411 3.676 4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.201 1.524 5.023 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.114 1.021 3.744 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.165 1.672 5.071 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.407 2.435 7.399 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.118 3.591 6.248 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.172 2.508 7.188 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.402 0.028 6.905 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.165 0.026 6.666 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.093 -0.583 5.383 1.00 0.00 H new ATOM 607 N LEU A 44 -5.784 3.352 1.917 1.00 0.00 N ATOM 608 CA LEU A 44 -6.034 3.260 0.485 1.00 0.00 C ATOM 609 C LEU A 44 -5.536 4.522 -0.209 1.00 0.00 C ATOM 610 O LEU A 44 -4.926 4.446 -1.264 1.00 0.00 O ATOM 611 CB LEU A 44 -7.525 2.976 0.167 1.00 0.00 C ATOM 612 CG LEU A 44 -8.487 4.178 0.072 1.00 0.00 C ATOM 613 CD1 LEU A 44 -8.366 4.885 -1.274 1.00 0.00 C ATOM 614 CD2 LEU A 44 -9.923 3.724 0.264 1.00 0.00 C ATOM 0 H LEU A 44 -6.573 3.676 2.477 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.477 2.408 0.097 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.568 2.438 -0.780 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -7.907 2.302 0.934 1.00 0.00 H new ATOM 0 HG LEU A 44 -8.211 4.877 0.862 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.058 5.727 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -7.346 5.248 -1.404 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -8.607 4.186 -2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -10.589 4.584 0.194 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -10.182 3.001 -0.509 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.030 3.261 1.245 1.00 0.00 H new ATOM 626 N ASP A 45 -5.753 5.675 0.413 1.00 0.00 N ATOM 627 CA ASP A 45 -5.349 6.948 -0.178 1.00 0.00 C ATOM 628 C ASP A 45 -3.836 7.079 -0.172 1.00 0.00 C ATOM 629 O ASP A 45 -3.255 7.781 -0.997 1.00 0.00 O ATOM 630 CB ASP A 45 -5.982 8.114 0.587 1.00 0.00 C ATOM 631 CG ASP A 45 -5.512 9.472 0.094 1.00 0.00 C ATOM 632 OD1 ASP A 45 -5.970 9.908 -0.981 1.00 0.00 O ATOM 633 OD2 ASP A 45 -4.695 10.117 0.792 1.00 0.00 O ATOM 0 H ASP A 45 -6.205 5.756 1.324 1.00 0.00 H new ATOM 0 HA ASP A 45 -5.697 6.975 -1.211 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.067 8.056 0.495 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.746 8.017 1.647 1.00 0.00 H new ATOM 638 N PHE A 46 -3.197 6.350 0.723 1.00 0.00 N ATOM 639 CA PHE A 46 -1.747 6.305 0.758 1.00 0.00 C ATOM 640 C PHE A 46 -1.231 5.481 -0.385 1.00 0.00 C ATOM 641 O PHE A 46 -0.288 5.863 -1.076 1.00 0.00 O ATOM 642 CB PHE A 46 -1.293 5.615 2.034 1.00 0.00 C ATOM 643 CG PHE A 46 -0.061 6.202 2.643 1.00 0.00 C ATOM 644 CD1 PHE A 46 -0.125 7.398 3.332 1.00 0.00 C ATOM 645 CD2 PHE A 46 1.159 5.558 2.528 1.00 0.00 C ATOM 646 CE1 PHE A 46 1.006 7.945 3.894 1.00 0.00 C ATOM 647 CE2 PHE A 46 2.296 6.100 3.088 1.00 0.00 C ATOM 648 CZ PHE A 46 2.219 7.295 3.774 1.00 0.00 C ATOM 0 H PHE A 46 -3.657 5.782 1.434 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.372 7.327 0.702 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.101 5.658 2.764 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.112 4.562 1.820 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -1.072 7.908 3.430 1.00 0.00 H new ATOM 0 HD2 PHE A 46 1.221 4.621 1.994 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.945 8.882 4.428 1.00 0.00 H new ATOM 0 HE2 PHE A 46 3.244 5.591 2.990 1.00 0.00 H new ATOM 0 HZ PHE A 46 3.107 7.722 4.217 1.00 0.00 H new ATOM 658 N ILE A 47 -1.862 4.355 -0.600 1.00 0.00 N ATOM 659 CA ILE A 47 -1.364 3.435 -1.575 1.00 0.00 C ATOM 660 C ILE A 47 -1.768 3.875 -2.980 1.00 0.00 C ATOM 661 O ILE A 47 -1.059 3.615 -3.951 1.00 0.00 O ATOM 662 CB ILE A 47 -1.812 1.996 -1.268 1.00 0.00 C ATOM 663 CG1 ILE A 47 -3.337 1.888 -1.296 1.00 0.00 C ATOM 664 CG2 ILE A 47 -1.278 1.596 0.098 1.00 0.00 C ATOM 665 CD1 ILE A 47 -3.866 0.524 -0.907 1.00 0.00 C ATOM 0 H ILE A 47 -2.711 4.061 -0.117 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.275 3.440 -1.528 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.416 1.323 -2.029 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.756 2.635 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.690 2.131 -2.298 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.590 0.577 0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.189 1.650 0.093 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -1.672 2.274 0.855 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.955 0.530 -0.952 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -3.478 -0.227 -1.596 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.546 0.285 0.107 1.00 0.00 H new ATOM 677 N GLN A 48 -2.895 4.576 -3.069 1.00 0.00 N ATOM 678 CA GLN A 48 -3.256 5.307 -4.268 1.00 0.00 C ATOM 679 C GLN A 48 -2.135 6.254 -4.640 1.00 0.00 C ATOM 680 O GLN A 48 -1.504 6.116 -5.669 1.00 0.00 O ATOM 681 CB GLN A 48 -4.530 6.123 -4.034 1.00 0.00 C ATOM 682 CG GLN A 48 -5.791 5.290 -3.892 1.00 0.00 C ATOM 683 CD GLN A 48 -6.102 4.488 -5.139 1.00 0.00 C ATOM 684 OE1 GLN A 48 -5.773 4.893 -6.254 1.00 0.00 O ATOM 685 NE2 GLN A 48 -6.743 3.348 -4.957 1.00 0.00 N ATOM 0 H GLN A 48 -3.577 4.650 -2.314 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.428 4.591 -5.071 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.402 6.723 -3.133 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -4.660 6.818 -4.864 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -5.681 4.612 -3.046 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.632 5.946 -3.667 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -6.997 3.050 -4.015 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -6.984 2.765 -5.758 1.00 0.00 H new ATOM 694 N LYS A 49 -1.827 7.132 -3.713 1.00 0.00 N ATOM 695 CA LYS A 49 -1.016 8.313 -3.968 1.00 0.00 C ATOM 696 C LYS A 49 0.484 8.012 -4.031 1.00 0.00 C ATOM 697 O LYS A 49 1.286 8.902 -4.281 1.00 0.00 O ATOM 698 CB LYS A 49 -1.373 9.327 -2.878 1.00 0.00 C ATOM 699 CG LYS A 49 -0.438 10.514 -2.702 1.00 0.00 C ATOM 700 CD LYS A 49 -0.999 11.496 -1.675 1.00 0.00 C ATOM 701 CE LYS A 49 -1.935 10.797 -0.696 1.00 0.00 C ATOM 702 NZ LYS A 49 -2.323 11.659 0.447 1.00 0.00 N ATOM 0 H LYS A 49 -2.135 7.050 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.237 8.717 -4.956 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.371 9.711 -3.087 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.428 8.796 -1.928 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.544 10.166 -2.381 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.300 11.019 -3.658 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.179 11.962 -1.128 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.535 12.295 -2.187 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.833 10.477 -1.225 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.451 9.897 -0.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.298 11.438 0.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.680 11.486 1.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.263 12.658 0.164 1.00 0.00 H new ATOM 716 N HIS A 50 0.901 6.779 -3.798 1.00 0.00 N ATOM 717 CA HIS A 50 2.300 6.486 -4.116 1.00 0.00 C ATOM 718 C HIS A 50 2.482 5.417 -5.201 1.00 0.00 C ATOM 719 O HIS A 50 3.612 5.107 -5.566 1.00 0.00 O ATOM 720 CB HIS A 50 3.058 6.114 -2.838 1.00 0.00 C ATOM 721 CG HIS A 50 2.855 7.120 -1.742 1.00 0.00 C ATOM 722 ND1 HIS A 50 2.156 6.838 -0.594 1.00 0.00 N ATOM 723 CD2 HIS A 50 3.203 8.427 -1.654 1.00 0.00 C ATOM 724 CE1 HIS A 50 2.074 7.923 0.149 1.00 0.00 C ATOM 725 NE2 HIS A 50 2.699 8.902 -0.466 1.00 0.00 N ATOM 0 H HIS A 50 0.346 6.012 -3.419 1.00 0.00 H new ATOM 0 HA HIS A 50 2.721 7.397 -4.540 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.727 5.134 -2.494 1.00 0.00 H new ATOM 0 HB3 HIS A 50 4.122 6.032 -3.060 1.00 0.00 H new ATOM 0 HD2 HIS A 50 3.770 8.990 -2.381 1.00 0.00 H new ATOM 0 HE1 HIS A 50 1.576 7.996 1.105 1.00 0.00 H new ATOM 0 HE2 HIS A 50 2.794 9.857 -0.119 1.00 0.00 H new ATOM 734 N LEU A 51 1.394 4.860 -5.730 1.00 0.00 N ATOM 735 CA LEU A 51 1.506 3.949 -6.882 1.00 0.00 C ATOM 736 C LEU A 51 0.750 4.485 -8.085 1.00 0.00 C ATOM 737 O LEU A 51 1.138 4.267 -9.230 1.00 0.00 O ATOM 738 CB LEU A 51 0.949 2.552 -6.582 1.00 0.00 C ATOM 739 CG LEU A 51 1.781 1.663 -5.652 1.00 0.00 C ATOM 740 CD1 LEU A 51 3.221 1.548 -6.137 1.00 0.00 C ATOM 741 CD2 LEU A 51 1.732 2.182 -4.235 1.00 0.00 C ATOM 0 H LEU A 51 0.443 5.014 -5.394 1.00 0.00 H new ATOM 0 HA LEU A 51 2.573 3.880 -7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.042 2.668 -6.144 1.00 0.00 H new ATOM 0 HB3 LEU A 51 0.820 2.027 -7.528 1.00 0.00 H new ATOM 0 HG LEU A 51 1.346 0.664 -5.668 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.785 0.911 -5.456 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.235 1.112 -7.136 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.675 2.538 -6.167 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.329 1.537 -3.590 1.00 0.00 H new ATOM 0 HD22 LEU A 51 2.132 3.196 -4.205 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.700 2.189 -3.886 1.00 0.00 H new ATOM 753 N ASN A 52 -0.340 5.164 -7.814 1.00 0.00 N ATOM 754 CA ASN A 52 -1.315 5.505 -8.838 1.00 0.00 C ATOM 755 C ASN A 52 -1.612 7.005 -8.855 1.00 0.00 C ATOM 756 O ASN A 52 -1.922 7.577 -9.899 1.00 0.00 O ATOM 757 CB ASN A 52 -2.584 4.689 -8.575 1.00 0.00 C ATOM 758 CG ASN A 52 -2.674 3.447 -9.449 1.00 0.00 C ATOM 759 OD1 ASN A 52 -3.767 2.989 -9.785 1.00 0.00 O ATOM 760 ND2 ASN A 52 -1.531 2.892 -9.828 1.00 0.00 N ATOM 0 H ASN A 52 -0.581 5.498 -6.881 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.914 5.262 -9.822 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.610 4.393 -7.526 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -3.458 5.316 -8.751 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -1.539 2.059 -10.417 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -0.644 3.298 -9.531 1.00 0.00 H new ATOM 767 N LYS A 53 -1.517 7.627 -7.695 1.00 0.00 N ATOM 768 CA LYS A 53 -1.663 9.064 -7.559 1.00 0.00 C ATOM 769 C LYS A 53 -0.309 9.688 -7.211 1.00 0.00 C ATOM 770 O LYS A 53 -0.197 10.333 -6.150 1.00 0.00 O ATOM 771 CB LYS A 53 -2.691 9.388 -6.464 1.00 0.00 C ATOM 772 CG LYS A 53 -4.038 9.844 -6.998 1.00 0.00 C ATOM 773 CD LYS A 53 -4.876 10.468 -5.891 1.00 0.00 C ATOM 774 CE LYS A 53 -5.457 9.421 -4.957 1.00 0.00 C ATOM 775 NZ LYS A 53 -6.640 8.737 -5.551 1.00 0.00 N ATOM 776 OXT LYS A 53 0.649 9.498 -7.994 1.00 0.00 O ATOM 0 H LYS A 53 -1.335 7.146 -6.814 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.016 9.479 -8.503 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -2.838 8.503 -5.844 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.285 10.166 -5.818 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -3.890 10.567 -7.800 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -4.570 8.995 -7.428 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -4.261 11.163 -5.319 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -5.686 11.049 -6.333 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -4.692 8.682 -4.721 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -5.745 9.893 -4.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -7.005 8.031 -4.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -7.381 9.438 -5.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -6.360 8.264 -6.434 1.00 0.00 H new ATOM 811 N VAL B 2 7.990 4.089 13.627 1.00 0.00 N ATOM 812 CA VAL B 2 7.664 2.956 14.485 1.00 0.00 C ATOM 813 C VAL B 2 7.671 1.655 13.680 1.00 0.00 C ATOM 814 O VAL B 2 7.520 0.561 14.224 1.00 0.00 O ATOM 815 CB VAL B 2 6.280 3.159 15.153 1.00 0.00 C ATOM 816 CG1 VAL B 2 5.162 3.120 14.120 1.00 0.00 C ATOM 817 CG2 VAL B 2 6.038 2.135 16.253 1.00 0.00 C ATOM 0 HA VAL B 2 8.422 2.890 15.265 1.00 0.00 H new ATOM 0 HB VAL B 2 6.280 4.147 15.614 1.00 0.00 H new ATOM 0 HG11 VAL B 2 4.203 3.265 14.617 1.00 0.00 H new ATOM 0 HG12 VAL B 2 5.315 3.913 13.388 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.167 2.154 13.615 1.00 0.00 H new ATOM 0 HG21 VAL B 2 5.059 2.306 16.700 1.00 0.00 H new ATOM 0 HG22 VAL B 2 6.073 1.131 15.830 1.00 0.00 H new ATOM 0 HG23 VAL B 2 6.808 2.234 17.018 1.00 0.00 H new ATOM 827 N ILE B 3 7.872 1.782 12.379 1.00 0.00 N ATOM 828 CA ILE B 3 7.858 0.628 11.499 1.00 0.00 C ATOM 829 C ILE B 3 9.093 0.615 10.607 1.00 0.00 C ATOM 830 O ILE B 3 9.528 1.657 10.117 1.00 0.00 O ATOM 831 CB ILE B 3 6.573 0.589 10.631 1.00 0.00 C ATOM 832 CG1 ILE B 3 6.525 -0.698 9.802 1.00 0.00 C ATOM 833 CG2 ILE B 3 6.484 1.815 9.727 1.00 0.00 C ATOM 834 CD1 ILE B 3 5.252 -0.859 9.001 1.00 0.00 C ATOM 0 H ILE B 3 8.046 2.671 11.911 1.00 0.00 H new ATOM 0 HA ILE B 3 7.867 -0.262 12.129 1.00 0.00 H new ATOM 0 HB ILE B 3 5.712 0.603 11.300 1.00 0.00 H new ATOM 0 HG12 ILE B 3 7.376 -0.713 9.121 1.00 0.00 H new ATOM 0 HG13 ILE B 3 6.635 -1.553 10.469 1.00 0.00 H new ATOM 0 HG21 ILE B 3 5.574 1.761 9.130 1.00 0.00 H new ATOM 0 HG22 ILE B 3 6.464 2.717 10.338 1.00 0.00 H new ATOM 0 HG23 ILE B 3 7.350 1.843 9.066 1.00 0.00 H new ATOM 0 HD11 ILE B 3 5.291 -1.793 8.440 1.00 0.00 H new ATOM 0 HD12 ILE B 3 4.397 -0.877 9.677 1.00 0.00 H new ATOM 0 HD13 ILE B 3 5.150 -0.024 8.308 1.00 0.00 H new ATOM 846 N ALA B 4 9.681 -0.560 10.453 1.00 0.00 N ATOM 847 CA ALA B 4 10.786 -0.751 9.531 1.00 0.00 C ATOM 848 C ALA B 4 10.456 -1.882 8.569 1.00 0.00 C ATOM 849 O ALA B 4 9.760 -2.835 8.927 1.00 0.00 O ATOM 850 CB ALA B 4 12.068 -1.048 10.294 1.00 0.00 C ATOM 0 H ALA B 4 9.408 -1.402 10.960 1.00 0.00 H new ATOM 0 HA ALA B 4 10.939 0.164 8.959 1.00 0.00 H new ATOM 0 HB1 ALA B 4 12.887 -1.189 9.589 1.00 0.00 H new ATOM 0 HB2 ALA B 4 12.299 -0.214 10.956 1.00 0.00 H new ATOM 0 HB3 ALA B 4 11.938 -1.955 10.885 1.00 0.00 H new ATOM 856 N THR B 5 10.962 -1.766 7.345 1.00 0.00 N ATOM 857 CA THR B 5 10.659 -2.716 6.279 1.00 0.00 C ATOM 858 C THR B 5 11.137 -4.123 6.635 1.00 0.00 C ATOM 859 O THR B 5 10.639 -5.110 6.101 1.00 0.00 O ATOM 860 CB THR B 5 11.318 -2.272 4.955 1.00 0.00 C ATOM 861 OG1 THR B 5 11.074 -0.874 4.733 1.00 0.00 O ATOM 862 CG2 THR B 5 10.776 -3.067 3.774 1.00 0.00 C ATOM 0 H THR B 5 11.591 -1.014 7.064 1.00 0.00 H new ATOM 0 HA THR B 5 9.576 -2.736 6.158 1.00 0.00 H new ATOM 0 HB THR B 5 12.389 -2.456 5.036 1.00 0.00 H new ATOM 0 HG1 THR B 5 11.496 -0.598 3.893 1.00 0.00 H new ATOM 0 HG21 THR B 5 11.259 -2.731 2.857 1.00 0.00 H new ATOM 0 HG22 THR B 5 10.980 -4.127 3.925 1.00 0.00 H new ATOM 0 HG23 THR B 5 9.700 -2.913 3.695 1.00 0.00 H new ATOM 870 N ASP B 6 12.058 -4.208 7.586 1.00 0.00 N ATOM 871 CA ASP B 6 12.691 -5.474 7.930 1.00 0.00 C ATOM 872 C ASP B 6 11.832 -6.277 8.899 1.00 0.00 C ATOM 873 O ASP B 6 12.198 -7.388 9.285 1.00 0.00 O ATOM 874 CB ASP B 6 14.070 -5.230 8.549 1.00 0.00 C ATOM 875 CG ASP B 6 15.000 -4.470 7.625 1.00 0.00 C ATOM 876 OD1 ASP B 6 15.728 -5.112 6.837 1.00 0.00 O ATOM 877 OD2 ASP B 6 15.018 -3.224 7.691 1.00 0.00 O ATOM 0 H ASP B 6 12.384 -3.412 8.134 1.00 0.00 H new ATOM 0 HA ASP B 6 12.803 -6.048 7.010 1.00 0.00 H new ATOM 0 HB2 ASP B 6 13.953 -4.673 9.479 1.00 0.00 H new ATOM 0 HB3 ASP B 6 14.523 -6.188 8.806 1.00 0.00 H new ATOM 882 N ASP B 7 10.694 -5.720 9.304 1.00 0.00 N ATOM 883 CA ASP B 7 9.776 -6.444 10.180 1.00 0.00 C ATOM 884 C ASP B 7 8.611 -7.001 9.376 1.00 0.00 C ATOM 885 O ASP B 7 7.937 -7.940 9.803 1.00 0.00 O ATOM 886 CB ASP B 7 9.215 -5.522 11.275 1.00 0.00 C ATOM 887 CG ASP B 7 10.277 -4.809 12.089 1.00 0.00 C ATOM 888 OD1 ASP B 7 11.151 -5.487 12.671 1.00 0.00 O ATOM 889 OD2 ASP B 7 10.234 -3.562 12.159 1.00 0.00 O ATOM 0 H ASP B 7 10.388 -4.782 9.044 1.00 0.00 H new ATOM 0 HA ASP B 7 10.336 -7.256 10.643 1.00 0.00 H new ATOM 0 HB2 ASP B 7 8.567 -4.778 10.811 1.00 0.00 H new ATOM 0 HB3 ASP B 7 8.592 -6.112 11.948 1.00 0.00 H new ATOM 894 N LEU B 8 8.379 -6.430 8.204 1.00 0.00 N ATOM 895 CA LEU B 8 7.282 -6.873 7.356 1.00 0.00 C ATOM 896 C LEU B 8 7.812 -7.604 6.133 1.00 0.00 C ATOM 897 O LEU B 8 7.056 -8.235 5.392 1.00 0.00 O ATOM 898 CB LEU B 8 6.403 -5.699 6.938 1.00 0.00 C ATOM 899 CG LEU B 8 5.461 -5.174 8.021 1.00 0.00 C ATOM 900 CD1 LEU B 8 6.219 -4.394 9.083 1.00 0.00 C ATOM 901 CD2 LEU B 8 4.375 -4.316 7.400 1.00 0.00 C ATOM 0 H LEU B 8 8.932 -5.664 7.820 1.00 0.00 H new ATOM 0 HA LEU B 8 6.669 -7.565 7.934 1.00 0.00 H new ATOM 0 HB2 LEU B 8 7.047 -4.882 6.611 1.00 0.00 H new ATOM 0 HB3 LEU B 8 5.808 -6.000 6.076 1.00 0.00 H new ATOM 0 HG LEU B 8 4.996 -6.030 8.509 1.00 0.00 H new ATOM 0 HD11 LEU B 8 5.520 -4.034 9.838 1.00 0.00 H new ATOM 0 HD12 LEU B 8 6.959 -5.043 9.552 1.00 0.00 H new ATOM 0 HD13 LEU B 8 6.722 -3.545 8.621 1.00 0.00 H new ATOM 0 HD21 LEU B 8 3.710 -3.948 8.182 1.00 0.00 H new ATOM 0 HD22 LEU B 8 4.830 -3.471 6.883 1.00 0.00 H new ATOM 0 HD23 LEU B 8 3.803 -4.912 6.688 1.00 0.00 H new ATOM 913 N GLU B 9 9.117 -7.521 5.951 1.00 0.00 N ATOM 914 CA GLU B 9 9.802 -8.251 4.903 1.00 0.00 C ATOM 915 C GLU B 9 11.132 -8.761 5.424 1.00 0.00 C ATOM 916 O GLU B 9 11.804 -8.099 6.215 1.00 0.00 O ATOM 917 CB GLU B 9 10.013 -7.398 3.648 1.00 0.00 C ATOM 918 CG GLU B 9 8.772 -7.276 2.779 1.00 0.00 C ATOM 919 CD GLU B 9 9.029 -6.537 1.483 1.00 0.00 C ATOM 920 OE1 GLU B 9 9.535 -5.398 1.534 1.00 0.00 O ATOM 921 OE2 GLU B 9 8.711 -7.089 0.404 1.00 0.00 O ATOM 0 H GLU B 9 9.731 -6.945 6.526 1.00 0.00 H new ATOM 0 HA GLU B 9 9.172 -9.093 4.615 1.00 0.00 H new ATOM 0 HB2 GLU B 9 10.336 -6.401 3.947 1.00 0.00 H new ATOM 0 HB3 GLU B 9 10.820 -7.831 3.056 1.00 0.00 H new ATOM 0 HG2 GLU B 9 8.393 -8.273 2.554 1.00 0.00 H new ATOM 0 HG3 GLU B 9 7.993 -6.758 3.338 1.00 0.00 H new ATOM 928 N VAL B 10 11.491 -9.943 4.987 1.00 0.00 N ATOM 929 CA VAL B 10 12.707 -10.591 5.417 1.00 0.00 C ATOM 930 C VAL B 10 13.501 -11.017 4.193 1.00 0.00 C ATOM 931 O VAL B 10 12.924 -11.411 3.177 1.00 0.00 O ATOM 932 CB VAL B 10 12.389 -11.813 6.313 1.00 0.00 C ATOM 933 CG1 VAL B 10 11.483 -12.801 5.596 1.00 0.00 C ATOM 934 CG2 VAL B 10 13.661 -12.499 6.779 1.00 0.00 C ATOM 0 H VAL B 10 10.945 -10.486 4.319 1.00 0.00 H new ATOM 0 HA VAL B 10 13.299 -9.892 6.008 1.00 0.00 H new ATOM 0 HB VAL B 10 11.860 -11.444 7.192 1.00 0.00 H new ATOM 0 HG11 VAL B 10 11.278 -13.648 6.251 1.00 0.00 H new ATOM 0 HG12 VAL B 10 10.546 -12.310 5.333 1.00 0.00 H new ATOM 0 HG13 VAL B 10 11.975 -13.154 4.690 1.00 0.00 H new ATOM 0 HG21 VAL B 10 13.405 -13.353 7.406 1.00 0.00 H new ATOM 0 HG22 VAL B 10 14.228 -12.841 5.913 1.00 0.00 H new ATOM 0 HG23 VAL B 10 14.265 -11.796 7.353 1.00 0.00 H new ATOM 944 N ALA B 11 14.818 -10.907 4.274 1.00 0.00 N ATOM 945 CA ALA B 11 15.668 -11.314 3.175 1.00 0.00 C ATOM 946 C ALA B 11 15.561 -12.809 2.971 1.00 0.00 C ATOM 947 O ALA B 11 15.619 -13.584 3.929 1.00 0.00 O ATOM 948 CB ALA B 11 17.104 -10.902 3.448 1.00 0.00 C ATOM 0 H ALA B 11 15.316 -10.541 5.086 1.00 0.00 H new ATOM 0 HA ALA B 11 15.341 -10.818 2.261 1.00 0.00 H new ATOM 0 HB1 ALA B 11 17.736 -11.212 2.616 1.00 0.00 H new ATOM 0 HB2 ALA B 11 17.157 -9.819 3.560 1.00 0.00 H new ATOM 0 HB3 ALA B 11 17.451 -11.379 4.365 1.00 0.00 H new ATOM 954 N CYS B 12 15.397 -13.195 1.717 1.00 0.00 N ATOM 955 CA CYS B 12 15.000 -14.542 1.355 1.00 0.00 C ATOM 956 C CYS B 12 16.114 -15.573 1.594 1.00 0.00 C ATOM 957 O CYS B 12 17.288 -15.215 1.600 1.00 0.00 O ATOM 958 CB CYS B 12 14.570 -14.501 -0.111 1.00 0.00 C ATOM 959 SG CYS B 12 13.980 -16.054 -0.779 1.00 0.00 S ATOM 0 H CYS B 12 15.537 -12.577 0.917 1.00 0.00 H new ATOM 0 HA CYS B 12 14.177 -14.869 1.991 1.00 0.00 H new ATOM 0 HB2 CYS B 12 13.783 -13.755 -0.221 1.00 0.00 H new ATOM 0 HB3 CYS B 12 15.415 -14.164 -0.711 1.00 0.00 H new ATOM 0 HG CYS B 12 14.638 -16.338 -1.864 1.00 0.00 H new ATOM 964 N PRO B 13 15.744 -16.867 1.806 1.00 0.00 N ATOM 965 CA PRO B 13 16.683 -17.956 2.107 1.00 0.00 C ATOM 966 C PRO B 13 18.023 -17.864 1.383 1.00 0.00 C ATOM 967 O PRO B 13 19.082 -18.059 1.983 1.00 0.00 O ATOM 968 CB PRO B 13 15.922 -19.179 1.605 1.00 0.00 C ATOM 969 CG PRO B 13 14.487 -18.878 1.863 1.00 0.00 C ATOM 970 CD PRO B 13 14.349 -17.373 1.791 1.00 0.00 C ATOM 0 HA PRO B 13 16.955 -17.956 3.163 1.00 0.00 H new ATOM 0 HB2 PRO B 13 16.104 -19.348 0.544 1.00 0.00 H new ATOM 0 HB3 PRO B 13 16.236 -20.081 2.130 1.00 0.00 H new ATOM 0 HG2 PRO B 13 13.849 -19.363 1.124 1.00 0.00 H new ATOM 0 HG3 PRO B 13 14.181 -19.250 2.841 1.00 0.00 H new ATOM 0 HD2 PRO B 13 13.826 -17.066 0.885 1.00 0.00 H new ATOM 0 HD3 PRO B 13 13.778 -16.987 2.635 1.00 0.00 H new ATOM 978 N LYS B 14 17.959 -17.523 0.103 1.00 0.00 N ATOM 979 CA LYS B 14 19.107 -17.633 -0.781 1.00 0.00 C ATOM 980 C LYS B 14 19.198 -16.448 -1.737 1.00 0.00 C ATOM 981 O LYS B 14 20.282 -16.106 -2.212 1.00 0.00 O ATOM 982 CB LYS B 14 19.023 -18.937 -1.577 1.00 0.00 C ATOM 983 CG LYS B 14 20.123 -19.105 -2.618 1.00 0.00 C ATOM 984 CD LYS B 14 19.897 -20.353 -3.452 1.00 0.00 C ATOM 985 CE LYS B 14 20.822 -20.386 -4.657 1.00 0.00 C ATOM 986 NZ LYS B 14 22.242 -20.573 -4.262 1.00 0.00 N ATOM 0 H LYS B 14 17.116 -17.165 -0.347 1.00 0.00 H new ATOM 0 HA LYS B 14 20.006 -17.633 -0.164 1.00 0.00 H new ATOM 0 HB2 LYS B 14 19.064 -19.777 -0.883 1.00 0.00 H new ATOM 0 HB3 LYS B 14 18.055 -18.983 -2.077 1.00 0.00 H new ATOM 0 HG2 LYS B 14 20.151 -18.230 -3.267 1.00 0.00 H new ATOM 0 HG3 LYS B 14 21.092 -19.165 -2.122 1.00 0.00 H new ATOM 0 HD2 LYS B 14 20.064 -21.238 -2.838 1.00 0.00 H new ATOM 0 HD3 LYS B 14 18.860 -20.387 -3.786 1.00 0.00 H new ATOM 0 HE2 LYS B 14 20.521 -21.195 -5.323 1.00 0.00 H new ATOM 0 HE3 LYS B 14 20.721 -19.457 -5.218 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 22.840 -20.590 -5.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 22.537 -19.788 -3.647 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 22.344 -21.472 -3.749 1.00 0.00 H new ATOM 1000 N CYS B 15 18.067 -15.825 -2.045 1.00 0.00 N ATOM 1001 CA CYS B 15 18.084 -14.707 -2.968 1.00 0.00 C ATOM 1002 C CYS B 15 17.652 -13.421 -2.293 1.00 0.00 C ATOM 1003 O CYS B 15 16.482 -13.191 -2.031 1.00 0.00 O ATOM 1004 CB CYS B 15 17.132 -14.979 -4.126 1.00 0.00 C ATOM 1005 SG CYS B 15 15.463 -15.405 -3.599 1.00 0.00 S ATOM 0 H CYS B 15 17.148 -16.070 -1.677 1.00 0.00 H new ATOM 0 HA CYS B 15 19.108 -14.595 -3.326 1.00 0.00 H new ATOM 0 HB2 CYS B 15 17.089 -14.097 -4.765 1.00 0.00 H new ATOM 0 HB3 CYS B 15 17.532 -15.792 -4.732 1.00 0.00 H new ATOM 0 HG CYS B 15 14.631 -14.499 -4.019 1.00 0.00 H new ATOM 1010 N GLU B 16 18.609 -12.553 -2.125 1.00 0.00 N ATOM 1011 CA GLU B 16 18.397 -11.288 -1.441 1.00 0.00 C ATOM 1012 C GLU B 16 19.404 -10.322 -1.991 1.00 0.00 C ATOM 1013 O GLU B 16 19.653 -9.258 -1.425 1.00 0.00 O ATOM 1014 CB GLU B 16 18.571 -11.375 0.087 1.00 0.00 C ATOM 1015 CG GLU B 16 18.650 -12.771 0.677 1.00 0.00 C ATOM 1016 CD GLU B 16 20.051 -13.339 0.599 1.00 0.00 C ATOM 1017 OE1 GLU B 16 20.479 -13.716 -0.504 1.00 0.00 O ATOM 1018 OE2 GLU B 16 20.738 -13.391 1.641 1.00 0.00 O ATOM 0 H GLU B 16 19.564 -12.693 -2.455 1.00 0.00 H new ATOM 0 HA GLU B 16 17.367 -10.975 -1.612 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.479 -10.837 0.359 1.00 0.00 H new ATOM 0 HB3 GLU B 16 17.738 -10.852 0.556 1.00 0.00 H new ATOM 0 HG2 GLU B 16 18.327 -12.744 1.718 1.00 0.00 H new ATOM 0 HG3 GLU B 16 17.962 -13.429 0.146 1.00 0.00 H new ATOM 1025 N ARG B 17 19.975 -10.711 -3.118 1.00 0.00 N ATOM 1026 CA ARG B 17 21.228 -10.168 -3.562 1.00 0.00 C ATOM 1027 C ARG B 17 21.233 -10.162 -5.092 1.00 0.00 C ATOM 1028 O ARG B 17 21.857 -9.315 -5.726 1.00 0.00 O ATOM 1029 CB ARG B 17 22.385 -11.014 -3.011 1.00 0.00 C ATOM 1030 CG ARG B 17 22.361 -12.469 -3.471 1.00 0.00 C ATOM 1031 CD ARG B 17 23.350 -13.322 -2.693 1.00 0.00 C ATOM 1032 NE ARG B 17 22.953 -13.478 -1.295 1.00 0.00 N ATOM 1033 CZ ARG B 17 23.803 -13.608 -0.279 1.00 0.00 C ATOM 1034 NH1 ARG B 17 25.112 -13.626 -0.494 1.00 0.00 N ATOM 1035 NH2 ARG B 17 23.337 -13.728 0.956 1.00 0.00 N ATOM 0 H ARG B 17 19.577 -11.411 -3.743 1.00 0.00 H new ATOM 0 HA ARG B 17 21.356 -9.149 -3.196 1.00 0.00 H new ATOM 0 HB2 ARG B 17 23.329 -10.563 -3.315 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.355 -10.987 -1.922 1.00 0.00 H new ATOM 0 HG2 ARG B 17 21.356 -12.873 -3.347 1.00 0.00 H new ATOM 0 HG3 ARG B 17 22.596 -12.518 -4.534 1.00 0.00 H new ATOM 0 HD2 ARG B 17 23.429 -14.304 -3.160 1.00 0.00 H new ATOM 0 HD3 ARG B 17 24.339 -12.866 -2.741 1.00 0.00 H new ATOM 0 HE ARG B 17 21.955 -13.488 -1.083 1.00 0.00 H new ATOM 0 HH11 ARG B 17 25.474 -13.540 -1.444 1.00 0.00 H new ATOM 0 HH12 ARG B 17 25.756 -13.726 0.290 1.00 0.00 H new ATOM 0 HH21 ARG B 17 22.331 -13.720 1.124 1.00 0.00 H new ATOM 0 HH22 ARG B 17 23.984 -13.828 1.738 1.00 0.00 H new ATOM 1049 N ALA B 18 20.514 -11.136 -5.670 1.00 0.00 N ATOM 1050 CA ALA B 18 20.539 -11.348 -7.116 1.00 0.00 C ATOM 1051 C ALA B 18 19.166 -11.201 -7.763 1.00 0.00 C ATOM 1052 O ALA B 18 19.040 -10.636 -8.844 1.00 0.00 O ATOM 1053 CB ALA B 18 21.120 -12.719 -7.430 1.00 0.00 C ATOM 0 H ALA B 18 19.914 -11.783 -5.158 1.00 0.00 H new ATOM 0 HA ALA B 18 21.172 -10.569 -7.540 1.00 0.00 H new ATOM 0 HB1 ALA B 18 21.135 -12.869 -8.509 1.00 0.00 H new ATOM 0 HB2 ALA B 18 22.136 -12.781 -7.041 1.00 0.00 H new ATOM 0 HB3 ALA B 18 20.505 -13.490 -6.965 1.00 0.00 H new ATOM 1059 N GLY B 19 18.139 -11.700 -7.096 1.00 0.00 N ATOM 1060 CA GLY B 19 16.806 -11.647 -7.662 1.00 0.00 C ATOM 1061 C GLY B 19 16.438 -12.937 -8.355 1.00 0.00 C ATOM 1062 O GLY B 19 15.454 -13.007 -9.085 1.00 0.00 O ATOM 0 H GLY B 19 18.202 -12.139 -6.177 1.00 0.00 H new ATOM 0 HA2 GLY B 19 16.084 -11.440 -6.872 1.00 0.00 H new ATOM 0 HA3 GLY B 19 16.746 -10.823 -8.373 1.00 0.00 H new ATOM 1066 N GLU B 20 17.205 -13.970 -8.066 1.00 0.00 N ATOM 1067 CA GLU B 20 17.022 -15.274 -8.676 1.00 0.00 C ATOM 1068 C GLU B 20 17.560 -16.335 -7.755 1.00 0.00 C ATOM 1069 O GLU B 20 18.206 -16.034 -6.748 1.00 0.00 O ATOM 1070 CB GLU B 20 17.733 -15.397 -10.034 1.00 0.00 C ATOM 1071 CG GLU B 20 19.045 -14.631 -10.121 1.00 0.00 C ATOM 1072 CD GLU B 20 19.758 -14.842 -11.440 1.00 0.00 C ATOM 1073 OE1 GLU B 20 20.545 -15.801 -11.546 1.00 0.00 O ATOM 1074 OE2 GLU B 20 19.537 -14.045 -12.376 1.00 0.00 O ATOM 0 H GLU B 20 17.976 -13.929 -7.399 1.00 0.00 H new ATOM 0 HA GLU B 20 15.953 -15.402 -8.845 1.00 0.00 H new ATOM 0 HB2 GLU B 20 17.926 -16.450 -10.237 1.00 0.00 H new ATOM 0 HB3 GLU B 20 17.063 -15.039 -10.816 1.00 0.00 H new ATOM 0 HG2 GLU B 20 18.850 -13.567 -9.984 1.00 0.00 H new ATOM 0 HG3 GLU B 20 19.698 -14.943 -9.306 1.00 0.00 H new ATOM 1081 N ILE B 21 17.287 -17.565 -8.104 1.00 0.00 N ATOM 1082 CA ILE B 21 17.878 -18.697 -7.442 1.00 0.00 C ATOM 1083 C ILE B 21 18.247 -19.701 -8.493 1.00 0.00 C ATOM 1084 O ILE B 21 17.399 -20.124 -9.277 1.00 0.00 O ATOM 1085 CB ILE B 21 16.954 -19.345 -6.386 1.00 0.00 C ATOM 1086 CG1 ILE B 21 16.786 -18.384 -5.194 1.00 0.00 C ATOM 1087 CG2 ILE B 21 17.511 -20.689 -5.936 1.00 0.00 C ATOM 1088 CD1 ILE B 21 16.111 -18.975 -3.972 1.00 0.00 C ATOM 0 H ILE B 21 16.646 -17.810 -8.858 1.00 0.00 H new ATOM 0 HA ILE B 21 18.754 -18.350 -6.893 1.00 0.00 H new ATOM 0 HB ILE B 21 15.975 -19.529 -6.828 1.00 0.00 H new ATOM 0 HG12 ILE B 21 17.771 -18.018 -4.903 1.00 0.00 H new ATOM 0 HG13 ILE B 21 16.209 -17.520 -5.524 1.00 0.00 H new ATOM 0 HG21 ILE B 21 16.846 -21.128 -5.193 1.00 0.00 H new ATOM 0 HG22 ILE B 21 17.588 -21.357 -6.794 1.00 0.00 H new ATOM 0 HG23 ILE B 21 18.499 -20.545 -5.499 1.00 0.00 H new ATOM 0 HD11 ILE B 21 16.042 -18.217 -3.192 1.00 0.00 H new ATOM 0 HD12 ILE B 21 15.110 -19.314 -4.238 1.00 0.00 H new ATOM 0 HD13 ILE B 21 16.695 -19.820 -3.607 1.00 0.00 H new ATOM 1100 N GLU B 22 19.517 -20.048 -8.522 1.00 0.00 N ATOM 1101 CA GLU B 22 20.018 -20.988 -9.497 1.00 0.00 C ATOM 1102 C GLU B 22 19.661 -20.525 -10.920 1.00 0.00 C ATOM 1103 O GLU B 22 19.198 -21.310 -11.747 1.00 0.00 O ATOM 1104 CB GLU B 22 19.414 -22.360 -9.184 1.00 0.00 C ATOM 1105 CG GLU B 22 20.397 -23.507 -9.329 1.00 0.00 C ATOM 1106 CD GLU B 22 21.561 -23.367 -8.365 1.00 0.00 C ATOM 1107 OE1 GLU B 22 22.565 -22.724 -8.732 1.00 0.00 O ATOM 1108 OE2 GLU B 22 21.470 -23.881 -7.231 1.00 0.00 O ATOM 0 H GLU B 22 20.222 -19.690 -7.878 1.00 0.00 H new ATOM 0 HA GLU B 22 21.105 -21.051 -9.446 1.00 0.00 H new ATOM 0 HB2 GLU B 22 19.026 -22.352 -8.165 1.00 0.00 H new ATOM 0 HB3 GLU B 22 18.566 -22.534 -9.847 1.00 0.00 H new ATOM 0 HG2 GLU B 22 19.885 -24.452 -9.148 1.00 0.00 H new ATOM 0 HG3 GLU B 22 20.772 -23.539 -10.352 1.00 0.00 H new ATOM 1115 N GLY B 23 19.835 -19.227 -11.178 1.00 0.00 N ATOM 1116 CA GLY B 23 19.574 -18.674 -12.504 1.00 0.00 C ATOM 1117 C GLY B 23 18.097 -18.606 -12.866 1.00 0.00 C ATOM 1118 O GLY B 23 17.740 -18.173 -13.962 1.00 0.00 O ATOM 0 H GLY B 23 20.153 -18.545 -10.490 1.00 0.00 H new ATOM 0 HA2 GLY B 23 19.997 -17.671 -12.558 1.00 0.00 H new ATOM 0 HA3 GLY B 23 20.092 -19.279 -13.248 1.00 0.00 H new ATOM 1122 N THR B 24 17.241 -19.030 -11.957 1.00 0.00 N ATOM 1123 CA THR B 24 15.819 -19.155 -12.247 1.00 0.00 C ATOM 1124 C THR B 24 14.971 -18.270 -11.319 1.00 0.00 C ATOM 1125 O THR B 24 15.445 -17.836 -10.263 1.00 0.00 O ATOM 1126 CB THR B 24 15.411 -20.644 -12.126 1.00 0.00 C ATOM 1127 OG1 THR B 24 14.494 -21.000 -13.165 1.00 0.00 O ATOM 1128 CG2 THR B 24 14.789 -20.965 -10.771 1.00 0.00 C ATOM 0 H THR B 24 17.503 -19.295 -11.008 1.00 0.00 H new ATOM 0 HA THR B 24 15.633 -18.809 -13.264 1.00 0.00 H new ATOM 0 HB THR B 24 16.326 -21.229 -12.224 1.00 0.00 H new ATOM 0 HG1 THR B 24 14.248 -21.944 -13.075 1.00 0.00 H new ATOM 0 HG21 THR B 24 14.520 -22.021 -10.735 1.00 0.00 H new ATOM 0 HG22 THR B 24 15.507 -20.746 -9.980 1.00 0.00 H new ATOM 0 HG23 THR B 24 13.895 -20.358 -10.628 1.00 0.00 H new ATOM 1136 N PRO B 25 13.716 -17.962 -11.722 1.00 0.00 N ATOM 1137 CA PRO B 25 12.776 -17.197 -10.895 1.00 0.00 C ATOM 1138 C PRO B 25 12.526 -17.879 -9.556 1.00 0.00 C ATOM 1139 O PRO B 25 12.319 -19.092 -9.485 1.00 0.00 O ATOM 1140 CB PRO B 25 11.493 -17.145 -11.736 1.00 0.00 C ATOM 1141 CG PRO B 25 11.644 -18.249 -12.723 1.00 0.00 C ATOM 1142 CD PRO B 25 13.115 -18.323 -13.015 1.00 0.00 C ATOM 0 HA PRO B 25 13.157 -16.206 -10.649 1.00 0.00 H new ATOM 0 HB2 PRO B 25 10.607 -17.286 -11.116 1.00 0.00 H new ATOM 0 HB3 PRO B 25 11.384 -16.181 -12.233 1.00 0.00 H new ATOM 0 HG2 PRO B 25 11.276 -19.192 -12.318 1.00 0.00 H new ATOM 0 HG3 PRO B 25 11.073 -18.047 -13.629 1.00 0.00 H new ATOM 0 HD2 PRO B 25 13.415 -19.320 -13.337 1.00 0.00 H new ATOM 0 HD3 PRO B 25 13.407 -17.631 -13.805 1.00 0.00 H new ATOM 1150 N CYS B 26 12.543 -17.090 -8.501 1.00 0.00 N ATOM 1151 CA CYS B 26 12.541 -17.623 -7.155 1.00 0.00 C ATOM 1152 C CYS B 26 11.124 -17.781 -6.588 1.00 0.00 C ATOM 1153 O CYS B 26 10.276 -16.909 -6.774 1.00 0.00 O ATOM 1154 CB CYS B 26 13.367 -16.714 -6.253 1.00 0.00 C ATOM 1155 SG CYS B 26 13.445 -17.282 -4.535 1.00 0.00 S ATOM 0 H CYS B 26 12.558 -16.071 -8.551 1.00 0.00 H new ATOM 0 HA CYS B 26 12.981 -18.620 -7.192 1.00 0.00 H new ATOM 0 HB2 CYS B 26 14.379 -16.643 -6.651 1.00 0.00 H new ATOM 0 HB3 CYS B 26 12.944 -15.710 -6.277 1.00 0.00 H new ATOM 0 HG CYS B 26 14.330 -16.585 -3.887 1.00 0.00 H new ATOM 1160 N PRO B 27 10.903 -18.896 -5.846 1.00 0.00 N ATOM 1161 CA PRO B 27 9.625 -19.298 -5.234 1.00 0.00 C ATOM 1162 C PRO B 27 8.652 -18.166 -4.882 1.00 0.00 C ATOM 1163 O PRO B 27 7.494 -18.182 -5.295 1.00 0.00 O ATOM 1164 CB PRO B 27 10.110 -19.966 -3.945 1.00 0.00 C ATOM 1165 CG PRO B 27 11.421 -20.602 -4.289 1.00 0.00 C ATOM 1166 CD PRO B 27 11.930 -19.919 -5.550 1.00 0.00 C ATOM 0 HA PRO B 27 9.044 -19.905 -5.928 1.00 0.00 H new ATOM 0 HB2 PRO B 27 10.227 -19.235 -3.145 1.00 0.00 H new ATOM 0 HB3 PRO B 27 9.394 -20.709 -3.595 1.00 0.00 H new ATOM 0 HG2 PRO B 27 12.133 -20.484 -3.472 1.00 0.00 H new ATOM 0 HG3 PRO B 27 11.299 -21.673 -4.453 1.00 0.00 H new ATOM 0 HD2 PRO B 27 12.909 -19.467 -5.391 1.00 0.00 H new ATOM 0 HD3 PRO B 27 12.036 -20.627 -6.372 1.00 0.00 H new ATOM 1174 N ALA B 28 9.126 -17.183 -4.126 1.00 0.00 N ATOM 1175 CA ALA B 28 8.224 -16.211 -3.510 1.00 0.00 C ATOM 1176 C ALA B 28 8.652 -14.766 -3.762 1.00 0.00 C ATOM 1177 O ALA B 28 7.966 -13.831 -3.358 1.00 0.00 O ATOM 1178 CB ALA B 28 8.116 -16.475 -2.014 1.00 0.00 C ATOM 0 H ALA B 28 10.115 -17.036 -3.925 1.00 0.00 H new ATOM 0 HA ALA B 28 7.248 -16.338 -3.978 1.00 0.00 H new ATOM 0 HB1 ALA B 28 7.442 -15.746 -1.564 1.00 0.00 H new ATOM 0 HB2 ALA B 28 7.727 -17.480 -1.849 1.00 0.00 H new ATOM 0 HB3 ALA B 28 9.102 -16.388 -1.557 1.00 0.00 H new ATOM 1184 N CYS B 29 9.794 -14.577 -4.404 1.00 0.00 N ATOM 1185 CA CYS B 29 10.261 -13.232 -4.711 1.00 0.00 C ATOM 1186 C CYS B 29 10.769 -13.174 -6.144 1.00 0.00 C ATOM 1187 O CYS B 29 11.846 -13.695 -6.455 1.00 0.00 O ATOM 1188 CB CYS B 29 11.352 -12.810 -3.722 1.00 0.00 C ATOM 1189 SG CYS B 29 12.870 -13.805 -3.824 1.00 0.00 S ATOM 0 H CYS B 29 10.409 -15.327 -4.720 1.00 0.00 H new ATOM 0 HA CYS B 29 9.430 -12.533 -4.613 1.00 0.00 H new ATOM 0 HB2 CYS B 29 11.603 -11.764 -3.899 1.00 0.00 H new ATOM 0 HB3 CYS B 29 10.955 -12.876 -2.709 1.00 0.00 H new ATOM 0 HG CYS B 29 12.564 -15.035 -4.113 1.00 0.00 H new ATOM 1194 N SER B 30 9.987 -12.566 -7.017 1.00 0.00 N ATOM 1195 CA SER B 30 10.322 -12.509 -8.429 1.00 0.00 C ATOM 1196 C SER B 30 11.329 -11.394 -8.739 1.00 0.00 C ATOM 1197 O SER B 30 11.057 -10.515 -9.557 1.00 0.00 O ATOM 1198 CB SER B 30 9.038 -12.298 -9.224 1.00 0.00 C ATOM 1199 OG SER B 30 8.016 -13.168 -8.762 1.00 0.00 O ATOM 0 H SER B 30 9.112 -12.103 -6.772 1.00 0.00 H new ATOM 0 HA SER B 30 10.796 -13.449 -8.712 1.00 0.00 H new ATOM 0 HB2 SER B 30 8.712 -11.262 -9.130 1.00 0.00 H new ATOM 0 HB3 SER B 30 9.225 -12.478 -10.283 1.00 0.00 H new ATOM 0 HG SER B 30 7.199 -13.018 -9.282 1.00 0.00 H new ATOM 1205 N GLY B 31 12.478 -11.416 -8.068 1.00 0.00 N ATOM 1206 CA GLY B 31 13.524 -10.461 -8.375 1.00 0.00 C ATOM 1207 C GLY B 31 13.357 -9.195 -7.577 1.00 0.00 C ATOM 1208 O GLY B 31 13.306 -8.097 -8.125 1.00 0.00 O ATOM 0 H GLY B 31 12.701 -12.075 -7.322 1.00 0.00 H new ATOM 0 HA2 GLY B 31 14.497 -10.903 -8.162 1.00 0.00 H new ATOM 0 HA3 GLY B 31 13.506 -10.228 -9.440 1.00 0.00 H new ATOM 1212 N LYS B 32 13.265 -9.356 -6.268 1.00 0.00 N ATOM 1213 CA LYS B 32 12.935 -8.259 -5.375 1.00 0.00 C ATOM 1214 C LYS B 32 14.006 -8.154 -4.304 1.00 0.00 C ATOM 1215 O LYS B 32 14.450 -7.067 -3.942 1.00 0.00 O ATOM 1216 CB LYS B 32 11.580 -8.548 -4.729 1.00 0.00 C ATOM 1217 CG LYS B 32 10.565 -9.094 -5.720 1.00 0.00 C ATOM 1218 CD LYS B 32 9.451 -9.856 -5.031 1.00 0.00 C ATOM 1219 CE LYS B 32 8.564 -8.939 -4.226 1.00 0.00 C ATOM 1220 NZ LYS B 32 7.930 -7.904 -5.087 1.00 0.00 N ATOM 0 H LYS B 32 13.416 -10.247 -5.796 1.00 0.00 H new ATOM 0 HA LYS B 32 12.885 -7.320 -5.926 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.713 -9.265 -3.919 1.00 0.00 H new ATOM 0 HB3 LYS B 32 11.191 -7.632 -4.284 1.00 0.00 H new ATOM 0 HG2 LYS B 32 10.140 -8.271 -6.294 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.068 -9.751 -6.430 1.00 0.00 H new ATOM 0 HD2 LYS B 32 8.852 -10.379 -5.777 1.00 0.00 H new ATOM 0 HD3 LYS B 32 9.880 -10.615 -4.376 1.00 0.00 H new ATOM 0 HE2 LYS B 32 7.791 -9.523 -3.728 1.00 0.00 H new ATOM 0 HE3 LYS B 32 9.151 -8.455 -3.445 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 7.287 -7.321 -4.513 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 8.667 -7.300 -5.503 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 7.392 -8.367 -5.847 1.00 0.00 H new ATOM 1234 N GLY B 33 14.400 -9.317 -3.801 1.00 0.00 N ATOM 1235 CA GLY B 33 15.437 -9.402 -2.798 1.00 0.00 C ATOM 1236 C GLY B 33 14.902 -9.972 -1.507 1.00 0.00 C ATOM 1237 O GLY B 33 15.563 -10.765 -0.839 1.00 0.00 O ATOM 0 H GLY B 33 14.009 -10.217 -4.078 1.00 0.00 H new ATOM 0 HA2 GLY B 33 16.251 -10.027 -3.165 1.00 0.00 H new ATOM 0 HA3 GLY B 33 15.853 -8.411 -2.616 1.00 0.00 H new ATOM 1241 N VAL B 34 13.681 -9.607 -1.165 1.00 0.00 N ATOM 1242 CA VAL B 34 13.104 -10.024 0.101 1.00 0.00 C ATOM 1243 C VAL B 34 11.747 -10.691 -0.093 1.00 0.00 C ATOM 1244 O VAL B 34 11.198 -10.707 -1.201 1.00 0.00 O ATOM 1245 CB VAL B 34 12.935 -8.815 1.051 1.00 0.00 C ATOM 1246 CG1 VAL B 34 14.289 -8.243 1.453 1.00 0.00 C ATOM 1247 CG2 VAL B 34 12.079 -7.740 0.399 1.00 0.00 C ATOM 0 H VAL B 34 13.072 -9.026 -1.741 1.00 0.00 H new ATOM 0 HA VAL B 34 13.792 -10.746 0.541 1.00 0.00 H new ATOM 0 HB VAL B 34 12.431 -9.163 1.953 1.00 0.00 H new ATOM 0 HG11 VAL B 34 14.142 -7.394 2.121 1.00 0.00 H new ATOM 0 HG12 VAL B 34 14.871 -9.010 1.964 1.00 0.00 H new ATOM 0 HG13 VAL B 34 14.824 -7.915 0.562 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.971 -6.897 1.082 1.00 0.00 H new ATOM 0 HG22 VAL B 34 12.557 -7.403 -0.521 1.00 0.00 H new ATOM 0 HG23 VAL B 34 11.095 -8.149 0.168 1.00 0.00 H new ATOM 1257 N ILE B 35 11.242 -11.272 0.985 1.00 0.00 N ATOM 1258 CA ILE B 35 9.900 -11.834 1.021 1.00 0.00 C ATOM 1259 C ILE B 35 9.154 -11.321 2.252 1.00 0.00 C ATOM 1260 O ILE B 35 9.773 -10.875 3.211 1.00 0.00 O ATOM 1261 CB ILE B 35 9.921 -13.378 1.030 1.00 0.00 C ATOM 1262 CG1 ILE B 35 10.940 -13.890 2.046 1.00 0.00 C ATOM 1263 CG2 ILE B 35 10.236 -13.916 -0.358 1.00 0.00 C ATOM 1264 CD1 ILE B 35 10.896 -15.388 2.258 1.00 0.00 C ATOM 0 H ILE B 35 11.753 -11.367 1.863 1.00 0.00 H new ATOM 0 HA ILE B 35 9.385 -11.514 0.115 1.00 0.00 H new ATOM 0 HB ILE B 35 8.933 -13.735 1.320 1.00 0.00 H new ATOM 0 HG12 ILE B 35 11.940 -13.609 1.716 1.00 0.00 H new ATOM 0 HG13 ILE B 35 10.768 -13.393 3.001 1.00 0.00 H new ATOM 0 HG21 ILE B 35 10.247 -15.006 -0.332 1.00 0.00 H new ATOM 0 HG22 ILE B 35 9.475 -13.577 -1.061 1.00 0.00 H new ATOM 0 HG23 ILE B 35 11.212 -13.551 -0.677 1.00 0.00 H new ATOM 0 HD11 ILE B 35 11.649 -15.674 2.993 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.909 -15.675 2.619 1.00 0.00 H new ATOM 0 HD13 ILE B 35 11.099 -15.895 1.315 1.00 0.00 H new ATOM 1276 N LEU B 36 7.830 -11.400 2.222 1.00 0.00 N ATOM 1277 CA LEU B 36 7.000 -10.753 3.242 1.00 0.00 C ATOM 1278 C LEU B 36 6.774 -11.625 4.472 1.00 0.00 C ATOM 1279 O LEU B 36 7.002 -12.836 4.453 1.00 0.00 O ATOM 1280 CB LEU B 36 5.633 -10.376 2.657 1.00 0.00 C ATOM 1281 CG LEU B 36 5.670 -9.470 1.427 1.00 0.00 C ATOM 1282 CD1 LEU B 36 5.723 -10.289 0.144 1.00 0.00 C ATOM 1283 CD2 LEU B 36 4.472 -8.544 1.426 1.00 0.00 C ATOM 0 H LEU B 36 7.305 -11.903 1.507 1.00 0.00 H new ATOM 0 HA LEU B 36 7.548 -9.864 3.555 1.00 0.00 H new ATOM 0 HB2 LEU B 36 5.104 -11.293 2.396 1.00 0.00 H new ATOM 0 HB3 LEU B 36 5.049 -9.881 3.433 1.00 0.00 H new ATOM 0 HG LEU B 36 6.577 -8.867 1.471 1.00 0.00 H new ATOM 0 HD11 LEU B 36 5.749 -9.618 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU B 36 6.618 -10.911 0.146 1.00 0.00 H new ATOM 0 HD13 LEU B 36 4.840 -10.925 0.082 1.00 0.00 H new ATOM 0 HD21 LEU B 36 4.508 -7.903 0.545 1.00 0.00 H new ATOM 0 HD22 LEU B 36 3.556 -9.134 1.408 1.00 0.00 H new ATOM 0 HD23 LEU B 36 4.488 -7.927 2.325 1.00 0.00 H new ATOM 1295 N THR B 37 6.313 -10.976 5.537 1.00 0.00 N ATOM 1296 CA THR B 37 5.900 -11.651 6.758 1.00 0.00 C ATOM 1297 C THR B 37 4.377 -11.627 6.828 1.00 0.00 C ATOM 1298 O THR B 37 3.749 -11.032 5.964 1.00 0.00 O ATOM 1299 CB THR B 37 6.479 -10.951 8.009 1.00 0.00 C ATOM 1300 OG1 THR B 37 5.923 -9.634 8.146 1.00 0.00 O ATOM 1301 CG2 THR B 37 7.993 -10.840 7.925 1.00 0.00 C ATOM 0 H THR B 37 6.216 -9.961 5.575 1.00 0.00 H new ATOM 0 HA THR B 37 6.274 -12.675 6.741 1.00 0.00 H new ATOM 0 HB THR B 37 6.215 -11.557 8.876 1.00 0.00 H new ATOM 0 HG1 THR B 37 6.170 -9.264 9.019 1.00 0.00 H new ATOM 0 HG21 THR B 37 8.372 -10.344 8.819 1.00 0.00 H new ATOM 0 HG22 THR B 37 8.427 -11.837 7.852 1.00 0.00 H new ATOM 0 HG23 THR B 37 8.267 -10.260 7.044 1.00 0.00 H new ATOM 1309 N ALA B 38 3.782 -12.254 7.838 1.00 0.00 N ATOM 1310 CA ALA B 38 2.322 -12.308 7.950 1.00 0.00 C ATOM 1311 C ALA B 38 1.701 -10.916 7.921 1.00 0.00 C ATOM 1312 O ALA B 38 0.737 -10.681 7.193 1.00 0.00 O ATOM 1313 CB ALA B 38 1.912 -13.051 9.207 1.00 0.00 C ATOM 0 H ALA B 38 4.282 -12.730 8.589 1.00 0.00 H new ATOM 0 HA ALA B 38 1.945 -12.852 7.083 1.00 0.00 H new ATOM 0 HB1 ALA B 38 0.824 -13.081 9.273 1.00 0.00 H new ATOM 0 HB2 ALA B 38 2.302 -14.068 9.172 1.00 0.00 H new ATOM 0 HB3 ALA B 38 2.315 -12.538 10.080 1.00 0.00 H new ATOM 1319 N GLN B 39 2.253 -9.993 8.704 1.00 0.00 N ATOM 1320 CA GLN B 39 1.785 -8.610 8.683 1.00 0.00 C ATOM 1321 C GLN B 39 1.954 -7.999 7.293 1.00 0.00 C ATOM 1322 O GLN B 39 1.069 -7.297 6.803 1.00 0.00 O ATOM 1323 CB GLN B 39 2.524 -7.767 9.727 1.00 0.00 C ATOM 1324 CG GLN B 39 2.203 -6.282 9.630 1.00 0.00 C ATOM 1325 CD GLN B 39 2.800 -5.468 10.758 1.00 0.00 C ATOM 1326 OE1 GLN B 39 3.826 -5.825 11.330 1.00 0.00 O ATOM 1327 NE2 GLN B 39 2.165 -4.351 11.072 1.00 0.00 N ATOM 0 H GLN B 39 3.017 -10.174 9.355 1.00 0.00 H new ATOM 0 HA GLN B 39 0.724 -8.614 8.932 1.00 0.00 H new ATOM 0 HB2 GLN B 39 2.265 -8.124 10.724 1.00 0.00 H new ATOM 0 HB3 GLN B 39 3.598 -7.909 9.606 1.00 0.00 H new ATOM 0 HG2 GLN B 39 2.572 -5.898 8.679 1.00 0.00 H new ATOM 0 HG3 GLN B 39 1.121 -6.150 9.628 1.00 0.00 H new ATOM 0 HE21 GLN B 39 1.315 -4.090 10.572 1.00 0.00 H new ATOM 0 HE22 GLN B 39 2.525 -3.751 11.814 1.00 0.00 H new ATOM 1336 N GLY B 40 3.083 -8.284 6.657 1.00 0.00 N ATOM 1337 CA GLY B 40 3.323 -7.797 5.317 1.00 0.00 C ATOM 1338 C GLY B 40 2.395 -8.444 4.313 1.00 0.00 C ATOM 1339 O GLY B 40 2.008 -7.827 3.324 1.00 0.00 O ATOM 0 H GLY B 40 3.838 -8.846 7.049 1.00 0.00 H new ATOM 0 HA2 GLY B 40 3.188 -6.716 5.293 1.00 0.00 H new ATOM 0 HA3 GLY B 40 4.358 -7.996 5.037 1.00 0.00 H new ATOM 1343 N TYR B 41 2.024 -9.687 4.583 1.00 0.00 N ATOM 1344 CA TYR B 41 1.091 -10.413 3.743 1.00 0.00 C ATOM 1345 C TYR B 41 -0.312 -9.840 3.868 1.00 0.00 C ATOM 1346 O TYR B 41 -1.071 -9.830 2.898 1.00 0.00 O ATOM 1347 CB TYR B 41 1.086 -11.897 4.131 1.00 0.00 C ATOM 1348 CG TYR B 41 2.023 -12.767 3.318 1.00 0.00 C ATOM 1349 CD1 TYR B 41 1.611 -13.321 2.112 1.00 0.00 C ATOM 1350 CD2 TYR B 41 3.308 -13.048 3.760 1.00 0.00 C ATOM 1351 CE1 TYR B 41 2.456 -14.125 1.368 1.00 0.00 C ATOM 1352 CE2 TYR B 41 4.158 -13.853 3.024 1.00 0.00 C ATOM 1353 CZ TYR B 41 3.727 -14.388 1.830 1.00 0.00 C ATOM 1354 OH TYR B 41 4.572 -15.191 1.094 1.00 0.00 O ATOM 0 H TYR B 41 2.361 -10.216 5.387 1.00 0.00 H new ATOM 0 HA TYR B 41 1.411 -10.311 2.706 1.00 0.00 H new ATOM 0 HB2 TYR B 41 1.353 -11.984 5.184 1.00 0.00 H new ATOM 0 HB3 TYR B 41 0.072 -12.282 4.027 1.00 0.00 H new ATOM 0 HD1 TYR B 41 0.614 -13.120 1.749 1.00 0.00 H new ATOM 0 HD2 TYR B 41 3.650 -12.631 4.695 1.00 0.00 H new ATOM 0 HE1 TYR B 41 2.121 -14.544 0.431 1.00 0.00 H new ATOM 0 HE2 TYR B 41 5.155 -14.061 3.384 1.00 0.00 H new ATOM 0 HH TYR B 41 5.431 -15.275 1.559 1.00 0.00 H new ATOM 1364 N THR B 42 -0.652 -9.339 5.046 1.00 0.00 N ATOM 1365 CA THR B 42 -1.914 -8.640 5.229 1.00 0.00 C ATOM 1366 C THR B 42 -1.895 -7.293 4.506 1.00 0.00 C ATOM 1367 O THR B 42 -2.909 -6.835 3.971 1.00 0.00 O ATOM 1368 CB THR B 42 -2.185 -8.398 6.720 1.00 0.00 C ATOM 1369 OG1 THR B 42 -1.912 -9.592 7.458 1.00 0.00 O ATOM 1370 CG2 THR B 42 -3.626 -7.971 6.950 1.00 0.00 C ATOM 0 H THR B 42 -0.075 -9.403 5.885 1.00 0.00 H new ATOM 0 HA THR B 42 -2.703 -9.266 4.811 1.00 0.00 H new ATOM 0 HB THR B 42 -1.531 -7.596 7.063 1.00 0.00 H new ATOM 0 HG1 THR B 42 -2.304 -9.520 8.353 1.00 0.00 H new ATOM 0 HG21 THR B 42 -3.791 -7.806 8.015 1.00 0.00 H new ATOM 0 HG22 THR B 42 -3.823 -7.048 6.405 1.00 0.00 H new ATOM 0 HG23 THR B 42 -4.298 -8.752 6.595 1.00 0.00 H new ATOM 1378 N LEU B 43 -0.716 -6.686 4.450 1.00 0.00 N ATOM 1379 CA LEU B 43 -0.570 -5.375 3.841 1.00 0.00 C ATOM 1380 C LEU B 43 -0.354 -5.500 2.339 1.00 0.00 C ATOM 1381 O LEU B 43 -0.499 -4.520 1.620 1.00 0.00 O ATOM 1382 CB LEU B 43 0.596 -4.591 4.477 1.00 0.00 C ATOM 1383 CG LEU B 43 0.213 -3.533 5.536 1.00 0.00 C ATOM 1384 CD1 LEU B 43 -0.618 -4.154 6.647 1.00 0.00 C ATOM 1385 CD2 LEU B 43 1.464 -2.896 6.115 1.00 0.00 C ATOM 0 H LEU B 43 0.149 -7.081 4.818 1.00 0.00 H new ATOM 0 HA LEU B 43 -1.493 -4.824 4.020 1.00 0.00 H new ATOM 0 HB2 LEU B 43 1.277 -5.306 4.938 1.00 0.00 H new ATOM 0 HB3 LEU B 43 1.148 -4.093 3.680 1.00 0.00 H new ATOM 0 HG LEU B 43 -0.386 -2.764 5.049 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -0.875 -3.389 7.380 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -1.531 -4.575 6.226 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -0.044 -4.944 7.132 1.00 0.00 H new ATOM 0 HD21 LEU B 43 1.182 -2.152 6.860 1.00 0.00 H new ATOM 0 HD22 LEU B 43 2.080 -3.664 6.584 1.00 0.00 H new ATOM 0 HD23 LEU B 43 2.030 -2.414 5.317 1.00 0.00 H new ATOM 1397 N LEU B 44 -0.037 -6.696 1.841 1.00 0.00 N ATOM 1398 CA LEU B 44 0.153 -6.859 0.406 1.00 0.00 C ATOM 1399 C LEU B 44 -1.194 -7.053 -0.280 1.00 0.00 C ATOM 1400 O LEU B 44 -1.438 -6.487 -1.335 1.00 0.00 O ATOM 1401 CB LEU B 44 1.141 -8.007 0.072 1.00 0.00 C ATOM 1402 CG LEU B 44 0.578 -9.440 -0.029 1.00 0.00 C ATOM 1403 CD1 LEU B 44 -0.105 -9.676 -1.371 1.00 0.00 C ATOM 1404 CD2 LEU B 44 1.688 -10.460 0.147 1.00 0.00 C ATOM 0 H LEU B 44 0.090 -7.543 2.395 1.00 0.00 H new ATOM 0 HA LEU B 44 0.608 -5.947 0.020 1.00 0.00 H new ATOM 0 HB2 LEU B 44 1.621 -7.769 -0.877 1.00 0.00 H new ATOM 0 HB3 LEU B 44 1.922 -8.008 0.833 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.159 -9.556 0.766 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.490 -10.695 -1.409 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -0.929 -8.972 -1.489 1.00 0.00 H new ATOM 0 HD13 LEU B 44 0.615 -9.530 -2.176 1.00 0.00 H new ATOM 0 HD21 LEU B 44 1.273 -11.465 0.073 1.00 0.00 H new ATOM 0 HD22 LEU B 44 2.439 -10.319 -0.631 1.00 0.00 H new ATOM 0 HD23 LEU B 44 2.150 -10.329 1.125 1.00 0.00 H new ATOM 1416 N ASP B 45 -2.083 -7.821 0.346 1.00 0.00 N ATOM 1417 CA ASP B 45 -3.392 -8.107 -0.238 1.00 0.00 C ATOM 1418 C ASP B 45 -4.260 -6.862 -0.222 1.00 0.00 C ATOM 1419 O ASP B 45 -5.161 -6.704 -1.044 1.00 0.00 O ATOM 1420 CB ASP B 45 -4.077 -9.240 0.531 1.00 0.00 C ATOM 1421 CG ASP B 45 -5.494 -9.515 0.056 1.00 0.00 C ATOM 1422 OD1 ASP B 45 -5.654 -10.185 -0.988 1.00 0.00 O ATOM 1423 OD2 ASP B 45 -6.451 -9.082 0.734 1.00 0.00 O ATOM 0 H ASP B 45 -1.922 -8.255 1.255 1.00 0.00 H new ATOM 0 HA ASP B 45 -3.252 -8.420 -1.273 1.00 0.00 H new ATOM 0 HB2 ASP B 45 -3.484 -10.149 0.430 1.00 0.00 H new ATOM 0 HB3 ASP B 45 -4.098 -8.989 1.592 1.00 0.00 H new ATOM 1428 N PHE B 46 -3.943 -5.951 0.678 1.00 0.00 N ATOM 1429 CA PHE B 46 -4.624 -4.671 0.727 1.00 0.00 C ATOM 1430 C PHE B 46 -4.174 -3.805 -0.413 1.00 0.00 C ATOM 1431 O PHE B 46 -4.980 -3.176 -1.098 1.00 0.00 O ATOM 1432 CB PHE B 46 -4.239 -3.944 2.004 1.00 0.00 C ATOM 1433 CG PHE B 46 -5.356 -3.178 2.633 1.00 0.00 C ATOM 1434 CD1 PHE B 46 -6.354 -3.837 3.324 1.00 0.00 C ATOM 1435 CD2 PHE B 46 -5.408 -1.798 2.531 1.00 0.00 C ATOM 1436 CE1 PHE B 46 -7.387 -3.135 3.903 1.00 0.00 C ATOM 1437 CE2 PHE B 46 -6.441 -1.090 3.109 1.00 0.00 C ATOM 1438 CZ PHE B 46 -7.432 -1.760 3.795 1.00 0.00 C ATOM 0 H PHE B 46 -3.218 -6.073 1.385 1.00 0.00 H new ATOM 0 HA PHE B 46 -5.698 -4.853 0.677 1.00 0.00 H new ATOM 0 HB2 PHE B 46 -3.862 -4.671 2.723 1.00 0.00 H new ATOM 0 HB3 PHE B 46 -3.421 -3.258 1.786 1.00 0.00 H new ATOM 0 HD1 PHE B 46 -6.324 -4.913 3.411 1.00 0.00 H new ATOM 0 HD2 PHE B 46 -4.633 -1.271 1.994 1.00 0.00 H new ATOM 0 HE1 PHE B 46 -8.162 -3.660 4.442 1.00 0.00 H new ATOM 0 HE2 PHE B 46 -6.474 -0.014 3.025 1.00 0.00 H new ATOM 0 HZ PHE B 46 -8.243 -1.209 4.248 1.00 0.00 H new ATOM 1448 N ILE B 47 -2.883 -3.783 -0.631 1.00 0.00 N ATOM 1449 CA ILE B 47 -2.344 -2.885 -1.605 1.00 0.00 C ATOM 1450 C ILE B 47 -2.533 -3.447 -3.013 1.00 0.00 C ATOM 1451 O ILE B 47 -2.667 -2.698 -3.979 1.00 0.00 O ATOM 1452 CB ILE B 47 -0.870 -2.555 -1.309 1.00 0.00 C ATOM 1453 CG1 ILE B 47 -0.011 -3.820 -1.368 1.00 0.00 C ATOM 1454 CG2 ILE B 47 -0.777 -1.915 0.066 1.00 0.00 C ATOM 1455 CD1 ILE B 47 1.437 -3.603 -0.980 1.00 0.00 C ATOM 0 H ILE B 47 -2.199 -4.369 -0.152 1.00 0.00 H new ATOM 0 HA ILE B 47 -2.894 -1.945 -1.547 1.00 0.00 H new ATOM 0 HB ILE B 47 -0.495 -1.862 -2.062 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -0.444 -4.571 -0.708 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -0.048 -4.225 -2.379 1.00 0.00 H new ATOM 0 HG21 ILE B 47 0.263 -1.677 0.287 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -1.370 -1.001 0.083 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -1.158 -2.608 0.816 1.00 0.00 H new ATOM 0 HD11 ILE B 47 1.977 -4.547 -1.048 1.00 0.00 H new ATOM 0 HD12 ILE B 47 1.890 -2.877 -1.655 1.00 0.00 H new ATOM 0 HD13 ILE B 47 1.488 -3.229 0.043 1.00 0.00 H new ATOM 1467 N GLN B 48 -2.588 -4.771 -3.106 1.00 0.00 N ATOM 1468 CA GLN B 48 -3.046 -5.441 -4.309 1.00 0.00 C ATOM 1469 C GLN B 48 -4.429 -4.939 -4.672 1.00 0.00 C ATOM 1470 O GLN B 48 -4.632 -4.329 -5.701 1.00 0.00 O ATOM 1471 CB GLN B 48 -3.126 -6.954 -4.088 1.00 0.00 C ATOM 1472 CG GLN B 48 -1.778 -7.643 -3.969 1.00 0.00 C ATOM 1473 CD GLN B 48 -0.930 -7.488 -5.215 1.00 0.00 C ATOM 1474 OE1 GLN B 48 -1.447 -7.356 -6.325 1.00 0.00 O ATOM 1475 NE2 GLN B 48 0.379 -7.508 -5.041 1.00 0.00 N ATOM 0 H GLN B 48 -2.317 -5.403 -2.353 1.00 0.00 H new ATOM 0 HA GLN B 48 -2.338 -5.228 -5.110 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -3.700 -7.147 -3.182 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -3.677 -7.401 -4.915 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -1.239 -7.233 -3.115 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -1.933 -8.703 -3.769 1.00 0.00 H new ATOM 0 HE21 GLN B 48 0.767 -7.619 -4.104 1.00 0.00 H new ATOM 0 HE22 GLN B 48 1.002 -7.412 -5.843 1.00 0.00 H new ATOM 1484 N LYS B 49 -5.336 -5.109 -3.740 1.00 0.00 N ATOM 1485 CA LYS B 49 -6.762 -4.996 -3.986 1.00 0.00 C ATOM 1486 C LYS B 49 -7.251 -3.547 -4.038 1.00 0.00 C ATOM 1487 O LYS B 49 -8.418 -3.294 -4.293 1.00 0.00 O ATOM 1488 CB LYS B 49 -7.455 -5.819 -2.896 1.00 0.00 C ATOM 1489 CG LYS B 49 -8.947 -5.598 -2.698 1.00 0.00 C ATOM 1490 CD LYS B 49 -9.508 -6.589 -1.680 1.00 0.00 C ATOM 1491 CE LYS B 49 -8.423 -7.061 -0.717 1.00 0.00 C ATOM 1492 NZ LYS B 49 -8.955 -7.878 0.400 1.00 0.00 N ATOM 0 H LYS B 49 -5.105 -5.334 -2.772 1.00 0.00 H new ATOM 0 HA LYS B 49 -7.008 -5.383 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -7.297 -6.874 -3.118 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -6.955 -5.614 -1.949 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -9.127 -4.578 -2.358 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -9.466 -5.713 -3.649 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -10.317 -6.121 -1.120 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -9.935 -7.446 -2.200 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -7.685 -7.645 -1.268 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -7.904 -6.193 -0.310 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -8.193 -8.466 0.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -9.327 -7.251 1.142 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -9.719 -8.490 0.049 1.00 0.00 H new ATOM 1506 N HIS B 50 -6.394 -2.571 -3.794 1.00 0.00 N ATOM 1507 CA HIS B 50 -6.844 -1.211 -4.096 1.00 0.00 C ATOM 1508 C HIS B 50 -6.017 -0.509 -5.181 1.00 0.00 C ATOM 1509 O HIS B 50 -6.317 0.626 -5.536 1.00 0.00 O ATOM 1510 CB HIS B 50 -6.895 -0.381 -2.810 1.00 0.00 C ATOM 1511 CG HIS B 50 -7.647 -1.079 -1.713 1.00 0.00 C ATOM 1512 ND1 HIS B 50 -7.039 -1.547 -0.574 1.00 0.00 N ATOM 1513 CD2 HIS B 50 -8.949 -1.448 -1.617 1.00 0.00 C ATOM 1514 CE1 HIS B 50 -7.924 -2.178 0.171 1.00 0.00 C ATOM 1515 NE2 HIS B 50 -9.090 -2.135 -0.436 1.00 0.00 N ATOM 0 H HIS B 50 -5.452 -2.671 -3.417 1.00 0.00 H new ATOM 0 HA HIS B 50 -7.847 -1.298 -4.514 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -5.879 -0.171 -2.475 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -7.367 0.579 -3.018 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -9.729 -1.240 -2.335 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -7.725 -2.651 1.121 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -9.957 -2.545 -0.087 1.00 0.00 H new ATOM 1524 N LEU B 51 -4.992 -1.169 -5.719 1.00 0.00 N ATOM 1525 CA LEU B 51 -4.265 -0.612 -6.872 1.00 0.00 C ATOM 1526 C LEU B 51 -4.352 -1.531 -8.080 1.00 0.00 C ATOM 1527 O LEU B 51 -4.352 -1.083 -9.224 1.00 0.00 O ATOM 1528 CB LEU B 51 -2.777 -0.394 -6.577 1.00 0.00 C ATOM 1529 CG LEU B 51 -2.417 0.764 -5.638 1.00 0.00 C ATOM 1530 CD1 LEU B 51 -3.041 2.074 -6.105 1.00 0.00 C ATOM 1531 CD2 LEU B 51 -2.830 0.448 -4.219 1.00 0.00 C ATOM 0 H LEU B 51 -4.648 -2.070 -5.388 1.00 0.00 H new ATOM 0 HA LEU B 51 -4.743 0.345 -7.078 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -2.378 -1.314 -6.149 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -2.263 -0.234 -7.525 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.334 0.888 -5.662 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -2.766 2.874 -5.417 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -2.678 2.314 -7.104 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -4.126 1.972 -6.128 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -2.566 1.282 -3.569 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -3.907 0.286 -4.181 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -2.315 -0.452 -3.882 1.00 0.00 H new ATOM 1543 N ASN B 52 -4.400 -2.817 -7.815 1.00 0.00 N ATOM 1544 CA ASN B 52 -4.193 -3.826 -8.842 1.00 0.00 C ATOM 1545 C ASN B 52 -5.334 -4.842 -8.884 1.00 0.00 C ATOM 1546 O ASN B 52 -5.642 -5.399 -9.937 1.00 0.00 O ATOM 1547 CB ASN B 52 -2.859 -4.519 -8.565 1.00 0.00 C ATOM 1548 CG ASN B 52 -1.722 -3.972 -9.409 1.00 0.00 C ATOM 1549 OD1 ASN B 52 -0.765 -4.685 -9.708 1.00 0.00 O ATOM 1550 ND2 ASN B 52 -1.814 -2.709 -9.801 1.00 0.00 N ATOM 0 H ASN B 52 -4.583 -3.197 -6.886 1.00 0.00 H new ATOM 0 HA ASN B 52 -4.175 -3.344 -9.819 1.00 0.00 H new ATOM 0 HB2 ASN B 52 -2.609 -4.406 -7.510 1.00 0.00 H new ATOM 0 HB3 ASN B 52 -2.964 -5.587 -8.755 1.00 0.00 H new ATOM 0 HD21 ASN B 52 -1.075 -2.297 -10.371 1.00 0.00 H new ATOM 0 HD22 ASN B 52 -2.624 -2.149 -9.533 1.00 0.00 H new ATOM 1557 N LYS B 53 -5.943 -5.079 -7.736 1.00 0.00 N ATOM 1558 CA LYS B 53 -7.095 -5.954 -7.625 1.00 0.00 C ATOM 1559 C LYS B 53 -8.345 -5.128 -7.331 1.00 0.00 C ATOM 1560 O LYS B 53 -8.888 -5.227 -6.213 1.00 0.00 O ATOM 1561 CB LYS B 53 -6.870 -6.987 -6.513 1.00 0.00 C ATOM 1562 CG LYS B 53 -6.587 -8.386 -7.029 1.00 0.00 C ATOM 1563 CD LYS B 53 -6.725 -9.410 -5.913 1.00 0.00 C ATOM 1564 CE LYS B 53 -5.536 -9.387 -4.972 1.00 0.00 C ATOM 1565 NZ LYS B 53 -4.358 -10.087 -5.551 1.00 0.00 N ATOM 1566 OXT LYS B 53 -8.764 -4.363 -8.225 1.00 0.00 O ATOM 0 H LYS B 53 -5.650 -4.667 -6.850 1.00 0.00 H new ATOM 0 HA LYS B 53 -7.232 -6.482 -8.569 1.00 0.00 H new ATOM 0 HB2 LYS B 53 -6.035 -6.663 -5.891 1.00 0.00 H new ATOM 0 HB3 LYS B 53 -7.752 -7.017 -5.873 1.00 0.00 H new ATOM 0 HG2 LYS B 53 -7.277 -8.627 -7.838 1.00 0.00 H new ATOM 0 HG3 LYS B 53 -5.581 -8.428 -7.446 1.00 0.00 H new ATOM 0 HD2 LYS B 53 -7.637 -9.212 -5.350 1.00 0.00 H new ATOM 0 HD3 LYS B 53 -6.827 -10.406 -6.345 1.00 0.00 H new ATOM 0 HE2 LYS B 53 -5.270 -8.354 -4.747 1.00 0.00 H new ATOM 0 HE3 LYS B 53 -5.811 -9.858 -4.028 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 -3.566 -10.049 -4.878 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 -4.603 -11.079 -5.742 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 -4.080 -9.622 -6.439 1.00 0.00 H new ATOM 1601 N VAL C 2 -7.362 4.623 13.796 1.00 0.00 N ATOM 1602 CA VAL C 2 -6.222 4.908 14.654 1.00 0.00 C ATOM 1603 C VAL C 2 -5.112 5.587 13.853 1.00 0.00 C ATOM 1604 O VAL C 2 -4.099 6.027 14.399 1.00 0.00 O ATOM 1605 CB VAL C 2 -5.693 3.606 15.304 1.00 0.00 C ATOM 1606 CG1 VAL C 2 -5.095 2.676 14.257 1.00 0.00 C ATOM 1607 CG2 VAL C 2 -4.686 3.905 16.406 1.00 0.00 C ATOM 0 HA VAL C 2 -6.547 5.583 15.446 1.00 0.00 H new ATOM 0 HB VAL C 2 -6.542 3.098 15.761 1.00 0.00 H new ATOM 0 HG11 VAL C 2 -4.731 1.770 14.741 1.00 0.00 H new ATOM 0 HG12 VAL C 2 -5.858 2.415 13.524 1.00 0.00 H new ATOM 0 HG13 VAL C 2 -4.267 3.177 13.756 1.00 0.00 H new ATOM 0 HG21 VAL C 2 -4.335 2.970 16.841 1.00 0.00 H new ATOM 0 HG22 VAL C 2 -3.840 4.451 15.988 1.00 0.00 H new ATOM 0 HG23 VAL C 2 -5.161 4.509 17.179 1.00 0.00 H new ATOM 1617 N ILE C 3 -5.324 5.693 12.551 1.00 0.00 N ATOM 1618 CA ILE C 3 -4.330 6.272 11.669 1.00 0.00 C ATOM 1619 C ILE C 3 -4.949 7.365 10.807 1.00 0.00 C ATOM 1620 O ILE C 3 -6.073 7.227 10.325 1.00 0.00 O ATOM 1621 CB ILE C 3 -3.675 5.195 10.766 1.00 0.00 C ATOM 1622 CG1 ILE C 3 -2.550 5.809 9.926 1.00 0.00 C ATOM 1623 CG2 ILE C 3 -4.716 4.530 9.868 1.00 0.00 C ATOM 1624 CD1 ILE C 3 -1.787 4.799 9.097 1.00 0.00 C ATOM 0 H ILE C 3 -6.177 5.385 12.084 1.00 0.00 H new ATOM 0 HA ILE C 3 -3.553 6.709 12.296 1.00 0.00 H new ATOM 0 HB ILE C 3 -3.245 4.428 11.410 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -2.974 6.563 9.263 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -1.853 6.322 10.588 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -4.232 3.779 9.244 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -5.478 4.053 10.485 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -5.183 5.283 9.233 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -1.007 5.308 8.530 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -1.332 4.058 9.754 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -2.471 4.303 8.408 1.00 0.00 H new ATOM 1636 N ALA C 4 -4.231 8.466 10.668 1.00 0.00 N ATOM 1637 CA ALA C 4 -4.625 9.532 9.766 1.00 0.00 C ATOM 1638 C ALA C 4 -3.485 9.830 8.804 1.00 0.00 C ATOM 1639 O ALA C 4 -2.310 9.674 9.147 1.00 0.00 O ATOM 1640 CB ALA C 4 -5.011 10.775 10.552 1.00 0.00 C ATOM 0 H ALA C 4 -3.364 8.645 11.174 1.00 0.00 H new ATOM 0 HA ALA C 4 -5.496 9.216 9.192 1.00 0.00 H new ATOM 0 HB1 ALA C 4 -5.304 11.566 9.861 1.00 0.00 H new ATOM 0 HB2 ALA C 4 -5.846 10.543 11.213 1.00 0.00 H new ATOM 0 HB3 ALA C 4 -4.160 11.109 11.146 1.00 0.00 H new ATOM 1646 N THR C 5 -3.844 10.254 7.599 1.00 0.00 N ATOM 1647 CA THR C 5 -2.881 10.479 6.529 1.00 0.00 C ATOM 1648 C THR C 5 -1.892 11.586 6.896 1.00 0.00 C ATOM 1649 O THR C 5 -0.796 11.661 6.344 1.00 0.00 O ATOM 1650 CB THR C 5 -3.610 10.852 5.219 1.00 0.00 C ATOM 1651 OG1 THR C 5 -4.702 9.946 5.000 1.00 0.00 O ATOM 1652 CG2 THR C 5 -2.668 10.798 4.024 1.00 0.00 C ATOM 0 H THR C 5 -4.810 10.451 7.336 1.00 0.00 H new ATOM 0 HA THR C 5 -2.326 9.552 6.385 1.00 0.00 H new ATOM 0 HB THR C 5 -3.981 11.872 5.319 1.00 0.00 H new ATOM 0 HG1 THR C 5 -5.164 10.185 4.170 1.00 0.00 H new ATOM 0 HG21 THR C 5 -3.213 11.066 3.119 1.00 0.00 H new ATOM 0 HG22 THR C 5 -1.848 11.500 4.175 1.00 0.00 H new ATOM 0 HG23 THR C 5 -2.268 9.789 3.921 1.00 0.00 H new ATOM 1660 N ASP C 6 -2.262 12.404 7.874 1.00 0.00 N ATOM 1661 CA ASP C 6 -1.468 13.566 8.246 1.00 0.00 C ATOM 1662 C ASP C 6 -0.336 13.189 9.198 1.00 0.00 C ATOM 1663 O ASP C 6 0.450 14.046 9.604 1.00 0.00 O ATOM 1664 CB ASP C 6 -2.350 14.632 8.899 1.00 0.00 C ATOM 1665 CG ASP C 6 -3.435 15.150 7.975 1.00 0.00 C ATOM 1666 OD1 ASP C 6 -4.534 14.559 7.957 1.00 0.00 O ATOM 1667 OD2 ASP C 6 -3.200 16.161 7.280 1.00 0.00 O ATOM 0 H ASP C 6 -3.111 12.282 8.425 1.00 0.00 H new ATOM 0 HA ASP C 6 -1.031 13.967 7.332 1.00 0.00 H new ATOM 0 HB2 ASP C 6 -2.811 14.215 9.794 1.00 0.00 H new ATOM 0 HB3 ASP C 6 -1.725 15.466 9.220 1.00 0.00 H new ATOM 1672 N ASP C 7 -0.247 11.913 9.561 1.00 0.00 N ATOM 1673 CA ASP C 7 0.856 11.451 10.404 1.00 0.00 C ATOM 1674 C ASP C 7 1.908 10.752 9.557 1.00 0.00 C ATOM 1675 O ASP C 7 3.063 10.616 9.963 1.00 0.00 O ATOM 1676 CB ASP C 7 0.371 10.450 11.466 1.00 0.00 C ATOM 1677 CG ASP C 7 -0.733 10.966 12.364 1.00 0.00 C ATOM 1678 OD1 ASP C 7 -0.450 11.778 13.265 1.00 0.00 O ATOM 1679 OD2 ASP C 7 -1.886 10.508 12.206 1.00 0.00 O ATOM 0 H ASP C 7 -0.913 11.189 9.291 1.00 0.00 H new ATOM 0 HA ASP C 7 1.274 12.331 10.894 1.00 0.00 H new ATOM 0 HB2 ASP C 7 0.020 9.549 10.963 1.00 0.00 H new ATOM 0 HB3 ASP C 7 1.219 10.159 12.086 1.00 0.00 H new ATOM 1684 N LEU C 8 1.508 10.304 8.378 1.00 0.00 N ATOM 1685 CA LEU C 8 2.422 9.594 7.496 1.00 0.00 C ATOM 1686 C LEU C 8 2.778 10.446 6.291 1.00 0.00 C ATOM 1687 O LEU C 8 3.704 10.132 5.541 1.00 0.00 O ATOM 1688 CB LEU C 8 1.832 8.257 7.054 1.00 0.00 C ATOM 1689 CG LEU C 8 1.853 7.152 8.111 1.00 0.00 C ATOM 1690 CD1 LEU C 8 0.799 7.389 9.180 1.00 0.00 C ATOM 1691 CD2 LEU C 8 1.656 5.797 7.459 1.00 0.00 C ATOM 0 H LEU C 8 0.563 10.418 8.011 1.00 0.00 H new ATOM 0 HA LEU C 8 3.336 9.391 8.055 1.00 0.00 H new ATOM 0 HB2 LEU C 8 0.800 8.419 6.742 1.00 0.00 H new ATOM 0 HB3 LEU C 8 2.379 7.909 6.178 1.00 0.00 H new ATOM 0 HG LEU C 8 2.828 7.169 8.598 1.00 0.00 H new ATOM 0 HD11 LEU C 8 0.840 6.586 9.916 1.00 0.00 H new ATOM 0 HD12 LEU C 8 0.988 8.343 9.673 1.00 0.00 H new ATOM 0 HD13 LEU C 8 -0.189 7.408 8.719 1.00 0.00 H new ATOM 0 HD21 LEU C 8 1.673 5.020 8.223 1.00 0.00 H new ATOM 0 HD22 LEU C 8 0.696 5.778 6.943 1.00 0.00 H new ATOM 0 HD23 LEU C 8 2.457 5.618 6.742 1.00 0.00 H new ATOM 1703 N GLU C 9 2.042 11.532 6.127 1.00 0.00 N ATOM 1704 CA GLU C 9 2.326 12.510 5.099 1.00 0.00 C ATOM 1705 C GLU C 9 2.120 13.905 5.652 1.00 0.00 C ATOM 1706 O GLU C 9 1.234 14.142 6.470 1.00 0.00 O ATOM 1707 CB GLU C 9 1.460 12.302 3.852 1.00 0.00 C ATOM 1708 CG GLU C 9 1.947 11.175 2.956 1.00 0.00 C ATOM 1709 CD GLU C 9 1.157 11.065 1.669 1.00 0.00 C ATOM 1710 OE1 GLU C 9 -0.083 10.949 1.736 1.00 0.00 O ATOM 1711 OE2 GLU C 9 1.779 11.080 0.581 1.00 0.00 O ATOM 0 H GLU C 9 1.232 11.758 6.704 1.00 0.00 H new ATOM 0 HA GLU C 9 3.365 12.383 4.796 1.00 0.00 H new ATOM 0 HB2 GLU C 9 0.436 12.093 4.161 1.00 0.00 H new ATOM 0 HB3 GLU C 9 1.436 13.228 3.277 1.00 0.00 H new ATOM 0 HG2 GLU C 9 2.999 11.334 2.719 1.00 0.00 H new ATOM 0 HG3 GLU C 9 1.882 10.232 3.499 1.00 0.00 H new ATOM 1718 N VAL C 10 2.964 14.811 5.218 1.00 0.00 N ATOM 1719 CA VAL C 10 2.917 16.186 5.657 1.00 0.00 C ATOM 1720 C VAL C 10 2.884 17.097 4.442 1.00 0.00 C ATOM 1721 O VAL C 10 3.512 16.805 3.421 1.00 0.00 O ATOM 1722 CB VAL C 10 4.136 16.522 6.551 1.00 0.00 C ATOM 1723 CG1 VAL C 10 5.444 16.257 5.820 1.00 0.00 C ATOM 1724 CG2 VAL C 10 4.075 17.958 7.044 1.00 0.00 C ATOM 0 H VAL C 10 3.707 14.614 4.547 1.00 0.00 H new ATOM 0 HA VAL C 10 2.016 16.339 6.251 1.00 0.00 H new ATOM 0 HB VAL C 10 4.098 15.865 7.420 1.00 0.00 H new ATOM 0 HG11 VAL C 10 6.282 16.502 6.473 1.00 0.00 H new ATOM 0 HG12 VAL C 10 5.498 15.205 5.540 1.00 0.00 H new ATOM 0 HG13 VAL C 10 5.491 16.874 4.923 1.00 0.00 H new ATOM 0 HG21 VAL C 10 4.944 18.165 7.669 1.00 0.00 H new ATOM 0 HG22 VAL C 10 4.072 18.636 6.190 1.00 0.00 H new ATOM 0 HG23 VAL C 10 3.165 18.104 7.627 1.00 0.00 H new ATOM 1734 N ALA C 11 2.127 18.178 4.530 1.00 0.00 N ATOM 1735 CA ALA C 11 2.040 19.126 3.440 1.00 0.00 C ATOM 1736 C ALA C 11 3.392 19.767 3.203 1.00 0.00 C ATOM 1737 O ALA C 11 4.057 20.213 4.140 1.00 0.00 O ATOM 1738 CB ALA C 11 0.983 20.173 3.754 1.00 0.00 C ATOM 0 H ALA C 11 1.565 18.418 5.347 1.00 0.00 H new ATOM 0 HA ALA C 11 1.747 18.607 2.527 1.00 0.00 H new ATOM 0 HB1 ALA C 11 0.920 20.885 2.931 1.00 0.00 H new ATOM 0 HB2 ALA C 11 0.017 19.686 3.887 1.00 0.00 H new ATOM 0 HB3 ALA C 11 1.253 20.699 4.669 1.00 0.00 H new ATOM 1744 N CYS C 12 3.796 19.788 1.940 1.00 0.00 N ATOM 1745 CA CYS C 12 5.147 20.133 1.548 1.00 0.00 C ATOM 1746 C CYS C 12 5.497 21.591 1.879 1.00 0.00 C ATOM 1747 O CYS C 12 4.601 22.419 1.962 1.00 0.00 O ATOM 1748 CB CYS C 12 5.285 19.845 0.053 1.00 0.00 C ATOM 1749 SG CYS C 12 6.878 20.289 -0.646 1.00 0.00 S ATOM 0 H CYS C 12 3.186 19.563 1.154 1.00 0.00 H new ATOM 0 HA CYS C 12 5.856 19.530 2.115 1.00 0.00 H new ATOM 0 HB2 CYS C 12 5.111 18.783 -0.117 1.00 0.00 H new ATOM 0 HB3 CYS C 12 4.504 20.386 -0.482 1.00 0.00 H new ATOM 0 HG CYS C 12 6.715 20.712 -1.864 1.00 0.00 H new ATOM 1754 N PRO C 13 6.794 21.913 2.095 1.00 0.00 N ATOM 1755 CA PRO C 13 7.258 23.267 2.447 1.00 0.00 C ATOM 1756 C PRO C 13 6.492 24.407 1.763 1.00 0.00 C ATOM 1757 O PRO C 13 6.195 25.435 2.380 1.00 0.00 O ATOM 1758 CB PRO C 13 8.699 23.244 1.942 1.00 0.00 C ATOM 1759 CG PRO C 13 9.160 21.843 2.156 1.00 0.00 C ATOM 1760 CD PRO C 13 7.932 20.967 2.035 1.00 0.00 C ATOM 0 HA PRO C 13 7.122 23.467 3.510 1.00 0.00 H new ATOM 0 HB2 PRO C 13 8.753 23.521 0.889 1.00 0.00 H new ATOM 0 HB3 PRO C 13 9.321 23.952 2.490 1.00 0.00 H new ATOM 0 HG2 PRO C 13 9.911 21.564 1.417 1.00 0.00 H new ATOM 0 HG3 PRO C 13 9.622 21.731 3.137 1.00 0.00 H new ATOM 0 HD2 PRO C 13 7.934 20.408 1.099 1.00 0.00 H new ATOM 0 HD3 PRO C 13 7.884 20.237 2.843 1.00 0.00 H new ATOM 1768 N LYS C 14 6.130 24.195 0.504 1.00 0.00 N ATOM 1769 CA LYS C 14 5.643 25.285 -0.325 1.00 0.00 C ATOM 1770 C LYS C 14 4.519 24.883 -1.284 1.00 0.00 C ATOM 1771 O LYS C 14 3.683 25.718 -1.624 1.00 0.00 O ATOM 1772 CB LYS C 14 6.810 25.874 -1.121 1.00 0.00 C ATOM 1773 CG LYS C 14 6.397 26.917 -2.150 1.00 0.00 C ATOM 1774 CD LYS C 14 7.575 27.335 -3.015 1.00 0.00 C ATOM 1775 CE LYS C 14 7.120 28.141 -4.219 1.00 0.00 C ATOM 1776 NZ LYS C 14 6.611 29.483 -3.839 1.00 0.00 N ATOM 0 H LYS C 14 6.164 23.287 0.040 1.00 0.00 H new ATOM 0 HA LYS C 14 5.215 26.024 0.353 1.00 0.00 H new ATOM 0 HB2 LYS C 14 7.518 26.325 -0.426 1.00 0.00 H new ATOM 0 HB3 LYS C 14 7.334 25.065 -1.630 1.00 0.00 H new ATOM 0 HG2 LYS C 14 5.604 26.515 -2.781 1.00 0.00 H new ATOM 0 HG3 LYS C 14 5.988 27.790 -1.642 1.00 0.00 H new ATOM 0 HD2 LYS C 14 8.272 27.927 -2.422 1.00 0.00 H new ATOM 0 HD3 LYS C 14 8.114 26.449 -3.351 1.00 0.00 H new ATOM 0 HE2 LYS C 14 7.952 28.254 -4.913 1.00 0.00 H new ATOM 0 HE3 LYS C 14 6.338 27.594 -4.745 1.00 0.00 H new ATOM 0 HZ1 LYS C 14 6.312 29.996 -4.693 1.00 0.00 H new ATOM 0 HZ2 LYS C 14 5.800 29.378 -3.197 1.00 0.00 H new ATOM 0 HZ3 LYS C 14 7.364 30.017 -3.360 1.00 0.00 H new ATOM 1790 N CYS C 15 4.470 23.635 -1.747 1.00 0.00 N ATOM 1791 CA CYS C 15 3.592 23.349 -2.878 1.00 0.00 C ATOM 1792 C CYS C 15 2.446 22.370 -2.588 1.00 0.00 C ATOM 1793 O CYS C 15 2.091 21.546 -3.438 1.00 0.00 O ATOM 1794 CB CYS C 15 4.460 22.763 -3.981 1.00 0.00 C ATOM 1795 SG CYS C 15 5.361 21.269 -3.488 1.00 0.00 S ATOM 0 H CYS C 15 4.998 22.843 -1.380 1.00 0.00 H new ATOM 0 HA CYS C 15 3.109 24.288 -3.149 1.00 0.00 H new ATOM 0 HB2 CYS C 15 3.831 22.530 -4.840 1.00 0.00 H new ATOM 0 HB3 CYS C 15 5.176 23.517 -4.306 1.00 0.00 H new ATOM 0 HG CYS C 15 4.675 20.217 -3.825 1.00 0.00 H new ATOM 1800 N GLU C 16 1.783 22.563 -1.467 1.00 0.00 N ATOM 1801 CA GLU C 16 0.733 21.662 -1.002 1.00 0.00 C ATOM 1802 C GLU C 16 -0.611 22.124 -1.519 1.00 0.00 C ATOM 1803 O GLU C 16 -1.649 21.860 -0.915 1.00 0.00 O ATOM 1804 CB GLU C 16 0.679 21.683 0.531 1.00 0.00 C ATOM 1805 CG GLU C 16 1.802 22.456 1.197 1.00 0.00 C ATOM 1806 CD GLU C 16 1.536 23.951 1.216 1.00 0.00 C ATOM 1807 OE1 GLU C 16 1.737 24.608 0.178 1.00 0.00 O ATOM 1808 OE2 GLU C 16 1.116 24.476 2.268 1.00 0.00 O ATOM 0 H GLU C 16 1.954 23.353 -0.844 1.00 0.00 H new ATOM 0 HA GLU C 16 0.952 20.658 -1.365 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -0.273 22.114 0.841 1.00 0.00 H new ATOM 0 HB3 GLU C 16 0.698 20.656 0.895 1.00 0.00 H new ATOM 0 HG2 GLU C 16 1.931 22.099 2.219 1.00 0.00 H new ATOM 0 HG3 GLU C 16 2.737 22.262 0.671 1.00 0.00 H new ATOM 1815 N ARG C 17 -0.591 22.811 -2.642 1.00 0.00 N ATOM 1816 CA ARG C 17 -1.727 23.591 -3.072 1.00 0.00 C ATOM 1817 C ARG C 17 -1.762 23.594 -4.596 1.00 0.00 C ATOM 1818 O ARG C 17 -2.800 23.812 -5.217 1.00 0.00 O ATOM 1819 CB ARG C 17 -1.607 25.016 -2.530 1.00 0.00 C ATOM 1820 CG ARG C 17 -0.334 25.729 -2.967 1.00 0.00 C ATOM 1821 CD ARG C 17 -0.078 26.976 -2.137 1.00 0.00 C ATOM 1822 NE ARG C 17 0.227 26.648 -0.744 1.00 0.00 N ATOM 1823 CZ ARG C 17 -0.115 27.406 0.295 1.00 0.00 C ATOM 1824 NH1 ARG C 17 -0.719 28.575 0.108 1.00 0.00 N ATOM 1825 NH2 ARG C 17 0.166 27.000 1.526 1.00 0.00 N ATOM 0 H ARG C 17 0.207 22.843 -3.276 1.00 0.00 H new ATOM 0 HA ARG C 17 -2.652 23.159 -2.690 1.00 0.00 H new ATOM 0 HB2 ARG C 17 -2.469 25.595 -2.860 1.00 0.00 H new ATOM 0 HB3 ARG C 17 -1.641 24.986 -1.441 1.00 0.00 H new ATOM 0 HG2 ARG C 17 0.514 25.050 -2.875 1.00 0.00 H new ATOM 0 HG3 ARG C 17 -0.412 26.001 -4.020 1.00 0.00 H new ATOM 0 HD2 ARG C 17 0.752 27.536 -2.569 1.00 0.00 H new ATOM 0 HD3 ARG C 17 -0.954 27.624 -2.175 1.00 0.00 H new ATOM 0 HE ARG C 17 0.734 25.783 -0.557 1.00 0.00 H new ATOM 0 HH11 ARG C 17 -0.924 28.898 -0.838 1.00 0.00 H new ATOM 0 HH12 ARG C 17 -0.978 29.150 0.910 1.00 0.00 H new ATOM 0 HH21 ARG C 17 0.642 26.110 1.673 1.00 0.00 H new ATOM 0 HH22 ARG C 17 -0.094 27.578 2.325 1.00 0.00 H new ATOM 1839 N ALA C 18 -0.588 23.349 -5.188 1.00 0.00 N ATOM 1840 CA ALA C 18 -0.423 23.523 -6.628 1.00 0.00 C ATOM 1841 C ALA C 18 0.136 22.289 -7.319 1.00 0.00 C ATOM 1842 O ALA C 18 -0.292 21.938 -8.416 1.00 0.00 O ATOM 1843 CB ALA C 18 0.457 24.731 -6.917 1.00 0.00 C ATOM 0 H ALA C 18 0.249 23.034 -4.697 1.00 0.00 H new ATOM 0 HA ALA C 18 -1.420 23.687 -7.038 1.00 0.00 H new ATOM 0 HB1 ALA C 18 0.571 24.848 -7.995 1.00 0.00 H new ATOM 0 HB2 ALA C 18 -0.006 25.626 -6.501 1.00 0.00 H new ATOM 0 HB3 ALA C 18 1.437 24.585 -6.462 1.00 0.00 H new ATOM 1849 N GLY C 19 1.090 21.631 -6.679 1.00 0.00 N ATOM 1850 CA GLY C 19 1.721 20.484 -7.296 1.00 0.00 C ATOM 1851 C GLY C 19 3.000 20.858 -8.020 1.00 0.00 C ATOM 1852 O GLY C 19 3.554 20.065 -8.775 1.00 0.00 O ATOM 0 H GLY C 19 1.437 21.868 -5.750 1.00 0.00 H new ATOM 0 HA2 GLY C 19 1.942 19.738 -6.533 1.00 0.00 H new ATOM 0 HA3 GLY C 19 1.027 20.024 -8.000 1.00 0.00 H new ATOM 1856 N GLU C 20 3.487 22.057 -7.738 1.00 0.00 N ATOM 1857 CA GLU C 20 4.686 22.592 -8.373 1.00 0.00 C ATOM 1858 C GLU C 20 5.323 23.617 -7.466 1.00 0.00 C ATOM 1859 O GLU C 20 4.691 24.119 -6.537 1.00 0.00 O ATOM 1860 CB GLU C 20 4.383 23.267 -9.717 1.00 0.00 C ATOM 1861 CG GLU C 20 3.051 24.000 -9.737 1.00 0.00 C ATOM 1862 CD GLU C 20 2.839 24.799 -11.004 1.00 0.00 C ATOM 1863 OE1 GLU C 20 3.291 25.959 -11.065 1.00 0.00 O ATOM 1864 OE2 GLU C 20 2.214 24.270 -11.943 1.00 0.00 O ATOM 0 H GLU C 20 3.062 22.690 -7.060 1.00 0.00 H new ATOM 0 HA GLU C 20 5.355 21.750 -8.552 1.00 0.00 H new ATOM 0 HB2 GLU C 20 5.181 23.972 -9.949 1.00 0.00 H new ATOM 0 HB3 GLU C 20 4.386 22.512 -10.503 1.00 0.00 H new ATOM 0 HG2 GLU C 20 2.242 23.277 -9.630 1.00 0.00 H new ATOM 0 HG3 GLU C 20 2.997 24.669 -8.878 1.00 0.00 H new ATOM 1871 N ILE C 21 6.560 23.937 -7.757 1.00 0.00 N ATOM 1872 CA ILE C 21 7.257 24.988 -7.058 1.00 0.00 C ATOM 1873 C ILE C 21 7.932 25.847 -8.082 1.00 0.00 C ATOM 1874 O ILE C 21 8.761 25.364 -8.852 1.00 0.00 O ATOM 1875 CB ILE C 21 8.291 24.472 -6.031 1.00 0.00 C ATOM 1876 CG1 ILE C 21 7.549 23.854 -4.839 1.00 0.00 C ATOM 1877 CG2 ILE C 21 9.214 25.595 -5.579 1.00 0.00 C ATOM 1878 CD1 ILE C 21 8.404 23.556 -3.625 1.00 0.00 C ATOM 0 H ILE C 21 7.110 23.478 -8.483 1.00 0.00 H new ATOM 0 HA ILE C 21 6.525 25.550 -6.478 1.00 0.00 H new ATOM 0 HB ILE C 21 8.914 23.709 -6.498 1.00 0.00 H new ATOM 0 HG12 ILE C 21 6.748 24.531 -4.541 1.00 0.00 H new ATOM 0 HG13 ILE C 21 7.078 22.927 -5.167 1.00 0.00 H new ATOM 0 HG21 ILE C 21 9.932 25.207 -4.857 1.00 0.00 H new ATOM 0 HG22 ILE C 21 9.747 25.997 -6.441 1.00 0.00 H new ATOM 0 HG23 ILE C 21 8.625 26.386 -5.115 1.00 0.00 H new ATOM 0 HD11 ILE C 21 7.784 23.122 -2.841 1.00 0.00 H new ATOM 0 HD12 ILE C 21 9.190 22.851 -3.897 1.00 0.00 H new ATOM 0 HD13 ILE C 21 8.855 24.480 -3.262 1.00 0.00 H new ATOM 1890 N GLU C 22 7.551 27.107 -8.103 1.00 0.00 N ATOM 1891 CA GLU C 22 8.086 28.035 -9.069 1.00 0.00 C ATOM 1892 C GLU C 22 7.831 27.527 -10.499 1.00 0.00 C ATOM 1893 O GLU C 22 8.713 27.577 -11.351 1.00 0.00 O ATOM 1894 CB GLU C 22 9.587 28.186 -8.796 1.00 0.00 C ATOM 1895 CG GLU C 22 10.115 29.594 -8.988 1.00 0.00 C ATOM 1896 CD GLU C 22 9.535 30.550 -7.966 1.00 0.00 C ATOM 1897 OE1 GLU C 22 10.105 30.660 -6.855 1.00 0.00 O ATOM 1898 OE2 GLU C 22 8.503 31.180 -8.261 1.00 0.00 O ATOM 0 H GLU C 22 6.871 27.510 -7.459 1.00 0.00 H new ATOM 0 HA GLU C 22 7.596 29.004 -8.979 1.00 0.00 H new ATOM 0 HB2 GLU C 22 9.793 27.869 -7.774 1.00 0.00 H new ATOM 0 HB3 GLU C 22 10.134 27.512 -9.455 1.00 0.00 H new ATOM 0 HG2 GLU C 22 11.202 29.590 -8.908 1.00 0.00 H new ATOM 0 HG3 GLU C 22 9.871 29.941 -9.992 1.00 0.00 H new ATOM 1905 N GLY C 23 6.628 26.999 -10.748 1.00 0.00 N ATOM 1906 CA GLY C 23 6.277 26.535 -12.087 1.00 0.00 C ATOM 1907 C GLY C 23 6.966 25.246 -12.500 1.00 0.00 C ATOM 1908 O GLY C 23 6.788 24.774 -13.622 1.00 0.00 O ATOM 0 H GLY C 23 5.894 26.885 -10.049 1.00 0.00 H new ATOM 0 HA2 GLY C 23 5.198 26.389 -12.138 1.00 0.00 H new ATOM 0 HA3 GLY C 23 6.527 27.314 -12.807 1.00 0.00 H new ATOM 1912 N THR C 24 7.759 24.685 -11.609 1.00 0.00 N ATOM 1913 CA THR C 24 8.555 23.513 -11.939 1.00 0.00 C ATOM 1914 C THR C 24 8.216 22.322 -11.028 1.00 0.00 C ATOM 1915 O THR C 24 7.621 22.502 -9.958 1.00 0.00 O ATOM 1916 CB THR C 24 10.055 23.884 -11.841 1.00 0.00 C ATOM 1917 OG1 THR C 24 10.795 23.249 -12.890 1.00 0.00 O ATOM 1918 CG2 THR C 24 10.660 23.493 -10.494 1.00 0.00 C ATOM 0 H THR C 24 7.871 25.019 -10.652 1.00 0.00 H new ATOM 0 HA THR C 24 8.323 23.201 -12.957 1.00 0.00 H new ATOM 0 HB THR C 24 10.120 24.968 -11.940 1.00 0.00 H new ATOM 0 HG1 THR C 24 10.352 23.413 -13.749 1.00 0.00 H new ATOM 0 HG21 THR C 24 11.713 23.773 -10.473 1.00 0.00 H new ATOM 0 HG22 THR C 24 10.131 24.010 -9.694 1.00 0.00 H new ATOM 0 HG23 THR C 24 10.568 22.416 -10.353 1.00 0.00 H new ATOM 1926 N PRO C 25 8.565 21.083 -11.457 1.00 0.00 N ATOM 1927 CA PRO C 25 8.388 19.878 -10.640 1.00 0.00 C ATOM 1928 C PRO C 25 9.113 19.998 -9.305 1.00 0.00 C ATOM 1929 O PRO C 25 10.244 20.475 -9.231 1.00 0.00 O ATOM 1930 CB PRO C 25 8.992 18.755 -11.494 1.00 0.00 C ATOM 1931 CG PRO C 25 9.855 19.455 -12.484 1.00 0.00 C ATOM 1932 CD PRO C 25 9.159 20.757 -12.765 1.00 0.00 C ATOM 0 HA PRO C 25 7.342 19.700 -10.389 1.00 0.00 H new ATOM 0 HB2 PRO C 25 9.571 18.062 -10.884 1.00 0.00 H new ATOM 0 HB3 PRO C 25 8.215 18.172 -11.988 1.00 0.00 H new ATOM 0 HG2 PRO C 25 10.856 19.622 -12.085 1.00 0.00 H new ATOM 0 HG3 PRO C 25 9.969 18.865 -13.394 1.00 0.00 H new ATOM 0 HD2 PRO C 25 9.855 21.527 -13.099 1.00 0.00 H new ATOM 0 HD3 PRO C 25 8.401 20.654 -13.542 1.00 0.00 H new ATOM 1940 N CYS C 26 8.449 19.561 -8.256 1.00 0.00 N ATOM 1941 CA CYS C 26 8.915 19.797 -6.907 1.00 0.00 C ATOM 1942 C CYS C 26 9.770 18.641 -6.365 1.00 0.00 C ATOM 1943 O CYS C 26 9.441 17.475 -6.572 1.00 0.00 O ATOM 1944 CB CYS C 26 7.712 20.030 -6.011 1.00 0.00 C ATOM 1945 SG CYS C 26 8.145 20.457 -4.303 1.00 0.00 S ATOM 0 H CYS C 26 7.577 19.036 -8.314 1.00 0.00 H new ATOM 0 HA CYS C 26 9.559 20.676 -6.919 1.00 0.00 H new ATOM 0 HB2 CYS C 26 7.105 20.831 -6.434 1.00 0.00 H new ATOM 0 HB3 CYS C 26 7.095 19.132 -6.006 1.00 0.00 H new ATOM 0 HG CYS C 26 7.113 20.983 -3.712 1.00 0.00 H new ATOM 1950 N PRO C 27 10.851 18.993 -5.624 1.00 0.00 N ATOM 1951 CA PRO C 27 11.848 18.076 -5.040 1.00 0.00 C ATOM 1952 C PRO C 27 11.367 16.658 -4.702 1.00 0.00 C ATOM 1953 O PRO C 27 11.983 15.675 -5.108 1.00 0.00 O ATOM 1954 CB PRO C 27 12.200 18.804 -3.747 1.00 0.00 C ATOM 1955 CG PRO C 27 12.084 20.263 -4.056 1.00 0.00 C ATOM 1956 CD PRO C 27 11.224 20.386 -5.305 1.00 0.00 C ATOM 0 HA PRO C 27 12.652 17.890 -5.752 1.00 0.00 H new ATOM 0 HB2 PRO C 27 11.523 18.520 -2.942 1.00 0.00 H new ATOM 0 HB3 PRO C 27 13.209 18.553 -3.419 1.00 0.00 H new ATOM 0 HG2 PRO C 27 11.631 20.799 -3.222 1.00 0.00 H new ATOM 0 HG3 PRO C 27 13.068 20.702 -4.221 1.00 0.00 H new ATOM 0 HD2 PRO C 27 10.344 21.003 -5.124 1.00 0.00 H new ATOM 0 HD3 PRO C 27 11.774 20.849 -6.124 1.00 0.00 H new ATOM 1964 N ALA C 28 10.273 16.554 -3.956 1.00 0.00 N ATOM 1965 CA ALA C 28 9.877 15.268 -3.382 1.00 0.00 C ATOM 1966 C ALA C 28 8.395 14.958 -3.594 1.00 0.00 C ATOM 1967 O ALA C 28 7.927 13.874 -3.263 1.00 0.00 O ATOM 1968 CB ALA C 28 10.217 15.237 -1.897 1.00 0.00 C ATOM 0 H ALA C 28 9.650 17.331 -3.735 1.00 0.00 H new ATOM 0 HA ALA C 28 10.438 14.494 -3.905 1.00 0.00 H new ATOM 0 HB1 ALA C 28 9.920 14.277 -1.476 1.00 0.00 H new ATOM 0 HB2 ALA C 28 11.291 15.374 -1.767 1.00 0.00 H new ATOM 0 HB3 ALA C 28 9.684 16.038 -1.385 1.00 0.00 H new ATOM 1974 N CYS C 29 7.651 15.908 -4.134 1.00 0.00 N ATOM 1975 CA CYS C 29 6.233 15.692 -4.386 1.00 0.00 C ATOM 1976 C CYS C 29 5.910 16.111 -5.816 1.00 0.00 C ATOM 1977 O CYS C 29 5.782 17.299 -6.115 1.00 0.00 O ATOM 1978 CB CYS C 29 5.381 16.464 -3.352 1.00 0.00 C ATOM 1979 SG CYS C 29 5.321 18.265 -3.597 1.00 0.00 S ATOM 0 H CYS C 29 7.999 16.828 -4.405 1.00 0.00 H new ATOM 0 HA CYS C 29 5.991 14.635 -4.276 1.00 0.00 H new ATOM 0 HB2 CYS C 29 4.363 16.075 -3.379 1.00 0.00 H new ATOM 0 HB3 CYS C 29 5.774 16.261 -2.356 1.00 0.00 H new ATOM 0 HG CYS C 29 5.468 18.536 -4.860 1.00 0.00 H new ATOM 1984 N SER C 30 5.829 15.137 -6.709 1.00 0.00 N ATOM 1985 CA SER C 30 5.605 15.411 -8.119 1.00 0.00 C ATOM 1986 C SER C 30 4.139 15.732 -8.417 1.00 0.00 C ATOM 1987 O SER C 30 3.504 15.077 -9.239 1.00 0.00 O ATOM 1988 CB SER C 30 6.072 14.209 -8.940 1.00 0.00 C ATOM 1989 OG SER C 30 7.396 13.849 -8.579 1.00 0.00 O ATOM 0 H SER C 30 5.915 14.147 -6.481 1.00 0.00 H new ATOM 0 HA SER C 30 6.181 16.295 -8.394 1.00 0.00 H new ATOM 0 HB2 SER C 30 5.401 13.366 -8.776 1.00 0.00 H new ATOM 0 HB3 SER C 30 6.030 14.448 -10.003 1.00 0.00 H new ATOM 0 HG SER C 30 7.682 13.077 -9.111 1.00 0.00 H new ATOM 1995 N GLY C 31 3.603 16.730 -7.724 1.00 0.00 N ATOM 1996 CA GLY C 31 2.257 17.181 -8.007 1.00 0.00 C ATOM 1997 C GLY C 31 1.245 16.406 -7.209 1.00 0.00 C ATOM 1998 O GLY C 31 0.247 15.926 -7.742 1.00 0.00 O ATOM 0 H GLY C 31 4.077 17.233 -6.973 1.00 0.00 H new ATOM 0 HA2 GLY C 31 2.170 18.243 -7.776 1.00 0.00 H new ATOM 0 HA3 GLY C 31 2.049 17.068 -9.071 1.00 0.00 H new ATOM 2002 N LYS C 32 1.506 16.289 -5.918 1.00 0.00 N ATOM 2003 CA LYS C 32 0.707 15.454 -5.044 1.00 0.00 C ATOM 2004 C LYS C 32 0.093 16.314 -3.947 1.00 0.00 C ATOM 2005 O LYS C 32 -1.042 16.096 -3.531 1.00 0.00 O ATOM 2006 CB LYS C 32 1.614 14.387 -4.433 1.00 0.00 C ATOM 2007 CG LYS C 32 2.569 13.786 -5.454 1.00 0.00 C ATOM 2008 CD LYS C 32 3.763 13.113 -4.800 1.00 0.00 C ATOM 2009 CE LYS C 32 3.368 11.833 -4.103 1.00 0.00 C ATOM 2010 NZ LYS C 32 2.750 10.867 -5.056 1.00 0.00 N ATOM 0 H LYS C 32 2.275 16.769 -5.450 1.00 0.00 H new ATOM 0 HA LYS C 32 -0.096 14.975 -5.604 1.00 0.00 H new ATOM 0 HB2 LYS C 32 2.188 14.825 -3.616 1.00 0.00 H new ATOM 0 HB3 LYS C 32 1.001 13.595 -4.003 1.00 0.00 H new ATOM 0 HG2 LYS C 32 2.034 13.058 -6.064 1.00 0.00 H new ATOM 0 HG3 LYS C 32 2.919 14.570 -6.126 1.00 0.00 H new ATOM 0 HD2 LYS C 32 4.519 12.898 -5.555 1.00 0.00 H new ATOM 0 HD3 LYS C 32 4.216 13.795 -4.080 1.00 0.00 H new ATOM 0 HE2 LYS C 32 4.246 11.381 -3.642 1.00 0.00 H new ATOM 0 HE3 LYS C 32 2.665 12.055 -3.300 1.00 0.00 H new ATOM 0 HZ1 LYS C 32 2.675 9.933 -4.604 1.00 0.00 H new ATOM 0 HZ2 LYS C 32 1.801 11.200 -5.321 1.00 0.00 H new ATOM 0 HZ3 LYS C 32 3.342 10.793 -5.908 1.00 0.00 H new ATOM 2024 N GLY C 33 0.872 17.289 -3.472 1.00 0.00 N ATOM 2025 CA GLY C 33 0.416 18.180 -2.445 1.00 0.00 C ATOM 2026 C GLY C 33 1.191 17.959 -1.170 1.00 0.00 C ATOM 2027 O GLY C 33 1.590 18.906 -0.498 1.00 0.00 O ATOM 0 H GLY C 33 1.823 17.468 -3.795 1.00 0.00 H new ATOM 0 HA2 GLY C 33 0.532 19.213 -2.774 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -0.647 18.021 -2.263 1.00 0.00 H new ATOM 2031 N VAL C 34 1.476 16.702 -0.866 1.00 0.00 N ATOM 2032 CA VAL C 34 2.150 16.364 0.379 1.00 0.00 C ATOM 2033 C VAL C 34 3.395 15.513 0.139 1.00 0.00 C ATOM 2034 O VAL C 34 3.647 15.054 -0.981 1.00 0.00 O ATOM 2035 CB VAL C 34 1.196 15.593 1.320 1.00 0.00 C ATOM 2036 CG1 VAL C 34 0.024 16.465 1.747 1.00 0.00 C ATOM 2037 CG2 VAL C 34 0.693 14.327 0.643 1.00 0.00 C ATOM 0 H VAL C 34 1.253 15.903 -1.460 1.00 0.00 H new ATOM 0 HA VAL C 34 2.452 17.304 0.840 1.00 0.00 H new ATOM 0 HB VAL C 34 1.755 15.316 2.214 1.00 0.00 H new ATOM 0 HG11 VAL C 34 -0.630 15.897 2.408 1.00 0.00 H new ATOM 0 HG12 VAL C 34 0.397 17.344 2.273 1.00 0.00 H new ATOM 0 HG13 VAL C 34 -0.535 16.780 0.866 1.00 0.00 H new ATOM 0 HG21 VAL C 34 0.023 13.795 1.318 1.00 0.00 H new ATOM 0 HG22 VAL C 34 0.156 14.590 -0.268 1.00 0.00 H new ATOM 0 HG23 VAL C 34 1.539 13.687 0.394 1.00 0.00 H new ATOM 2047 N ILE C 35 4.181 15.353 1.194 1.00 0.00 N ATOM 2048 CA ILE C 35 5.332 14.459 1.199 1.00 0.00 C ATOM 2049 C ILE C 35 5.261 13.529 2.410 1.00 0.00 C ATOM 2050 O ILE C 35 4.559 13.817 3.372 1.00 0.00 O ATOM 2051 CB ILE C 35 6.664 15.240 1.231 1.00 0.00 C ATOM 2052 CG1 ILE C 35 6.616 16.332 2.304 1.00 0.00 C ATOM 2053 CG2 ILE C 35 6.963 15.840 -0.134 1.00 0.00 C ATOM 2054 CD1 ILE C 35 7.925 17.071 2.490 1.00 0.00 C ATOM 0 H ILE C 35 4.038 15.843 2.077 1.00 0.00 H new ATOM 0 HA ILE C 35 5.302 13.878 0.277 1.00 0.00 H new ATOM 0 HB ILE C 35 7.467 14.547 1.482 1.00 0.00 H new ATOM 0 HG12 ILE C 35 5.839 17.050 2.042 1.00 0.00 H new ATOM 0 HG13 ILE C 35 6.327 15.882 3.254 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.905 16.387 -0.093 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.038 15.043 -0.873 1.00 0.00 H new ATOM 0 HG23 ILE C 35 6.160 16.521 -0.416 1.00 0.00 H new ATOM 0 HD11 ILE C 35 7.809 17.827 3.266 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.702 16.366 2.784 1.00 0.00 H new ATOM 0 HD13 ILE C 35 8.207 17.553 1.554 1.00 0.00 H new ATOM 2066 N LEU C 36 6.000 12.431 2.364 1.00 0.00 N ATOM 2067 CA LEU C 36 5.869 11.375 3.369 1.00 0.00 C ATOM 2068 C LEU C 36 6.755 11.601 4.590 1.00 0.00 C ATOM 2069 O LEU C 36 7.684 12.407 4.572 1.00 0.00 O ATOM 2070 CB LEU C 36 6.214 10.011 2.761 1.00 0.00 C ATOM 2071 CG LEU C 36 5.396 9.612 1.532 1.00 0.00 C ATOM 2072 CD1 LEU C 36 6.062 10.094 0.250 1.00 0.00 C ATOM 2073 CD2 LEU C 36 5.196 8.111 1.503 1.00 0.00 C ATOM 0 H LEU C 36 6.698 12.244 1.644 1.00 0.00 H new ATOM 0 HA LEU C 36 4.830 11.399 3.697 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.270 10.010 2.489 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.082 9.247 3.527 1.00 0.00 H new ATOM 0 HG LEU C 36 4.420 10.093 1.599 1.00 0.00 H new ATOM 0 HD11 LEU C 36 5.459 9.796 -0.608 1.00 0.00 H new ATOM 0 HD12 LEU C 36 6.150 11.180 0.272 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.054 9.651 0.167 1.00 0.00 H new ATOM 0 HD21 LEU C 36 4.612 7.839 0.624 1.00 0.00 H new ATOM 0 HD22 LEU C 36 6.166 7.615 1.462 1.00 0.00 H new ATOM 0 HD23 LEU C 36 4.666 7.797 2.402 1.00 0.00 H new ATOM 2085 N THR C 37 6.445 10.857 5.648 1.00 0.00 N ATOM 2086 CA THR C 37 7.256 10.822 6.854 1.00 0.00 C ATOM 2087 C THR C 37 8.008 9.498 6.888 1.00 0.00 C ATOM 2088 O THR C 37 7.813 8.677 6.001 1.00 0.00 O ATOM 2089 CB THR C 37 6.386 10.937 8.125 1.00 0.00 C ATOM 2090 OG1 THR C 37 5.555 9.773 8.266 1.00 0.00 O ATOM 2091 CG2 THR C 37 5.501 12.169 8.070 1.00 0.00 C ATOM 0 H THR C 37 5.619 10.260 5.690 1.00 0.00 H new ATOM 0 HA THR C 37 7.944 11.667 6.837 1.00 0.00 H new ATOM 0 HB THR C 37 7.058 11.019 8.980 1.00 0.00 H new ATOM 0 HG1 THR C 37 5.130 9.780 9.149 1.00 0.00 H new ATOM 0 HG21 THR C 37 4.899 12.225 8.977 1.00 0.00 H new ATOM 0 HG22 THR C 37 6.123 13.061 7.991 1.00 0.00 H new ATOM 0 HG23 THR C 37 4.844 12.107 7.202 1.00 0.00 H new ATOM 2099 N ALA C 38 8.846 9.273 7.891 1.00 0.00 N ATOM 2100 CA ALA C 38 9.616 8.030 7.969 1.00 0.00 C ATOM 2101 C ALA C 38 8.712 6.799 7.943 1.00 0.00 C ATOM 2102 O ALA C 38 8.979 5.849 7.205 1.00 0.00 O ATOM 2103 CB ALA C 38 10.493 8.022 9.205 1.00 0.00 C ATOM 0 H ALA C 38 9.012 9.925 8.657 1.00 0.00 H new ATOM 0 HA ALA C 38 10.254 7.985 7.087 1.00 0.00 H new ATOM 0 HB1 ALA C 38 11.057 7.090 9.245 1.00 0.00 H new ATOM 0 HB2 ALA C 38 11.185 8.864 9.166 1.00 0.00 H new ATOM 0 HB3 ALA C 38 9.869 8.107 10.095 1.00 0.00 H new ATOM 2109 N GLN C 39 7.644 6.815 8.735 1.00 0.00 N ATOM 2110 CA GLN C 39 6.677 5.723 8.712 1.00 0.00 C ATOM 2111 C GLN C 39 6.037 5.606 7.333 1.00 0.00 C ATOM 2112 O GLN C 39 5.839 4.503 6.822 1.00 0.00 O ATOM 2113 CB GLN C 39 5.600 5.915 9.781 1.00 0.00 C ATOM 2114 CG GLN C 39 4.466 4.906 9.673 1.00 0.00 C ATOM 2115 CD GLN C 39 3.482 4.986 10.820 1.00 0.00 C ATOM 2116 OE1 GLN C 39 3.296 6.038 11.427 1.00 0.00 O ATOM 2117 NE2 GLN C 39 2.834 3.870 11.112 1.00 0.00 N ATOM 0 H GLN C 39 7.428 7.563 9.394 1.00 0.00 H new ATOM 0 HA GLN C 39 7.211 4.799 8.932 1.00 0.00 H new ATOM 0 HB2 GLN C 39 6.057 5.835 10.767 1.00 0.00 H new ATOM 0 HB3 GLN C 39 5.191 6.922 9.700 1.00 0.00 H new ATOM 0 HG2 GLN C 39 3.934 5.067 8.735 1.00 0.00 H new ATOM 0 HG3 GLN C 39 4.886 3.901 9.633 1.00 0.00 H new ATOM 0 HE21 GLN C 39 3.020 3.019 10.582 1.00 0.00 H new ATOM 0 HE22 GLN C 39 2.149 3.861 11.867 1.00 0.00 H new ATOM 2126 N GLY C 40 5.744 6.748 6.722 1.00 0.00 N ATOM 2127 CA GLY C 40 5.169 6.746 5.394 1.00 0.00 C ATOM 2128 C GLY C 40 6.156 6.250 4.359 1.00 0.00 C ATOM 2129 O GLY C 40 5.778 5.610 3.381 1.00 0.00 O ATOM 0 H GLY C 40 5.895 7.673 7.124 1.00 0.00 H new ATOM 0 HA2 GLY C 40 4.281 6.114 5.383 1.00 0.00 H new ATOM 0 HA3 GLY C 40 4.846 7.754 5.135 1.00 0.00 H new ATOM 2133 N TYR C 41 7.429 6.531 4.596 1.00 0.00 N ATOM 2134 CA TYR C 41 8.500 6.088 3.721 1.00 0.00 C ATOM 2135 C TYR C 41 8.695 4.584 3.814 1.00 0.00 C ATOM 2136 O TYR C 41 9.068 3.937 2.833 1.00 0.00 O ATOM 2137 CB TYR C 41 9.801 6.806 4.102 1.00 0.00 C ATOM 2138 CG TYR C 41 10.086 8.064 3.307 1.00 0.00 C ATOM 2139 CD1 TYR C 41 10.760 8.002 2.095 1.00 0.00 C ATOM 2140 CD2 TYR C 41 9.694 9.313 3.770 1.00 0.00 C ATOM 2141 CE1 TYR C 41 11.030 9.144 1.366 1.00 0.00 C ATOM 2142 CE2 TYR C 41 9.961 10.461 3.048 1.00 0.00 C ATOM 2143 CZ TYR C 41 10.629 10.370 1.847 1.00 0.00 C ATOM 2144 OH TYR C 41 10.898 11.512 1.122 1.00 0.00 O ATOM 0 H TYR C 41 7.746 7.072 5.400 1.00 0.00 H new ATOM 0 HA TYR C 41 8.231 6.332 2.693 1.00 0.00 H new ATOM 0 HB2 TYR C 41 9.762 7.063 5.161 1.00 0.00 H new ATOM 0 HB3 TYR C 41 10.633 6.114 3.972 1.00 0.00 H new ATOM 0 HD1 TYR C 41 11.079 7.043 1.715 1.00 0.00 H new ATOM 0 HD2 TYR C 41 9.171 9.389 4.712 1.00 0.00 H new ATOM 0 HE1 TYR C 41 11.553 9.075 0.424 1.00 0.00 H new ATOM 0 HE2 TYR C 41 9.648 11.424 3.423 1.00 0.00 H new ATOM 0 HH TYR C 41 10.548 12.293 1.600 1.00 0.00 H new ATOM 2154 N THR C 42 8.426 4.020 4.977 1.00 0.00 N ATOM 2155 CA THR C 42 8.476 2.577 5.146 1.00 0.00 C ATOM 2156 C THR C 42 7.300 1.914 4.435 1.00 0.00 C ATOM 2157 O THR C 42 7.422 0.816 3.883 1.00 0.00 O ATOM 2158 CB THR C 42 8.442 2.202 6.635 1.00 0.00 C ATOM 2159 OG1 THR C 42 9.393 2.993 7.351 1.00 0.00 O ATOM 2160 CG2 THR C 42 8.756 0.729 6.830 1.00 0.00 C ATOM 0 H THR C 42 8.171 4.537 5.818 1.00 0.00 H new ATOM 0 HA THR C 42 9.410 2.223 4.709 1.00 0.00 H new ATOM 0 HB THR C 42 7.439 2.395 7.016 1.00 0.00 H new ATOM 0 HG1 THR C 42 9.089 3.924 7.379 1.00 0.00 H new ATOM 0 HG21 THR C 42 8.726 0.488 7.893 1.00 0.00 H new ATOM 0 HG22 THR C 42 8.018 0.126 6.300 1.00 0.00 H new ATOM 0 HG23 THR C 42 9.750 0.514 6.437 1.00 0.00 H new ATOM 2168 N LEU C 43 6.175 2.615 4.398 1.00 0.00 N ATOM 2169 CA LEU C 43 4.972 2.074 3.791 1.00 0.00 C ATOM 2170 C LEU C 43 4.974 2.346 2.297 1.00 0.00 C ATOM 2171 O LEU C 43 4.218 1.725 1.561 1.00 0.00 O ATOM 2172 CB LEU C 43 3.701 2.673 4.423 1.00 0.00 C ATOM 2173 CG LEU C 43 2.991 1.816 5.493 1.00 0.00 C ATOM 2174 CD1 LEU C 43 3.964 1.388 6.579 1.00 0.00 C ATOM 2175 CD2 LEU C 43 1.839 2.596 6.103 1.00 0.00 C ATOM 0 H LEU C 43 6.073 3.555 4.780 1.00 0.00 H new ATOM 0 HA LEU C 43 4.966 0.999 3.969 1.00 0.00 H new ATOM 0 HB2 LEU C 43 3.963 3.631 4.873 1.00 0.00 H new ATOM 0 HB3 LEU C 43 2.989 2.880 3.624 1.00 0.00 H new ATOM 0 HG LEU C 43 2.602 0.919 5.011 1.00 0.00 H new ATOM 0 HD11 LEU C 43 3.439 0.786 7.321 1.00 0.00 H new ATOM 0 HD12 LEU C 43 4.768 0.800 6.136 1.00 0.00 H new ATOM 0 HD13 LEU C 43 4.384 2.271 7.060 1.00 0.00 H new ATOM 0 HD21 LEU C 43 1.344 1.984 6.857 1.00 0.00 H new ATOM 0 HD22 LEU C 43 2.221 3.505 6.567 1.00 0.00 H new ATOM 0 HD23 LEU C 43 1.125 2.859 5.323 1.00 0.00 H new ATOM 2187 N LEU C 44 5.838 3.247 1.825 1.00 0.00 N ATOM 2188 CA LEU C 44 5.881 3.546 0.405 1.00 0.00 C ATOM 2189 C LEU C 44 6.711 2.494 -0.321 1.00 0.00 C ATOM 2190 O LEU C 44 6.325 2.025 -1.382 1.00 0.00 O ATOM 2191 CB LEU C 44 6.393 4.986 0.142 1.00 0.00 C ATOM 2192 CG LEU C 44 7.911 5.204 -0.033 1.00 0.00 C ATOM 2193 CD1 LEU C 44 8.391 4.755 -1.409 1.00 0.00 C ATOM 2194 CD2 LEU C 44 8.257 6.673 0.149 1.00 0.00 C ATOM 0 H LEU C 44 6.502 3.769 2.397 1.00 0.00 H new ATOM 0 HA LEU C 44 4.867 3.507 0.007 1.00 0.00 H new ATOM 0 HB2 LEU C 44 5.899 5.355 -0.757 1.00 0.00 H new ATOM 0 HB3 LEU C 44 6.061 5.613 0.969 1.00 0.00 H new ATOM 0 HG LEU C 44 8.411 4.602 0.726 1.00 0.00 H new ATOM 0 HD11 LEU C 44 9.464 4.925 -1.493 1.00 0.00 H new ATOM 0 HD12 LEU C 44 8.180 3.694 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU C 44 7.872 5.325 -2.179 1.00 0.00 H new ATOM 0 HD21 LEU C 44 9.331 6.812 0.023 1.00 0.00 H new ATOM 0 HD22 LEU C 44 7.724 7.267 -0.594 1.00 0.00 H new ATOM 0 HD23 LEU C 44 7.964 6.995 1.149 1.00 0.00 H new ATOM 2206 N ASP C 45 7.827 2.086 0.280 1.00 0.00 N ATOM 2207 CA ASP C 45 8.708 1.095 -0.337 1.00 0.00 C ATOM 2208 C ASP C 45 8.046 -0.269 -0.342 1.00 0.00 C ATOM 2209 O ASP C 45 8.327 -1.109 -1.194 1.00 0.00 O ATOM 2210 CB ASP C 45 10.043 1.026 0.410 1.00 0.00 C ATOM 2211 CG ASP C 45 10.919 -0.128 -0.053 1.00 0.00 C ATOM 2212 OD1 ASP C 45 11.419 -0.076 -1.192 1.00 0.00 O ATOM 2213 OD2 ASP C 45 11.118 -1.086 0.730 1.00 0.00 O ATOM 0 H ASP C 45 8.142 2.424 1.189 1.00 0.00 H new ATOM 0 HA ASP C 45 8.898 1.398 -1.367 1.00 0.00 H new ATOM 0 HB2 ASP C 45 10.581 1.963 0.270 1.00 0.00 H new ATOM 0 HB3 ASP C 45 9.851 0.925 1.478 1.00 0.00 H new ATOM 2218 N PHE C 46 7.111 -0.460 0.569 1.00 0.00 N ATOM 2219 CA PHE C 46 6.342 -1.688 0.610 1.00 0.00 C ATOM 2220 C PHE C 46 5.353 -1.710 -0.517 1.00 0.00 C ATOM 2221 O PHE C 46 5.200 -2.710 -1.217 1.00 0.00 O ATOM 2222 CB PHE C 46 5.538 -1.736 1.899 1.00 0.00 C ATOM 2223 CG PHE C 46 5.437 -3.096 2.506 1.00 0.00 C ATOM 2224 CD1 PHE C 46 6.511 -3.639 3.182 1.00 0.00 C ATOM 2225 CD2 PHE C 46 4.268 -3.829 2.399 1.00 0.00 C ATOM 2226 CE1 PHE C 46 6.424 -4.892 3.743 1.00 0.00 C ATOM 2227 CE2 PHE C 46 4.175 -5.086 2.958 1.00 0.00 C ATOM 2228 CZ PHE C 46 5.255 -5.618 3.632 1.00 0.00 C ATOM 0 H PHE C 46 6.866 0.219 1.290 1.00 0.00 H new ATOM 0 HA PHE C 46 7.032 -2.528 0.538 1.00 0.00 H new ATOM 0 HB2 PHE C 46 5.993 -1.060 2.623 1.00 0.00 H new ATOM 0 HB3 PHE C 46 4.533 -1.363 1.702 1.00 0.00 H new ATOM 0 HD1 PHE C 46 7.428 -3.075 3.271 1.00 0.00 H new ATOM 0 HD2 PHE C 46 3.421 -3.413 1.873 1.00 0.00 H new ATOM 0 HE1 PHE C 46 7.270 -5.308 4.270 1.00 0.00 H new ATOM 0 HE2 PHE C 46 3.260 -5.652 2.869 1.00 0.00 H new ATOM 0 HZ PHE C 46 5.186 -6.602 4.072 1.00 0.00 H new ATOM 2238 N ILE C 47 4.693 -0.596 -0.711 1.00 0.00 N ATOM 2239 CA ILE C 47 3.633 -0.556 -1.669 1.00 0.00 C ATOM 2240 C ILE C 47 4.195 -0.420 -3.082 1.00 0.00 C ATOM 2241 O ILE C 47 3.603 -0.900 -4.047 1.00 0.00 O ATOM 2242 CB ILE C 47 2.621 0.553 -1.340 1.00 0.00 C ATOM 2243 CG1 ILE C 47 3.294 1.926 -1.362 1.00 0.00 C ATOM 2244 CG2 ILE C 47 2.021 0.278 0.029 1.00 0.00 C ATOM 2245 CD1 ILE C 47 2.387 3.065 -0.944 1.00 0.00 C ATOM 0 H ILE C 47 4.872 0.281 -0.222 1.00 0.00 H new ATOM 0 HA ILE C 47 3.089 -1.499 -1.619 1.00 0.00 H new ATOM 0 HB ILE C 47 1.833 0.558 -2.093 1.00 0.00 H new ATOM 0 HG12 ILE C 47 4.161 1.905 -0.702 1.00 0.00 H new ATOM 0 HG13 ILE C 47 3.665 2.121 -2.368 1.00 0.00 H new ATOM 0 HG21 ILE C 47 1.301 1.059 0.274 1.00 0.00 H new ATOM 0 HG22 ILE C 47 1.518 -0.689 0.018 1.00 0.00 H new ATOM 0 HG23 ILE C 47 2.813 0.267 0.778 1.00 0.00 H new ATOM 0 HD11 ILE C 47 2.939 4.004 -0.986 1.00 0.00 H new ATOM 0 HD12 ILE C 47 1.532 3.116 -1.618 1.00 0.00 H new ATOM 0 HD13 ILE C 47 2.036 2.896 0.074 1.00 0.00 H new ATOM 2257 N GLN C 48 5.368 0.200 -3.184 1.00 0.00 N ATOM 2258 CA GLN C 48 6.163 0.154 -4.396 1.00 0.00 C ATOM 2259 C GLN C 48 6.409 -1.290 -4.786 1.00 0.00 C ATOM 2260 O GLN C 48 5.958 -1.756 -5.814 1.00 0.00 O ATOM 2261 CB GLN C 48 7.519 0.835 -4.175 1.00 0.00 C ATOM 2262 CG GLN C 48 7.443 2.345 -4.028 1.00 0.00 C ATOM 2263 CD GLN C 48 6.961 3.026 -5.292 1.00 0.00 C ATOM 2264 OE1 GLN C 48 7.201 2.545 -6.399 1.00 0.00 O ATOM 2265 NE2 GLN C 48 6.281 4.146 -5.133 1.00 0.00 N ATOM 0 H GLN C 48 5.787 0.744 -2.430 1.00 0.00 H new ATOM 0 HA GLN C 48 5.619 0.674 -5.184 1.00 0.00 H new ATOM 0 HB2 GLN C 48 7.981 0.417 -3.280 1.00 0.00 H new ATOM 0 HB3 GLN C 48 8.174 0.596 -5.013 1.00 0.00 H new ATOM 0 HG2 GLN C 48 6.772 2.594 -3.206 1.00 0.00 H new ATOM 0 HG3 GLN C 48 8.427 2.731 -3.763 1.00 0.00 H new ATOM 0 HE21 GLN C 48 6.106 4.508 -4.195 1.00 0.00 H new ATOM 0 HE22 GLN C 48 5.931 4.650 -5.948 1.00 0.00 H new ATOM 2274 N LYS C 49 7.026 -2.006 -3.875 1.00 0.00 N ATOM 2275 CA LYS C 49 7.636 -3.295 -4.156 1.00 0.00 C ATOM 2276 C LYS C 49 6.627 -4.445 -4.218 1.00 0.00 C ATOM 2277 O LYS C 49 6.990 -5.579 -4.502 1.00 0.00 O ATOM 2278 CB LYS C 49 8.712 -3.505 -3.086 1.00 0.00 C ATOM 2279 CG LYS C 49 9.265 -4.912 -2.919 1.00 0.00 C ATOM 2280 CD LYS C 49 10.411 -4.925 -1.909 1.00 0.00 C ATOM 2281 CE LYS C 49 10.296 -3.763 -0.926 1.00 0.00 C ATOM 2282 NZ LYS C 49 11.276 -3.846 0.185 1.00 0.00 N ATOM 0 H LYS C 49 7.122 -1.710 -2.904 1.00 0.00 H new ATOM 0 HA LYS C 49 8.077 -3.293 -5.153 1.00 0.00 H new ATOM 0 HB2 LYS C 49 9.546 -2.840 -3.311 1.00 0.00 H new ATOM 0 HB3 LYS C 49 8.301 -3.188 -2.128 1.00 0.00 H new ATOM 0 HG2 LYS C 49 8.473 -5.582 -2.586 1.00 0.00 H new ATOM 0 HG3 LYS C 49 9.617 -5.286 -3.880 1.00 0.00 H new ATOM 0 HD2 LYS C 49 10.407 -5.868 -1.363 1.00 0.00 H new ATOM 0 HD3 LYS C 49 11.364 -4.866 -2.436 1.00 0.00 H new ATOM 0 HE2 LYS C 49 10.441 -2.825 -1.462 1.00 0.00 H new ATOM 0 HE3 LYS C 49 9.287 -3.742 -0.513 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 11.444 -2.895 0.571 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 10.901 -4.463 0.934 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 12.171 -4.238 -0.170 1.00 0.00 H new ATOM 2296 N HIS C 50 5.355 -4.193 -3.954 1.00 0.00 N ATOM 2297 CA HIS C 50 4.393 -5.253 -4.259 1.00 0.00 C ATOM 2298 C HIS C 50 3.355 -4.862 -5.319 1.00 0.00 C ATOM 2299 O HIS C 50 2.509 -5.680 -5.671 1.00 0.00 O ATOM 2300 CB HIS C 50 3.719 -5.735 -2.970 1.00 0.00 C ATOM 2301 CG HIS C 50 4.711 -6.055 -1.889 1.00 0.00 C ATOM 2302 ND1 HIS C 50 4.827 -5.308 -0.741 1.00 0.00 N ATOM 2303 CD2 HIS C 50 5.678 -7.004 -1.813 1.00 0.00 C ATOM 2304 CE1 HIS C 50 5.820 -5.775 -0.011 1.00 0.00 C ATOM 2305 NE2 HIS C 50 6.354 -6.802 -0.635 1.00 0.00 N ATOM 0 H HIS C 50 4.978 -3.332 -3.558 1.00 0.00 H new ATOM 0 HA HIS C 50 4.959 -6.073 -4.701 1.00 0.00 H new ATOM 0 HB2 HIS C 50 3.033 -4.967 -2.613 1.00 0.00 H new ATOM 0 HB3 HIS C 50 3.122 -6.621 -3.185 1.00 0.00 H new ATOM 0 HD2 HIS C 50 5.878 -7.774 -2.543 1.00 0.00 H new ATOM 0 HE1 HIS C 50 6.142 -5.380 0.941 1.00 0.00 H new ATOM 0 HE2 HIS C 50 7.141 -7.357 -0.299 1.00 0.00 H new ATOM 2314 N LEU C 51 3.407 -3.639 -5.840 1.00 0.00 N ATOM 2315 CA LEU C 51 2.545 -3.273 -6.976 1.00 0.00 C ATOM 2316 C LEU C 51 3.368 -2.881 -8.194 1.00 0.00 C ATOM 2317 O LEU C 51 2.968 -3.105 -9.335 1.00 0.00 O ATOM 2318 CB LEU C 51 1.620 -2.093 -6.652 1.00 0.00 C ATOM 2319 CG LEU C 51 0.452 -2.373 -5.695 1.00 0.00 C ATOM 2320 CD1 LEU C 51 -0.380 -3.561 -6.167 1.00 0.00 C ATOM 2321 CD2 LEU C 51 0.953 -2.594 -4.288 1.00 0.00 C ATOM 0 H LEU C 51 4.020 -2.895 -5.508 1.00 0.00 H new ATOM 0 HA LEU C 51 1.948 -4.161 -7.184 1.00 0.00 H new ATOM 0 HB2 LEU C 51 2.226 -1.294 -6.225 1.00 0.00 H new ATOM 0 HB3 LEU C 51 1.209 -1.716 -7.589 1.00 0.00 H new ATOM 0 HG LEU C 51 -0.194 -1.495 -5.694 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -1.198 -3.733 -5.468 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -0.786 -3.351 -7.156 1.00 0.00 H new ATOM 0 HD13 LEU C 51 0.249 -4.450 -6.215 1.00 0.00 H new ATOM 0 HD21 LEU C 51 0.108 -2.791 -3.628 1.00 0.00 H new ATOM 0 HD22 LEU C 51 1.631 -3.447 -4.273 1.00 0.00 H new ATOM 0 HD23 LEU C 51 1.482 -1.704 -3.946 1.00 0.00 H new ATOM 2333 N ASN C 52 4.509 -2.282 -7.938 1.00 0.00 N ATOM 2334 CA ASN C 52 5.273 -1.597 -8.965 1.00 0.00 C ATOM 2335 C ASN C 52 6.719 -2.089 -9.019 1.00 0.00 C ATOM 2336 O ASN C 52 7.341 -2.114 -10.081 1.00 0.00 O ATOM 2337 CB ASN C 52 5.209 -0.095 -8.681 1.00 0.00 C ATOM 2338 CG ASN C 52 4.162 0.614 -9.526 1.00 0.00 C ATOM 2339 OD1 ASN C 52 4.292 1.801 -9.828 1.00 0.00 O ATOM 2340 ND2 ASN C 52 3.120 -0.104 -9.921 1.00 0.00 N ATOM 0 H ASN C 52 4.937 -2.254 -7.012 1.00 0.00 H new ATOM 0 HA ASN C 52 4.842 -1.811 -9.943 1.00 0.00 H new ATOM 0 HB2 ASN C 52 4.987 0.063 -7.626 1.00 0.00 H new ATOM 0 HB3 ASN C 52 6.186 0.349 -8.871 1.00 0.00 H new ATOM 0 HD21 ASN C 52 2.393 0.325 -10.494 1.00 0.00 H new ATOM 0 HD22 ASN C 52 3.045 -1.085 -9.652 1.00 0.00 H new ATOM 2347 N LYS C 53 7.239 -2.488 -7.873 1.00 0.00 N ATOM 2348 CA LYS C 53 8.566 -3.064 -7.775 1.00 0.00 C ATOM 2349 C LYS C 53 8.459 -4.555 -7.458 1.00 0.00 C ATOM 2350 O LYS C 53 8.987 -4.993 -6.420 1.00 0.00 O ATOM 2351 CB LYS C 53 9.372 -2.354 -6.677 1.00 0.00 C ATOM 2352 CG LYS C 53 10.435 -1.408 -7.205 1.00 0.00 C ATOM 2353 CD LYS C 53 11.413 -1.027 -6.104 1.00 0.00 C ATOM 2354 CE LYS C 53 10.818 -0.016 -5.140 1.00 0.00 C ATOM 2355 NZ LYS C 53 10.825 1.358 -5.709 1.00 0.00 N ATOM 2356 OXT LYS C 53 7.826 -5.281 -8.253 1.00 0.00 O ATOM 0 H LYS C 53 6.750 -2.421 -6.980 1.00 0.00 H new ATOM 0 HA LYS C 53 9.079 -2.934 -8.728 1.00 0.00 H new ATOM 0 HB2 LYS C 53 8.686 -1.795 -6.041 1.00 0.00 H new ATOM 0 HB3 LYS C 53 9.849 -3.105 -6.048 1.00 0.00 H new ATOM 0 HG2 LYS C 53 10.972 -1.880 -8.028 1.00 0.00 H new ATOM 0 HG3 LYS C 53 9.963 -0.511 -7.605 1.00 0.00 H new ATOM 0 HD2 LYS C 53 11.708 -1.921 -5.555 1.00 0.00 H new ATOM 0 HD3 LYS C 53 12.318 -0.614 -6.550 1.00 0.00 H new ATOM 0 HE2 LYS C 53 9.795 -0.304 -4.897 1.00 0.00 H new ATOM 0 HE3 LYS C 53 11.383 -0.026 -4.208 1.00 0.00 H new ATOM 0 HZ1 LYS C 53 10.411 2.020 -5.022 1.00 0.00 H new ATOM 0 HZ2 LYS C 53 11.803 1.642 -5.918 1.00 0.00 H new ATOM 0 HZ3 LYS C 53 10.265 1.374 -6.585 1.00 0.00 H new