USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 982 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 SER OG : rot 25:sc= 0.0453 USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.226 USER MOD Single : A 8 THR OG1 : rot 87:sc= 0.311 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -7.07! C(o=-7.1!,f=-10!) USER MOD Single : A 25 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0314) USER MOD Single : A 27 TYR OH : rot -175:sc= -0.306 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -147:sc= 1.08 (180deg=0.349) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.885 K(o=-0.89,f=-2.4!) USER MOD Single : A 43 THR OG1 : rot 180:sc= -0.0649 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -3.43 K(o=-3.4,f=-9.8!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 52 ASN : amide:sc= -5.13! C(o=-5.1!,f=-12!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.141) USER MOD Single : A 61 TYR OH : rot 30:sc= -1.34 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : B 5 SER OG : rot 31:sc= 0.155 USER MOD Single : B 7 THR OG1 : rot 180:sc= -0.201 USER MOD Single : B 8 THR OG1 : rot 85:sc= 0.482 USER MOD Single : B 14 TYR OH : rot 180:sc= 0 USER MOD Single : B 23 HIS : no HD1:sc= -7.02! C(o=-7!,f=-10!) USER MOD Single : B 25 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.0236) USER MOD Single : B 27 TYR OH : rot -176:sc= -0.301 USER MOD Single : B 29 TYR OH : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ -150:sc= 0.976 (180deg=0.277) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 ASN : amide:sc= -0.863 K(o=-0.86,f=-2.4!) USER MOD Single : B 43 THR OG1 : rot 180:sc= -0.0491 USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 ASN : amide:sc= -3.41 K(o=-3.4,f=-9.7!) USER MOD Single : B 48 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : B 52 ASN : amide:sc= -5.01! C(o=-5!,f=-12!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.156) USER MOD Single : B 61 TYR OH : rot 30:sc= -1.34 USER MOD Single : B 63 ASN : amide:sc=-0.00667 X(o=-0.0067,f=-0.12) USER MOD Single : B 64 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 58 N SER A 5 13.424 -6.518 -3.279 1.00 0.00 N ATOM 59 CA SER A 5 12.965 -5.158 -2.880 1.00 0.00 C ATOM 60 C SER A 5 12.464 -4.409 -4.117 1.00 0.00 C ATOM 61 O SER A 5 13.231 -4.046 -4.987 1.00 0.00 O ATOM 62 CB SER A 5 14.131 -4.390 -2.254 1.00 0.00 C ATOM 63 OG SER A 5 14.734 -5.186 -1.245 1.00 0.00 O ATOM 0 HA SER A 5 12.156 -5.243 -2.154 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.865 -4.135 -3.019 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.776 -3.452 -1.828 1.00 0.00 H new ATOM 0 HG SER A 5 14.566 -6.133 -1.432 1.00 0.00 H new ATOM 69 N ASP A 6 11.183 -4.179 -4.206 1.00 0.00 N ATOM 70 CA ASP A 6 10.637 -3.460 -5.390 1.00 0.00 C ATOM 71 C ASP A 6 9.203 -3.019 -5.103 1.00 0.00 C ATOM 72 O ASP A 6 8.848 -2.743 -3.974 1.00 0.00 O ATOM 73 CB ASP A 6 10.681 -4.392 -6.606 1.00 0.00 C ATOM 74 CG ASP A 6 9.727 -5.571 -6.393 1.00 0.00 C ATOM 75 OD1 ASP A 6 8.542 -5.396 -6.619 1.00 0.00 O ATOM 76 OD2 ASP A 6 10.200 -6.628 -6.011 1.00 0.00 O ATOM 0 H ASP A 6 10.491 -4.458 -3.510 1.00 0.00 H new ATOM 0 HA ASP A 6 11.237 -2.574 -5.599 1.00 0.00 H new ATOM 0 HB2 ASP A 6 10.401 -3.844 -7.506 1.00 0.00 H new ATOM 0 HB3 ASP A 6 11.697 -4.757 -6.759 1.00 0.00 H new ATOM 81 N THR A 7 8.377 -2.927 -6.109 1.00 0.00 N ATOM 82 CA THR A 7 6.987 -2.478 -5.872 1.00 0.00 C ATOM 83 C THR A 7 6.173 -3.621 -5.268 1.00 0.00 C ATOM 84 O THR A 7 6.651 -4.729 -5.125 1.00 0.00 O ATOM 85 CB THR A 7 6.360 -2.037 -7.198 1.00 0.00 C ATOM 86 OG1 THR A 7 5.051 -1.536 -6.961 1.00 0.00 O ATOM 87 CG2 THR A 7 6.284 -3.230 -8.155 1.00 0.00 C ATOM 0 H THR A 7 8.608 -3.143 -7.079 1.00 0.00 H new ATOM 0 HA THR A 7 6.990 -1.637 -5.178 1.00 0.00 H new ATOM 0 HB THR A 7 6.974 -1.255 -7.644 1.00 0.00 H new ATOM 0 HG1 THR A 7 4.651 -1.252 -7.809 1.00 0.00 H new ATOM 0 HG21 THR A 7 5.837 -2.913 -9.097 1.00 0.00 H new ATOM 0 HG22 THR A 7 7.288 -3.613 -8.340 1.00 0.00 H new ATOM 0 HG23 THR A 7 5.673 -4.015 -7.710 1.00 0.00 H new ATOM 95 N THR A 8 4.948 -3.362 -4.913 1.00 0.00 N ATOM 96 CA THR A 8 4.103 -4.433 -4.319 1.00 0.00 C ATOM 97 C THR A 8 2.623 -4.079 -4.514 1.00 0.00 C ATOM 98 O THR A 8 2.100 -3.237 -3.812 1.00 0.00 O ATOM 99 CB THR A 8 4.406 -4.553 -2.824 1.00 0.00 C ATOM 100 OG1 THR A 8 5.615 -3.868 -2.529 1.00 0.00 O ATOM 101 CG2 THR A 8 4.548 -6.029 -2.449 1.00 0.00 C ATOM 0 H THR A 8 4.494 -2.454 -5.008 1.00 0.00 H new ATOM 0 HA THR A 8 4.319 -5.382 -4.810 1.00 0.00 H new ATOM 0 HB THR A 8 3.591 -4.111 -2.251 1.00 0.00 H new ATOM 0 HG1 THR A 8 5.421 -2.924 -2.351 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.764 -6.115 -1.384 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.619 -6.553 -2.674 1.00 0.00 H new ATOM 0 HG23 THR A 8 5.363 -6.473 -3.021 1.00 0.00 H new ATOM 109 N PRO A 9 1.983 -4.735 -5.459 1.00 0.00 N ATOM 110 CA PRO A 9 0.559 -4.494 -5.742 1.00 0.00 C ATOM 111 C PRO A 9 -0.265 -4.721 -4.477 1.00 0.00 C ATOM 112 O PRO A 9 -0.734 -5.811 -4.217 1.00 0.00 O ATOM 113 CB PRO A 9 0.196 -5.526 -6.822 1.00 0.00 C ATOM 114 CG PRO A 9 1.491 -6.301 -7.185 1.00 0.00 C ATOM 115 CD PRO A 9 2.615 -5.763 -6.309 1.00 0.00 C ATOM 0 HA PRO A 9 0.360 -3.474 -6.072 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.570 -6.210 -6.456 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.213 -5.031 -7.703 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.356 -7.370 -7.020 1.00 0.00 H new ATOM 0 HG3 PRO A 9 1.732 -6.170 -8.240 1.00 0.00 H new ATOM 0 HD2 PRO A 9 3.058 -6.555 -5.706 1.00 0.00 H new ATOM 0 HD3 PRO A 9 3.416 -5.337 -6.913 1.00 0.00 H new ATOM 123 N CYS A 10 -0.433 -3.704 -3.678 1.00 0.00 N ATOM 124 CA CYS A 10 -1.215 -3.868 -2.423 1.00 0.00 C ATOM 125 C CYS A 10 -2.201 -2.722 -2.268 1.00 0.00 C ATOM 126 O CYS A 10 -2.001 -1.635 -2.775 1.00 0.00 O ATOM 127 CB CYS A 10 -0.260 -3.884 -1.228 1.00 0.00 C ATOM 128 SG CYS A 10 0.574 -5.487 -1.137 1.00 0.00 S ATOM 0 H CYS A 10 -0.063 -2.768 -3.841 1.00 0.00 H new ATOM 0 HA CYS A 10 -1.766 -4.807 -2.467 1.00 0.00 H new ATOM 0 HB2 CYS A 10 0.475 -3.086 -1.327 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -0.812 -3.697 -0.307 1.00 0.00 H new ATOM 133 N CYS A 11 -3.270 -2.964 -1.571 1.00 0.00 N ATOM 134 CA CYS A 11 -4.284 -1.904 -1.375 1.00 0.00 C ATOM 135 C CYS A 11 -4.023 -1.232 -0.012 1.00 0.00 C ATOM 136 O CYS A 11 -3.626 -1.876 0.939 1.00 0.00 O ATOM 137 CB CYS A 11 -5.688 -2.551 -1.485 1.00 0.00 C ATOM 138 SG CYS A 11 -6.832 -2.023 -0.179 1.00 0.00 S ATOM 0 H CYS A 11 -3.485 -3.857 -1.127 1.00 0.00 H new ATOM 0 HA CYS A 11 -4.227 -1.125 -2.135 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -6.118 -2.304 -2.456 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -5.584 -3.635 -1.449 1.00 0.00 H new ATOM 143 N PHE A 12 -4.237 0.055 0.086 1.00 0.00 N ATOM 144 CA PHE A 12 -3.992 0.748 1.384 1.00 0.00 C ATOM 145 C PHE A 12 -5.312 0.901 2.147 1.00 0.00 C ATOM 146 O PHE A 12 -5.390 0.632 3.330 1.00 0.00 O ATOM 147 CB PHE A 12 -3.368 2.129 1.128 1.00 0.00 C ATOM 148 CG PHE A 12 -4.367 3.044 0.453 1.00 0.00 C ATOM 149 CD1 PHE A 12 -4.448 3.088 -0.957 1.00 0.00 C ATOM 150 CD2 PHE A 12 -5.208 3.869 1.234 1.00 0.00 C ATOM 151 CE1 PHE A 12 -5.368 3.955 -1.586 1.00 0.00 C ATOM 152 CE2 PHE A 12 -6.127 4.738 0.605 1.00 0.00 C ATOM 153 CZ PHE A 12 -6.208 4.780 -0.805 1.00 0.00 C ATOM 0 H PHE A 12 -4.569 0.652 -0.672 1.00 0.00 H new ATOM 0 HA PHE A 12 -3.302 0.154 1.984 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -3.043 2.568 2.071 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -2.481 2.024 0.503 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.806 2.458 -1.554 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -5.148 3.835 2.312 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -5.430 3.988 -2.664 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.768 5.370 1.202 1.00 0.00 H new ATOM 0 HZ PHE A 12 -6.912 5.443 -1.286 1.00 0.00 H new ATOM 163 N ALA A 13 -6.349 1.329 1.481 1.00 0.00 N ATOM 164 CA ALA A 13 -7.659 1.497 2.168 1.00 0.00 C ATOM 165 C ALA A 13 -8.740 0.787 1.372 1.00 0.00 C ATOM 166 O ALA A 13 -8.742 0.800 0.156 1.00 0.00 O ATOM 167 CB ALA A 13 -7.994 2.985 2.278 1.00 0.00 C ATOM 0 H ALA A 13 -6.345 1.570 0.490 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.603 1.067 3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.953 3.106 2.781 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -7.217 3.491 2.851 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -8.050 3.420 1.280 1.00 0.00 H new ATOM 173 N TYR A 14 -9.658 0.153 2.043 1.00 0.00 N ATOM 174 CA TYR A 14 -10.728 -0.567 1.307 1.00 0.00 C ATOM 175 C TYR A 14 -12.073 0.131 1.517 1.00 0.00 C ATOM 176 O TYR A 14 -12.393 0.578 2.600 1.00 0.00 O ATOM 177 CB TYR A 14 -10.833 -2.033 1.764 1.00 0.00 C ATOM 178 CG TYR A 14 -10.291 -2.197 3.163 1.00 0.00 C ATOM 179 CD1 TYR A 14 -8.896 -2.167 3.390 1.00 0.00 C ATOM 180 CD2 TYR A 14 -11.183 -2.323 4.246 1.00 0.00 C ATOM 181 CE1 TYR A 14 -8.395 -2.261 4.703 1.00 0.00 C ATOM 182 CE2 TYR A 14 -10.682 -2.427 5.562 1.00 0.00 C ATOM 183 CZ TYR A 14 -9.288 -2.392 5.792 1.00 0.00 C ATOM 184 OH TYR A 14 -8.797 -2.486 7.079 1.00 0.00 O ATOM 0 H TYR A 14 -9.713 0.103 3.060 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.470 -0.554 0.248 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.874 -2.355 1.732 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -10.280 -2.674 1.077 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -8.215 -2.072 2.557 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -12.248 -2.340 4.070 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -7.330 -2.233 4.878 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -11.364 -2.533 6.393 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.543 -2.570 7.709 1.00 0.00 H new ATOM 194 N ILE A 15 -12.864 0.220 0.481 1.00 0.00 N ATOM 195 CA ILE A 15 -14.193 0.881 0.603 1.00 0.00 C ATOM 196 C ILE A 15 -15.128 -0.016 1.418 1.00 0.00 C ATOM 197 O ILE A 15 -14.871 -1.187 1.610 1.00 0.00 O ATOM 198 CB ILE A 15 -14.778 1.095 -0.797 1.00 0.00 C ATOM 199 CG1 ILE A 15 -16.182 1.696 -0.687 1.00 0.00 C ATOM 200 CG2 ILE A 15 -14.857 -0.250 -1.524 1.00 0.00 C ATOM 201 CD1 ILE A 15 -16.623 2.220 -2.056 1.00 0.00 C ATOM 0 H ILE A 15 -12.644 -0.139 -0.448 1.00 0.00 H new ATOM 0 HA ILE A 15 -14.085 1.843 1.104 1.00 0.00 H new ATOM 0 HB ILE A 15 -14.137 1.778 -1.355 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -16.885 0.943 -0.331 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -16.186 2.506 0.043 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -15.273 -0.101 -2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.858 -0.677 -1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -15.497 -0.930 -0.962 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -17.622 2.648 -1.977 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -15.926 2.987 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -16.635 1.399 -2.773 1.00 0.00 H new ATOM 213 N ALA A 16 -16.215 0.526 1.892 1.00 0.00 N ATOM 214 CA ALA A 16 -17.171 -0.292 2.688 1.00 0.00 C ATOM 215 C ALA A 16 -18.436 -0.533 1.859 1.00 0.00 C ATOM 216 O ALA A 16 -19.338 0.279 1.833 1.00 0.00 O ATOM 217 CB ALA A 16 -17.536 0.457 3.972 1.00 0.00 C ATOM 0 H ALA A 16 -16.483 1.502 1.762 1.00 0.00 H new ATOM 0 HA ALA A 16 -16.713 -1.247 2.945 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -18.236 -0.141 4.556 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -16.634 0.635 4.558 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -17.998 1.411 3.718 1.00 0.00 H new ATOM 223 N ARG A 17 -18.505 -1.644 1.174 1.00 0.00 N ATOM 224 CA ARG A 17 -19.702 -1.942 0.340 1.00 0.00 C ATOM 225 C ARG A 17 -19.416 -3.195 -0.508 1.00 0.00 C ATOM 226 O ARG A 17 -18.574 -3.150 -1.384 1.00 0.00 O ATOM 227 CB ARG A 17 -19.988 -0.759 -0.588 1.00 0.00 C ATOM 228 CG ARG A 17 -21.336 -0.137 -0.221 1.00 0.00 C ATOM 229 CD ARG A 17 -22.033 0.358 -1.489 1.00 0.00 C ATOM 230 NE ARG A 17 -23.081 1.353 -1.123 1.00 0.00 N ATOM 231 CZ ARG A 17 -23.610 2.111 -2.043 1.00 0.00 C ATOM 232 NH1 ARG A 17 -24.662 1.703 -2.699 1.00 0.00 N ATOM 233 NH2 ARG A 17 -23.087 3.277 -2.307 1.00 0.00 N ATOM 0 H ARG A 17 -17.779 -2.360 1.158 1.00 0.00 H new ATOM 0 HA ARG A 17 -20.566 -2.113 0.982 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -19.196 -0.015 -0.501 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -20.000 -1.092 -1.626 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -21.961 -0.872 0.287 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -21.189 0.691 0.473 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -21.306 0.811 -2.163 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -22.482 -0.481 -2.021 1.00 0.00 H new ATOM 0 HE ARG A 17 -23.384 1.441 -0.153 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -25.070 0.791 -2.492 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -25.076 2.296 -3.419 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.265 3.595 -1.794 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -23.500 3.870 -3.026 1.00 0.00 H new ATOM 247 N PRO A 18 -20.110 -4.282 -0.235 1.00 0.00 N ATOM 248 CA PRO A 18 -19.904 -5.531 -0.988 1.00 0.00 C ATOM 249 C PRO A 18 -20.150 -5.301 -2.480 1.00 0.00 C ATOM 250 O PRO A 18 -21.274 -5.271 -2.941 1.00 0.00 O ATOM 251 CB PRO A 18 -20.922 -6.520 -0.404 1.00 0.00 C ATOM 252 CG PRO A 18 -21.733 -5.770 0.683 1.00 0.00 C ATOM 253 CD PRO A 18 -21.140 -4.363 0.820 1.00 0.00 C ATOM 0 HA PRO A 18 -18.884 -5.905 -0.899 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -21.584 -6.895 -1.185 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -20.414 -7.384 0.025 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -22.786 -5.716 0.405 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -21.681 -6.301 1.633 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -21.904 -3.597 0.686 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -20.706 -4.211 1.808 1.00 0.00 H new ATOM 261 N LEU A 19 -19.096 -5.138 -3.236 1.00 0.00 N ATOM 262 CA LEU A 19 -19.243 -4.908 -4.702 1.00 0.00 C ATOM 263 C LEU A 19 -20.146 -5.998 -5.306 1.00 0.00 C ATOM 264 O LEU A 19 -19.845 -7.164 -5.170 1.00 0.00 O ATOM 265 CB LEU A 19 -17.865 -4.992 -5.366 1.00 0.00 C ATOM 266 CG LEU A 19 -16.911 -3.974 -4.739 1.00 0.00 C ATOM 267 CD1 LEU A 19 -15.570 -4.015 -5.474 1.00 0.00 C ATOM 268 CD2 LEU A 19 -17.507 -2.571 -4.850 1.00 0.00 C ATOM 0 H LEU A 19 -18.134 -5.155 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 19 -19.684 -3.925 -4.870 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -17.460 -5.998 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -17.957 -4.804 -6.436 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.761 -4.220 -3.688 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -14.889 -3.290 -5.029 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.141 -5.014 -5.393 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -15.724 -3.770 -6.525 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -16.824 -1.849 -4.402 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -17.660 -2.323 -5.900 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -18.463 -2.539 -4.327 1.00 0.00 H new ATOM 280 N PRO A 20 -21.222 -5.609 -5.962 1.00 0.00 N ATOM 281 CA PRO A 20 -22.134 -6.587 -6.579 1.00 0.00 C ATOM 282 C PRO A 20 -21.374 -7.453 -7.588 1.00 0.00 C ATOM 283 O PRO A 20 -20.437 -7.008 -8.219 1.00 0.00 O ATOM 284 CB PRO A 20 -23.205 -5.741 -7.284 1.00 0.00 C ATOM 285 CG PRO A 20 -22.919 -4.253 -6.956 1.00 0.00 C ATOM 286 CD PRO A 20 -21.617 -4.196 -6.143 1.00 0.00 C ATOM 0 HA PRO A 20 -22.572 -7.267 -5.848 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -23.177 -5.908 -8.361 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -24.201 -6.023 -6.944 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -22.823 -3.671 -7.873 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -23.743 -3.821 -6.389 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -20.846 -3.634 -6.670 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -21.771 -3.702 -5.183 1.00 0.00 H new ATOM 294 N ARG A 21 -21.766 -8.689 -7.738 1.00 0.00 N ATOM 295 CA ARG A 21 -21.061 -9.587 -8.699 1.00 0.00 C ATOM 296 C ARG A 21 -21.306 -9.112 -10.131 1.00 0.00 C ATOM 297 O ARG A 21 -20.529 -9.385 -11.024 1.00 0.00 O ATOM 298 CB ARG A 21 -21.586 -11.016 -8.539 1.00 0.00 C ATOM 299 CG ARG A 21 -20.631 -11.995 -9.227 1.00 0.00 C ATOM 300 CD ARG A 21 -21.010 -12.132 -10.704 1.00 0.00 C ATOM 301 NE ARG A 21 -20.892 -13.558 -11.122 1.00 0.00 N ATOM 302 CZ ARG A 21 -21.319 -13.929 -12.298 1.00 0.00 C ATOM 303 NH1 ARG A 21 -21.021 -13.221 -13.353 1.00 0.00 N ATOM 304 NH2 ARG A 21 -22.045 -15.007 -12.419 1.00 0.00 N ATOM 0 H ARG A 21 -22.544 -9.117 -7.237 1.00 0.00 H new ATOM 0 HA ARG A 21 -19.991 -9.564 -8.492 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -21.677 -11.264 -7.482 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -22.582 -11.099 -8.973 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -19.604 -11.641 -9.136 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -20.677 -12.968 -8.738 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -22.029 -11.780 -10.862 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -20.359 -11.508 -11.316 1.00 0.00 H new ATOM 0 HE ARG A 21 -20.478 -14.243 -10.490 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -20.455 -12.378 -13.258 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -21.355 -13.511 -14.272 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -22.279 -15.560 -11.594 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -22.379 -15.297 -13.338 1.00 0.00 H new ATOM 318 N ALA A 22 -22.376 -8.406 -10.364 1.00 0.00 N ATOM 319 CA ALA A 22 -22.655 -7.930 -11.745 1.00 0.00 C ATOM 320 C ALA A 22 -21.809 -6.694 -12.060 1.00 0.00 C ATOM 321 O ALA A 22 -21.709 -6.280 -13.198 1.00 0.00 O ATOM 322 CB ALA A 22 -24.139 -7.585 -11.881 1.00 0.00 C ATOM 0 H ALA A 22 -23.066 -8.139 -9.662 1.00 0.00 H new ATOM 0 HA ALA A 22 -22.400 -8.722 -12.449 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -24.340 -7.237 -12.894 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -24.739 -8.472 -11.676 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -24.397 -6.800 -11.170 1.00 0.00 H new ATOM 328 N HIS A 23 -21.196 -6.104 -11.073 1.00 0.00 N ATOM 329 CA HIS A 23 -20.359 -4.905 -11.343 1.00 0.00 C ATOM 330 C HIS A 23 -18.887 -5.309 -11.353 1.00 0.00 C ATOM 331 O HIS A 23 -18.064 -4.645 -11.947 1.00 0.00 O ATOM 332 CB HIS A 23 -20.582 -3.859 -10.250 1.00 0.00 C ATOM 333 CG HIS A 23 -22.046 -3.514 -10.166 1.00 0.00 C ATOM 334 ND1 HIS A 23 -22.487 -2.206 -10.005 1.00 0.00 N ATOM 335 CD2 HIS A 23 -23.181 -4.290 -10.197 1.00 0.00 C ATOM 336 CE1 HIS A 23 -23.824 -2.230 -9.944 1.00 0.00 C ATOM 337 NE2 HIS A 23 -24.299 -3.479 -10.058 1.00 0.00 N ATOM 0 H HIS A 23 -21.238 -6.398 -10.097 1.00 0.00 H new ATOM 0 HA HIS A 23 -20.637 -4.485 -12.310 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -20.233 -4.242 -9.291 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -20.000 -2.963 -10.466 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -23.200 -5.364 -10.312 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -24.443 -1.354 -9.819 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -25.276 -3.771 -10.045 1.00 0.00 H new ATOM 345 N ILE A 24 -18.541 -6.395 -10.707 1.00 0.00 N ATOM 346 CA ILE A 24 -17.108 -6.809 -10.699 1.00 0.00 C ATOM 347 C ILE A 24 -16.828 -7.738 -11.879 1.00 0.00 C ATOM 348 O ILE A 24 -17.721 -8.353 -12.425 1.00 0.00 O ATOM 349 CB ILE A 24 -16.746 -7.561 -9.417 1.00 0.00 C ATOM 350 CG1 ILE A 24 -17.165 -6.767 -8.180 1.00 0.00 C ATOM 351 CG2 ILE A 24 -15.234 -7.787 -9.382 1.00 0.00 C ATOM 352 CD1 ILE A 24 -16.833 -7.566 -6.919 1.00 0.00 C ATOM 0 H ILE A 24 -19.179 -7.003 -10.193 1.00 0.00 H new ATOM 0 HA ILE A 24 -16.510 -5.900 -10.766 1.00 0.00 H new ATOM 0 HB ILE A 24 -17.274 -8.515 -9.411 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -16.649 -5.807 -8.160 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -18.233 -6.554 -8.217 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -14.967 -8.323 -8.471 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -14.934 -8.375 -10.250 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -14.722 -6.825 -9.400 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -17.133 -6.998 -6.039 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -17.369 -8.515 -6.938 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -15.760 -7.756 -6.880 1.00 0.00 H new ATOM 364 N LYS A 25 -15.587 -7.858 -12.259 1.00 0.00 N ATOM 365 CA LYS A 25 -15.238 -8.767 -13.388 1.00 0.00 C ATOM 366 C LYS A 25 -14.293 -9.866 -12.883 1.00 0.00 C ATOM 367 O LYS A 25 -14.241 -10.953 -13.424 1.00 0.00 O ATOM 368 CB LYS A 25 -14.549 -7.968 -14.496 1.00 0.00 C ATOM 369 CG LYS A 25 -15.591 -7.129 -15.239 1.00 0.00 C ATOM 370 CD LYS A 25 -16.073 -7.892 -16.474 1.00 0.00 C ATOM 371 CE LYS A 25 -16.612 -6.901 -17.508 1.00 0.00 C ATOM 372 NZ LYS A 25 -15.475 -6.294 -18.254 1.00 0.00 N ATOM 0 H LYS A 25 -14.799 -7.367 -11.837 1.00 0.00 H new ATOM 0 HA LYS A 25 -16.147 -9.221 -13.783 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.782 -7.322 -14.070 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.048 -8.644 -15.189 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.433 -6.910 -14.582 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.160 -6.172 -15.534 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -15.253 -8.469 -16.901 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -16.851 -8.602 -16.195 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -17.284 -7.410 -18.199 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -17.193 -6.123 -17.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -15.731 -5.332 -18.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -14.638 -6.253 -17.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -15.261 -6.872 -19.091 1.00 0.00 H new ATOM 386 N GLU A 26 -13.542 -9.585 -11.851 1.00 0.00 N ATOM 387 CA GLU A 26 -12.589 -10.588 -11.299 1.00 0.00 C ATOM 388 C GLU A 26 -12.152 -10.092 -9.916 1.00 0.00 C ATOM 389 O GLU A 26 -12.811 -9.257 -9.326 1.00 0.00 O ATOM 390 CB GLU A 26 -11.369 -10.725 -12.237 1.00 0.00 C ATOM 391 CG GLU A 26 -11.097 -9.410 -12.985 1.00 0.00 C ATOM 392 CD GLU A 26 -11.593 -9.517 -14.431 1.00 0.00 C ATOM 393 OE1 GLU A 26 -12.264 -10.487 -14.741 1.00 0.00 O ATOM 394 OE2 GLU A 26 -11.296 -8.621 -15.203 1.00 0.00 O ATOM 0 H GLU A 26 -13.550 -8.690 -11.362 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.058 -11.568 -11.218 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.490 -11.006 -11.657 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.546 -11.526 -12.955 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -11.599 -8.584 -12.480 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.030 -9.190 -12.973 1.00 0.00 H new ATOM 401 N TYR A 27 -11.051 -10.562 -9.393 1.00 0.00 N ATOM 402 CA TYR A 27 -10.606 -10.071 -8.070 1.00 0.00 C ATOM 403 C TYR A 27 -9.120 -10.397 -7.918 1.00 0.00 C ATOM 404 O TYR A 27 -8.507 -10.909 -8.835 1.00 0.00 O ATOM 405 CB TYR A 27 -11.470 -10.715 -6.968 1.00 0.00 C ATOM 406 CG TYR A 27 -10.942 -12.090 -6.603 1.00 0.00 C ATOM 407 CD1 TYR A 27 -11.188 -13.187 -7.459 1.00 0.00 C ATOM 408 CD2 TYR A 27 -10.178 -12.269 -5.428 1.00 0.00 C ATOM 409 CE1 TYR A 27 -10.673 -14.464 -7.139 1.00 0.00 C ATOM 410 CE2 TYR A 27 -9.665 -13.547 -5.107 1.00 0.00 C ATOM 411 CZ TYR A 27 -9.913 -14.643 -5.963 1.00 0.00 C ATOM 412 OH TYR A 27 -9.408 -15.890 -5.653 1.00 0.00 O ATOM 0 H TYR A 27 -10.448 -11.261 -9.827 1.00 0.00 H new ATOM 0 HA TYR A 27 -10.730 -8.992 -7.981 1.00 0.00 H new ATOM 0 HB2 TYR A 27 -11.476 -10.077 -6.085 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -12.502 -10.796 -7.310 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -11.770 -13.050 -8.358 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -9.986 -11.430 -4.775 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -10.861 -15.302 -7.794 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -9.084 -13.685 -4.207 1.00 0.00 H new ATOM 0 HH TYR A 27 -8.977 -15.859 -4.774 1.00 0.00 H new ATOM 422 N PHE A 28 -8.520 -10.102 -6.795 1.00 0.00 N ATOM 423 CA PHE A 28 -7.076 -10.409 -6.673 1.00 0.00 C ATOM 424 C PHE A 28 -6.624 -10.334 -5.209 1.00 0.00 C ATOM 425 O PHE A 28 -6.367 -9.268 -4.686 1.00 0.00 O ATOM 426 CB PHE A 28 -6.288 -9.396 -7.517 1.00 0.00 C ATOM 427 CG PHE A 28 -4.801 -9.559 -7.289 1.00 0.00 C ATOM 428 CD1 PHE A 28 -4.086 -10.571 -7.965 1.00 0.00 C ATOM 429 CD2 PHE A 28 -4.127 -8.684 -6.407 1.00 0.00 C ATOM 430 CE1 PHE A 28 -2.694 -10.711 -7.759 1.00 0.00 C ATOM 431 CE2 PHE A 28 -2.737 -8.825 -6.198 1.00 0.00 C ATOM 432 CZ PHE A 28 -2.021 -9.838 -6.875 1.00 0.00 C ATOM 0 H PHE A 28 -8.958 -9.673 -5.980 1.00 0.00 H new ATOM 0 HA PHE A 28 -6.891 -11.422 -7.030 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -6.518 -9.537 -8.573 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -6.593 -8.382 -7.257 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -4.602 -11.238 -8.639 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -4.675 -7.908 -5.893 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -2.146 -11.484 -8.277 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -2.222 -8.159 -5.521 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.958 -9.945 -6.716 1.00 0.00 H new ATOM 442 N TYR A 29 -6.501 -11.454 -4.551 1.00 0.00 N ATOM 443 CA TYR A 29 -6.045 -11.431 -3.134 1.00 0.00 C ATOM 444 C TYR A 29 -4.673 -10.768 -3.060 1.00 0.00 C ATOM 445 O TYR A 29 -3.761 -11.107 -3.788 1.00 0.00 O ATOM 446 CB TYR A 29 -5.952 -12.858 -2.597 1.00 0.00 C ATOM 447 CG TYR A 29 -5.430 -12.847 -1.180 1.00 0.00 C ATOM 448 CD1 TYR A 29 -6.261 -12.417 -0.123 1.00 0.00 C ATOM 449 CD2 TYR A 29 -4.109 -13.273 -0.912 1.00 0.00 C ATOM 450 CE1 TYR A 29 -5.773 -12.413 1.203 1.00 0.00 C ATOM 451 CE2 TYR A 29 -3.621 -13.269 0.413 1.00 0.00 C ATOM 452 CZ TYR A 29 -4.453 -12.838 1.471 1.00 0.00 C ATOM 453 OH TYR A 29 -3.976 -12.836 2.766 1.00 0.00 O ATOM 0 H TYR A 29 -6.696 -12.380 -4.932 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.759 -10.869 -2.532 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.934 -13.331 -2.627 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.293 -13.451 -3.231 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.270 -12.091 -0.328 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -3.473 -13.602 -1.721 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.409 -12.085 2.012 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -2.612 -13.595 0.618 1.00 0.00 H new ATOM 0 HH TYR A 29 -3.051 -13.159 2.774 1.00 0.00 H new ATOM 463 N THR A 30 -4.531 -9.825 -2.183 1.00 0.00 N ATOM 464 CA THR A 30 -3.224 -9.121 -2.040 1.00 0.00 C ATOM 465 C THR A 30 -2.229 -10.035 -1.321 1.00 0.00 C ATOM 466 O THR A 30 -2.590 -10.794 -0.445 1.00 0.00 O ATOM 467 CB THR A 30 -3.422 -7.842 -1.225 1.00 0.00 C ATOM 468 OG1 THR A 30 -4.428 -7.044 -1.831 1.00 0.00 O ATOM 469 CG2 THR A 30 -2.108 -7.059 -1.181 1.00 0.00 C ATOM 0 H THR A 30 -5.265 -9.505 -1.552 1.00 0.00 H new ATOM 0 HA THR A 30 -2.837 -8.867 -3.027 1.00 0.00 H new ATOM 0 HB THR A 30 -3.727 -8.101 -0.211 1.00 0.00 H new ATOM 0 HG1 THR A 30 -4.556 -6.225 -1.308 1.00 0.00 H new ATOM 0 HG21 THR A 30 -2.247 -6.147 -0.601 1.00 0.00 H new ATOM 0 HG22 THR A 30 -1.335 -7.671 -0.716 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.804 -6.801 -2.195 1.00 0.00 H new ATOM 477 N SER A 31 -0.978 -9.967 -1.686 1.00 0.00 N ATOM 478 CA SER A 31 0.039 -10.833 -1.022 1.00 0.00 C ATOM 479 C SER A 31 0.125 -10.471 0.463 1.00 0.00 C ATOM 480 O SER A 31 -0.517 -9.551 0.926 1.00 0.00 O ATOM 481 CB SER A 31 1.402 -10.617 -1.681 1.00 0.00 C ATOM 482 OG SER A 31 1.477 -11.383 -2.875 1.00 0.00 O ATOM 0 H SER A 31 -0.616 -9.351 -2.414 1.00 0.00 H new ATOM 0 HA SER A 31 -0.251 -11.879 -1.125 1.00 0.00 H new ATOM 0 HB2 SER A 31 1.546 -9.560 -1.905 1.00 0.00 H new ATOM 0 HB3 SER A 31 2.199 -10.910 -0.998 1.00 0.00 H new ATOM 0 HG SER A 31 2.350 -11.244 -3.299 1.00 0.00 H new ATOM 488 N GLY A 32 0.914 -11.193 1.213 1.00 0.00 N ATOM 489 CA GLY A 32 1.038 -10.892 2.667 1.00 0.00 C ATOM 490 C GLY A 32 2.466 -10.442 2.980 1.00 0.00 C ATOM 491 O GLY A 32 3.152 -11.037 3.788 1.00 0.00 O ATOM 0 H GLY A 32 1.477 -11.977 0.882 1.00 0.00 H new ATOM 0 HA2 GLY A 32 0.331 -10.112 2.948 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.788 -11.776 3.254 1.00 0.00 H new ATOM 495 N LYS A 33 2.922 -9.396 2.349 1.00 0.00 N ATOM 496 CA LYS A 33 4.305 -8.909 2.614 1.00 0.00 C ATOM 497 C LYS A 33 4.368 -7.399 2.378 1.00 0.00 C ATOM 498 O LYS A 33 5.401 -6.858 2.043 1.00 0.00 O ATOM 499 CB LYS A 33 5.284 -9.610 1.671 1.00 0.00 C ATOM 500 CG LYS A 33 4.776 -9.500 0.232 1.00 0.00 C ATOM 501 CD LYS A 33 5.854 -8.864 -0.648 1.00 0.00 C ATOM 502 CE LYS A 33 5.707 -9.378 -2.082 1.00 0.00 C ATOM 503 NZ LYS A 33 7.032 -9.341 -2.762 1.00 0.00 N ATOM 0 H LYS A 33 2.397 -8.857 1.661 1.00 0.00 H new ATOM 0 HA LYS A 33 4.574 -9.129 3.647 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.272 -9.158 1.754 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.388 -10.658 1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.518 -10.488 -0.149 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.867 -8.899 0.202 1.00 0.00 H new ATOM 0 HD2 LYS A 33 5.762 -7.778 -0.628 1.00 0.00 H new ATOM 0 HD3 LYS A 33 6.844 -9.107 -0.262 1.00 0.00 H new ATOM 0 HE2 LYS A 33 5.318 -10.396 -2.076 1.00 0.00 H new ATOM 0 HE3 LYS A 33 4.989 -8.765 -2.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 6.898 -9.136 -3.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.622 -8.599 -2.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 7.503 -10.262 -2.656 1.00 0.00 H new ATOM 517 N CYS A 34 3.270 -6.715 2.549 1.00 0.00 N ATOM 518 CA CYS A 34 3.271 -5.242 2.331 1.00 0.00 C ATOM 519 C CYS A 34 2.428 -4.559 3.413 1.00 0.00 C ATOM 520 O CYS A 34 1.974 -3.444 3.247 1.00 0.00 O ATOM 521 CB CYS A 34 2.683 -4.932 0.955 1.00 0.00 C ATOM 522 SG CYS A 34 1.040 -5.681 0.817 1.00 0.00 S ATOM 0 H CYS A 34 2.374 -7.112 2.830 1.00 0.00 H new ATOM 0 HA CYS A 34 4.294 -4.870 2.383 1.00 0.00 H new ATOM 0 HB2 CYS A 34 2.616 -3.854 0.811 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.337 -5.318 0.173 1.00 0.00 H new ATOM 527 N SER A 35 2.216 -5.216 4.522 1.00 0.00 N ATOM 528 CA SER A 35 1.406 -4.602 5.612 1.00 0.00 C ATOM 529 C SER A 35 0.049 -4.158 5.060 1.00 0.00 C ATOM 530 O SER A 35 -0.570 -3.243 5.568 1.00 0.00 O ATOM 531 CB SER A 35 2.150 -3.388 6.174 1.00 0.00 C ATOM 532 OG SER A 35 2.862 -3.769 7.342 1.00 0.00 O ATOM 0 H SER A 35 2.569 -6.152 4.720 1.00 0.00 H new ATOM 0 HA SER A 35 1.250 -5.335 6.404 1.00 0.00 H new ATOM 0 HB2 SER A 35 2.839 -2.993 5.428 1.00 0.00 H new ATOM 0 HB3 SER A 35 1.444 -2.592 6.409 1.00 0.00 H new ATOM 0 HG SER A 35 3.340 -2.993 7.702 1.00 0.00 H new ATOM 538 N ASN A 36 -0.421 -4.799 4.025 1.00 0.00 N ATOM 539 CA ASN A 36 -1.739 -4.415 3.445 1.00 0.00 C ATOM 540 C ASN A 36 -2.512 -5.673 3.022 1.00 0.00 C ATOM 541 O ASN A 36 -2.930 -5.774 1.886 1.00 0.00 O ATOM 542 CB ASN A 36 -1.512 -3.525 2.221 1.00 0.00 C ATOM 543 CG ASN A 36 -1.372 -2.067 2.665 1.00 0.00 C ATOM 544 OD1 ASN A 36 -2.005 -1.645 3.611 1.00 0.00 O ATOM 545 ND2 ASN A 36 -0.562 -1.275 2.016 1.00 0.00 N ATOM 0 H ASN A 36 0.051 -5.572 3.556 1.00 0.00 H new ATOM 0 HA ASN A 36 -2.317 -3.874 4.194 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.614 -3.842 1.690 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -2.346 -3.626 1.526 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -0.461 -0.302 2.304 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -0.030 -1.630 1.221 1.00 0.00 H new ATOM 552 N PRO A 37 -2.697 -6.600 3.944 1.00 0.00 N ATOM 553 CA PRO A 37 -3.437 -7.838 3.648 1.00 0.00 C ATOM 554 C PRO A 37 -4.866 -7.487 3.236 1.00 0.00 C ATOM 555 O PRO A 37 -5.523 -6.694 3.881 1.00 0.00 O ATOM 556 CB PRO A 37 -3.439 -8.625 4.968 1.00 0.00 C ATOM 557 CG PRO A 37 -2.702 -7.768 6.028 1.00 0.00 C ATOM 558 CD PRO A 37 -2.195 -6.496 5.333 1.00 0.00 C ATOM 0 HA PRO A 37 -2.991 -8.412 2.836 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -4.460 -8.834 5.287 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.942 -9.587 4.841 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.374 -7.514 6.848 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.870 -8.325 6.459 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -2.573 -5.599 5.824 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -1.107 -6.439 5.357 1.00 0.00 H new ATOM 566 N ALA A 38 -5.355 -8.051 2.165 1.00 0.00 N ATOM 567 CA ALA A 38 -6.739 -7.717 1.731 1.00 0.00 C ATOM 568 C ALA A 38 -7.075 -8.464 0.439 1.00 0.00 C ATOM 569 O ALA A 38 -6.543 -9.522 0.165 1.00 0.00 O ATOM 570 CB ALA A 38 -6.834 -6.205 1.501 1.00 0.00 C ATOM 0 H ALA A 38 -4.861 -8.722 1.577 1.00 0.00 H new ATOM 0 HA ALA A 38 -7.449 -8.017 2.501 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -7.844 -5.948 1.182 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.601 -5.681 2.428 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -6.124 -5.909 0.729 1.00 0.00 H new ATOM 576 N VAL A 39 -7.946 -7.916 -0.360 1.00 0.00 N ATOM 577 CA VAL A 39 -8.317 -8.565 -1.632 1.00 0.00 C ATOM 578 C VAL A 39 -8.537 -7.424 -2.608 1.00 0.00 C ATOM 579 O VAL A 39 -8.701 -6.291 -2.193 1.00 0.00 O ATOM 580 CB VAL A 39 -9.582 -9.436 -1.415 1.00 0.00 C ATOM 581 CG1 VAL A 39 -10.826 -8.851 -2.103 1.00 0.00 C ATOM 582 CG2 VAL A 39 -9.329 -10.844 -1.954 1.00 0.00 C ATOM 0 H VAL A 39 -8.420 -7.032 -0.176 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.555 -9.242 -2.018 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.778 -9.460 -0.343 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.682 -9.500 -1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.030 -7.858 -1.702 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.649 -8.780 -3.176 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -10.217 -11.457 -1.802 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.103 -10.791 -3.019 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.486 -11.290 -1.426 1.00 0.00 H new ATOM 592 N VAL A 40 -8.515 -7.675 -3.876 1.00 0.00 N ATOM 593 CA VAL A 40 -8.700 -6.535 -4.801 1.00 0.00 C ATOM 594 C VAL A 40 -9.612 -6.898 -5.955 1.00 0.00 C ATOM 595 O VAL A 40 -9.306 -7.731 -6.778 1.00 0.00 O ATOM 596 CB VAL A 40 -7.330 -6.083 -5.296 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.461 -5.041 -6.404 1.00 0.00 C ATOM 598 CG2 VAL A 40 -6.602 -5.452 -4.121 1.00 0.00 C ATOM 0 H VAL A 40 -8.381 -8.591 -4.305 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.184 -5.715 -4.271 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.789 -6.941 -5.694 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.469 -4.737 -6.737 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.010 -5.469 -7.243 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.998 -4.172 -6.024 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -5.616 -5.117 -4.442 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.173 -4.599 -3.754 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.494 -6.187 -3.323 1.00 0.00 H new ATOM 608 N PHE A 41 -10.730 -6.248 -6.030 1.00 0.00 N ATOM 609 CA PHE A 41 -11.661 -6.538 -7.129 1.00 0.00 C ATOM 610 C PHE A 41 -11.287 -5.743 -8.358 1.00 0.00 C ATOM 611 O PHE A 41 -10.907 -4.597 -8.295 1.00 0.00 O ATOM 612 CB PHE A 41 -13.093 -6.208 -6.704 1.00 0.00 C ATOM 613 CG PHE A 41 -13.601 -7.280 -5.770 1.00 0.00 C ATOM 614 CD1 PHE A 41 -13.749 -8.608 -6.231 1.00 0.00 C ATOM 615 CD2 PHE A 41 -13.927 -6.956 -4.434 1.00 0.00 C ATOM 616 CE1 PHE A 41 -14.226 -9.610 -5.357 1.00 0.00 C ATOM 617 CE2 PHE A 41 -14.403 -7.959 -3.559 1.00 0.00 C ATOM 618 CZ PHE A 41 -14.552 -9.286 -4.021 1.00 0.00 C ATOM 0 H PHE A 41 -11.035 -5.528 -5.375 1.00 0.00 H new ATOM 0 HA PHE A 41 -11.599 -7.599 -7.369 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -13.122 -5.237 -6.210 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -13.737 -6.139 -7.581 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -13.497 -8.857 -7.251 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -13.812 -5.942 -4.081 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -14.342 -10.624 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -14.653 -7.711 -2.538 1.00 0.00 H new ATOM 0 HZ PHE A 41 -14.915 -10.053 -3.353 1.00 0.00 H new ATOM 628 N VAL A 42 -11.406 -6.372 -9.477 1.00 0.00 N ATOM 629 CA VAL A 42 -11.088 -5.715 -10.765 1.00 0.00 C ATOM 630 C VAL A 42 -12.433 -5.571 -11.503 1.00 0.00 C ATOM 631 O VAL A 42 -12.767 -6.342 -12.380 1.00 0.00 O ATOM 632 CB VAL A 42 -10.111 -6.579 -11.575 1.00 0.00 C ATOM 633 CG1 VAL A 42 -8.805 -5.817 -11.723 1.00 0.00 C ATOM 634 CG2 VAL A 42 -9.803 -7.903 -10.869 1.00 0.00 C ATOM 0 H VAL A 42 -11.718 -7.340 -9.560 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.609 -4.746 -10.620 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.570 -6.795 -12.540 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -8.097 -6.416 -12.296 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.989 -4.877 -12.242 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -8.390 -5.611 -10.736 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.108 -8.485 -11.474 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.355 -7.701 -9.896 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -10.726 -8.466 -10.733 1.00 0.00 H new ATOM 644 N THR A 43 -13.233 -4.633 -11.070 1.00 0.00 N ATOM 645 CA THR A 43 -14.617 -4.450 -11.635 1.00 0.00 C ATOM 646 C THR A 43 -14.633 -3.823 -13.030 1.00 0.00 C ATOM 647 O THR A 43 -13.675 -3.889 -13.775 1.00 0.00 O ATOM 648 CB THR A 43 -15.430 -3.568 -10.671 1.00 0.00 C ATOM 649 OG1 THR A 43 -15.101 -2.203 -10.892 1.00 0.00 O ATOM 650 CG2 THR A 43 -15.114 -3.939 -9.219 1.00 0.00 C ATOM 0 H THR A 43 -12.987 -3.970 -10.335 1.00 0.00 H new ATOM 0 HA THR A 43 -15.055 -5.443 -11.738 1.00 0.00 H new ATOM 0 HB THR A 43 -16.493 -3.727 -10.854 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.619 -1.639 -10.281 1.00 0.00 H new ATOM 0 HG21 THR A 43 -15.696 -3.308 -8.547 1.00 0.00 H new ATOM 0 HG22 THR A 43 -15.370 -4.984 -9.047 1.00 0.00 H new ATOM 0 HG23 THR A 43 -14.051 -3.789 -9.028 1.00 0.00 H new ATOM 658 N ARG A 44 -15.763 -3.251 -13.396 1.00 0.00 N ATOM 659 CA ARG A 44 -15.922 -2.642 -14.747 1.00 0.00 C ATOM 660 C ARG A 44 -14.706 -1.782 -15.092 1.00 0.00 C ATOM 661 O ARG A 44 -13.955 -2.105 -15.992 1.00 0.00 O ATOM 662 CB ARG A 44 -17.202 -1.791 -14.800 1.00 0.00 C ATOM 663 CG ARG A 44 -17.402 -1.025 -13.485 1.00 0.00 C ATOM 664 CD ARG A 44 -18.742 -1.421 -12.863 1.00 0.00 C ATOM 665 NE ARG A 44 -18.718 -1.120 -11.404 1.00 0.00 N ATOM 666 CZ ARG A 44 -19.486 -0.184 -10.918 1.00 0.00 C ATOM 667 NH1 ARG A 44 -19.403 1.033 -11.380 1.00 0.00 N ATOM 668 NH2 ARG A 44 -20.332 -0.463 -9.965 1.00 0.00 N ATOM 0 H ARG A 44 -16.589 -3.184 -12.801 1.00 0.00 H new ATOM 0 HA ARG A 44 -16.001 -3.444 -15.480 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -17.142 -1.087 -15.630 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -18.063 -2.433 -14.987 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -16.588 -1.248 -12.795 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -17.378 0.049 -13.670 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -19.554 -0.877 -13.345 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -18.931 -2.482 -13.024 1.00 0.00 H new ATOM 0 HE ARG A 44 -18.101 -1.646 -10.785 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -18.738 1.253 -12.121 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -20.003 1.765 -11.000 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -20.393 -1.413 -9.599 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -20.932 0.269 -9.585 1.00 0.00 H new ATOM 682 N LYS A 45 -14.467 -0.713 -14.369 1.00 0.00 N ATOM 683 CA LYS A 45 -13.251 0.110 -14.665 1.00 0.00 C ATOM 684 C LYS A 45 -12.058 -0.843 -14.608 1.00 0.00 C ATOM 685 O LYS A 45 -11.078 -0.705 -15.315 1.00 0.00 O ATOM 686 CB LYS A 45 -13.094 1.218 -13.621 1.00 0.00 C ATOM 687 CG LYS A 45 -13.389 2.574 -14.267 1.00 0.00 C ATOM 688 CD LYS A 45 -14.655 3.169 -13.647 1.00 0.00 C ATOM 689 CE LYS A 45 -15.883 2.651 -14.399 1.00 0.00 C ATOM 690 NZ LYS A 45 -16.209 3.579 -15.519 1.00 0.00 N ATOM 0 H LYS A 45 -15.049 -0.379 -13.601 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.327 0.588 -15.641 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.774 1.045 -12.787 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -12.082 1.209 -13.215 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -12.547 3.250 -14.120 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -13.519 2.456 -15.343 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -14.719 2.897 -12.593 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -14.619 4.257 -13.694 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -15.690 1.651 -14.786 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -16.732 2.572 -13.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -17.044 3.227 -16.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -16.410 4.526 -15.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -15.401 3.633 -16.171 1.00 0.00 H new ATOM 704 N ASN A 46 -12.191 -1.844 -13.783 1.00 0.00 N ATOM 705 CA ASN A 46 -11.157 -2.889 -13.647 1.00 0.00 C ATOM 706 C ASN A 46 -9.935 -2.368 -12.937 1.00 0.00 C ATOM 707 O ASN A 46 -8.959 -3.080 -12.796 1.00 0.00 O ATOM 708 CB ASN A 46 -10.773 -3.427 -15.027 1.00 0.00 C ATOM 709 CG ASN A 46 -11.232 -4.880 -15.161 1.00 0.00 C ATOM 710 OD1 ASN A 46 -11.334 -5.589 -14.182 1.00 0.00 O ATOM 711 ND2 ASN A 46 -11.514 -5.356 -16.344 1.00 0.00 N ATOM 0 H ASN A 46 -13.003 -1.978 -13.181 1.00 0.00 H new ATOM 0 HA ASN A 46 -11.573 -3.697 -13.046 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -11.231 -2.818 -15.806 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -9.694 -3.362 -15.166 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -11.820 -6.324 -16.445 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -11.428 -4.760 -17.167 1.00 0.00 H new ATOM 718 N ARG A 47 -9.978 -1.177 -12.399 1.00 0.00 N ATOM 719 CA ARG A 47 -8.804 -0.722 -11.608 1.00 0.00 C ATOM 720 C ARG A 47 -8.682 -1.761 -10.505 1.00 0.00 C ATOM 721 O ARG A 47 -9.595 -2.546 -10.327 1.00 0.00 O ATOM 722 CB ARG A 47 -9.053 0.668 -11.019 1.00 0.00 C ATOM 723 CG ARG A 47 -9.376 1.650 -12.148 1.00 0.00 C ATOM 724 CD ARG A 47 -8.432 2.852 -12.066 1.00 0.00 C ATOM 725 NE ARG A 47 -9.228 4.111 -12.106 1.00 0.00 N ATOM 726 CZ ARG A 47 -8.791 5.179 -11.496 1.00 0.00 C ATOM 727 NH1 ARG A 47 -8.807 5.236 -10.192 1.00 0.00 N ATOM 728 NH2 ARG A 47 -8.338 6.187 -12.188 1.00 0.00 N ATOM 0 H ARG A 47 -10.753 -0.518 -12.471 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.898 -0.638 -12.209 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -9.878 0.631 -10.308 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -8.174 1.005 -10.470 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.271 1.157 -13.114 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.411 1.982 -12.071 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -7.848 2.807 -11.147 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.724 2.830 -12.895 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.114 4.138 -12.610 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -9.161 4.447 -9.651 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.466 6.070 -9.714 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.325 6.141 -13.207 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.997 7.021 -11.710 1.00 0.00 H new ATOM 742 N GLN A 48 -7.608 -1.836 -9.795 1.00 0.00 N ATOM 743 CA GLN A 48 -7.546 -2.893 -8.772 1.00 0.00 C ATOM 744 C GLN A 48 -8.186 -2.371 -7.504 1.00 0.00 C ATOM 745 O GLN A 48 -7.542 -1.981 -6.556 1.00 0.00 O ATOM 746 CB GLN A 48 -6.113 -3.354 -8.586 1.00 0.00 C ATOM 747 CG GLN A 48 -5.940 -4.589 -9.470 1.00 0.00 C ATOM 748 CD GLN A 48 -4.486 -5.067 -9.430 1.00 0.00 C ATOM 749 OE1 GLN A 48 -3.579 -4.311 -9.715 1.00 0.00 O ATOM 750 NE2 GLN A 48 -4.226 -6.301 -9.093 1.00 0.00 N ATOM 0 H GLN A 48 -6.791 -1.230 -9.873 1.00 0.00 H new ATOM 0 HA GLN A 48 -8.104 -3.776 -9.081 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -5.412 -2.570 -8.873 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -5.914 -3.593 -7.541 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.602 -5.385 -9.129 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.225 -4.354 -10.495 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -4.988 -6.936 -8.854 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -3.261 -6.631 -9.069 1.00 0.00 H new ATOM 759 N VAL A 49 -9.483 -2.360 -7.527 1.00 0.00 N ATOM 760 CA VAL A 49 -10.282 -1.860 -6.385 1.00 0.00 C ATOM 761 C VAL A 49 -10.017 -2.735 -5.161 1.00 0.00 C ATOM 762 O VAL A 49 -9.548 -3.847 -5.269 1.00 0.00 O ATOM 763 CB VAL A 49 -11.788 -1.889 -6.721 1.00 0.00 C ATOM 764 CG1 VAL A 49 -12.441 -0.657 -6.102 1.00 0.00 C ATOM 765 CG2 VAL A 49 -12.052 -1.872 -8.251 1.00 0.00 C ATOM 0 H VAL A 49 -10.039 -2.688 -8.317 1.00 0.00 H new ATOM 0 HA VAL A 49 -9.991 -0.830 -6.177 1.00 0.00 H new ATOM 0 HB VAL A 49 -12.205 -2.813 -6.321 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -13.507 -0.658 -6.328 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.299 -0.674 -5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -11.984 0.243 -6.514 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -13.126 -1.894 -8.435 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.628 -0.966 -8.683 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -11.588 -2.745 -8.710 1.00 0.00 H new ATOM 775 N CYS A 50 -10.307 -2.235 -3.996 1.00 0.00 N ATOM 776 CA CYS A 50 -10.065 -3.024 -2.759 1.00 0.00 C ATOM 777 C CYS A 50 -11.404 -3.411 -2.127 1.00 0.00 C ATOM 778 O CYS A 50 -12.447 -2.942 -2.537 1.00 0.00 O ATOM 779 CB CYS A 50 -9.288 -2.152 -1.780 1.00 0.00 C ATOM 780 SG CYS A 50 -8.397 -3.186 -0.602 1.00 0.00 S ATOM 0 H CYS A 50 -10.704 -1.308 -3.846 1.00 0.00 H new ATOM 0 HA CYS A 50 -9.504 -3.928 -2.997 1.00 0.00 H new ATOM 0 HB2 CYS A 50 -8.587 -1.518 -2.323 1.00 0.00 H new ATOM 0 HB3 CYS A 50 -9.972 -1.489 -1.250 1.00 0.00 H new ATOM 785 N ALA A 51 -11.391 -4.256 -1.127 1.00 0.00 N ATOM 786 CA ALA A 51 -12.678 -4.645 -0.486 1.00 0.00 C ATOM 787 C ALA A 51 -12.452 -5.361 0.842 1.00 0.00 C ATOM 788 O ALA A 51 -13.317 -6.060 1.317 1.00 0.00 O ATOM 789 CB ALA A 51 -13.454 -5.563 -1.433 1.00 0.00 C ATOM 0 H ALA A 51 -10.555 -4.687 -0.733 1.00 0.00 H new ATOM 0 HA ALA A 51 -13.246 -3.737 -0.285 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -14.397 -5.851 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -13.655 -5.037 -2.366 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -12.864 -6.456 -1.639 1.00 0.00 H new ATOM 795 N ASN A 52 -11.325 -5.164 1.471 1.00 0.00 N ATOM 796 CA ASN A 52 -11.087 -5.810 2.797 1.00 0.00 C ATOM 797 C ASN A 52 -10.991 -7.339 2.659 1.00 0.00 C ATOM 798 O ASN A 52 -11.734 -7.929 1.899 1.00 0.00 O ATOM 799 CB ASN A 52 -12.262 -5.486 3.718 1.00 0.00 C ATOM 800 CG ASN A 52 -11.914 -5.873 5.157 1.00 0.00 C ATOM 801 OD1 ASN A 52 -12.439 -6.832 5.684 1.00 0.00 O ATOM 802 ND2 ASN A 52 -11.047 -5.158 5.820 1.00 0.00 N ATOM 0 H ASN A 52 -10.559 -4.585 1.126 1.00 0.00 H new ATOM 0 HA ASN A 52 -10.149 -5.431 3.203 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -12.496 -4.423 3.664 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -13.151 -6.025 3.392 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -10.811 -5.405 6.781 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -10.606 -4.352 5.377 1.00 0.00 H new ATOM 809 N PRO A 53 -10.089 -7.949 3.409 1.00 0.00 N ATOM 810 CA PRO A 53 -9.913 -9.409 3.383 1.00 0.00 C ATOM 811 C PRO A 53 -10.946 -10.095 4.287 1.00 0.00 C ATOM 812 O PRO A 53 -11.549 -11.083 3.921 1.00 0.00 O ATOM 813 CB PRO A 53 -8.517 -9.625 3.975 1.00 0.00 C ATOM 814 CG PRO A 53 -8.146 -8.330 4.745 1.00 0.00 C ATOM 815 CD PRO A 53 -9.157 -7.249 4.326 1.00 0.00 C ATOM 0 HA PRO A 53 -10.033 -9.818 2.380 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.510 -10.486 4.643 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -7.791 -9.827 3.187 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -8.185 -8.497 5.821 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.129 -8.019 4.508 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.682 -6.840 5.189 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -8.663 -6.414 3.829 1.00 0.00 H new ATOM 823 N GLU A 54 -11.125 -9.588 5.482 1.00 0.00 N ATOM 824 CA GLU A 54 -12.086 -10.221 6.436 1.00 0.00 C ATOM 825 C GLU A 54 -13.431 -9.488 6.432 1.00 0.00 C ATOM 826 O GLU A 54 -14.028 -9.272 7.468 1.00 0.00 O ATOM 827 CB GLU A 54 -11.494 -10.167 7.847 1.00 0.00 C ATOM 828 CG GLU A 54 -12.125 -11.261 8.709 1.00 0.00 C ATOM 829 CD GLU A 54 -11.058 -12.292 9.084 1.00 0.00 C ATOM 830 OE1 GLU A 54 -10.175 -12.522 8.274 1.00 0.00 O ATOM 831 OE2 GLU A 54 -11.140 -12.832 10.175 1.00 0.00 O ATOM 0 H GLU A 54 -10.646 -8.761 5.838 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.253 -11.253 6.127 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.413 -10.301 7.804 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.676 -9.189 8.292 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -12.558 -10.825 9.610 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -12.938 -11.744 8.166 1.00 0.00 H new ATOM 838 N LYS A 55 -13.924 -9.116 5.285 1.00 0.00 N ATOM 839 CA LYS A 55 -15.242 -8.418 5.241 1.00 0.00 C ATOM 840 C LYS A 55 -16.352 -9.448 4.989 1.00 0.00 C ATOM 841 O LYS A 55 -17.436 -9.111 4.562 1.00 0.00 O ATOM 842 CB LYS A 55 -15.242 -7.372 4.122 1.00 0.00 C ATOM 843 CG LYS A 55 -15.159 -5.970 4.733 1.00 0.00 C ATOM 844 CD LYS A 55 -16.550 -5.528 5.189 1.00 0.00 C ATOM 845 CE LYS A 55 -16.426 -4.703 6.472 1.00 0.00 C ATOM 846 NZ LYS A 55 -17.763 -4.589 7.118 1.00 0.00 N ATOM 0 H LYS A 55 -13.476 -9.263 4.380 1.00 0.00 H new ATOM 0 HA LYS A 55 -15.418 -7.917 6.193 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -14.398 -7.539 3.453 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -16.147 -7.466 3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.471 -5.971 5.578 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -14.764 -5.266 4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -17.030 -4.937 4.409 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -17.182 -6.399 5.363 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -15.719 -5.175 7.154 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -16.035 -3.712 6.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -17.680 -4.029 7.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -18.424 -4.120 6.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -18.119 -5.538 7.349 1.00 0.00 H new ATOM 860 N LYS A 56 -16.084 -10.702 5.263 1.00 0.00 N ATOM 861 CA LYS A 56 -17.112 -11.766 5.058 1.00 0.00 C ATOM 862 C LYS A 56 -17.505 -11.860 3.574 1.00 0.00 C ATOM 863 O LYS A 56 -16.951 -12.639 2.829 1.00 0.00 O ATOM 864 CB LYS A 56 -18.347 -11.456 5.916 1.00 0.00 C ATOM 865 CG LYS A 56 -19.433 -12.504 5.657 1.00 0.00 C ATOM 866 CD LYS A 56 -19.724 -13.269 6.950 1.00 0.00 C ATOM 867 CE LYS A 56 -20.099 -14.714 6.616 1.00 0.00 C ATOM 868 NZ LYS A 56 -21.342 -14.727 5.792 1.00 0.00 N ATOM 0 H LYS A 56 -15.189 -11.035 5.623 1.00 0.00 H new ATOM 0 HA LYS A 56 -16.694 -12.726 5.360 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -18.076 -11.452 6.972 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -18.725 -10.461 5.680 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -20.341 -12.021 5.296 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -19.108 -13.195 4.879 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -18.850 -13.250 7.600 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -20.537 -12.788 7.494 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -19.285 -15.196 6.074 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -20.252 -15.283 7.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -21.692 -15.703 5.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -22.067 -14.138 6.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -21.135 -14.350 4.845 1.00 0.00 H new ATOM 882 N TRP A 57 -18.468 -11.089 3.146 1.00 0.00 N ATOM 883 CA TRP A 57 -18.913 -11.146 1.719 1.00 0.00 C ATOM 884 C TRP A 57 -17.715 -11.165 0.753 1.00 0.00 C ATOM 885 O TRP A 57 -17.776 -11.777 -0.293 1.00 0.00 O ATOM 886 CB TRP A 57 -19.812 -9.941 1.436 1.00 0.00 C ATOM 887 CG TRP A 57 -19.026 -8.698 1.552 1.00 0.00 C ATOM 888 CD1 TRP A 57 -19.053 -7.820 2.575 1.00 0.00 C ATOM 889 CD2 TRP A 57 -18.184 -8.136 0.544 1.00 0.00 C ATOM 890 NE1 TRP A 57 -18.212 -6.762 2.269 1.00 0.00 N ATOM 891 CE2 TRP A 57 -17.659 -6.907 1.014 1.00 0.00 C ATOM 892 CE3 TRP A 57 -17.824 -8.589 -0.736 1.00 0.00 C ATOM 893 CZ2 TRP A 57 -16.792 -6.139 0.221 1.00 0.00 C ATOM 894 CZ3 TRP A 57 -16.982 -7.825 -1.546 1.00 0.00 C ATOM 895 CH2 TRP A 57 -16.466 -6.595 -1.076 1.00 0.00 C ATOM 0 H TRP A 57 -18.970 -10.417 3.726 1.00 0.00 H new ATOM 0 HA TRP A 57 -19.468 -12.070 1.558 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -20.240 -10.021 0.437 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -20.645 -9.923 2.139 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -19.633 -7.924 3.480 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -18.026 -5.976 2.892 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -18.201 -9.535 -1.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -16.380 -5.214 0.596 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -16.724 -8.174 -2.535 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -15.822 -6.003 -1.709 1.00 0.00 H new ATOM 906 N VAL A 58 -16.636 -10.509 1.077 1.00 0.00 N ATOM 907 CA VAL A 58 -15.463 -10.510 0.137 1.00 0.00 C ATOM 908 C VAL A 58 -15.036 -11.940 -0.198 1.00 0.00 C ATOM 909 O VAL A 58 -14.800 -12.259 -1.342 1.00 0.00 O ATOM 910 CB VAL A 58 -14.255 -9.785 0.729 1.00 0.00 C ATOM 911 CG1 VAL A 58 -14.297 -8.318 0.330 1.00 0.00 C ATOM 912 CG2 VAL A 58 -14.232 -9.916 2.239 1.00 0.00 C ATOM 0 H VAL A 58 -16.509 -9.977 1.938 1.00 0.00 H new ATOM 0 HA VAL A 58 -15.791 -9.989 -0.762 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.346 -10.242 0.337 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -13.435 -7.801 0.752 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -14.273 -8.236 -0.757 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -15.213 -7.864 0.708 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -13.363 -9.392 2.636 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -15.140 -9.481 2.656 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.176 -10.970 2.512 1.00 0.00 H new ATOM 922 N ARG A 59 -14.907 -12.799 0.780 1.00 0.00 N ATOM 923 CA ARG A 59 -14.479 -14.195 0.474 1.00 0.00 C ATOM 924 C ARG A 59 -15.596 -14.884 -0.309 1.00 0.00 C ATOM 925 O ARG A 59 -15.351 -15.706 -1.168 1.00 0.00 O ATOM 926 CB ARG A 59 -14.194 -14.967 1.766 1.00 0.00 C ATOM 927 CG ARG A 59 -15.321 -14.739 2.773 1.00 0.00 C ATOM 928 CD ARG A 59 -15.326 -15.872 3.802 1.00 0.00 C ATOM 929 NE ARG A 59 -16.398 -16.850 3.463 1.00 0.00 N ATOM 930 CZ ARG A 59 -16.852 -17.663 4.378 1.00 0.00 C ATOM 931 NH1 ARG A 59 -17.065 -17.229 5.589 1.00 0.00 N ATOM 932 NH2 ARG A 59 -17.090 -18.912 4.080 1.00 0.00 N ATOM 0 H ARG A 59 -15.077 -12.597 1.765 1.00 0.00 H new ATOM 0 HA ARG A 59 -13.563 -14.174 -0.116 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -14.099 -16.031 1.550 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -13.244 -14.642 2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -15.187 -13.780 3.273 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -16.280 -14.698 2.257 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -14.356 -16.370 3.815 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.490 -15.469 4.801 1.00 0.00 H new ATOM 0 HE ARG A 59 -16.777 -16.884 2.517 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.877 -16.254 5.822 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -17.420 -17.865 6.304 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -16.921 -19.251 3.133 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -17.445 -19.548 4.794 1.00 0.00 H new ATOM 946 N GLU A 60 -16.823 -14.530 -0.036 1.00 0.00 N ATOM 947 CA GLU A 60 -17.956 -15.139 -0.788 1.00 0.00 C ATOM 948 C GLU A 60 -17.887 -14.660 -2.242 1.00 0.00 C ATOM 949 O GLU A 60 -18.492 -15.228 -3.128 1.00 0.00 O ATOM 950 CB GLU A 60 -19.283 -14.697 -0.168 1.00 0.00 C ATOM 951 CG GLU A 60 -19.731 -15.724 0.874 1.00 0.00 C ATOM 952 CD GLU A 60 -21.259 -15.738 0.957 1.00 0.00 C ATOM 953 OE1 GLU A 60 -21.807 -14.846 1.582 1.00 0.00 O ATOM 954 OE2 GLU A 60 -21.854 -16.641 0.393 1.00 0.00 O ATOM 0 H GLU A 60 -17.089 -13.847 0.674 1.00 0.00 H new ATOM 0 HA GLU A 60 -17.889 -16.226 -0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -19.170 -13.718 0.297 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -20.042 -14.596 -0.943 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -19.362 -16.714 0.606 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -19.306 -15.479 1.847 1.00 0.00 H new ATOM 961 N TYR A 61 -17.138 -13.617 -2.484 1.00 0.00 N ATOM 962 CA TYR A 61 -16.996 -13.081 -3.859 1.00 0.00 C ATOM 963 C TYR A 61 -15.759 -13.710 -4.494 1.00 0.00 C ATOM 964 O TYR A 61 -15.682 -13.897 -5.692 1.00 0.00 O ATOM 965 CB TYR A 61 -16.823 -11.561 -3.780 1.00 0.00 C ATOM 966 CG TYR A 61 -18.145 -10.891 -4.057 1.00 0.00 C ATOM 967 CD1 TYR A 61 -19.086 -10.747 -3.015 1.00 0.00 C ATOM 968 CD2 TYR A 61 -18.442 -10.410 -5.349 1.00 0.00 C ATOM 969 CE1 TYR A 61 -20.325 -10.122 -3.263 1.00 0.00 C ATOM 970 CE2 TYR A 61 -19.684 -9.785 -5.598 1.00 0.00 C ATOM 971 CZ TYR A 61 -20.626 -9.640 -4.556 1.00 0.00 C ATOM 972 OH TYR A 61 -21.836 -9.023 -4.799 1.00 0.00 O ATOM 0 H TYR A 61 -16.612 -13.110 -1.772 1.00 0.00 H new ATOM 0 HA TYR A 61 -17.877 -13.314 -4.458 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -16.458 -11.276 -2.793 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -16.077 -11.231 -4.503 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -18.857 -11.116 -2.026 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -17.722 -10.519 -6.146 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -21.044 -10.012 -2.465 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.914 -9.417 -6.587 1.00 0.00 H new ATOM 0 HH TYR A 61 -22.146 -8.578 -3.983 1.00 0.00 H new ATOM 982 N ILE A 62 -14.792 -14.045 -3.685 1.00 0.00 N ATOM 983 CA ILE A 62 -13.553 -14.671 -4.215 1.00 0.00 C ATOM 984 C ILE A 62 -13.900 -16.020 -4.857 1.00 0.00 C ATOM 985 O ILE A 62 -13.407 -16.358 -5.914 1.00 0.00 O ATOM 986 CB ILE A 62 -12.573 -14.876 -3.055 1.00 0.00 C ATOM 987 CG1 ILE A 62 -12.114 -13.513 -2.534 1.00 0.00 C ATOM 988 CG2 ILE A 62 -11.360 -15.671 -3.533 1.00 0.00 C ATOM 989 CD1 ILE A 62 -11.322 -13.700 -1.238 1.00 0.00 C ATOM 0 H ILE A 62 -14.809 -13.910 -2.674 1.00 0.00 H new ATOM 0 HA ILE A 62 -13.097 -14.029 -4.969 1.00 0.00 H new ATOM 0 HB ILE A 62 -13.070 -15.427 -2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -11.496 -13.016 -3.282 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -12.977 -12.871 -2.356 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -10.668 -15.813 -2.703 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -11.685 -16.643 -3.904 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -10.860 -15.126 -4.333 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -10.995 -12.728 -0.868 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -11.955 -14.179 -0.491 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -10.451 -14.326 -1.431 1.00 0.00 H new ATOM 1001 N ASN A 63 -14.741 -16.791 -4.224 1.00 0.00 N ATOM 1002 CA ASN A 63 -15.114 -18.115 -4.798 1.00 0.00 C ATOM 1003 C ASN A 63 -16.303 -17.947 -5.747 1.00 0.00 C ATOM 1004 O ASN A 63 -16.423 -18.642 -6.735 1.00 0.00 O ATOM 1005 CB ASN A 63 -15.496 -19.072 -3.667 1.00 0.00 C ATOM 1006 CG ASN A 63 -14.685 -20.363 -3.793 1.00 0.00 C ATOM 1007 OD1 ASN A 63 -13.471 -20.333 -3.806 1.00 0.00 O ATOM 1008 ND2 ASN A 63 -15.310 -21.505 -3.884 1.00 0.00 N ATOM 0 H ASN A 63 -15.186 -16.562 -3.335 1.00 0.00 H new ATOM 0 HA ASN A 63 -14.266 -18.522 -5.349 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -15.306 -18.604 -2.701 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -16.562 -19.294 -3.709 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -14.779 -22.372 -3.966 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -16.330 -21.531 -3.873 1.00 0.00 H new ATOM 1015 N SER A 64 -17.183 -17.029 -5.454 1.00 0.00 N ATOM 1016 CA SER A 64 -18.362 -16.819 -6.339 1.00 0.00 C ATOM 1017 C SER A 64 -17.885 -16.446 -7.745 1.00 0.00 C ATOM 1018 O SER A 64 -18.574 -16.663 -8.723 1.00 0.00 O ATOM 1019 CB SER A 64 -19.226 -15.688 -5.778 1.00 0.00 C ATOM 1020 OG SER A 64 -20.258 -15.377 -6.703 1.00 0.00 O ATOM 0 H SER A 64 -17.136 -16.416 -4.640 1.00 0.00 H new ATOM 0 HA SER A 64 -18.949 -17.736 -6.385 1.00 0.00 H new ATOM 0 HB2 SER A 64 -19.657 -15.985 -4.822 1.00 0.00 H new ATOM 0 HB3 SER A 64 -18.613 -14.806 -5.591 1.00 0.00 H new ATOM 0 HG SER A 64 -20.813 -14.654 -6.343 1.00 0.00 H new ATOM 1026 N LEU A 65 -16.711 -15.887 -7.855 1.00 0.00 N ATOM 1027 CA LEU A 65 -16.192 -15.501 -9.197 1.00 0.00 C ATOM 1028 C LEU A 65 -15.685 -16.747 -9.925 1.00 0.00 C ATOM 1029 O LEU A 65 -16.349 -17.289 -10.786 1.00 0.00 O ATOM 1030 CB LEU A 65 -15.044 -14.504 -9.033 1.00 0.00 C ATOM 1031 CG LEU A 65 -15.613 -13.105 -8.781 1.00 0.00 C ATOM 1032 CD1 LEU A 65 -14.538 -12.227 -8.137 1.00 0.00 C ATOM 1033 CD2 LEU A 65 -16.048 -12.486 -10.111 1.00 0.00 C ATOM 0 H LEU A 65 -16.089 -15.681 -7.073 1.00 0.00 H new ATOM 0 HA LEU A 65 -16.992 -15.041 -9.777 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -14.405 -14.803 -8.202 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -14.422 -14.499 -9.928 1.00 0.00 H new ATOM 0 HG LEU A 65 -16.472 -13.175 -8.114 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -14.942 -11.231 -7.957 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -14.226 -12.669 -7.190 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -13.679 -12.155 -8.804 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -16.453 -11.490 -9.933 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -15.188 -12.414 -10.777 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -16.813 -13.112 -10.571 1.00 0.00 H new ATOM 1147 N SER B 5 -10.528 3.479 -3.140 1.00 0.00 N ATOM 1148 CA SER B 5 -10.037 2.184 -2.591 1.00 0.00 C ATOM 1149 C SER B 5 -9.623 1.268 -3.745 1.00 0.00 C ATOM 1150 O SER B 5 -10.448 0.792 -4.499 1.00 0.00 O ATOM 1151 CB SER B 5 -11.152 1.515 -1.785 1.00 0.00 C ATOM 1152 OG SER B 5 -11.690 2.449 -0.859 1.00 0.00 O ATOM 0 HA SER B 5 -9.180 2.365 -1.943 1.00 0.00 H new ATOM 0 HB2 SER B 5 -11.935 1.157 -2.454 1.00 0.00 H new ATOM 0 HB3 SER B 5 -10.762 0.645 -1.256 1.00 0.00 H new ATOM 0 HG SER B 5 -11.626 3.353 -1.232 1.00 0.00 H new ATOM 1158 N ASP B 6 -8.350 1.022 -3.893 1.00 0.00 N ATOM 1159 CA ASP B 6 -7.885 0.144 -5.003 1.00 0.00 C ATOM 1160 C ASP B 6 -6.432 -0.261 -4.756 1.00 0.00 C ATOM 1161 O ASP B 6 -5.999 -0.378 -3.627 1.00 0.00 O ATOM 1162 CB ASP B 6 -8.015 0.900 -6.330 1.00 0.00 C ATOM 1163 CG ASP B 6 -7.053 2.092 -6.345 1.00 0.00 C ATOM 1164 OD1 ASP B 6 -5.885 1.881 -6.623 1.00 0.00 O ATOM 1165 OD2 ASP B 6 -7.504 3.195 -6.082 1.00 0.00 O ATOM 0 H ASP B 6 -7.612 1.391 -3.293 1.00 0.00 H new ATOM 0 HA ASP B 6 -8.496 -0.758 -5.048 1.00 0.00 H new ATOM 0 HB2 ASP B 6 -7.794 0.232 -7.163 1.00 0.00 H new ATOM 0 HB3 ASP B 6 -9.040 1.246 -6.463 1.00 0.00 H new ATOM 1170 N THR B 7 -5.679 -0.499 -5.795 1.00 0.00 N ATOM 1171 CA THR B 7 -4.273 -0.916 -5.595 1.00 0.00 C ATOM 1172 C THR B 7 -3.425 0.294 -5.209 1.00 0.00 C ATOM 1173 O THR B 7 -3.895 1.414 -5.186 1.00 0.00 O ATOM 1174 CB THR B 7 -3.736 -1.536 -6.888 1.00 0.00 C ATOM 1175 OG1 THR B 7 -2.413 -2.005 -6.675 1.00 0.00 O ATOM 1176 CG2 THR B 7 -3.732 -0.484 -8.000 1.00 0.00 C ATOM 0 H THR B 7 -5.979 -0.422 -6.767 1.00 0.00 H new ATOM 0 HA THR B 7 -4.225 -1.654 -4.794 1.00 0.00 H new ATOM 0 HB THR B 7 -4.375 -2.369 -7.181 1.00 0.00 H new ATOM 0 HG1 THR B 7 -2.070 -2.403 -7.502 1.00 0.00 H new ATOM 0 HG21 THR B 7 -3.349 -0.928 -8.919 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.748 -0.126 -8.166 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.096 0.351 -7.708 1.00 0.00 H new ATOM 1184 N THR B 8 -2.176 0.078 -4.906 1.00 0.00 N ATOM 1185 CA THR B 8 -1.297 1.215 -4.524 1.00 0.00 C ATOM 1186 C THR B 8 0.168 0.830 -4.770 1.00 0.00 C ATOM 1187 O THR B 8 0.740 0.088 -3.997 1.00 0.00 O ATOM 1188 CB THR B 8 -1.497 1.538 -3.041 1.00 0.00 C ATOM 1189 OG1 THR B 8 -2.677 0.901 -2.572 1.00 0.00 O ATOM 1190 CG2 THR B 8 -1.624 3.053 -2.861 1.00 0.00 C ATOM 0 H THR B 8 -1.726 -0.838 -4.907 1.00 0.00 H new ATOM 0 HA THR B 8 -1.550 2.089 -5.123 1.00 0.00 H new ATOM 0 HB THR B 8 -0.641 1.177 -2.471 1.00 0.00 H new ATOM 0 HG1 THR B 8 -2.469 -0.020 -2.310 1.00 0.00 H new ATOM 0 HG21 THR B 8 -1.766 3.283 -1.805 1.00 0.00 H new ATOM 0 HG22 THR B 8 -0.717 3.539 -3.219 1.00 0.00 H new ATOM 0 HG23 THR B 8 -2.479 3.417 -3.430 1.00 0.00 H new ATOM 1198 N PRO B 9 0.740 1.347 -5.838 1.00 0.00 N ATOM 1199 CA PRO B 9 2.141 1.061 -6.182 1.00 0.00 C ATOM 1200 C PRO B 9 3.050 1.456 -5.018 1.00 0.00 C ATOM 1201 O PRO B 9 3.532 2.567 -4.943 1.00 0.00 O ATOM 1202 CB PRO B 9 2.425 1.933 -7.415 1.00 0.00 C ATOM 1203 CG PRO B 9 1.106 2.658 -7.792 1.00 0.00 C ATOM 1204 CD PRO B 9 0.046 2.253 -6.776 1.00 0.00 C ATOM 0 HA PRO B 9 2.320 0.005 -6.382 1.00 0.00 H new ATOM 0 HB2 PRO B 9 3.211 2.656 -7.199 1.00 0.00 H new ATOM 0 HB3 PRO B 9 2.775 1.320 -8.245 1.00 0.00 H new ATOM 0 HG2 PRO B 9 1.249 3.739 -7.785 1.00 0.00 H new ATOM 0 HG3 PRO B 9 0.794 2.384 -8.800 1.00 0.00 H new ATOM 0 HD2 PRO B 9 -0.357 3.123 -6.258 1.00 0.00 H new ATOM 0 HD3 PRO B 9 -0.793 1.753 -7.260 1.00 0.00 H new ATOM 1212 N CYS B 10 3.276 0.555 -4.102 1.00 0.00 N ATOM 1213 CA CYS B 10 4.142 0.884 -2.938 1.00 0.00 C ATOM 1214 C CYS B 10 5.140 -0.238 -2.697 1.00 0.00 C ATOM 1215 O CYS B 10 4.909 -1.381 -3.037 1.00 0.00 O ATOM 1216 CB CYS B 10 3.275 1.070 -1.692 1.00 0.00 C ATOM 1217 SG CYS B 10 2.443 2.675 -1.763 1.00 0.00 S ATOM 0 H CYS B 10 2.899 -0.393 -4.110 1.00 0.00 H new ATOM 0 HA CYS B 10 4.685 1.806 -3.148 1.00 0.00 H new ATOM 0 HB2 CYS B 10 2.538 0.270 -1.627 1.00 0.00 H new ATOM 0 HB3 CYS B 10 3.892 1.008 -0.795 1.00 0.00 H new ATOM 1222 N CYS B 11 6.253 0.090 -2.114 1.00 0.00 N ATOM 1223 CA CYS B 11 7.281 -0.941 -1.845 1.00 0.00 C ATOM 1224 C CYS B 11 7.119 -1.418 -0.389 1.00 0.00 C ATOM 1225 O CYS B 11 6.786 -0.649 0.490 1.00 0.00 O ATOM 1226 CB CYS B 11 8.673 -0.324 -2.139 1.00 0.00 C ATOM 1227 SG CYS B 11 9.905 -0.672 -0.854 1.00 0.00 S ATOM 0 H CYS B 11 6.495 1.033 -1.811 1.00 0.00 H new ATOM 0 HA CYS B 11 7.171 -1.816 -2.485 1.00 0.00 H new ATOM 0 HB2 CYS B 11 9.037 -0.706 -3.093 1.00 0.00 H new ATOM 0 HB3 CYS B 11 8.568 0.755 -2.247 1.00 0.00 H new ATOM 1232 N PHE B 12 7.343 -2.681 -0.129 1.00 0.00 N ATOM 1233 CA PHE B 12 7.191 -3.187 1.266 1.00 0.00 C ATOM 1234 C PHE B 12 8.561 -3.242 1.949 1.00 0.00 C ATOM 1235 O PHE B 12 8.721 -2.812 3.073 1.00 0.00 O ATOM 1236 CB PHE B 12 6.554 -4.586 1.246 1.00 0.00 C ATOM 1237 CG PHE B 12 7.504 -5.594 0.638 1.00 0.00 C ATOM 1238 CD1 PHE B 12 7.485 -5.834 -0.754 1.00 0.00 C ATOM 1239 CD2 PHE B 12 8.401 -6.307 1.465 1.00 0.00 C ATOM 1240 CE1 PHE B 12 8.366 -6.784 -1.320 1.00 0.00 C ATOM 1241 CE2 PHE B 12 9.280 -7.258 0.899 1.00 0.00 C ATOM 1242 CZ PHE B 12 9.263 -7.495 -0.493 1.00 0.00 C ATOM 0 H PHE B 12 7.623 -3.379 -0.818 1.00 0.00 H new ATOM 0 HA PHE B 12 6.543 -2.512 1.825 1.00 0.00 H new ATOM 0 HB2 PHE B 12 6.295 -4.888 2.261 1.00 0.00 H new ATOM 0 HB3 PHE B 12 5.626 -4.561 0.674 1.00 0.00 H new ATOM 0 HD1 PHE B 12 6.797 -5.292 -1.386 1.00 0.00 H new ATOM 0 HD2 PHE B 12 8.415 -6.125 2.529 1.00 0.00 H new ATOM 0 HE1 PHE B 12 8.353 -6.966 -2.385 1.00 0.00 H new ATOM 0 HE2 PHE B 12 9.965 -7.804 1.531 1.00 0.00 H new ATOM 0 HZ PHE B 12 9.936 -8.220 -0.925 1.00 0.00 H new ATOM 1252 N ALA B 13 9.550 -3.767 1.279 1.00 0.00 N ATOM 1253 CA ALA B 13 10.906 -3.846 1.891 1.00 0.00 C ATOM 1254 C ALA B 13 11.927 -3.257 0.932 1.00 0.00 C ATOM 1255 O ALA B 13 11.847 -3.437 -0.267 1.00 0.00 O ATOM 1256 CB ALA B 13 11.255 -5.307 2.182 1.00 0.00 C ATOM 0 H ALA B 13 9.477 -4.145 0.334 1.00 0.00 H new ATOM 0 HA ALA B 13 10.917 -3.283 2.824 1.00 0.00 H new ATOM 0 HB1 ALA B 13 12.247 -5.362 2.630 1.00 0.00 H new ATOM 0 HB2 ALA B 13 10.522 -5.726 2.872 1.00 0.00 H new ATOM 0 HB3 ALA B 13 11.244 -5.876 1.252 1.00 0.00 H new ATOM 1262 N TYR B 14 12.886 -2.541 1.448 1.00 0.00 N ATOM 1263 CA TYR B 14 13.901 -1.934 0.549 1.00 0.00 C ATOM 1264 C TYR B 14 15.261 -2.606 0.758 1.00 0.00 C ATOM 1265 O TYR B 14 15.658 -2.899 1.868 1.00 0.00 O ATOM 1266 CB TYR B 14 14.031 -0.419 0.793 1.00 0.00 C ATOM 1267 CG TYR B 14 13.586 -0.065 2.190 1.00 0.00 C ATOM 1268 CD1 TYR B 14 12.210 -0.055 2.514 1.00 0.00 C ATOM 1269 CD2 TYR B 14 14.549 0.203 3.182 1.00 0.00 C ATOM 1270 CE1 TYR B 14 11.801 0.222 3.834 1.00 0.00 C ATOM 1271 CE2 TYR B 14 14.141 0.487 4.502 1.00 0.00 C ATOM 1272 CZ TYR B 14 12.765 0.494 4.831 1.00 0.00 C ATOM 1273 OH TYR B 14 12.365 0.764 6.123 1.00 0.00 O ATOM 0 H TYR B 14 13.009 -2.352 2.443 1.00 0.00 H new ATOM 0 HA TYR B 14 13.571 -2.090 -0.478 1.00 0.00 H new ATOM 0 HB2 TYR B 14 15.066 -0.109 0.646 1.00 0.00 H new ATOM 0 HB3 TYR B 14 13.429 0.125 0.065 1.00 0.00 H new ATOM 0 HD1 TYR B 14 11.473 -0.259 1.751 1.00 0.00 H new ATOM 0 HD2 TYR B 14 15.600 0.191 2.932 1.00 0.00 H new ATOM 0 HE1 TYR B 14 10.750 0.226 4.084 1.00 0.00 H new ATOM 0 HE2 TYR B 14 14.879 0.699 5.262 1.00 0.00 H new ATOM 0 HH TYR B 14 13.153 0.928 6.682 1.00 0.00 H new ATOM 1283 N ILE B 15 15.976 -2.845 -0.308 1.00 0.00 N ATOM 1284 CA ILE B 15 17.313 -3.491 -0.188 1.00 0.00 C ATOM 1285 C ILE B 15 18.300 -2.501 0.434 1.00 0.00 C ATOM 1286 O ILE B 15 18.051 -1.313 0.486 1.00 0.00 O ATOM 1287 CB ILE B 15 17.802 -3.896 -1.583 1.00 0.00 C ATOM 1288 CG1 ILE B 15 19.212 -4.485 -1.488 1.00 0.00 C ATOM 1289 CG2 ILE B 15 17.826 -2.664 -2.490 1.00 0.00 C ATOM 1290 CD1 ILE B 15 19.559 -5.194 -2.799 1.00 0.00 C ATOM 0 H ILE B 15 15.690 -2.619 -1.261 1.00 0.00 H new ATOM 0 HA ILE B 15 17.241 -4.375 0.445 1.00 0.00 H new ATOM 0 HB ILE B 15 17.127 -4.645 -1.998 1.00 0.00 H new ATOM 0 HG12 ILE B 15 19.935 -3.694 -1.288 1.00 0.00 H new ATOM 0 HG13 ILE B 15 19.269 -5.187 -0.656 1.00 0.00 H new ATOM 0 HG21 ILE B 15 18.174 -2.950 -3.483 1.00 0.00 H new ATOM 0 HG22 ILE B 15 16.822 -2.247 -2.563 1.00 0.00 H new ATOM 0 HG23 ILE B 15 18.500 -1.917 -2.071 1.00 0.00 H new ATOM 0 HD11 ILE B 15 20.563 -5.613 -2.731 1.00 0.00 H new ATOM 0 HD12 ILE B 15 18.843 -5.995 -2.980 1.00 0.00 H new ATOM 0 HD13 ILE B 15 19.519 -4.479 -3.621 1.00 0.00 H new ATOM 1302 N ALA B 16 19.418 -2.981 0.902 1.00 0.00 N ATOM 1303 CA ALA B 16 20.422 -2.068 1.517 1.00 0.00 C ATOM 1304 C ALA B 16 21.628 -1.938 0.584 1.00 0.00 C ATOM 1305 O ALA B 16 22.549 -2.729 0.630 1.00 0.00 O ATOM 1306 CB ALA B 16 20.873 -2.641 2.861 1.00 0.00 C ATOM 0 H ALA B 16 19.680 -3.967 0.885 1.00 0.00 H new ATOM 0 HA ALA B 16 19.977 -1.085 1.673 1.00 0.00 H new ATOM 0 HB1 ALA B 16 21.608 -1.974 3.313 1.00 0.00 H new ATOM 0 HB2 ALA B 16 20.013 -2.735 3.524 1.00 0.00 H new ATOM 0 HB3 ALA B 16 21.321 -3.623 2.706 1.00 0.00 H new ATOM 1312 N ARG B 17 21.626 -0.946 -0.264 1.00 0.00 N ATOM 1313 CA ARG B 17 22.768 -0.760 -1.206 1.00 0.00 C ATOM 1314 C ARG B 17 22.425 0.373 -2.191 1.00 0.00 C ATOM 1315 O ARG B 17 21.515 0.225 -2.983 1.00 0.00 O ATOM 1316 CB ARG B 17 23.002 -2.056 -1.987 1.00 0.00 C ATOM 1317 CG ARG B 17 24.376 -2.628 -1.630 1.00 0.00 C ATOM 1318 CD ARG B 17 24.985 -3.300 -2.862 1.00 0.00 C ATOM 1319 NE ARG B 17 26.058 -4.242 -2.435 1.00 0.00 N ATOM 1320 CZ ARG B 17 26.526 -5.124 -3.277 1.00 0.00 C ATOM 1321 NH1 ARG B 17 27.529 -4.817 -4.052 1.00 0.00 N ATOM 1322 NH2 ARG B 17 25.991 -6.312 -3.341 1.00 0.00 N ATOM 0 H ARG B 17 20.881 -0.254 -0.346 1.00 0.00 H new ATOM 0 HA ARG B 17 23.669 -0.506 -0.647 1.00 0.00 H new ATOM 0 HB2 ARG B 17 22.223 -2.781 -1.751 1.00 0.00 H new ATOM 0 HB3 ARG B 17 22.944 -1.863 -3.058 1.00 0.00 H new ATOM 0 HG2 ARG B 17 25.032 -1.833 -1.275 1.00 0.00 H new ATOM 0 HG3 ARG B 17 24.282 -3.349 -0.818 1.00 0.00 H new ATOM 0 HD2 ARG B 17 24.214 -3.837 -3.415 1.00 0.00 H new ATOM 0 HD3 ARG B 17 25.394 -2.547 -3.535 1.00 0.00 H new ATOM 0 HE ARG B 17 26.427 -4.198 -1.485 1.00 0.00 H new ATOM 0 HH11 ARG B 17 27.948 -3.888 -4.000 1.00 0.00 H new ATOM 0 HH12 ARG B 17 27.895 -5.506 -4.710 1.00 0.00 H new ATOM 0 HH21 ARG B 17 25.207 -6.552 -2.734 1.00 0.00 H new ATOM 0 HH22 ARG B 17 26.356 -7.001 -3.998 1.00 0.00 H new ATOM 1336 N PRO B 18 23.147 1.477 -2.128 1.00 0.00 N ATOM 1337 CA PRO B 18 22.885 2.613 -3.026 1.00 0.00 C ATOM 1338 C PRO B 18 23.026 2.180 -4.487 1.00 0.00 C ATOM 1339 O PRO B 18 24.114 2.083 -5.018 1.00 0.00 O ATOM 1340 CB PRO B 18 23.940 3.666 -2.658 1.00 0.00 C ATOM 1341 CG PRO B 18 24.834 3.065 -1.543 1.00 0.00 C ATOM 1342 CD PRO B 18 24.262 1.686 -1.180 1.00 0.00 C ATOM 0 HA PRO B 18 21.873 3.003 -2.915 1.00 0.00 H new ATOM 0 HB2 PRO B 18 24.540 3.928 -3.530 1.00 0.00 H new ATOM 0 HB3 PRO B 18 23.462 4.583 -2.313 1.00 0.00 H new ATOM 0 HG2 PRO B 18 25.864 2.974 -1.886 1.00 0.00 H new ATOM 0 HG3 PRO B 18 24.846 3.716 -0.669 1.00 0.00 H new ATOM 0 HD2 PRO B 18 25.017 0.906 -1.280 1.00 0.00 H new ATOM 0 HD3 PRO B 18 23.913 1.662 -0.148 1.00 0.00 H new ATOM 1350 N LEU B 19 21.923 1.918 -5.136 1.00 0.00 N ATOM 1351 CA LEU B 19 21.968 1.488 -6.563 1.00 0.00 C ATOM 1352 C LEU B 19 22.822 2.480 -7.372 1.00 0.00 C ATOM 1353 O LEU B 19 22.528 3.656 -7.377 1.00 0.00 O ATOM 1354 CB LEU B 19 20.547 1.490 -7.132 1.00 0.00 C ATOM 1355 CG LEU B 19 19.642 0.568 -6.311 1.00 0.00 C ATOM 1356 CD1 LEU B 19 18.253 0.519 -6.951 1.00 0.00 C ATOM 1357 CD2 LEU B 19 20.235 -0.839 -6.279 1.00 0.00 C ATOM 0 H LEU B 19 20.987 1.984 -4.736 1.00 0.00 H new ATOM 0 HA LEU B 19 22.399 0.489 -6.627 1.00 0.00 H new ATOM 0 HB2 LEU B 19 20.147 2.504 -7.124 1.00 0.00 H new ATOM 0 HB3 LEU B 19 20.564 1.162 -8.171 1.00 0.00 H new ATOM 0 HG LEU B 19 19.564 0.951 -5.293 1.00 0.00 H new ATOM 0 HD11 LEU B 19 17.607 -0.137 -6.368 1.00 0.00 H new ATOM 0 HD12 LEU B 19 17.827 1.522 -6.973 1.00 0.00 H new ATOM 0 HD13 LEU B 19 18.335 0.137 -7.969 1.00 0.00 H new ATOM 0 HD21 LEU B 19 19.589 -1.493 -5.694 1.00 0.00 H new ATOM 0 HD22 LEU B 19 20.315 -1.223 -7.296 1.00 0.00 H new ATOM 0 HD23 LEU B 19 21.225 -0.806 -5.824 1.00 0.00 H new ATOM 1369 N PRO B 20 23.852 1.998 -8.044 1.00 0.00 N ATOM 1370 CA PRO B 20 24.717 2.877 -8.850 1.00 0.00 C ATOM 1371 C PRO B 20 23.887 3.602 -9.914 1.00 0.00 C ATOM 1372 O PRO B 20 22.907 3.082 -10.411 1.00 0.00 O ATOM 1373 CB PRO B 20 25.737 1.934 -9.505 1.00 0.00 C ATOM 1374 CG PRO B 20 25.480 0.508 -8.956 1.00 0.00 C ATOM 1375 CD PRO B 20 24.237 0.571 -8.057 1.00 0.00 C ATOM 0 HA PRO B 20 25.202 3.647 -8.251 1.00 0.00 H new ATOM 0 HB2 PRO B 20 25.632 1.951 -10.590 1.00 0.00 H new ATOM 0 HB3 PRO B 20 26.754 2.254 -9.278 1.00 0.00 H new ATOM 0 HG2 PRO B 20 25.325 -0.195 -9.775 1.00 0.00 H new ATOM 0 HG3 PRO B 20 26.343 0.154 -8.392 1.00 0.00 H new ATOM 0 HD2 PRO B 20 23.433 -0.052 -8.449 1.00 0.00 H new ATOM 0 HD3 PRO B 20 24.457 0.212 -7.052 1.00 0.00 H new ATOM 1383 N ARG B 21 24.266 4.801 -10.261 1.00 0.00 N ATOM 1384 CA ARG B 21 23.494 5.565 -11.285 1.00 0.00 C ATOM 1385 C ARG B 21 23.641 4.896 -12.652 1.00 0.00 C ATOM 1386 O ARG B 21 22.803 5.050 -13.519 1.00 0.00 O ATOM 1387 CB ARG B 21 24.024 6.998 -11.358 1.00 0.00 C ATOM 1388 CG ARG B 21 23.019 7.880 -12.105 1.00 0.00 C ATOM 1389 CD ARG B 21 23.294 7.812 -13.610 1.00 0.00 C ATOM 1390 NE ARG B 21 23.143 9.168 -14.209 1.00 0.00 N ATOM 1391 CZ ARG B 21 23.486 9.372 -15.452 1.00 0.00 C ATOM 1392 NH1 ARG B 21 23.120 8.528 -16.376 1.00 0.00 N ATOM 1393 NH2 ARG B 21 24.199 10.420 -15.769 1.00 0.00 N ATOM 0 H ARG B 21 25.078 5.287 -9.880 1.00 0.00 H new ATOM 0 HA ARG B 21 22.441 5.579 -11.004 1.00 0.00 H new ATOM 0 HB2 ARG B 21 24.188 7.387 -10.353 1.00 0.00 H new ATOM 0 HB3 ARG B 21 24.987 7.015 -11.868 1.00 0.00 H new ATOM 0 HG2 ARG B 21 22.002 7.548 -11.896 1.00 0.00 H new ATOM 0 HG3 ARG B 21 23.095 8.910 -11.757 1.00 0.00 H new ATOM 0 HD2 ARG B 21 24.301 7.435 -13.789 1.00 0.00 H new ATOM 0 HD3 ARG B 21 22.603 7.115 -14.085 1.00 0.00 H new ATOM 0 HE ARG B 21 22.772 9.936 -13.649 1.00 0.00 H new ATOM 0 HH11 ARG B 21 22.566 7.709 -16.128 1.00 0.00 H new ATOM 0 HH12 ARG B 21 23.388 8.687 -17.347 1.00 0.00 H new ATOM 0 HH21 ARG B 21 24.487 11.078 -15.045 1.00 0.00 H new ATOM 0 HH22 ARG B 21 24.467 10.580 -16.740 1.00 0.00 H new ATOM 1407 N ALA B 22 24.696 4.161 -12.859 1.00 0.00 N ATOM 1408 CA ALA B 22 24.881 3.499 -14.179 1.00 0.00 C ATOM 1409 C ALA B 22 24.024 2.236 -14.264 1.00 0.00 C ATOM 1410 O ALA B 22 23.847 1.672 -15.325 1.00 0.00 O ATOM 1411 CB ALA B 22 26.355 3.130 -14.365 1.00 0.00 C ATOM 0 H ALA B 22 25.434 3.990 -12.176 1.00 0.00 H new ATOM 0 HA ALA B 22 24.573 4.188 -14.965 1.00 0.00 H new ATOM 0 HB1 ALA B 22 26.489 2.645 -15.332 1.00 0.00 H new ATOM 0 HB2 ALA B 22 26.964 4.033 -14.324 1.00 0.00 H new ATOM 0 HB3 ALA B 22 26.662 2.449 -13.572 1.00 0.00 H new ATOM 1417 N HIS B 23 23.482 1.787 -13.165 1.00 0.00 N ATOM 1418 CA HIS B 23 22.637 0.566 -13.213 1.00 0.00 C ATOM 1419 C HIS B 23 21.166 0.968 -13.184 1.00 0.00 C ATOM 1420 O HIS B 23 20.309 0.224 -13.613 1.00 0.00 O ATOM 1421 CB HIS B 23 22.934 -0.321 -12.003 1.00 0.00 C ATOM 1422 CG HIS B 23 24.400 -0.660 -11.970 1.00 0.00 C ATOM 1423 ND1 HIS B 23 24.854 -1.936 -11.660 1.00 0.00 N ATOM 1424 CD2 HIS B 23 25.527 0.099 -12.182 1.00 0.00 C ATOM 1425 CE1 HIS B 23 26.191 -1.912 -11.695 1.00 0.00 C ATOM 1426 NE2 HIS B 23 26.654 -0.694 -12.010 1.00 0.00 N ATOM 0 H HIS B 23 23.588 2.211 -12.243 1.00 0.00 H new ATOM 0 HA HIS B 23 22.856 0.017 -14.129 1.00 0.00 H new ATOM 0 HB2 HIS B 23 22.649 0.193 -11.085 1.00 0.00 H new ATOM 0 HB3 HIS B 23 22.341 -1.234 -12.055 1.00 0.00 H new ATOM 0 HD2 HIS B 23 25.534 1.147 -12.442 1.00 0.00 H new ATOM 0 HE1 HIS B 23 26.819 -2.767 -11.494 1.00 0.00 H new ATOM 0 HE2 HIS B 23 27.629 -0.410 -12.104 1.00 0.00 H new ATOM 1434 N ILE B 24 20.859 2.136 -12.682 1.00 0.00 N ATOM 1435 CA ILE B 24 19.429 2.553 -12.633 1.00 0.00 C ATOM 1436 C ILE B 24 19.060 3.321 -13.899 1.00 0.00 C ATOM 1437 O ILE B 24 19.910 3.847 -14.591 1.00 0.00 O ATOM 1438 CB ILE B 24 19.167 3.464 -11.437 1.00 0.00 C ATOM 1439 CG1 ILE B 24 19.700 2.830 -10.153 1.00 0.00 C ATOM 1440 CG2 ILE B 24 17.659 3.696 -11.305 1.00 0.00 C ATOM 1441 CD1 ILE B 24 19.452 3.781 -8.979 1.00 0.00 C ATOM 0 H ILE B 24 21.527 2.810 -12.309 1.00 0.00 H new ATOM 0 HA ILE B 24 18.827 1.648 -12.546 1.00 0.00 H new ATOM 0 HB ILE B 24 19.679 4.413 -11.595 1.00 0.00 H new ATOM 0 HG12 ILE B 24 19.206 1.875 -9.973 1.00 0.00 H new ATOM 0 HG13 ILE B 24 20.766 2.624 -10.251 1.00 0.00 H new ATOM 0 HG21 ILE B 24 17.464 4.346 -10.452 1.00 0.00 H new ATOM 0 HG22 ILE B 24 17.282 4.166 -12.213 1.00 0.00 H new ATOM 0 HG23 ILE B 24 17.156 2.741 -11.155 1.00 0.00 H new ATOM 0 HD11 ILE B 24 19.831 3.332 -8.061 1.00 0.00 H new ATOM 0 HD12 ILE B 24 19.966 4.725 -9.161 1.00 0.00 H new ATOM 0 HD13 ILE B 24 18.382 3.964 -8.879 1.00 0.00 H new ATOM 1453 N LYS B 25 17.794 3.403 -14.195 1.00 0.00 N ATOM 1454 CA LYS B 25 17.360 4.156 -15.406 1.00 0.00 C ATOM 1455 C LYS B 25 16.446 5.317 -14.986 1.00 0.00 C ATOM 1456 O LYS B 25 16.348 6.319 -15.665 1.00 0.00 O ATOM 1457 CB LYS B 25 16.599 3.217 -16.344 1.00 0.00 C ATOM 1458 CG LYS B 25 17.589 2.275 -17.033 1.00 0.00 C ATOM 1459 CD LYS B 25 17.984 2.856 -18.393 1.00 0.00 C ATOM 1460 CE LYS B 25 18.454 1.728 -19.313 1.00 0.00 C ATOM 1461 NZ LYS B 25 17.271 1.031 -19.891 1.00 0.00 N ATOM 0 H LYS B 25 17.040 2.982 -13.652 1.00 0.00 H new ATOM 0 HA LYS B 25 18.235 4.552 -15.922 1.00 0.00 H new ATOM 0 HB2 LYS B 25 15.863 2.642 -15.782 1.00 0.00 H new ATOM 0 HB3 LYS B 25 16.051 3.794 -17.089 1.00 0.00 H new ATOM 0 HG2 LYS B 25 18.474 2.143 -16.411 1.00 0.00 H new ATOM 0 HG3 LYS B 25 17.140 1.290 -17.163 1.00 0.00 H new ATOM 0 HD2 LYS B 25 17.135 3.374 -18.839 1.00 0.00 H new ATOM 0 HD3 LYS B 25 18.778 3.593 -18.269 1.00 0.00 H new ATOM 0 HE2 LYS B 25 19.077 2.131 -20.111 1.00 0.00 H new ATOM 0 HE3 LYS B 25 19.068 1.022 -18.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 17.529 0.053 -20.134 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 16.499 1.023 -19.195 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 16.959 1.530 -20.748 1.00 0.00 H new ATOM 1475 N GLU B 26 15.773 5.183 -13.873 1.00 0.00 N ATOM 1476 CA GLU B 26 14.857 6.258 -13.397 1.00 0.00 C ATOM 1477 C GLU B 26 14.510 5.955 -11.934 1.00 0.00 C ATOM 1478 O GLU B 26 15.194 5.187 -11.285 1.00 0.00 O ATOM 1479 CB GLU B 26 13.578 6.275 -14.263 1.00 0.00 C ATOM 1480 CG GLU B 26 13.258 4.872 -14.804 1.00 0.00 C ATOM 1481 CD GLU B 26 13.649 4.776 -16.282 1.00 0.00 C ATOM 1482 OE1 GLU B 26 14.289 5.694 -16.771 1.00 0.00 O ATOM 1483 OE2 GLU B 26 13.303 3.784 -16.901 1.00 0.00 O ATOM 0 H GLU B 26 15.821 4.364 -13.267 1.00 0.00 H new ATOM 0 HA GLU B 26 15.331 7.236 -13.477 1.00 0.00 H new ATOM 0 HB2 GLU B 26 12.739 6.640 -13.671 1.00 0.00 H new ATOM 0 HB3 GLU B 26 13.707 6.968 -15.094 1.00 0.00 H new ATOM 0 HG2 GLU B 26 13.797 4.120 -14.228 1.00 0.00 H new ATOM 0 HG3 GLU B 26 12.195 4.662 -14.687 1.00 0.00 H new ATOM 1490 N TYR B 27 13.452 6.513 -11.405 1.00 0.00 N ATOM 1491 CA TYR B 27 13.087 6.203 -10.005 1.00 0.00 C ATOM 1492 C TYR B 27 11.613 6.546 -9.807 1.00 0.00 C ATOM 1493 O TYR B 27 10.936 6.921 -10.746 1.00 0.00 O ATOM 1494 CB TYR B 27 13.994 6.986 -9.037 1.00 0.00 C ATOM 1495 CG TYR B 27 13.500 8.407 -8.857 1.00 0.00 C ATOM 1496 CD1 TYR B 27 13.695 9.364 -9.877 1.00 0.00 C ATOM 1497 CD2 TYR B 27 12.821 8.767 -7.672 1.00 0.00 C ATOM 1498 CE1 TYR B 27 13.212 10.681 -9.712 1.00 0.00 C ATOM 1499 CE2 TYR B 27 12.340 10.085 -7.505 1.00 0.00 C ATOM 1500 CZ TYR B 27 12.535 11.041 -8.525 1.00 0.00 C ATOM 1501 OH TYR B 27 12.057 12.326 -8.365 1.00 0.00 O ATOM 0 H TYR B 27 12.832 7.166 -11.885 1.00 0.00 H new ATOM 0 HA TYR B 27 13.233 5.144 -9.794 1.00 0.00 H new ATOM 0 HB2 TYR B 27 14.021 6.482 -8.071 1.00 0.00 H new ATOM 0 HB3 TYR B 27 15.015 6.998 -9.419 1.00 0.00 H new ATOM 0 HD1 TYR B 27 14.214 9.089 -10.783 1.00 0.00 H new ATOM 0 HD2 TYR B 27 12.669 8.034 -6.893 1.00 0.00 H new ATOM 0 HE1 TYR B 27 13.360 11.413 -10.493 1.00 0.00 H new ATOM 0 HE2 TYR B 27 11.823 10.361 -6.598 1.00 0.00 H new ATOM 0 HH TYR B 27 11.673 12.423 -7.468 1.00 0.00 H new ATOM 1511 N PHE B 28 11.096 6.419 -8.615 1.00 0.00 N ATOM 1512 CA PHE B 28 9.663 6.743 -8.437 1.00 0.00 C ATOM 1513 C PHE B 28 9.317 6.872 -6.948 1.00 0.00 C ATOM 1514 O PHE B 28 9.098 5.889 -6.268 1.00 0.00 O ATOM 1515 CB PHE B 28 8.828 5.626 -9.077 1.00 0.00 C ATOM 1516 CG PHE B 28 7.361 5.824 -8.772 1.00 0.00 C ATOM 1517 CD1 PHE B 28 6.597 6.741 -9.529 1.00 0.00 C ATOM 1518 CD2 PHE B 28 6.753 5.084 -7.736 1.00 0.00 C ATOM 1519 CE1 PHE B 28 5.224 6.916 -9.248 1.00 0.00 C ATOM 1520 CE2 PHE B 28 5.382 5.260 -7.453 1.00 0.00 C ATOM 1521 CZ PHE B 28 4.616 6.176 -8.208 1.00 0.00 C ATOM 0 H PHE B 28 11.594 6.112 -7.779 1.00 0.00 H new ATOM 0 HA PHE B 28 9.443 7.697 -8.916 1.00 0.00 H new ATOM 0 HB2 PHE B 28 8.984 5.619 -10.156 1.00 0.00 H new ATOM 0 HB3 PHE B 28 9.156 4.657 -8.701 1.00 0.00 H new ATOM 0 HD1 PHE B 28 7.063 7.307 -10.322 1.00 0.00 H new ATOM 0 HD2 PHE B 28 7.337 4.382 -7.159 1.00 0.00 H new ATOM 0 HE1 PHE B 28 4.639 7.615 -9.827 1.00 0.00 H new ATOM 0 HE2 PHE B 28 4.918 4.694 -6.659 1.00 0.00 H new ATOM 0 HZ PHE B 28 3.567 6.311 -7.991 1.00 0.00 H new ATOM 1531 N TYR B 29 9.240 8.073 -6.442 1.00 0.00 N ATOM 1532 CA TYR B 29 8.886 8.246 -5.006 1.00 0.00 C ATOM 1533 C TYR B 29 7.525 7.608 -4.748 1.00 0.00 C ATOM 1534 O TYR B 29 6.563 7.850 -5.449 1.00 0.00 O ATOM 1535 CB TYR B 29 8.827 9.734 -4.666 1.00 0.00 C ATOM 1536 CG TYR B 29 8.403 9.920 -3.228 1.00 0.00 C ATOM 1537 CD1 TYR B 29 9.307 9.634 -2.181 1.00 0.00 C ATOM 1538 CD2 TYR B 29 7.103 10.387 -2.930 1.00 0.00 C ATOM 1539 CE1 TYR B 29 8.912 9.814 -0.837 1.00 0.00 C ATOM 1540 CE2 TYR B 29 6.708 10.569 -1.586 1.00 0.00 C ATOM 1541 CZ TYR B 29 7.613 10.282 -0.540 1.00 0.00 C ATOM 1542 OH TYR B 29 7.228 10.459 0.773 1.00 0.00 O ATOM 0 H TYR B 29 9.406 8.937 -6.958 1.00 0.00 H new ATOM 0 HA TYR B 29 9.641 7.767 -4.382 1.00 0.00 H new ATOM 0 HB2 TYR B 29 9.803 10.191 -4.828 1.00 0.00 H new ATOM 0 HB3 TYR B 29 8.125 10.239 -5.329 1.00 0.00 H new ATOM 0 HD1 TYR B 29 10.301 9.277 -2.408 1.00 0.00 H new ATOM 0 HD2 TYR B 29 6.411 10.605 -3.730 1.00 0.00 H new ATOM 0 HE1 TYR B 29 9.603 9.594 -0.037 1.00 0.00 H new ATOM 0 HE2 TYR B 29 5.715 10.927 -1.358 1.00 0.00 H new ATOM 0 HH TYR B 29 6.305 10.787 0.802 1.00 0.00 H new ATOM 1552 N THR B 30 7.447 6.796 -3.741 1.00 0.00 N ATOM 1553 CA THR B 30 6.157 6.127 -3.413 1.00 0.00 C ATOM 1554 C THR B 30 5.210 7.136 -2.760 1.00 0.00 C ATOM 1555 O THR B 30 5.627 8.006 -2.022 1.00 0.00 O ATOM 1556 CB THR B 30 6.413 4.970 -2.445 1.00 0.00 C ATOM 1557 OG1 THR B 30 7.379 4.091 -3.005 1.00 0.00 O ATOM 1558 CG2 THR B 30 5.109 4.208 -2.206 1.00 0.00 C ATOM 0 H THR B 30 8.224 6.562 -3.123 1.00 0.00 H new ATOM 0 HA THR B 30 5.705 5.743 -4.328 1.00 0.00 H new ATOM 0 HB THR B 30 6.783 5.362 -1.498 1.00 0.00 H new ATOM 0 HG1 THR B 30 7.545 3.350 -2.385 1.00 0.00 H new ATOM 0 HG21 THR B 30 5.291 3.384 -1.516 1.00 0.00 H new ATOM 0 HG22 THR B 30 4.367 4.882 -1.778 1.00 0.00 H new ATOM 0 HG23 THR B 30 4.739 3.814 -3.153 1.00 0.00 H new ATOM 1566 N SER B 31 3.937 7.027 -3.025 1.00 0.00 N ATOM 1567 CA SER B 31 2.966 7.981 -2.419 1.00 0.00 C ATOM 1568 C SER B 31 2.982 7.827 -0.896 1.00 0.00 C ATOM 1569 O SER B 31 3.659 6.974 -0.357 1.00 0.00 O ATOM 1570 CB SER B 31 1.560 7.686 -2.948 1.00 0.00 C ATOM 1571 OG SER B 31 1.401 8.283 -4.227 1.00 0.00 O ATOM 0 H SER B 31 3.528 6.319 -3.635 1.00 0.00 H new ATOM 0 HA SER B 31 3.246 9.001 -2.684 1.00 0.00 H new ATOM 0 HB2 SER B 31 1.404 6.609 -3.015 1.00 0.00 H new ATOM 0 HB3 SER B 31 0.811 8.074 -2.258 1.00 0.00 H new ATOM 0 HG SER B 31 0.502 8.093 -4.567 1.00 0.00 H new ATOM 1577 N GLY B 32 2.244 8.648 -0.200 1.00 0.00 N ATOM 1578 CA GLY B 32 2.221 8.550 1.287 1.00 0.00 C ATOM 1579 C GLY B 32 0.819 8.155 1.754 1.00 0.00 C ATOM 1580 O GLY B 32 0.189 8.860 2.519 1.00 0.00 O ATOM 0 H GLY B 32 1.657 9.382 -0.596 1.00 0.00 H new ATOM 0 HA2 GLY B 32 2.949 7.812 1.624 1.00 0.00 H new ATOM 0 HA3 GLY B 32 2.507 9.505 1.729 1.00 0.00 H new ATOM 1584 N LYS B 33 0.325 7.035 1.305 1.00 0.00 N ATOM 1585 CA LYS B 33 -1.035 6.598 1.729 1.00 0.00 C ATOM 1586 C LYS B 33 -1.109 5.070 1.705 1.00 0.00 C ATOM 1587 O LYS B 33 -2.162 4.493 1.515 1.00 0.00 O ATOM 1588 CB LYS B 33 -2.080 7.174 0.770 1.00 0.00 C ATOM 1589 CG LYS B 33 -1.668 6.882 -0.674 1.00 0.00 C ATOM 1590 CD LYS B 33 -2.793 6.128 -1.385 1.00 0.00 C ATOM 1591 CE LYS B 33 -2.751 6.439 -2.883 1.00 0.00 C ATOM 1592 NZ LYS B 33 -4.120 6.313 -3.455 1.00 0.00 N ATOM 0 H LYS B 33 0.804 6.403 0.663 1.00 0.00 H new ATOM 0 HA LYS B 33 -1.233 6.957 2.739 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -3.057 6.737 0.976 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -2.174 8.249 0.922 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -1.453 7.814 -1.197 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -0.753 6.290 -0.689 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -2.685 5.056 -1.223 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -3.758 6.418 -0.970 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -2.369 7.447 -3.045 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.070 5.754 -3.388 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -4.055 6.019 -4.450 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -4.656 5.602 -2.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -4.606 7.230 -3.397 1.00 0.00 H new ATOM 1606 N CYS B 34 -0.001 4.409 1.895 1.00 0.00 N ATOM 1607 CA CYS B 34 -0.011 2.919 1.882 1.00 0.00 C ATOM 1608 C CYS B 34 0.908 2.386 2.985 1.00 0.00 C ATOM 1609 O CYS B 34 1.353 1.257 2.943 1.00 0.00 O ATOM 1610 CB CYS B 34 0.484 2.421 0.522 1.00 0.00 C ATOM 1611 SG CYS B 34 2.110 3.134 0.174 1.00 0.00 S ATOM 0 H CYS B 34 0.911 4.836 2.059 1.00 0.00 H new ATOM 0 HA CYS B 34 -1.026 2.563 2.056 1.00 0.00 H new ATOM 0 HB2 CYS B 34 0.545 1.333 0.521 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -0.223 2.701 -0.259 1.00 0.00 H new ATOM 1616 N SER B 35 1.192 3.189 3.976 1.00 0.00 N ATOM 1617 CA SER B 35 2.078 2.724 5.082 1.00 0.00 C ATOM 1618 C SER B 35 3.396 2.201 4.505 1.00 0.00 C ATOM 1619 O SER B 35 4.049 1.360 5.089 1.00 0.00 O ATOM 1620 CB SER B 35 1.380 1.604 5.856 1.00 0.00 C ATOM 1621 OG SER B 35 0.748 2.146 7.006 1.00 0.00 O ATOM 0 H SER B 35 0.849 4.145 4.067 1.00 0.00 H new ATOM 0 HA SER B 35 2.285 3.558 5.753 1.00 0.00 H new ATOM 0 HB2 SER B 35 0.643 1.113 5.221 1.00 0.00 H new ATOM 0 HB3 SER B 35 2.104 0.844 6.150 1.00 0.00 H new ATOM 0 HG SER B 35 0.299 1.429 7.501 1.00 0.00 H new ATOM 1627 N ASN B 36 3.792 2.693 3.363 1.00 0.00 N ATOM 1628 CA ASN B 36 5.067 2.223 2.751 1.00 0.00 C ATOM 1629 C ASN B 36 5.806 3.408 2.109 1.00 0.00 C ATOM 1630 O ASN B 36 6.145 3.349 0.944 1.00 0.00 O ATOM 1631 CB ASN B 36 4.760 1.177 1.680 1.00 0.00 C ATOM 1632 CG ASN B 36 4.655 -0.206 2.327 1.00 0.00 C ATOM 1633 OD1 ASN B 36 5.354 -0.499 3.277 1.00 0.00 O ATOM 1634 ND2 ASN B 36 3.805 -1.075 1.851 1.00 0.00 N ATOM 0 H ASN B 36 3.288 3.400 2.828 1.00 0.00 H new ATOM 0 HA ASN B 36 5.696 1.784 3.525 1.00 0.00 H new ATOM 0 HB2 ASN B 36 3.827 1.424 1.173 1.00 0.00 H new ATOM 0 HB3 ASN B 36 5.544 1.177 0.923 1.00 0.00 H new ATOM 0 HD21 ASN B 36 3.728 -1.999 2.276 1.00 0.00 H new ATOM 0 HD22 ASN B 36 3.218 -0.830 1.054 1.00 0.00 H new ATOM 1641 N PRO B 37 6.050 4.451 2.880 1.00 0.00 N ATOM 1642 CA PRO B 37 6.765 5.632 2.368 1.00 0.00 C ATOM 1643 C PRO B 37 8.163 5.219 1.910 1.00 0.00 C ATOM 1644 O PRO B 37 8.866 4.518 2.610 1.00 0.00 O ATOM 1645 CB PRO B 37 6.854 6.592 3.564 1.00 0.00 C ATOM 1646 CG PRO B 37 6.195 5.893 4.779 1.00 0.00 C ATOM 1647 CD PRO B 37 5.646 4.541 4.302 1.00 0.00 C ATOM 0 HA PRO B 37 6.263 6.093 1.517 1.00 0.00 H new ATOM 0 HB2 PRO B 37 7.894 6.837 3.781 1.00 0.00 H new ATOM 0 HB3 PRO B 37 6.346 7.530 3.340 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.923 5.749 5.578 1.00 0.00 H new ATOM 0 HG3 PRO B 37 5.393 6.509 5.185 1.00 0.00 H new ATOM 0 HD2 PRO B 37 6.060 3.718 4.884 1.00 0.00 H new ATOM 0 HD3 PRO B 37 4.562 4.494 4.409 1.00 0.00 H new ATOM 1655 N ALA B 38 8.575 5.628 0.741 1.00 0.00 N ATOM 1656 CA ALA B 38 9.927 5.229 0.262 1.00 0.00 C ATOM 1657 C ALA B 38 10.170 5.790 -1.139 1.00 0.00 C ATOM 1658 O ALA B 38 9.617 6.804 -1.517 1.00 0.00 O ATOM 1659 CB ALA B 38 10.010 3.699 0.235 1.00 0.00 C ATOM 0 H ALA B 38 8.039 6.216 0.103 1.00 0.00 H new ATOM 0 HA ALA B 38 10.688 5.627 0.933 1.00 0.00 H new ATOM 0 HB1 ALA B 38 10.996 3.394 -0.114 1.00 0.00 H new ATOM 0 HB2 ALA B 38 9.844 3.308 1.239 1.00 0.00 H new ATOM 0 HB3 ALA B 38 9.249 3.305 -0.439 1.00 0.00 H new ATOM 1665 N VAL B 39 10.986 5.133 -1.914 1.00 0.00 N ATOM 1666 CA VAL B 39 11.266 5.601 -3.286 1.00 0.00 C ATOM 1667 C VAL B 39 11.422 4.337 -4.109 1.00 0.00 C ATOM 1668 O VAL B 39 11.622 3.270 -3.557 1.00 0.00 O ATOM 1669 CB VAL B 39 12.540 6.486 -3.277 1.00 0.00 C ATOM 1670 CG1 VAL B 39 13.736 5.803 -3.961 1.00 0.00 C ATOM 1671 CG2 VAL B 39 12.246 7.807 -3.986 1.00 0.00 C ATOM 0 H VAL B 39 11.475 4.279 -1.645 1.00 0.00 H new ATOM 0 HA VAL B 39 10.477 6.224 -3.707 1.00 0.00 H new ATOM 0 HB VAL B 39 12.809 6.657 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL B 39 14.601 6.465 -3.927 1.00 0.00 H new ATOM 0 HG12 VAL B 39 13.970 4.873 -3.442 1.00 0.00 H new ATOM 0 HG13 VAL B 39 13.486 5.586 -4.999 1.00 0.00 H new ATOM 0 HG21 VAL B 39 13.140 8.430 -3.980 1.00 0.00 H new ATOM 0 HG22 VAL B 39 11.948 7.609 -5.016 1.00 0.00 H new ATOM 0 HG23 VAL B 39 11.439 8.326 -3.468 1.00 0.00 H new ATOM 1681 N VAL B 40 11.310 4.412 -5.395 1.00 0.00 N ATOM 1682 CA VAL B 40 11.435 3.156 -6.166 1.00 0.00 C ATOM 1683 C VAL B 40 12.265 3.354 -7.418 1.00 0.00 C ATOM 1684 O VAL B 40 11.903 4.073 -8.322 1.00 0.00 O ATOM 1685 CB VAL B 40 10.037 2.648 -6.499 1.00 0.00 C ATOM 1686 CG1 VAL B 40 10.096 1.463 -7.460 1.00 0.00 C ATOM 1687 CG2 VAL B 40 9.393 2.186 -5.201 1.00 0.00 C ATOM 0 H VAL B 40 11.142 5.261 -5.935 1.00 0.00 H new ATOM 0 HA VAL B 40 11.957 2.412 -5.564 1.00 0.00 H new ATOM 0 HB VAL B 40 9.467 3.447 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL B 40 9.084 1.122 -7.680 1.00 0.00 H new ATOM 0 HG12 VAL B 40 10.585 1.769 -8.385 1.00 0.00 H new ATOM 0 HG13 VAL B 40 10.661 0.651 -7.002 1.00 0.00 H new ATOM 0 HG21 VAL B 40 8.388 1.815 -5.405 1.00 0.00 H new ATOM 0 HG22 VAL B 40 9.992 1.388 -4.762 1.00 0.00 H new ATOM 0 HG23 VAL B 40 9.337 3.023 -4.505 1.00 0.00 H new ATOM 1697 N PHE B 41 13.375 2.688 -7.482 1.00 0.00 N ATOM 1698 CA PHE B 41 14.228 2.820 -8.671 1.00 0.00 C ATOM 1699 C PHE B 41 13.774 1.865 -9.751 1.00 0.00 C ATOM 1700 O PHE B 41 13.400 0.742 -9.506 1.00 0.00 O ATOM 1701 CB PHE B 41 15.688 2.540 -8.303 1.00 0.00 C ATOM 1702 CG PHE B 41 16.255 3.727 -7.561 1.00 0.00 C ATOM 1703 CD1 PHE B 41 16.368 4.979 -8.208 1.00 0.00 C ATOM 1704 CD2 PHE B 41 16.675 3.585 -6.219 1.00 0.00 C ATOM 1705 CE1 PHE B 41 16.901 6.087 -7.513 1.00 0.00 C ATOM 1706 CE2 PHE B 41 17.208 4.695 -5.525 1.00 0.00 C ATOM 1707 CZ PHE B 41 17.321 5.946 -6.172 1.00 0.00 C ATOM 0 H PHE B 41 13.724 2.059 -6.759 1.00 0.00 H new ATOM 0 HA PHE B 41 14.146 3.839 -9.049 1.00 0.00 H new ATOM 0 HB2 PHE B 41 15.753 1.645 -7.684 1.00 0.00 H new ATOM 0 HB3 PHE B 41 16.271 2.348 -9.204 1.00 0.00 H new ATOM 0 HD1 PHE B 41 16.047 5.088 -9.233 1.00 0.00 H new ATOM 0 HD2 PHE B 41 16.589 2.629 -5.724 1.00 0.00 H new ATOM 0 HE1 PHE B 41 16.987 7.043 -8.008 1.00 0.00 H new ATOM 0 HE2 PHE B 41 17.529 4.587 -4.500 1.00 0.00 H new ATOM 0 HZ PHE B 41 17.728 6.794 -5.641 1.00 0.00 H new ATOM 1717 N VAL B 42 13.816 2.333 -10.952 1.00 0.00 N ATOM 1718 CA VAL B 42 13.413 1.509 -12.113 1.00 0.00 C ATOM 1719 C VAL B 42 14.703 1.257 -12.914 1.00 0.00 C ATOM 1720 O VAL B 42 14.975 1.899 -13.909 1.00 0.00 O ATOM 1721 CB VAL B 42 12.379 2.260 -12.964 1.00 0.00 C ATOM 1722 CG1 VAL B 42 11.068 1.493 -12.917 1.00 0.00 C ATOM 1723 CG2 VAL B 42 12.115 3.668 -12.426 1.00 0.00 C ATOM 0 H VAL B 42 14.121 3.278 -11.188 1.00 0.00 H new ATOM 0 HA VAL B 42 12.949 0.572 -11.805 1.00 0.00 H new ATOM 0 HB VAL B 42 12.771 2.340 -13.978 1.00 0.00 H new ATOM 0 HG11 VAL B 42 10.321 2.013 -13.517 1.00 0.00 H new ATOM 0 HG12 VAL B 42 11.219 0.490 -13.315 1.00 0.00 H new ATOM 0 HG13 VAL B 42 10.722 1.426 -11.885 1.00 0.00 H new ATOM 0 HG21 VAL B 42 11.378 4.166 -13.056 1.00 0.00 H new ATOM 0 HG22 VAL B 42 11.736 3.603 -11.406 1.00 0.00 H new ATOM 0 HG23 VAL B 42 13.043 4.240 -12.432 1.00 0.00 H new ATOM 1733 N THR B 43 15.535 0.381 -12.414 1.00 0.00 N ATOM 1734 CA THR B 43 16.876 0.114 -13.041 1.00 0.00 C ATOM 1735 C THR B 43 16.799 -0.700 -14.334 1.00 0.00 C ATOM 1736 O THR B 43 15.792 -0.729 -15.014 1.00 0.00 O ATOM 1737 CB THR B 43 17.758 -0.632 -12.024 1.00 0.00 C ATOM 1738 OG1 THR B 43 17.421 -2.012 -12.033 1.00 0.00 O ATOM 1739 CG2 THR B 43 17.540 -0.064 -10.616 1.00 0.00 C ATOM 0 H THR B 43 15.342 -0.175 -11.581 1.00 0.00 H new ATOM 0 HA THR B 43 17.301 1.081 -13.309 1.00 0.00 H new ATOM 0 HB THR B 43 18.805 -0.504 -12.300 1.00 0.00 H new ATOM 0 HG1 THR B 43 17.982 -2.490 -11.387 1.00 0.00 H new ATOM 0 HG21 THR B 43 18.170 -0.600 -9.906 1.00 0.00 H new ATOM 0 HG22 THR B 43 17.802 0.994 -10.606 1.00 0.00 H new ATOM 0 HG23 THR B 43 16.494 -0.182 -10.334 1.00 0.00 H new ATOM 1747 N ARG B 44 17.902 -1.325 -14.695 1.00 0.00 N ATOM 1748 CA ARG B 44 17.967 -2.116 -15.958 1.00 0.00 C ATOM 1749 C ARG B 44 16.732 -3.003 -16.097 1.00 0.00 C ATOM 1750 O ARG B 44 15.919 -2.799 -16.977 1.00 0.00 O ATOM 1751 CB ARG B 44 19.238 -2.981 -15.983 1.00 0.00 C ATOM 1752 CG ARG B 44 19.536 -3.554 -14.590 1.00 0.00 C ATOM 1753 CD ARG B 44 20.913 -3.079 -14.124 1.00 0.00 C ATOM 1754 NE ARG B 44 20.994 -3.176 -12.639 1.00 0.00 N ATOM 1755 CZ ARG B 44 21.797 -4.043 -12.084 1.00 0.00 C ATOM 1756 NH1 ARG B 44 21.685 -5.311 -12.368 1.00 0.00 N ATOM 1757 NH2 ARG B 44 22.705 -3.641 -11.237 1.00 0.00 N ATOM 0 H ARG B 44 18.768 -1.316 -14.155 1.00 0.00 H new ATOM 0 HA ARG B 44 17.996 -1.420 -16.797 1.00 0.00 H new ATOM 0 HB2 ARG B 44 19.115 -3.795 -16.697 1.00 0.00 H new ATOM 0 HB3 ARG B 44 20.083 -2.383 -16.324 1.00 0.00 H new ATOM 0 HG2 ARG B 44 18.771 -3.234 -13.883 1.00 0.00 H new ATOM 0 HG3 ARG B 44 19.507 -4.643 -14.620 1.00 0.00 H new ATOM 0 HD2 ARG B 44 21.694 -3.686 -14.582 1.00 0.00 H new ATOM 0 HD3 ARG B 44 21.082 -2.050 -14.442 1.00 0.00 H new ATOM 0 HE ARG B 44 20.422 -2.565 -12.056 1.00 0.00 H new ATOM 0 HH11 ARG B 44 20.970 -5.626 -13.024 1.00 0.00 H new ATOM 0 HH12 ARG B 44 22.313 -5.988 -11.934 1.00 0.00 H new ATOM 0 HH21 ARG B 44 22.787 -2.650 -11.009 1.00 0.00 H new ATOM 0 HH22 ARG B 44 23.333 -4.318 -10.803 1.00 0.00 H new ATOM 1771 N LYS B 45 16.548 -3.962 -15.222 1.00 0.00 N ATOM 1772 CA LYS B 45 15.317 -4.809 -15.316 1.00 0.00 C ATOM 1773 C LYS B 45 14.128 -3.849 -15.307 1.00 0.00 C ATOM 1774 O LYS B 45 13.102 -4.076 -15.919 1.00 0.00 O ATOM 1775 CB LYS B 45 15.237 -5.762 -14.121 1.00 0.00 C ATOM 1776 CG LYS B 45 15.492 -7.195 -14.594 1.00 0.00 C ATOM 1777 CD LYS B 45 16.800 -7.708 -13.987 1.00 0.00 C ATOM 1778 CE LYS B 45 17.972 -7.305 -14.885 1.00 0.00 C ATOM 1779 NZ LYS B 45 18.222 -8.379 -15.887 1.00 0.00 N ATOM 0 H LYS B 45 17.185 -4.193 -14.459 1.00 0.00 H new ATOM 0 HA LYS B 45 15.326 -5.417 -16.220 1.00 0.00 H new ATOM 0 HB2 LYS B 45 15.972 -5.480 -13.367 1.00 0.00 H new ATOM 0 HB3 LYS B 45 14.256 -5.692 -13.651 1.00 0.00 H new ATOM 0 HG2 LYS B 45 14.664 -7.840 -14.298 1.00 0.00 H new ATOM 0 HG3 LYS B 45 15.547 -7.226 -15.682 1.00 0.00 H new ATOM 0 HD2 LYS B 45 16.936 -7.296 -12.987 1.00 0.00 H new ATOM 0 HD3 LYS B 45 16.764 -8.792 -13.883 1.00 0.00 H new ATOM 0 HE2 LYS B 45 17.750 -6.365 -15.391 1.00 0.00 H new ATOM 0 HE3 LYS B 45 18.865 -7.140 -14.283 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 19.018 -8.106 -16.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 18.451 -9.266 -15.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 17.371 -8.516 -16.469 1.00 0.00 H new ATOM 1793 N ASN B 46 14.315 -2.745 -14.640 1.00 0.00 N ATOM 1794 CA ASN B 46 13.291 -1.685 -14.577 1.00 0.00 C ATOM 1795 C ASN B 46 12.122 -2.095 -13.720 1.00 0.00 C ATOM 1796 O ASN B 46 11.156 -1.364 -13.611 1.00 0.00 O ATOM 1797 CB ASN B 46 12.810 -1.337 -15.988 1.00 0.00 C ATOM 1798 CG ASN B 46 13.255 0.080 -16.351 1.00 0.00 C ATOM 1799 OD1 ASN B 46 13.421 0.917 -15.488 1.00 0.00 O ATOM 1800 ND2 ASN B 46 13.453 0.388 -17.604 1.00 0.00 N ATOM 0 H ASN B 46 15.167 -2.534 -14.121 1.00 0.00 H new ATOM 0 HA ASN B 46 13.747 -0.806 -14.122 1.00 0.00 H new ATOM 0 HB2 ASN B 46 13.214 -2.050 -16.706 1.00 0.00 H new ATOM 0 HB3 ASN B 46 11.724 -1.412 -16.041 1.00 0.00 H new ATOM 0 HD21 ASN B 46 13.747 1.331 -17.857 1.00 0.00 H new ATOM 0 HD22 ASN B 46 13.314 -0.315 -18.330 1.00 0.00 H new ATOM 1807 N ARG B 47 12.205 -3.202 -13.029 1.00 0.00 N ATOM 1808 CA ARG B 47 11.091 -3.537 -12.104 1.00 0.00 C ATOM 1809 C ARG B 47 11.041 -2.355 -11.148 1.00 0.00 C ATOM 1810 O ARG B 47 11.961 -1.558 -11.144 1.00 0.00 O ATOM 1811 CB ARG B 47 11.384 -4.834 -11.348 1.00 0.00 C ATOM 1812 CG ARG B 47 11.632 -5.963 -12.351 1.00 0.00 C ATOM 1813 CD ARG B 47 10.700 -7.137 -12.040 1.00 0.00 C ATOM 1814 NE ARG B 47 11.495 -8.395 -11.962 1.00 0.00 N ATOM 1815 CZ ARG B 47 11.105 -9.366 -11.183 1.00 0.00 C ATOM 1816 NH1 ARG B 47 11.211 -9.246 -9.888 1.00 0.00 N ATOM 1817 NH2 ARG B 47 10.610 -10.458 -11.698 1.00 0.00 N ATOM 0 H ARG B 47 12.975 -3.870 -13.064 1.00 0.00 H new ATOM 0 HA ARG B 47 10.147 -3.698 -12.624 1.00 0.00 H new ATOM 0 HB2 ARG B 47 12.256 -4.705 -10.706 1.00 0.00 H new ATOM 0 HB3 ARG B 47 10.545 -5.087 -10.699 1.00 0.00 H new ATOM 0 HG2 ARG B 47 11.458 -5.606 -13.366 1.00 0.00 H new ATOM 0 HG3 ARG B 47 12.672 -6.287 -12.300 1.00 0.00 H new ATOM 0 HD2 ARG B 47 10.181 -6.963 -11.097 1.00 0.00 H new ATOM 0 HD3 ARG B 47 9.937 -7.224 -12.813 1.00 0.00 H new ATOM 0 HE ARG B 47 12.344 -8.497 -12.518 1.00 0.00 H new ATOM 0 HH11 ARG B 47 11.599 -8.393 -9.485 1.00 0.00 H new ATOM 0 HH12 ARG B 47 10.906 -10.005 -9.279 1.00 0.00 H new ATOM 0 HH21 ARG B 47 10.528 -10.553 -12.710 1.00 0.00 H new ATOM 0 HH22 ARG B 47 10.305 -11.217 -11.088 1.00 0.00 H new ATOM 1831 N GLN B 48 10.019 -2.176 -10.383 1.00 0.00 N ATOM 1832 CA GLN B 48 10.025 -0.987 -9.513 1.00 0.00 C ATOM 1833 C GLN B 48 10.753 -1.334 -8.232 1.00 0.00 C ATOM 1834 O GLN B 48 10.178 -1.581 -7.199 1.00 0.00 O ATOM 1835 CB GLN B 48 8.606 -0.497 -9.293 1.00 0.00 C ATOM 1836 CG GLN B 48 8.368 0.611 -10.321 1.00 0.00 C ATOM 1837 CD GLN B 48 6.919 1.096 -10.245 1.00 0.00 C ATOM 1838 OE1 GLN B 48 5.996 0.313 -10.360 1.00 0.00 O ATOM 1839 NE2 GLN B 48 6.677 2.365 -10.064 1.00 0.00 N ATOM 0 H GLN B 48 9.200 -2.781 -10.320 1.00 0.00 H new ATOM 0 HA GLN B 48 10.558 -0.158 -9.979 1.00 0.00 H new ATOM 0 HB2 GLN B 48 7.890 -1.309 -9.424 1.00 0.00 H new ATOM 0 HB3 GLN B 48 8.478 -0.120 -8.278 1.00 0.00 H new ATOM 0 HG2 GLN B 48 9.048 1.442 -10.135 1.00 0.00 H new ATOM 0 HG3 GLN B 48 8.584 0.240 -11.323 1.00 0.00 H new ATOM 0 HE21 GLN B 48 7.450 3.023 -9.967 1.00 0.00 H new ATOM 0 HE22 GLN B 48 5.714 2.699 -10.019 1.00 0.00 H new ATOM 1848 N VAL B 49 12.045 -1.358 -8.343 1.00 0.00 N ATOM 1849 CA VAL B 49 12.922 -1.703 -7.201 1.00 0.00 C ATOM 1850 C VAL B 49 12.739 -0.667 -6.092 1.00 0.00 C ATOM 1851 O VAL B 49 12.259 0.423 -6.319 1.00 0.00 O ATOM 1852 CB VAL B 49 14.402 -1.730 -7.641 1.00 0.00 C ATOM 1853 CG1 VAL B 49 15.099 -2.870 -6.903 1.00 0.00 C ATOM 1854 CG2 VAL B 49 14.561 -1.959 -9.168 1.00 0.00 C ATOM 0 H VAL B 49 12.545 -1.146 -9.207 1.00 0.00 H new ATOM 0 HA VAL B 49 12.649 -2.693 -6.835 1.00 0.00 H new ATOM 0 HB VAL B 49 14.843 -0.762 -7.403 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.147 -2.908 -7.199 1.00 0.00 H new ATOM 0 HG12 VAL B 49 15.031 -2.703 -5.828 1.00 0.00 H new ATOM 0 HG13 VAL B 49 14.617 -3.815 -7.154 1.00 0.00 H new ATOM 0 HG21 VAL B 49 15.620 -1.970 -9.426 1.00 0.00 H new ATOM 0 HG22 VAL B 49 14.111 -2.913 -9.442 1.00 0.00 H new ATOM 0 HG23 VAL B 49 14.064 -1.155 -9.710 1.00 0.00 H new ATOM 1864 N CYS B 50 13.111 -1.003 -4.893 1.00 0.00 N ATOM 1865 CA CYS B 50 12.953 -0.053 -3.762 1.00 0.00 C ATOM 1866 C CYS B 50 14.331 0.409 -3.281 1.00 0.00 C ATOM 1867 O CYS B 50 15.345 -0.118 -3.694 1.00 0.00 O ATOM 1868 CB CYS B 50 12.248 -0.778 -2.622 1.00 0.00 C ATOM 1869 SG CYS B 50 11.434 0.412 -1.539 1.00 0.00 S ATOM 0 H CYS B 50 13.522 -1.903 -4.645 1.00 0.00 H new ATOM 0 HA CYS B 50 12.374 0.813 -4.082 1.00 0.00 H new ATOM 0 HB2 CYS B 50 11.514 -1.477 -3.024 1.00 0.00 H new ATOM 0 HB3 CYS B 50 12.969 -1.365 -2.053 1.00 0.00 H new ATOM 1874 N ALA B 51 14.384 1.381 -2.406 1.00 0.00 N ATOM 1875 CA ALA B 51 15.711 1.846 -1.915 1.00 0.00 C ATOM 1876 C ALA B 51 15.573 2.737 -0.684 1.00 0.00 C ATOM 1877 O ALA B 51 16.467 3.488 -0.368 1.00 0.00 O ATOM 1878 CB ALA B 51 16.415 2.622 -3.027 1.00 0.00 C ATOM 0 H ALA B 51 13.576 1.866 -2.016 1.00 0.00 H new ATOM 0 HA ALA B 51 16.296 0.970 -1.633 1.00 0.00 H new ATOM 0 HB1 ALA B 51 17.387 2.965 -2.672 1.00 0.00 H new ATOM 0 HB2 ALA B 51 16.552 1.974 -3.892 1.00 0.00 H new ATOM 0 HB3 ALA B 51 15.809 3.482 -3.311 1.00 0.00 H new ATOM 1884 N ASN B 52 14.493 2.636 0.042 1.00 0.00 N ATOM 1885 CA ASN B 52 14.345 3.459 1.280 1.00 0.00 C ATOM 1886 C ASN B 52 14.236 4.955 0.941 1.00 0.00 C ATOM 1887 O ASN B 52 14.923 5.431 0.059 1.00 0.00 O ATOM 1888 CB ASN B 52 15.580 3.254 2.155 1.00 0.00 C ATOM 1889 CG ASN B 52 15.330 3.837 3.547 1.00 0.00 C ATOM 1890 OD1 ASN B 52 15.888 4.857 3.899 1.00 0.00 O ATOM 1891 ND2 ASN B 52 14.513 3.227 4.360 1.00 0.00 N ATOM 0 H ASN B 52 13.707 2.021 -0.167 1.00 0.00 H new ATOM 0 HA ASN B 52 13.437 3.147 1.797 1.00 0.00 H new ATOM 0 HB2 ASN B 52 15.811 2.191 2.232 1.00 0.00 H new ATOM 0 HB3 ASN B 52 16.445 3.736 1.699 1.00 0.00 H new ATOM 0 HD21 ASN B 52 14.343 3.606 5.291 1.00 0.00 H new ATOM 0 HD22 ASN B 52 14.044 2.371 4.065 1.00 0.00 H new ATOM 1898 N PRO B 53 13.385 5.668 1.661 1.00 0.00 N ATOM 1899 CA PRO B 53 13.203 7.112 1.448 1.00 0.00 C ATOM 1900 C PRO B 53 14.292 7.909 2.179 1.00 0.00 C ATOM 1901 O PRO B 53 14.864 8.837 1.642 1.00 0.00 O ATOM 1902 CB PRO B 53 11.850 7.415 2.099 1.00 0.00 C ATOM 1903 CG PRO B 53 11.537 6.240 3.060 1.00 0.00 C ATOM 1904 CD PRO B 53 12.521 5.106 2.725 1.00 0.00 C ATOM 0 HA PRO B 53 13.253 7.379 0.392 1.00 0.00 H new ATOM 0 HB2 PRO B 53 11.886 8.359 2.643 1.00 0.00 H new ATOM 0 HB3 PRO B 53 11.071 7.513 1.343 1.00 0.00 H new ATOM 0 HG2 PRO B 53 11.648 6.552 4.098 1.00 0.00 H new ATOM 0 HG3 PRO B 53 10.507 5.905 2.936 1.00 0.00 H new ATOM 0 HD2 PRO B 53 13.105 4.816 3.599 1.00 0.00 H new ATOM 0 HD3 PRO B 53 11.997 4.214 2.381 1.00 0.00 H new ATOM 1912 N GLU B 54 14.557 7.567 3.417 1.00 0.00 N ATOM 1913 CA GLU B 54 15.578 8.319 4.208 1.00 0.00 C ATOM 1914 C GLU B 54 16.923 7.586 4.213 1.00 0.00 C ATOM 1915 O GLU B 54 17.594 7.521 5.223 1.00 0.00 O ATOM 1916 CB GLU B 54 15.084 8.463 5.649 1.00 0.00 C ATOM 1917 CG GLU B 54 15.769 9.662 6.307 1.00 0.00 C ATOM 1918 CD GLU B 54 14.726 10.741 6.608 1.00 0.00 C ATOM 1919 OE1 GLU B 54 13.789 10.863 5.837 1.00 0.00 O ATOM 1920 OE2 GLU B 54 14.882 11.426 7.606 1.00 0.00 O ATOM 0 H GLU B 54 14.108 6.797 3.914 1.00 0.00 H new ATOM 0 HA GLU B 54 15.719 9.298 3.750 1.00 0.00 H new ATOM 0 HB2 GLU B 54 14.002 8.597 5.662 1.00 0.00 H new ATOM 0 HB3 GLU B 54 15.300 7.554 6.211 1.00 0.00 H new ATOM 0 HG2 GLU B 54 16.264 9.352 7.227 1.00 0.00 H new ATOM 0 HG3 GLU B 54 16.541 10.060 5.649 1.00 0.00 H new ATOM 1927 N LYS B 55 17.334 7.052 3.099 1.00 0.00 N ATOM 1928 CA LYS B 55 18.649 6.348 3.058 1.00 0.00 C ATOM 1929 C LYS B 55 19.735 7.328 2.591 1.00 0.00 C ATOM 1930 O LYS B 55 20.789 6.929 2.140 1.00 0.00 O ATOM 1931 CB LYS B 55 18.575 5.160 2.096 1.00 0.00 C ATOM 1932 CG LYS B 55 18.540 3.854 2.894 1.00 0.00 C ATOM 1933 CD LYS B 55 19.961 3.469 3.310 1.00 0.00 C ATOM 1934 CE LYS B 55 19.929 2.829 4.698 1.00 0.00 C ATOM 1935 NZ LYS B 55 21.309 2.797 5.260 1.00 0.00 N ATOM 0 H LYS B 55 16.821 7.071 2.218 1.00 0.00 H new ATOM 0 HA LYS B 55 18.894 5.981 4.055 1.00 0.00 H new ATOM 0 HB2 LYS B 55 17.685 5.240 1.471 1.00 0.00 H new ATOM 0 HB3 LYS B 55 19.436 5.166 1.427 1.00 0.00 H new ATOM 0 HG2 LYS B 55 17.911 3.972 3.776 1.00 0.00 H new ATOM 0 HG3 LYS B 55 18.099 3.060 2.292 1.00 0.00 H new ATOM 0 HD2 LYS B 55 20.387 2.774 2.587 1.00 0.00 H new ATOM 0 HD3 LYS B 55 20.601 4.352 3.319 1.00 0.00 H new ATOM 0 HE2 LYS B 55 19.269 3.394 5.356 1.00 0.00 H new ATOM 0 HE3 LYS B 55 19.526 1.818 4.635 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 21.289 2.362 6.204 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 21.926 2.240 4.635 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 21.676 3.767 5.333 1.00 0.00 H new ATOM 1949 N LYS B 56 19.483 8.609 2.707 1.00 0.00 N ATOM 1950 CA LYS B 56 20.491 9.629 2.288 1.00 0.00 C ATOM 1951 C LYS B 56 20.780 9.516 0.782 1.00 0.00 C ATOM 1952 O LYS B 56 20.172 10.190 -0.023 1.00 0.00 O ATOM 1953 CB LYS B 56 21.783 9.432 3.091 1.00 0.00 C ATOM 1954 CG LYS B 56 22.845 10.429 2.617 1.00 0.00 C ATOM 1955 CD LYS B 56 23.223 11.362 3.770 1.00 0.00 C ATOM 1956 CE LYS B 56 23.570 12.745 3.214 1.00 0.00 C ATOM 1957 NZ LYS B 56 24.752 12.637 2.314 1.00 0.00 N ATOM 0 H LYS B 56 18.614 8.994 3.078 1.00 0.00 H new ATOM 0 HA LYS B 56 20.091 10.624 2.485 1.00 0.00 H new ATOM 0 HB2 LYS B 56 21.587 9.573 4.154 1.00 0.00 H new ATOM 0 HB3 LYS B 56 22.147 8.412 2.967 1.00 0.00 H new ATOM 0 HG2 LYS B 56 23.727 9.895 2.263 1.00 0.00 H new ATOM 0 HG3 LYS B 56 22.465 11.009 1.776 1.00 0.00 H new ATOM 0 HD2 LYS B 56 22.396 11.439 4.476 1.00 0.00 H new ATOM 0 HD3 LYS B 56 24.073 10.955 4.318 1.00 0.00 H new ATOM 0 HE2 LYS B 56 22.720 13.153 2.667 1.00 0.00 H new ATOM 0 HE3 LYS B 56 23.784 13.434 4.031 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 25.112 13.588 2.099 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 25.496 12.083 2.784 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 24.474 12.164 1.431 1.00 0.00 H new ATOM 1971 N TRP B 57 21.713 8.690 0.398 1.00 0.00 N ATOM 1972 CA TRP B 57 22.059 8.548 -1.051 1.00 0.00 C ATOM 1973 C TRP B 57 20.797 8.439 -1.923 1.00 0.00 C ATOM 1974 O TRP B 57 20.783 8.892 -3.049 1.00 0.00 O ATOM 1975 CB TRP B 57 22.942 7.311 -1.228 1.00 0.00 C ATOM 1976 CG TRP B 57 22.172 6.099 -0.890 1.00 0.00 C ATOM 1977 CD1 TRP B 57 22.273 5.366 0.238 1.00 0.00 C ATOM 1978 CD2 TRP B 57 21.264 5.410 -1.752 1.00 0.00 C ATOM 1979 NE1 TRP B 57 21.417 4.283 0.137 1.00 0.00 N ATOM 1980 CE2 TRP B 57 20.775 4.259 -1.084 1.00 0.00 C ATOM 1981 CE3 TRP B 57 20.812 5.688 -3.053 1.00 0.00 C ATOM 1982 CZ2 TRP B 57 19.857 3.398 -1.702 1.00 0.00 C ATOM 1983 CZ3 TRP B 57 19.917 4.826 -3.691 1.00 0.00 C ATOM 1984 CH2 TRP B 57 19.439 3.675 -3.022 1.00 0.00 C ATOM 0 H TRP B 57 22.257 8.101 1.028 1.00 0.00 H new ATOM 0 HA TRP B 57 22.598 9.438 -1.375 1.00 0.00 H new ATOM 0 HB2 TRP B 57 23.300 7.252 -2.256 1.00 0.00 H new ATOM 0 HB3 TRP B 57 23.821 7.385 -0.588 1.00 0.00 H new ATOM 0 HD1 TRP B 57 22.914 5.587 1.079 1.00 0.00 H new ATOM 0 HE1 TRP B 57 21.278 3.590 0.873 1.00 0.00 H new ATOM 0 HE3 TRP B 57 21.159 6.574 -3.563 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 19.475 2.535 -1.176 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 19.589 5.039 -4.698 1.00 0.00 H new ATOM 0 HH2 TRP B 57 18.753 3.007 -3.522 1.00 0.00 H new ATOM 1995 N VAL B 58 19.744 7.848 -1.431 1.00 0.00 N ATOM 1996 CA VAL B 58 18.509 7.725 -2.277 1.00 0.00 C ATOM 1997 C VAL B 58 18.056 9.095 -2.780 1.00 0.00 C ATOM 1998 O VAL B 58 17.747 9.254 -3.940 1.00 0.00 O ATOM 1999 CB VAL B 58 17.348 7.097 -1.506 1.00 0.00 C ATOM 2000 CG1 VAL B 58 17.367 5.589 -1.705 1.00 0.00 C ATOM 2001 CG2 VAL B 58 17.428 7.433 -0.025 1.00 0.00 C ATOM 0 H VAL B 58 19.678 7.448 -0.495 1.00 0.00 H new ATOM 0 HA VAL B 58 18.774 7.081 -3.115 1.00 0.00 H new ATOM 0 HB VAL B 58 16.413 7.505 -1.890 1.00 0.00 H new ATOM 0 HG11 VAL B 58 16.540 5.139 -1.156 1.00 0.00 H new ATOM 0 HG12 VAL B 58 17.265 5.361 -2.766 1.00 0.00 H new ATOM 0 HG13 VAL B 58 18.310 5.185 -1.336 1.00 0.00 H new ATOM 0 HG21 VAL B 58 16.590 6.973 0.498 1.00 0.00 H new ATOM 0 HG22 VAL B 58 18.364 7.053 0.384 1.00 0.00 H new ATOM 0 HG23 VAL B 58 17.388 8.514 0.105 1.00 0.00 H new ATOM 2011 N ARG B 59 17.989 10.082 -1.926 1.00 0.00 N ATOM 2012 CA ARG B 59 17.539 11.425 -2.395 1.00 0.00 C ATOM 2013 C ARG B 59 18.598 11.990 -3.341 1.00 0.00 C ATOM 2014 O ARG B 59 18.292 12.691 -4.287 1.00 0.00 O ATOM 2015 CB ARG B 59 17.343 12.371 -1.207 1.00 0.00 C ATOM 2016 CG ARG B 59 18.538 12.274 -0.258 1.00 0.00 C ATOM 2017 CD ARG B 59 18.610 13.537 0.605 1.00 0.00 C ATOM 2018 NE ARG B 59 19.653 14.452 0.061 1.00 0.00 N ATOM 2019 CZ ARG B 59 20.166 15.380 0.821 1.00 0.00 C ATOM 2020 NH1 ARG B 59 20.465 15.115 2.064 1.00 0.00 N ATOM 2021 NH2 ARG B 59 20.380 16.574 0.341 1.00 0.00 N ATOM 0 H ARG B 59 18.223 10.018 -0.935 1.00 0.00 H new ATOM 0 HA ARG B 59 16.585 11.329 -2.914 1.00 0.00 H new ATOM 0 HB2 ARG B 59 17.232 13.396 -1.562 1.00 0.00 H new ATOM 0 HB3 ARG B 59 16.425 12.117 -0.677 1.00 0.00 H new ATOM 0 HG2 ARG B 59 18.442 11.393 0.376 1.00 0.00 H new ATOM 0 HG3 ARG B 59 19.460 12.157 -0.828 1.00 0.00 H new ATOM 0 HD2 ARG B 59 17.642 14.038 0.617 1.00 0.00 H new ATOM 0 HD3 ARG B 59 18.845 13.273 1.636 1.00 0.00 H new ATOM 0 HE ARG B 59 19.966 14.353 -0.905 1.00 0.00 H new ATOM 0 HH11 ARG B 59 20.298 14.182 2.441 1.00 0.00 H new ATOM 0 HH12 ARG B 59 20.866 15.841 2.658 1.00 0.00 H new ATOM 0 HH21 ARG B 59 20.146 16.783 -0.630 1.00 0.00 H new ATOM 0 HH22 ARG B 59 20.781 17.299 0.936 1.00 0.00 H new ATOM 2035 N GLU B 60 19.841 11.669 -3.106 1.00 0.00 N ATOM 2036 CA GLU B 60 20.919 12.162 -4.010 1.00 0.00 C ATOM 2037 C GLU B 60 20.753 11.500 -5.381 1.00 0.00 C ATOM 2038 O GLU B 60 21.291 11.950 -6.372 1.00 0.00 O ATOM 2039 CB GLU B 60 22.287 11.800 -3.428 1.00 0.00 C ATOM 2040 CG GLU B 60 22.803 12.956 -2.570 1.00 0.00 C ATOM 2041 CD GLU B 60 24.333 12.972 -2.599 1.00 0.00 C ATOM 2042 OE1 GLU B 60 24.928 12.171 -1.897 1.00 0.00 O ATOM 2043 OE2 GLU B 60 24.884 13.785 -3.323 1.00 0.00 O ATOM 0 H GLU B 60 20.156 11.088 -2.329 1.00 0.00 H new ATOM 0 HA GLU B 60 20.851 13.245 -4.109 1.00 0.00 H new ATOM 0 HB2 GLU B 60 22.209 10.894 -2.827 1.00 0.00 H new ATOM 0 HB3 GLU B 60 22.991 11.589 -4.233 1.00 0.00 H new ATOM 0 HG2 GLU B 60 22.412 13.902 -2.943 1.00 0.00 H new ATOM 0 HG3 GLU B 60 22.450 12.847 -1.545 1.00 0.00 H new ATOM 2050 N TYR B 61 19.996 10.437 -5.439 1.00 0.00 N ATOM 2051 CA TYR B 61 19.767 9.738 -6.728 1.00 0.00 C ATOM 2052 C TYR B 61 18.488 10.290 -7.346 1.00 0.00 C ATOM 2053 O TYR B 61 18.332 10.342 -8.550 1.00 0.00 O ATOM 2054 CB TYR B 61 19.598 8.240 -6.467 1.00 0.00 C ATOM 2055 CG TYR B 61 20.906 7.531 -6.709 1.00 0.00 C ATOM 2056 CD1 TYR B 61 21.904 7.525 -5.709 1.00 0.00 C ATOM 2057 CD2 TYR B 61 21.127 6.862 -7.930 1.00 0.00 C ATOM 2058 CE1 TYR B 61 23.125 6.853 -5.933 1.00 0.00 C ATOM 2059 CE2 TYR B 61 22.348 6.191 -8.156 1.00 0.00 C ATOM 2060 CZ TYR B 61 23.347 6.186 -7.157 1.00 0.00 C ATOM 2061 OH TYR B 61 24.540 5.528 -7.379 1.00 0.00 O ATOM 0 H TYR B 61 19.523 10.022 -4.636 1.00 0.00 H new ATOM 0 HA TYR B 61 20.611 9.893 -7.400 1.00 0.00 H new ATOM 0 HB2 TYR B 61 19.268 8.075 -5.441 1.00 0.00 H new ATOM 0 HB3 TYR B 61 18.826 7.832 -7.120 1.00 0.00 H new ATOM 0 HD1 TYR B 61 21.733 8.035 -4.773 1.00 0.00 H new ATOM 0 HD2 TYR B 61 20.362 6.863 -8.692 1.00 0.00 H new ATOM 0 HE1 TYR B 61 23.888 6.849 -5.169 1.00 0.00 H new ATOM 0 HE2 TYR B 61 22.519 5.681 -9.093 1.00 0.00 H new ATOM 0 HH TYR B 61 24.898 5.203 -6.527 1.00 0.00 H new ATOM 2071 N ILE B 62 17.569 10.707 -6.520 1.00 0.00 N ATOM 2072 CA ILE B 62 16.293 11.265 -7.036 1.00 0.00 C ATOM 2073 C ILE B 62 16.590 12.511 -7.878 1.00 0.00 C ATOM 2074 O ILE B 62 16.025 12.706 -8.935 1.00 0.00 O ATOM 2075 CB ILE B 62 15.399 11.633 -5.848 1.00 0.00 C ATOM 2076 CG1 ILE B 62 14.984 10.357 -5.113 1.00 0.00 C ATOM 2077 CG2 ILE B 62 14.150 12.361 -6.342 1.00 0.00 C ATOM 2078 CD1 ILE B 62 14.276 10.723 -3.807 1.00 0.00 C ATOM 0 H ILE B 62 17.650 10.684 -5.503 1.00 0.00 H new ATOM 0 HA ILE B 62 15.784 10.530 -7.659 1.00 0.00 H new ATOM 0 HB ILE B 62 15.951 12.286 -5.172 1.00 0.00 H new ATOM 0 HG12 ILE B 62 14.322 9.762 -5.742 1.00 0.00 H new ATOM 0 HG13 ILE B 62 15.861 9.745 -4.904 1.00 0.00 H new ATOM 0 HG21 ILE B 62 13.519 12.619 -5.491 1.00 0.00 H new ATOM 0 HG22 ILE B 62 14.443 13.271 -6.866 1.00 0.00 H new ATOM 0 HG23 ILE B 62 13.596 11.713 -7.021 1.00 0.00 H new ATOM 0 HD11 ILE B 62 13.981 9.812 -3.285 1.00 0.00 H new ATOM 0 HD12 ILE B 62 14.952 11.300 -3.176 1.00 0.00 H new ATOM 0 HD13 ILE B 62 13.390 11.318 -4.028 1.00 0.00 H new ATOM 2090 N ASN B 63 17.471 13.355 -7.416 1.00 0.00 N ATOM 2091 CA ASN B 63 17.799 14.587 -8.189 1.00 0.00 C ATOM 2092 C ASN B 63 18.921 14.282 -9.184 1.00 0.00 C ATOM 2093 O ASN B 63 18.972 14.836 -10.264 1.00 0.00 O ATOM 2094 CB ASN B 63 18.255 15.686 -7.227 1.00 0.00 C ATOM 2095 CG ASN B 63 17.434 16.954 -7.471 1.00 0.00 C ATOM 2096 OD1 ASN B 63 16.221 16.930 -7.398 1.00 0.00 O ATOM 2097 ND2 ASN B 63 18.048 18.069 -7.762 1.00 0.00 N ATOM 0 H ASN B 63 17.978 13.245 -6.538 1.00 0.00 H new ATOM 0 HA ASN B 63 16.915 14.922 -8.731 1.00 0.00 H new ATOM 0 HB2 ASN B 63 18.133 15.354 -6.196 1.00 0.00 H new ATOM 0 HB3 ASN B 63 19.315 15.893 -7.372 1.00 0.00 H new ATOM 0 HD21 ASN B 63 17.510 18.919 -7.928 1.00 0.00 H new ATOM 0 HD22 ASN B 63 19.066 18.090 -7.823 1.00 0.00 H new ATOM 2104 N SER B 64 19.820 13.407 -8.830 1.00 0.00 N ATOM 2105 CA SER B 64 20.937 13.070 -9.757 1.00 0.00 C ATOM 2106 C SER B 64 20.366 12.511 -11.062 1.00 0.00 C ATOM 2107 O SER B 64 20.986 12.588 -12.105 1.00 0.00 O ATOM 2108 CB SER B 64 21.841 12.021 -9.106 1.00 0.00 C ATOM 2109 OG SER B 64 22.808 11.578 -10.048 1.00 0.00 O ATOM 0 H SER B 64 19.830 12.910 -7.939 1.00 0.00 H new ATOM 0 HA SER B 64 21.517 13.968 -9.969 1.00 0.00 H new ATOM 0 HB2 SER B 64 22.336 12.444 -8.232 1.00 0.00 H new ATOM 0 HB3 SER B 64 21.245 11.178 -8.757 1.00 0.00 H new ATOM 0 HG SER B 64 23.388 10.907 -9.631 1.00 0.00 H new ATOM 2115 N LEU B 65 19.190 11.949 -11.014 1.00 0.00 N ATOM 2116 CA LEU B 65 18.581 11.387 -12.252 1.00 0.00 C ATOM 2117 C LEU B 65 18.021 12.525 -13.107 1.00 0.00 C ATOM 2118 O LEU B 65 18.623 12.940 -14.078 1.00 0.00 O ATOM 2119 CB LEU B 65 17.449 10.429 -11.874 1.00 0.00 C ATOM 2120 CG LEU B 65 18.039 9.075 -11.473 1.00 0.00 C ATOM 2121 CD1 LEU B 65 17.014 8.299 -10.642 1.00 0.00 C ATOM 2122 CD2 LEU B 65 18.383 8.276 -12.731 1.00 0.00 C ATOM 0 H LEU B 65 18.624 11.855 -10.171 1.00 0.00 H new ATOM 0 HA LEU B 65 19.341 10.847 -12.818 1.00 0.00 H new ATOM 0 HB2 LEU B 65 16.868 10.843 -11.050 1.00 0.00 H new ATOM 0 HB3 LEU B 65 16.767 10.306 -12.715 1.00 0.00 H new ATOM 0 HG LEU B 65 18.942 9.232 -10.884 1.00 0.00 H new ATOM 0 HD11 LEU B 65 17.433 7.334 -10.356 1.00 0.00 H new ATOM 0 HD12 LEU B 65 16.767 8.868 -9.746 1.00 0.00 H new ATOM 0 HD13 LEU B 65 16.111 8.142 -11.232 1.00 0.00 H new ATOM 0 HD21 LEU B 65 18.803 7.312 -12.446 1.00 0.00 H new ATOM 0 HD22 LEU B 65 17.480 8.118 -13.320 1.00 0.00 H new ATOM 0 HD23 LEU B 65 19.112 8.828 -13.325 1.00 0.00 H new