USER MOD reduce.3.24.130724 H: found=0, std=0, add=608, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 615 hydrogens (4 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 NoAdj : A 178 ASNHD21 : A 178 ASN OD1 : A 246 CACA :(metal ligand) USER MOD NoAdj : A 178 ASNHD22 : A 178 ASN OD1 : A 246 CACA :(metal ligand) USER MOD NoAdj : A 217 ASNHD21 : A 217 ASN OD1 : A 247 CACA :(metal ligand) USER MOD NoAdj : A 217 ASNHD22 : A 217 ASN OD1 : A 247 CACA :(metal ligand) USER MOD Single : A 159 LYS NZ :NH3+ -155:sc= -0.0177 (180deg=-0.311) USER MOD Single : A 165 SER OG : rot -50:sc= 0.103 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 SER OG : rot 14:sc= 0.99 USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 TYR OH : rot 180:sc= -0.197 USER MOD Single : A 193 TYR OH : rot 110:sc= -3.74! USER MOD Single : A 194 ASN : amide:sc= -2.21 K(o=-2.2,f=-3.6!) USER MOD Single : A 196 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00316) USER MOD Single : A 197 SER OG : rot 180:sc= 0 USER MOD Single : A 198 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 199 SER OG : rot 180:sc= 0 USER MOD Single : A 207 SER OG : rot 180:sc= 0 USER MOD Single : A 209 ASN : amide:sc= 0.0289 X(o=0.029,f=0) USER MOD Single : A 210 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 213 GLN : amide:sc= -3 K(o=-3,f=-2.4) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 222 TYR OH : rot 180:sc= 0 USER MOD Single : A 223 THR OG1 : rot 21:sc= -0.292 USER MOD Single : A 225 TYR OH : rot 49:sc= -3.02! USER MOD Single : A 229 LYS NZ :NH3+ -178:sc= -0.0126 (180deg=-0.0204) USER MOD Single : A 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 238 GLN : amide:sc= -0.0584 X(o=-0.058,f=0) USER MOD Single : A 239 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 SER OG : rot 180:sc= 0 USER MOD Single : A 245 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 159 15.026 7.797 -14.890 -0.10 0.02 N ATOM 2 CA LYS A 159 15.469 7.204 -13.601 0.22 0.02 C ATOM 3 C LYS A 159 16.202 8.231 -12.744 0.48 0.02 C ATOM 4 O LYS A 159 16.429 9.363 -13.172 -0.48 0.02 O ATOM 5 CB LYS A 159 16.384 6.015 -13.900 -0.20 0.02 C ATOM 6 CG LYS A 159 15.740 4.960 -14.785 -0.20 0.02 C ATOM 7 CD LYS A 159 14.533 4.325 -14.111 -0.20 0.02 C ATOM 8 CE LYS A 159 14.615 2.807 -14.135 0.30 5.02 C ATOM 9 NZ LYS A 159 14.765 2.280 -15.520 -0.81 0.02 N ATOM 0 HA LYS A 159 14.595 6.874 -13.040 0.22 0.02 H new ATOM 0 HB2 LYS A 159 17.291 6.378 -14.383 -0.20 0.02 H new ATOM 0 HB3 LYS A 159 16.686 5.554 -12.960 -0.20 0.02 H new ATOM 0 HG2 LYS A 159 15.434 5.413 -15.728 -0.20 0.02 H new ATOM 0 HG3 LYS A 159 16.472 4.188 -15.024 -0.20 0.02 H new ATOM 0 HD2 LYS A 159 14.468 4.670 -13.079 -0.20 0.02 H new ATOM 0 HD3 LYS A 159 13.622 4.649 -14.614 -0.20 0.02 H new ATOM 0 HE2 LYS A 159 15.460 2.480 -13.529 0.30 5.02 H new ATOM 0 HE3 LYS A 159 13.716 2.388 -13.683 0.30 5.02 H new ATOM 0 HZ1 LYS A 159 14.403 1.306 -15.562 -0.81 0.02 H new ATOM 0 HZ2 LYS A 159 14.227 2.878 -16.179 -0.81 0.02 H new ATOM 0 HZ3 LYS A 159 15.770 2.288 -15.788 -0.81 0.02 H new ATOM 25 N ASP A 160 16.571 7.829 -11.532 -0.36 0.02 N ATOM 26 CA ASP A 160 17.279 8.715 -10.614 1.00 0.01 C ATOM 27 C ASP A 160 18.079 7.913 -9.591 0.48 0.02 C ATOM 28 O ASP A 160 19.290 7.741 -9.732 -0.48 0.02 O ATOM 29 CB ASP A 160 16.297 9.651 -9.898 -0.45 0.01 C ATOM 30 CG ASP A 160 14.914 9.045 -9.735 0.49 0.01 C ATOM 31 OD1 ASP A 160 14.774 8.081 -8.950 -0.62 0.01 O ATOM 32 OD2 ASP A 160 13.972 9.534 -10.391 -0.62 0.01 O ATOM 0 H ASP A 160 16.392 6.895 -11.162 -0.36 0.02 H new ATOM 0 HA ASP A 160 17.973 9.318 -11.200 1.00 0.01 H new ATOM 0 HB2 ASP A 160 16.695 9.904 -8.915 -0.45 0.01 H new ATOM 0 HB3 ASP A 160 16.216 10.582 -10.459 -0.45 0.01 H new ATOM 37 N VAL A 161 17.395 7.422 -8.563 -0.36 0.01 N ATOM 38 CA VAL A 161 18.038 6.638 -7.518 1.00 0.01 C ATOM 39 C VAL A 161 17.012 5.804 -6.759 0.48 0.01 C ATOM 40 O VAL A 161 15.819 6.121 -6.766 -0.48 0.01 O ATOM 41 CB VAL A 161 18.798 7.539 -6.524 -0.10 0.01 C ATOM 42 CG1 VAL A 161 17.842 8.494 -5.824 -0.30 0.02 C ATOM 43 CG2 VAL A 161 19.560 6.697 -5.512 -0.30 0.02 C ATOM 0 H VAL A 161 16.392 7.554 -8.432 -0.36 0.01 H new ATOM 0 HA VAL A 161 18.753 5.976 -8.007 1.00 0.01 H new ATOM 0 HB VAL A 161 19.520 8.133 -7.084 -0.10 0.01 H new ATOM 0 HG11 VAL A 161 18.399 9.120 -5.127 -0.30 0.02 H new ATOM 0 HG12 VAL A 161 17.350 9.124 -6.565 -0.30 0.02 H new ATOM 0 HG13 VAL A 161 17.092 7.922 -5.278 -0.30 0.02 H new ATOM 0 HG21 VAL A 161 20.090 7.351 -4.820 -0.30 0.02 H new ATOM 0 HG22 VAL A 161 18.860 6.072 -4.957 -0.30 0.02 H new ATOM 0 HG23 VAL A 161 20.278 6.063 -6.033 -0.30 0.02 H new ATOM 53 N ASP A 162 17.484 4.736 -6.110 -0.36 0.01 N ATOM 54 CA ASP A 162 16.614 3.844 -5.344 1.00 0.01 C ATOM 55 C ASP A 162 15.339 3.530 -6.119 0.48 0.01 C ATOM 56 O ASP A 162 14.435 4.359 -6.206 -0.48 0.02 O ATOM 57 CB ASP A 162 16.264 4.474 -3.994 -0.45 0.01 C ATOM 58 CG ASP A 162 17.408 4.389 -3.002 0.49 0.02 C ATOM 59 OD1 ASP A 162 17.561 3.328 -2.362 -0.62 0.02 O ATOM 60 OD2 ASP A 162 18.149 5.385 -2.864 -0.62 0.02 O ATOM 0 H ASP A 162 18.468 4.469 -6.101 -0.36 0.01 H new ATOM 0 HA ASP A 162 17.152 2.911 -5.173 1.00 0.01 H new ATOM 0 HB2 ASP A 162 15.993 5.519 -4.143 -0.45 0.01 H new ATOM 0 HB3 ASP A 162 15.389 3.974 -3.579 -0.45 0.01 H new ATOM 65 N GLU A 163 15.264 2.334 -6.688 -0.36 0.02 N ATOM 66 CA GLU A 163 14.091 1.950 -7.454 1.00 0.02 C ATOM 67 C GLU A 163 13.309 0.858 -6.742 0.48 0.02 C ATOM 68 O GLU A 163 12.099 0.969 -6.548 -0.48 0.02 O ATOM 69 CB GLU A 163 14.496 1.493 -8.857 -0.20 0.01 C ATOM 70 CG GLU A 163 15.549 2.380 -9.503 -0.45 0.01 C ATOM 71 CD GLU A 163 15.085 3.816 -9.676 0.49 0.01 C ATOM 72 OE1 GLU A 163 14.629 4.421 -8.681 -0.62 0.01 O ATOM 73 OE2 GLU A 163 15.178 4.336 -10.808 -0.62 0.01 O ATOM 0 H GLU A 163 15.993 1.622 -6.634 -0.36 0.02 H new ATOM 0 HA GLU A 163 13.444 2.823 -7.545 1.00 0.02 H new ATOM 0 HB2 GLU A 163 14.875 0.473 -8.803 -0.20 0.01 H new ATOM 0 HB3 GLU A 163 13.611 1.471 -9.493 -0.20 0.01 H new ATOM 0 HG2 GLU A 163 16.453 2.366 -8.893 -0.45 0.01 H new ATOM 0 HG3 GLU A 163 15.815 1.969 -10.477 -0.45 0.01 H new ATOM 80 N CYS A 164 14.011 -0.191 -6.345 -0.36 0.02 N ATOM 81 CA CYS A 164 13.389 -1.302 -5.642 1.00 0.02 C ATOM 82 C CYS A 164 13.951 -1.426 -4.227 0.48 0.02 C ATOM 83 O CYS A 164 13.467 -2.220 -3.421 -0.48 0.02 O ATOM 84 CB CYS A 164 13.593 -2.592 -6.428 0.20 0.02 C ATOM 85 SG CYS A 164 13.175 -2.432 -8.195 -0.20 0.02 S ATOM 0 H CYS A 164 15.014 -0.297 -6.498 -0.36 0.02 H new ATOM 0 HA CYS A 164 12.319 -1.114 -5.558 1.00 0.02 H new ATOM 0 HB2 CYS A 164 14.633 -2.906 -6.334 0.20 0.02 H new ATOM 0 HB3 CYS A 164 12.981 -3.379 -5.987 0.20 0.02 H new ATOM 90 N SER A 165 14.962 -0.612 -3.929 -0.36 0.02 N ATOM 91 CA SER A 165 15.581 -0.596 -2.612 1.00 0.02 C ATOM 92 C SER A 165 15.265 0.723 -1.907 0.48 0.02 C ATOM 93 O SER A 165 15.966 1.126 -0.979 -0.48 0.02 O ATOM 94 CB SER A 165 17.096 -0.771 -2.735 0.08 0.02 C ATOM 95 OG SER A 165 17.663 -1.192 -1.505 -0.68 0.02 O ATOM 0 H SER A 165 15.370 0.049 -4.590 -0.36 0.02 H new ATOM 0 HA SER A 165 15.180 -1.422 -2.025 1.00 0.02 H new ATOM 0 HB2 SER A 165 17.319 -1.503 -3.511 0.08 0.02 H new ATOM 0 HB3 SER A 165 17.550 0.170 -3.045 0.08 0.02 H new ATOM 0 HG SER A 165 17.351 -0.607 -0.784 -0.68 0.02 H new ATOM 101 N LEU A 166 14.203 1.393 -2.363 -0.36 0.02 N ATOM 102 CA LEU A 166 13.793 2.669 -1.786 1.00 0.02 C ATOM 103 C LEU A 166 13.194 2.467 -0.400 0.48 0.02 C ATOM 104 O LEU A 166 13.423 3.262 0.511 -0.48 0.02 O ATOM 105 CB LEU A 166 12.776 3.360 -2.702 -0.20 0.02 C ATOM 106 CG LEU A 166 12.636 4.873 -2.500 -0.10 0.02 C ATOM 107 CD1 LEU A 166 13.556 5.624 -3.450 -0.30 0.02 C ATOM 108 CD2 LEU A 166 11.189 5.309 -2.699 -0.30 0.02 C ATOM 0 H LEU A 166 13.614 1.070 -3.130 -0.36 0.02 H new ATOM 0 HA LEU A 166 14.675 3.302 -1.692 1.00 0.02 H new ATOM 0 HB2 LEU A 166 13.059 3.173 -3.738 -0.20 0.02 H new ATOM 0 HB3 LEU A 166 11.801 2.898 -2.549 -0.20 0.02 H new ATOM 0 HG LEU A 166 12.928 5.112 -1.477 -0.10 0.02 H new ATOM 0 HD11 LEU A 166 13.444 6.697 -3.293 -0.30 0.02 H new ATOM 0 HD12 LEU A 166 14.590 5.336 -3.259 -0.30 0.02 H new ATOM 0 HD13 LEU A 166 13.295 5.379 -4.479 -0.30 0.02 H new ATOM 0 HD21 LEU A 166 11.110 6.386 -2.551 -0.30 0.02 H new ATOM 0 HD22 LEU A 166 10.869 5.057 -3.710 -0.30 0.02 H new ATOM 0 HD23 LEU A 166 10.552 4.796 -1.978 -0.30 0.02 H new ATOM 120 N LYS A 167 12.429 1.392 -0.249 -0.36 0.02 N ATOM 121 CA LYS A 167 11.797 1.072 1.023 1.00 0.02 C ATOM 122 C LYS A 167 12.312 -0.264 1.554 0.48 0.02 C ATOM 123 O LYS A 167 12.960 -1.017 0.827 -0.48 0.02 O ATOM 124 CB LYS A 167 10.276 1.024 0.858 -0.20 0.02 C ATOM 125 CG LYS A 167 9.580 2.313 1.265 -0.20 0.02 C ATOM 126 CD LYS A 167 8.136 2.063 1.671 -0.20 0.02 C ATOM 127 CE LYS A 167 7.329 1.468 0.528 0.30 5.02 C ATOM 128 NZ LYS A 167 6.488 0.324 0.978 -0.81 0.02 N ATOM 0 H LYS A 167 12.232 0.726 -0.996 -0.36 0.02 H new ATOM 0 HA LYS A 167 12.049 1.851 1.742 1.00 0.02 H new ATOM 0 HB2 LYS A 167 10.038 0.805 -0.183 -0.20 0.02 H new ATOM 0 HB3 LYS A 167 9.880 0.202 1.455 -0.20 0.02 H new ATOM 0 HG2 LYS A 167 10.118 2.772 2.095 -0.20 0.02 H new ATOM 0 HG3 LYS A 167 9.609 3.020 0.436 -0.20 0.02 H new ATOM 0 HD2 LYS A 167 8.109 1.388 2.526 -0.20 0.02 H new ATOM 0 HD3 LYS A 167 7.680 3.000 1.990 -0.20 0.02 H new ATOM 0 HE2 LYS A 167 6.692 2.238 0.094 0.30 5.02 H new ATOM 0 HE3 LYS A 167 8.006 1.134 -0.259 0.30 5.02 H new ATOM 0 HZ1 LYS A 167 5.954 -0.053 0.169 -0.81 0.02 H new ATOM 0 HZ2 LYS A 167 7.098 -0.422 1.369 -0.81 0.02 H new ATOM 0 HZ3 LYS A 167 5.825 0.648 1.710 -0.81 0.02 H new ATOM 142 N PRO A 168 12.034 -0.580 2.831 -0.36 0.02 N ATOM 143 CA PRO A 168 12.475 -1.832 3.448 1.00 0.02 C ATOM 144 C PRO A 168 12.179 -3.044 2.569 0.48 0.02 C ATOM 145 O PRO A 168 12.937 -4.014 2.557 -0.48 0.02 O ATOM 146 CB PRO A 168 11.673 -1.905 4.759 -0.20 0.02 C ATOM 147 CG PRO A 168 10.685 -0.783 4.698 -0.20 0.02 C ATOM 148 CD PRO A 168 11.272 0.244 3.775 0.06 0.02 C ATOM 0 HA PRO A 168 13.554 -1.847 3.602 1.00 0.02 H new ATOM 0 HB2 PRO A 168 11.167 -2.866 4.855 -0.20 0.02 H new ATOM 0 HB3 PRO A 168 12.328 -1.802 5.624 -0.20 0.02 H new ATOM 0 HG2 PRO A 168 9.721 -1.133 4.328 -0.20 0.02 H new ATOM 0 HG3 PRO A 168 10.512 -0.362 5.689 -0.20 0.02 H new ATOM 0 HD2 PRO A 168 10.500 0.828 3.273 0.06 0.02 H new ATOM 0 HD3 PRO A 168 11.911 0.950 4.306 0.06 0.02 H new ATOM 156 N SER A 169 11.074 -2.980 1.833 -0.36 0.02 N ATOM 157 CA SER A 169 10.681 -4.072 0.949 1.00 0.02 C ATOM 158 C SER A 169 9.698 -3.588 -0.114 0.48 0.02 C ATOM 159 O SER A 169 8.503 -3.456 0.149 -0.48 0.02 O ATOM 160 CB SER A 169 10.054 -5.209 1.757 0.08 0.02 C ATOM 161 OG SER A 169 11.043 -5.937 2.464 -0.68 0.02 O ATOM 0 H SER A 169 10.435 -2.185 1.831 -0.36 0.02 H new ATOM 0 HA SER A 169 11.577 -4.440 0.449 1.00 0.02 H new ATOM 0 HB2 SER A 169 9.326 -4.802 2.459 0.08 0.02 H new ATOM 0 HB3 SER A 169 9.513 -5.879 1.089 0.08 0.02 H new ATOM 0 HG SER A 169 11.882 -5.430 2.468 -0.68 0.02 H new ATOM 167 N ILE A 170 10.206 -3.327 -1.316 -0.36 0.02 N ATOM 168 CA ILE A 170 9.363 -2.862 -2.413 1.00 0.02 C ATOM 169 C ILE A 170 9.009 -3.996 -3.361 0.48 0.02 C ATOM 170 O ILE A 170 7.937 -4.593 -3.264 -0.48 0.02 O ATOM 171 CB ILE A 170 10.044 -1.758 -3.242 -0.10 0.02 C ATOM 172 CG1 ILE A 170 10.480 -0.588 -2.353 -0.20 0.02 C ATOM 173 CG2 ILE A 170 9.116 -1.284 -4.346 -0.30 0.02 C ATOM 174 CD1 ILE A 170 9.929 0.750 -2.804 -0.30 0.02 C ATOM 0 H ILE A 170 11.193 -3.429 -1.554 -0.36 0.02 H new ATOM 0 HA ILE A 170 8.463 -2.465 -1.943 1.00 0.02 H new ATOM 0 HB ILE A 170 10.941 -2.176 -3.698 -0.10 0.02 H new ATOM 0 HG12 ILE A 170 10.157 -0.779 -1.330 -0.20 0.02 H new ATOM 0 HG13 ILE A 170 11.569 -0.538 -2.339 -0.20 0.02 H new ATOM 0 HG21 ILE A 170 9.609 -0.503 -4.925 -0.30 0.02 H new ATOM 0 HG22 ILE A 170 8.871 -2.121 -5.000 -0.30 0.02 H new ATOM 0 HG23 ILE A 170 8.201 -0.887 -3.907 -0.30 0.02 H new ATOM 0 HD11 ILE A 170 10.277 1.533 -2.130 -0.30 0.02 H new ATOM 0 HD12 ILE A 170 10.273 0.963 -3.816 -0.30 0.02 H new ATOM 0 HD13 ILE A 170 8.840 0.718 -2.791 -0.30 0.02 H new ATOM 186 N CYS A 171 9.912 -4.270 -4.299 -0.36 0.02 N ATOM 187 CA CYS A 171 9.688 -5.304 -5.280 1.00 0.02 C ATOM 188 C CYS A 171 10.953 -6.124 -5.519 0.48 0.02 C ATOM 189 O CYS A 171 11.317 -6.406 -6.660 -0.48 0.02 O ATOM 190 CB CYS A 171 9.165 -4.672 -6.577 0.20 0.02 C ATOM 191 SG CYS A 171 7.358 -4.825 -6.779 -0.20 0.02 S ATOM 0 H CYS A 171 10.804 -3.784 -4.392 -0.36 0.02 H new ATOM 0 HA CYS A 171 8.935 -5.996 -4.903 1.00 0.02 H new ATOM 0 HB2 CYS A 171 9.437 -3.617 -6.594 0.20 0.02 H new ATOM 0 HB3 CYS A 171 9.659 -5.142 -7.427 0.20 0.02 H new ATOM 196 N GLY A 172 11.603 -6.512 -4.413 -0.36 0.02 N ATOM 197 CA GLY A 172 12.822 -7.315 -4.468 -0.10 0.02 C ATOM 198 C GLY A 172 13.597 -7.147 -5.758 0.48 0.02 C ATOM 199 O GLY A 172 13.944 -8.132 -6.409 -0.48 0.02 O ATOM 0 H GLY A 172 11.299 -6.279 -3.468 -0.36 0.02 H new ATOM 0 HA2 GLY A 172 13.464 -7.045 -3.630 -0.10 0.02 H new ATOM 0 HA3 GLY A 172 12.561 -8.366 -4.344 -0.10 0.02 H new ATOM 203 N THR A 173 13.861 -5.891 -6.120 -0.36 0.02 N ATOM 204 CA THR A 173 14.590 -5.556 -7.336 1.00 0.02 C ATOM 205 C THR A 173 14.426 -6.637 -8.404 0.48 0.02 C ATOM 206 O THR A 173 15.394 -7.073 -9.026 -0.48 0.02 O ATOM 207 CB THR A 173 16.060 -5.316 -7.008 0.18 0.02 C ATOM 208 OG1 THR A 173 16.238 -5.124 -5.616 -0.68 0.02 O ATOM 209 CG2 THR A 173 16.645 -4.107 -7.715 -0.30 0.02 C ATOM 0 H THR A 173 13.573 -5.078 -5.575 -0.36 0.02 H new ATOM 0 HA THR A 173 14.171 -4.638 -7.749 1.00 0.02 H new ATOM 0 HB THR A 173 16.581 -6.208 -7.356 0.18 0.02 H new ATOM 0 HG1 THR A 173 17.187 -4.973 -5.425 -0.68 0.02 H new ATOM 0 HG21 THR A 173 17.693 -3.995 -7.437 -0.30 0.02 H new ATOM 0 HG22 THR A 173 16.568 -4.244 -8.794 -0.30 0.02 H new ATOM 0 HG23 THR A 173 16.094 -3.213 -7.423 -0.30 0.02 H new ATOM 217 N ALA A 174 13.176 -7.055 -8.602 -0.36 0.02 N ATOM 218 CA ALA A 174 12.841 -8.078 -9.585 1.00 0.02 C ATOM 219 C ALA A 174 12.799 -7.469 -10.980 0.48 0.02 C ATOM 220 O ALA A 174 13.655 -7.735 -11.823 -0.48 0.02 O ATOM 221 CB ALA A 174 11.490 -8.705 -9.235 -0.30 0.02 C ATOM 0 H ALA A 174 12.373 -6.695 -8.087 -0.36 0.02 H new ATOM 0 HA ALA A 174 13.605 -8.855 -9.570 1.00 0.02 H new ATOM 0 HB1 ALA A 174 11.242 -9.469 -9.971 -0.30 0.02 H new ATOM 0 HB2 ALA A 174 11.545 -9.159 -8.245 -0.30 0.02 H new ATOM 0 HB3 ALA A 174 10.719 -7.934 -9.238 -0.30 0.02 H new ATOM 227 N VAL A 175 11.798 -6.634 -11.191 -0.36 0.02 N ATOM 228 CA VAL A 175 11.600 -5.936 -12.453 1.00 0.02 C ATOM 229 C VAL A 175 10.726 -4.720 -12.197 0.48 0.02 C ATOM 230 O VAL A 175 9.667 -4.553 -12.803 -0.48 0.02 O ATOM 231 CB VAL A 175 10.930 -6.838 -13.511 -0.10 0.02 C ATOM 232 CG1 VAL A 175 10.817 -6.110 -14.841 -0.30 0.02 C ATOM 233 CG2 VAL A 175 11.700 -8.140 -13.674 -0.30 0.02 C ATOM 0 H VAL A 175 11.092 -6.418 -10.487 -0.36 0.02 H new ATOM 0 HA VAL A 175 12.574 -5.642 -12.843 1.00 0.02 H new ATOM 0 HB VAL A 175 9.924 -7.079 -13.167 -0.10 0.02 H new ATOM 0 HG11 VAL A 175 10.342 -6.762 -15.574 -0.30 0.02 H new ATOM 0 HG12 VAL A 175 10.216 -5.210 -14.713 -0.30 0.02 H new ATOM 0 HG13 VAL A 175 11.812 -5.835 -15.191 -0.30 0.02 H new ATOM 0 HG21 VAL A 175 11.210 -8.761 -14.424 -0.30 0.02 H new ATOM 0 HG22 VAL A 175 12.720 -7.922 -13.992 -0.30 0.02 H new ATOM 0 HG23 VAL A 175 11.722 -8.671 -12.722 -0.30 0.02 H new ATOM 243 N CYS A 176 11.163 -3.898 -11.249 -0.36 0.02 N ATOM 244 CA CYS A 176 10.410 -2.720 -10.851 1.00 0.02 C ATOM 245 C CYS A 176 10.957 -1.429 -11.441 0.48 0.02 C ATOM 246 O CYS A 176 12.102 -1.049 -11.196 -0.48 0.02 O ATOM 247 CB CYS A 176 10.360 -2.595 -9.319 0.20 0.02 C ATOM 248 SG CYS A 176 11.555 -3.633 -8.410 -0.20 0.02 S ATOM 0 H CYS A 176 12.038 -4.029 -10.742 -0.36 0.02 H new ATOM 0 HA CYS A 176 9.405 -2.862 -11.249 1.00 0.02 H new ATOM 0 HB2 CYS A 176 10.532 -1.553 -9.051 0.20 0.02 H new ATOM 0 HB3 CYS A 176 9.355 -2.849 -8.983 0.20 0.02 H new ATOM 253 N LYS A 177 10.096 -0.732 -12.173 -0.36 0.02 N ATOM 254 CA LYS A 177 10.442 0.553 -12.750 1.00 0.02 C ATOM 255 C LYS A 177 10.055 1.634 -11.751 0.48 0.02 C ATOM 256 O LYS A 177 8.871 1.853 -11.487 -0.48 0.02 O ATOM 257 CB LYS A 177 9.714 0.769 -14.079 -0.20 0.02 C ATOM 258 CG LYS A 177 10.264 -0.071 -15.219 -0.20 0.02 C ATOM 259 CD LYS A 177 9.774 -1.508 -15.139 -0.20 0.02 C ATOM 260 CE LYS A 177 9.405 -2.049 -16.512 0.30 5.02 C ATOM 261 NZ LYS A 177 7.941 -1.958 -16.770 -0.81 0.02 N ATOM 0 H LYS A 177 9.147 -1.042 -12.380 -0.36 0.02 H new ATOM 0 HA LYS A 177 11.512 0.591 -12.955 1.00 0.02 H new ATOM 0 HB2 LYS A 177 8.657 0.538 -13.946 -0.20 0.02 H new ATOM 0 HB3 LYS A 177 9.778 1.822 -14.352 -0.20 0.02 H new ATOM 0 HG2 LYS A 177 9.963 0.365 -16.172 -0.20 0.02 H new ATOM 0 HG3 LYS A 177 11.354 -0.055 -15.191 -0.20 0.02 H new ATOM 0 HD2 LYS A 177 10.549 -2.134 -14.697 -0.20 0.02 H new ATOM 0 HD3 LYS A 177 8.907 -1.562 -14.481 -0.20 0.02 H new ATOM 0 HE2 LYS A 177 9.944 -1.492 -17.278 0.30 5.02 H new ATOM 0 HE3 LYS A 177 9.723 -3.089 -16.590 0.30 5.02 H new ATOM 0 HZ1 LYS A 177 7.731 -2.337 -17.716 -0.81 0.02 H new ATOM 0 HZ2 LYS A 177 7.427 -2.510 -16.054 -0.81 0.02 H new ATOM 0 HZ3 LYS A 177 7.641 -0.963 -16.721 -0.81 0.02 H new ATOM 275 N ASN A 178 11.052 2.273 -11.158 -0.36 0.02 N ATOM 276 CA ASN A 178 10.801 3.292 -10.150 1.00 0.01 C ATOM 277 C ASN A 178 10.981 4.699 -10.699 0.48 0.02 C ATOM 278 O ASN A 178 11.558 4.900 -11.767 -0.48 0.02 O ATOM 279 CB ASN A 178 11.730 3.079 -8.960 -0.20 0.01 C ATOM 280 CG ASN A 178 11.290 3.842 -7.726 0.48 0.01 C ATOM 281 OD1 ASN A 178 11.463 5.058 -7.638 -0.48 0.01 O ATOM 282 ND2 ASN A 178 10.723 3.128 -6.761 -0.52 0.01 N ATOM 0 H ASN A 178 12.038 2.105 -11.356 -0.36 0.02 H new ATOM 0 HA ASN A 178 9.762 3.194 -9.835 1.00 0.01 H new ATOM 0 HB2 ASN A 178 11.776 2.015 -8.727 -0.20 0.01 H new ATOM 0 HB3 ASN A 178 12.739 3.389 -9.233 -0.20 0.01 H new ATOM 0 HD21 ASN A 178 10.411 3.585 -5.904 -0.52 0.01 H new ATOM 0 HD22 ASN A 178 10.599 2.122 -6.876 -0.52 0.01 H new ATOM 289 N ILE A 179 10.480 5.668 -9.944 -0.36 0.01 N ATOM 290 CA ILE A 179 10.572 7.067 -10.321 1.00 0.01 C ATOM 291 C ILE A 179 10.972 7.915 -9.110 0.48 0.01 C ATOM 292 O ILE A 179 11.035 7.406 -7.987 -0.48 0.01 O ATOM 293 CB ILE A 179 9.235 7.557 -10.915 -0.10 0.01 C ATOM 294 CG1 ILE A 179 8.091 7.345 -9.920 -0.20 0.02 C ATOM 295 CG2 ILE A 179 8.954 6.824 -12.219 -0.30 0.02 C ATOM 296 CD1 ILE A 179 6.714 7.471 -10.541 -0.30 5.62 C ATOM 0 H ILE A 179 10.001 5.505 -9.058 -0.36 0.01 H new ATOM 0 HA ILE A 179 11.341 7.173 -11.086 1.00 0.01 H new ATOM 0 HB ILE A 179 9.309 8.625 -11.118 -0.10 0.01 H new ATOM 0 HG12 ILE A 179 8.189 6.356 -9.472 -0.20 0.02 H new ATOM 0 HG13 ILE A 179 8.184 8.071 -9.113 -0.20 0.02 H new ATOM 0 HG21 ILE A 179 8.009 7.172 -12.636 -0.30 0.02 H new ATOM 0 HG22 ILE A 179 9.758 7.021 -12.928 -0.30 0.02 H new ATOM 0 HG23 ILE A 179 8.893 5.753 -12.028 -0.30 0.02 H new ATOM 0 HD11 ILE A 179 5.954 7.309 -9.777 -0.30 5.62 H new ATOM 0 HD12 ILE A 179 6.596 8.468 -10.964 -0.30 5.62 H new ATOM 0 HD13 ILE A 179 6.601 6.727 -11.329 -0.30 5.62 H new ATOM 308 N PRO A 180 11.278 9.211 -9.318 -0.36 0.01 N ATOM 309 CA PRO A 180 11.701 10.112 -8.240 1.00 0.01 C ATOM 310 C PRO A 180 10.929 9.931 -6.935 0.48 0.01 C ATOM 311 O PRO A 180 11.453 10.212 -5.858 -0.48 0.02 O ATOM 312 CB PRO A 180 11.441 11.490 -8.838 -0.20 0.01 C ATOM 313 CG PRO A 180 11.709 11.308 -10.291 -0.20 0.02 C ATOM 314 CD PRO A 180 11.265 9.905 -10.625 0.06 0.01 C ATOM 0 HA PRO A 180 12.735 9.928 -7.948 1.00 0.01 H new ATOM 0 HB2 PRO A 180 10.416 11.816 -8.659 -0.20 0.01 H new ATOM 0 HB3 PRO A 180 12.096 12.244 -8.403 -0.20 0.01 H new ATOM 0 HG2 PRO A 180 11.162 12.041 -10.883 -0.20 0.02 H new ATOM 0 HG3 PRO A 180 12.767 11.445 -10.512 -0.20 0.02 H new ATOM 0 HD2 PRO A 180 10.271 9.896 -11.073 0.06 0.01 H new ATOM 0 HD3 PRO A 180 11.940 9.430 -11.337 0.06 0.01 H new ATOM 322 N GLY A 181 9.689 9.468 -7.027 -0.36 0.02 N ATOM 323 CA GLY A 181 8.895 9.275 -5.824 -0.10 0.02 C ATOM 324 C GLY A 181 7.727 8.324 -6.012 0.48 0.02 C ATOM 325 O GLY A 181 6.606 8.623 -5.600 -0.48 0.02 O ATOM 0 H GLY A 181 9.221 9.225 -7.900 -0.36 0.02 H new ATOM 0 HA2 GLY A 181 9.539 8.894 -5.031 -0.10 0.02 H new ATOM 0 HA3 GLY A 181 8.516 10.241 -5.490 -0.10 0.02 H new ATOM 329 N ASP A 182 7.989 7.172 -6.617 -0.36 0.02 N ATOM 330 CA ASP A 182 6.954 6.170 -6.837 1.00 0.02 C ATOM 331 C ASP A 182 7.586 4.879 -7.332 0.48 0.02 C ATOM 332 O ASP A 182 8.801 4.719 -7.255 -0.48 0.02 O ATOM 333 CB ASP A 182 5.909 6.674 -7.831 -0.45 0.02 C ATOM 334 CG ASP A 182 4.509 6.678 -7.247 0.49 0.02 C ATOM 335 OD1 ASP A 182 4.261 5.905 -6.297 -0.62 0.02 O ATOM 336 OD2 ASP A 182 3.662 7.453 -7.738 -0.62 0.02 O ATOM 0 H ASP A 182 8.911 6.908 -6.964 -0.36 0.02 H new ATOM 0 HA ASP A 182 6.448 5.977 -5.891 1.00 0.02 H new ATOM 0 HB2 ASP A 182 6.170 7.684 -8.148 -0.45 0.02 H new ATOM 0 HB3 ASP A 182 5.926 6.046 -8.722 -0.45 0.02 H new ATOM 341 N PHE A 183 6.775 3.954 -7.833 -0.36 0.02 N ATOM 342 CA PHE A 183 7.318 2.691 -8.316 1.00 0.02 C ATOM 343 C PHE A 183 6.295 1.839 -9.067 0.48 0.02 C ATOM 344 O PHE A 183 5.093 2.102 -9.050 -0.48 0.02 O ATOM 345 CB PHE A 183 7.886 1.884 -7.138 -0.16 0.02 C ATOM 346 CG PHE A 183 6.947 0.828 -6.604 0.03 0.02 C ATOM 347 CD1 PHE A 183 5.628 1.141 -6.301 -0.16 0.02 C ATOM 348 CD2 PHE A 183 7.379 -0.476 -6.416 -0.16 0.02 C ATOM 349 CE1 PHE A 183 4.763 0.173 -5.822 -0.15 0.02 C ATOM 350 CE2 PHE A 183 6.515 -1.444 -5.935 -0.15 0.02 C ATOM 351 CZ PHE A 183 5.209 -1.119 -5.640 -0.15 0.02 C ATOM 0 H PHE A 183 5.763 4.050 -7.914 -0.36 0.02 H new ATOM 0 HA PHE A 183 8.105 2.944 -9.026 1.00 0.02 H new ATOM 0 HB2 PHE A 183 8.813 1.405 -7.453 -0.16 0.02 H new ATOM 0 HB3 PHE A 183 8.141 2.570 -6.330 -0.16 0.02 H new ATOM 0 HD1 PHE A 183 5.274 2.152 -6.441 -0.16 0.02 H new ATOM 0 HD2 PHE A 183 8.401 -0.739 -6.647 -0.16 0.02 H new ATOM 0 HE1 PHE A 183 3.740 0.429 -5.591 -0.15 0.02 H new ATOM 0 HE2 PHE A 183 6.865 -2.456 -5.791 -0.15 0.02 H new ATOM 0 HZ PHE A 183 4.535 -1.876 -5.266 -0.15 0.02 H new ATOM 361 N GLU A 184 6.818 0.793 -9.698 -0.36 0.02 N ATOM 362 CA GLU A 184 6.027 -0.172 -10.448 1.00 0.02 C ATOM 363 C GLU A 184 6.866 -1.429 -10.646 0.48 0.02 C ATOM 364 O GLU A 184 8.087 -1.363 -10.557 -0.48 0.02 O ATOM 365 CB GLU A 184 5.606 0.407 -11.801 -0.20 0.02 C ATOM 366 CG GLU A 184 4.371 1.291 -11.727 -0.45 0.02 C ATOM 367 CD GLU A 184 4.678 2.749 -12.006 0.49 0.02 C ATOM 368 OE1 GLU A 184 5.330 3.392 -11.157 -0.62 0.02 O ATOM 369 OE2 GLU A 184 4.266 3.249 -13.075 -0.62 0.02 O ATOM 0 H GLU A 184 7.818 0.590 -9.702 -0.36 0.02 H new ATOM 0 HA GLU A 184 5.119 -0.412 -9.895 1.00 0.02 H new ATOM 0 HB2 GLU A 184 6.433 0.986 -12.212 -0.20 0.02 H new ATOM 0 HB3 GLU A 184 5.415 -0.412 -12.494 -0.20 0.02 H new ATOM 0 HG2 GLU A 184 3.631 0.936 -12.445 -0.45 0.02 H new ATOM 0 HG3 GLU A 184 3.924 1.201 -10.737 -0.45 0.02 H new ATOM 376 N CYS A 185 6.235 -2.571 -10.901 -0.36 0.02 N ATOM 377 CA CYS A 185 6.992 -3.810 -11.095 1.00 0.02 C ATOM 378 C CYS A 185 6.195 -4.858 -11.853 0.48 0.02 C ATOM 379 O CYS A 185 5.051 -4.634 -12.248 -0.48 0.02 O ATOM 380 CB CYS A 185 7.463 -4.406 -9.761 0.20 0.02 C ATOM 381 SG CYS A 185 6.912 -3.523 -8.269 -0.20 0.02 S ATOM 0 H CYS A 185 5.223 -2.668 -10.978 -0.36 0.02 H new ATOM 0 HA CYS A 185 7.862 -3.535 -11.690 1.00 0.02 H new ATOM 0 HB2 CYS A 185 7.115 -5.437 -9.701 0.20 0.02 H new ATOM 0 HB3 CYS A 185 8.553 -4.437 -9.762 0.20 0.02 H new ATOM 386 N GLU A 186 6.824 -6.015 -12.039 -0.36 0.02 N ATOM 387 CA GLU A 186 6.204 -7.131 -12.734 1.00 0.02 C ATOM 388 C GLU A 186 5.122 -7.775 -11.874 0.48 0.02 C ATOM 389 O GLU A 186 4.394 -8.652 -12.338 -0.48 0.02 O ATOM 390 CB GLU A 186 7.262 -8.171 -13.099 -0.20 0.02 C ATOM 391 CG GLU A 186 7.622 -8.184 -14.576 -0.45 0.02 C ATOM 392 CD GLU A 186 7.818 -9.587 -15.116 0.49 0.02 C ATOM 393 OE1 GLU A 186 6.822 -10.337 -15.196 -0.62 0.02 O ATOM 394 OE2 GLU A 186 8.967 -9.936 -15.458 -0.62 0.02 O ATOM 0 H GLU A 186 7.772 -6.202 -11.713 -0.36 0.02 H new ATOM 0 HA GLU A 186 5.740 -6.751 -13.644 1.00 0.02 H new ATOM 0 HB2 GLU A 186 8.163 -7.980 -12.516 -0.20 0.02 H new ATOM 0 HB3 GLU A 186 6.901 -9.159 -12.813 -0.20 0.02 H new ATOM 0 HG2 GLU A 186 6.834 -7.687 -15.143 -0.45 0.02 H new ATOM 0 HG3 GLU A 186 8.535 -7.609 -14.729 -0.45 0.02 H new ATOM 401 N CYS A 187 5.017 -7.341 -10.620 -0.36 0.02 N ATOM 402 CA CYS A 187 4.017 -7.893 -9.722 1.00 0.02 C ATOM 403 C CYS A 187 2.623 -7.501 -10.191 0.48 0.02 C ATOM 404 O CYS A 187 2.466 -6.532 -10.930 -0.48 0.02 O ATOM 405 CB CYS A 187 4.260 -7.441 -8.277 0.20 0.02 C ATOM 406 SG CYS A 187 5.088 -8.680 -7.214 -0.20 0.02 S ATOM 0 H CYS A 187 5.607 -6.617 -10.210 -0.36 0.02 H new ATOM 0 HA CYS A 187 4.098 -8.980 -9.741 1.00 0.02 H new ATOM 0 HB2 CYS A 187 4.864 -6.534 -8.292 0.20 0.02 H new ATOM 0 HB3 CYS A 187 3.302 -7.179 -7.827 0.20 0.02 H new ATOM 411 N PRO A 188 1.603 -8.289 -9.810 -0.36 0.02 N ATOM 412 CA PRO A 188 0.209 -8.069 -10.229 1.00 0.02 C ATOM 413 C PRO A 188 -0.342 -6.667 -9.953 0.48 0.02 C ATOM 414 O PRO A 188 -1.383 -6.525 -9.311 -0.48 0.02 O ATOM 415 CB PRO A 188 -0.572 -9.109 -9.422 -0.20 0.02 C ATOM 416 CG PRO A 188 0.412 -10.188 -9.141 -0.20 0.02 C ATOM 417 CD PRO A 188 1.739 -9.503 -8.981 0.06 0.02 C ATOM 0 HA PRO A 188 0.125 -8.163 -11.312 1.00 0.02 H new ATOM 0 HB2 PRO A 188 -0.964 -8.681 -8.499 -0.20 0.02 H new ATOM 0 HB3 PRO A 188 -1.425 -9.488 -9.985 -0.20 0.02 H new ATOM 0 HG2 PRO A 188 0.144 -10.736 -8.238 -0.20 0.02 H new ATOM 0 HG3 PRO A 188 0.442 -10.912 -9.956 -0.20 0.02 H new ATOM 0 HD2 PRO A 188 1.940 -9.257 -7.938 0.06 0.02 H new ATOM 0 HD3 PRO A 188 2.560 -10.133 -9.324 0.06 0.02 H new ATOM 425 N GLU A 189 0.325 -5.631 -10.468 -0.36 0.02 N ATOM 426 CA GLU A 189 -0.144 -4.252 -10.298 1.00 0.02 C ATOM 427 C GLU A 189 -0.075 -3.811 -8.874 0.48 0.02 C ATOM 428 O GLU A 189 -0.944 -4.135 -8.064 -0.48 0.02 O ATOM 429 CB GLU A 189 -1.577 -4.116 -10.754 -0.20 0.02 C ATOM 430 CG GLU A 189 -1.943 -5.178 -11.738 -0.45 0.02 C ATOM 431 CD GLU A 189 -2.960 -4.723 -12.767 0.49 0.02 C ATOM 432 OE1 GLU A 189 -2.603 -3.887 -13.624 -0.62 0.02 O ATOM 433 OE2 GLU A 189 -4.112 -5.202 -12.716 -0.62 0.02 O ATOM 0 H GLU A 189 1.188 -5.719 -11.004 -0.36 0.02 H new ATOM 0 HA GLU A 189 0.513 -3.627 -10.902 1.00 0.02 H new ATOM 0 HB2 GLU A 189 -2.241 -4.174 -9.892 -0.20 0.02 H new ATOM 0 HB3 GLU A 189 -1.725 -3.135 -11.205 -0.20 0.02 H new ATOM 0 HG2 GLU A 189 -1.042 -5.512 -12.252 -0.45 0.02 H new ATOM 0 HG3 GLU A 189 -2.341 -6.039 -11.201 -0.45 0.02 H new ATOM 440 N GLY A 190 0.951 -3.074 -8.565 -0.36 0.02 N ATOM 441 CA GLY A 190 1.109 -2.597 -7.224 -0.10 0.02 C ATOM 442 C GLY A 190 1.534 -3.694 -6.285 0.48 0.02 C ATOM 443 O GLY A 190 2.144 -3.420 -5.261 -0.48 0.02 O ATOM 0 H GLY A 190 1.684 -2.793 -9.216 -0.36 0.02 H new ATOM 0 HA2 GLY A 190 1.850 -1.798 -7.208 -0.10 0.02 H new ATOM 0 HA3 GLY A 190 0.169 -2.167 -6.878 -0.10 0.02 H new ATOM 447 N TYR A 191 1.258 -4.954 -6.633 -0.36 0.02 N ATOM 448 CA TYR A 191 1.672 -6.043 -5.770 1.00 0.02 C ATOM 449 C TYR A 191 3.159 -5.932 -5.494 0.48 0.02 C ATOM 450 O TYR A 191 3.960 -5.668 -6.389 -0.48 0.02 O ATOM 451 CB TYR A 191 1.336 -7.397 -6.397 -0.20 0.02 C ATOM 452 CG TYR A 191 -0.091 -7.841 -6.169 1.00 0.02 C ATOM 453 CD1 TYR A 191 -1.156 -7.095 -6.657 -0.14 0.02 C ATOM 454 CD2 TYR A 191 -0.372 -9.008 -5.471 -0.14 0.02 C ATOM 455 CE1 TYR A 191 -2.461 -7.500 -6.457 -0.14 0.02 C ATOM 456 CE2 TYR A 191 -1.675 -9.421 -5.268 -0.14 0.02 C ATOM 457 CZ TYR A 191 -2.716 -8.664 -5.762 0.20 0.02 C ATOM 458 OH TYR A 191 -4.014 -9.071 -5.561 -0.60 0.02 O ATOM 0 H TYR A 191 0.765 -5.232 -7.481 -0.36 0.02 H new ATOM 0 HA TYR A 191 1.128 -5.973 -4.828 1.00 0.02 H new ATOM 0 HB2 TYR A 191 1.523 -7.346 -7.470 -0.20 0.02 H new ATOM 0 HB3 TYR A 191 2.010 -8.151 -5.991 -0.20 0.02 H new ATOM 0 HD1 TYR A 191 -0.960 -6.183 -7.202 -0.14 0.02 H new ATOM 0 HD2 TYR A 191 0.441 -9.602 -5.081 -0.14 0.02 H new ATOM 0 HE1 TYR A 191 -3.278 -6.908 -6.843 -0.14 0.02 H new ATOM 0 HE2 TYR A 191 -1.877 -10.332 -4.725 -0.14 0.02 H new ATOM 0 HH TYR A 191 -4.019 -9.910 -5.054 -0.60 0.02 H new ATOM 468 N ARG A 192 3.506 -6.089 -4.239 -0.36 0.02 N ATOM 469 CA ARG A 192 4.896 -5.970 -3.806 1.00 0.02 C ATOM 470 C ARG A 192 5.607 -7.319 -3.857 0.48 0.02 C ATOM 471 O ARG A 192 5.070 -8.337 -3.430 -0.48 0.02 O ATOM 472 CB ARG A 192 4.959 -5.405 -2.385 -0.20 0.02 C ATOM 473 CG ARG A 192 5.043 -3.888 -2.337 -0.20 0.02 C ATOM 474 CD ARG A 192 5.045 -3.373 -0.906 -0.10 0.02 C ATOM 475 NE ARG A 192 5.967 -4.122 -0.055 -0.60 0.02 N ATOM 476 CZ ARG A 192 5.629 -5.211 0.635 0.60 0.02 C ATOM 477 NH1 ARG A 192 4.391 -5.686 0.580 -0.60 0.02 N ATOM 478 NH2 ARG A 192 6.535 -5.827 1.384 -0.60 0.02 N ATOM 0 H ARG A 192 2.848 -6.301 -3.489 -0.36 0.02 H new ATOM 0 HA ARG A 192 5.403 -5.289 -4.489 1.00 0.02 H new ATOM 0 HB2 ARG A 192 4.076 -5.729 -1.834 -0.20 0.02 H new ATOM 0 HB3 ARG A 192 5.825 -5.825 -1.874 -0.20 0.02 H new ATOM 0 HG2 ARG A 192 5.949 -3.557 -2.845 -0.20 0.02 H new ATOM 0 HG3 ARG A 192 4.199 -3.459 -2.878 -0.20 0.02 H new ATOM 0 HD2 ARG A 192 5.322 -2.319 -0.901 -0.10 0.02 H new ATOM 0 HD3 ARG A 192 4.037 -3.440 -0.495 -0.10 0.02 H new ATOM 0 HE ARG A 192 6.929 -3.791 0.015 -0.60 0.02 H new ATOM 0 HH11 ARG A 192 3.690 -5.217 0.006 -0.60 0.02 H new ATOM 0 HH12 ARG A 192 4.141 -6.520 1.111 -0.60 0.02 H new ATOM 0 HH21 ARG A 192 7.488 -5.467 1.431 -0.60 0.02 H new ATOM 0 HH22 ARG A 192 6.278 -6.661 1.913 -0.60 0.02 H new ATOM 492 N TYR A 193 6.816 -7.312 -4.409 -0.36 0.02 N ATOM 493 CA TYR A 193 7.615 -8.516 -4.561 1.00 0.02 C ATOM 494 C TYR A 193 8.637 -8.675 -3.440 0.48 0.02 C ATOM 495 O TYR A 193 9.036 -7.703 -2.799 -0.48 0.02 O ATOM 496 CB TYR A 193 8.338 -8.455 -5.899 -0.20 0.02 C ATOM 497 CG TYR A 193 8.984 -9.750 -6.298 1.00 0.02 C ATOM 498 CD1 TYR A 193 8.265 -10.713 -6.977 -0.14 0.02 C ATOM 499 CD2 TYR A 193 10.314 -10.000 -6.007 -0.14 0.02 C ATOM 500 CE1 TYR A 193 8.849 -11.902 -7.359 -0.14 0.02 C ATOM 501 CE2 TYR A 193 10.915 -11.183 -6.388 -0.14 0.02 C ATOM 502 CZ TYR A 193 10.178 -12.133 -7.065 0.20 0.02 C ATOM 503 OH TYR A 193 10.777 -13.311 -7.457 -0.60 0.02 O ATOM 0 H TYR A 193 7.267 -6.469 -4.763 -0.36 0.02 H new ATOM 0 HA TYR A 193 6.946 -9.375 -4.517 1.00 0.02 H new ATOM 0 HB2 TYR A 193 7.628 -8.161 -6.672 -0.20 0.02 H new ATOM 0 HB3 TYR A 193 9.101 -7.678 -5.854 -0.20 0.02 H new ATOM 0 HD1 TYR A 193 7.227 -10.532 -7.213 -0.14 0.02 H new ATOM 0 HD2 TYR A 193 10.890 -9.258 -5.474 -0.14 0.02 H new ATOM 0 HE1 TYR A 193 8.271 -12.648 -7.885 -0.14 0.02 H new ATOM 0 HE2 TYR A 193 11.955 -11.364 -6.158 -0.14 0.02 H new ATOM 0 HH TYR A 193 11.421 -13.128 -8.173 -0.60 0.02 H new ATOM 513 N ASN A 194 9.055 -9.918 -3.219 -0.36 0.02 N ATOM 514 CA ASN A 194 10.034 -10.233 -2.185 1.00 0.02 C ATOM 515 C ASN A 194 11.145 -11.121 -2.739 0.48 0.02 C ATOM 516 O ASN A 194 10.876 -12.171 -3.327 -0.48 0.02 O ATOM 517 CB ASN A 194 9.348 -10.935 -1.015 -0.20 0.02 C ATOM 518 CG ASN A 194 9.815 -10.412 0.330 0.48 0.02 C ATOM 519 OD1 ASN A 194 10.254 -9.268 0.446 -0.48 0.02 O ATOM 520 ND2 ASN A 194 9.722 -11.251 1.355 -0.52 0.02 N ATOM 0 H ASN A 194 8.728 -10.728 -3.746 -0.36 0.02 H new ATOM 0 HA ASN A 194 10.478 -9.300 -1.839 1.00 0.02 H new ATOM 0 HB2 ASN A 194 8.269 -10.803 -1.098 -0.20 0.02 H new ATOM 0 HB3 ASN A 194 9.543 -12.006 -1.073 -0.20 0.02 H new ATOM 0 HD21 ASN A 194 10.021 -10.956 2.284 -0.52 0.02 H new ATOM 0 HD22 ASN A 194 9.352 -12.191 1.213 -0.52 0.02 H new ATOM 527 N LEU A 195 12.393 -10.698 -2.548 -0.36 0.02 N ATOM 528 CA LEU A 195 13.543 -11.459 -3.026 1.00 0.02 C ATOM 529 C LEU A 195 13.854 -12.630 -2.095 0.48 0.02 C ATOM 530 O LEU A 195 14.629 -13.521 -2.440 -0.48 0.02 O ATOM 531 CB LEU A 195 14.767 -10.548 -3.143 -0.20 0.02 C ATOM 532 CG LEU A 195 15.981 -11.178 -3.829 -0.10 0.02 C ATOM 533 CD1 LEU A 195 16.051 -10.753 -5.288 -0.30 0.02 C ATOM 534 CD2 LEU A 195 17.263 -10.801 -3.101 -0.30 0.02 C ATOM 0 H LEU A 195 12.633 -9.832 -2.065 -0.36 0.02 H new ATOM 0 HA LEU A 195 13.297 -11.859 -4.009 1.00 0.02 H new ATOM 0 HB2 LEU A 195 14.482 -9.652 -3.694 -0.20 0.02 H new ATOM 0 HB3 LEU A 195 15.060 -10.228 -2.143 -0.20 0.02 H new ATOM 0 HG LEU A 195 15.871 -12.262 -3.792 -0.10 0.02 H new ATOM 0 HD11 LEU A 195 16.921 -11.211 -5.759 -0.30 0.02 H new ATOM 0 HD12 LEU A 195 15.147 -11.075 -5.805 -0.30 0.02 H new ATOM 0 HD13 LEU A 195 16.136 -9.668 -5.347 -0.30 0.02 H new ATOM 0 HD21 LEU A 195 18.115 -11.259 -3.604 -0.30 0.02 H new ATOM 0 HD22 LEU A 195 17.378 -9.717 -3.105 -0.30 0.02 H new ATOM 0 HD23 LEU A 195 17.215 -11.157 -2.072 -0.30 0.02 H new ATOM 546 N LYS A 196 13.255 -12.622 -0.909 -0.36 0.02 N ATOM 547 CA LYS A 196 13.474 -13.682 0.062 1.00 0.02 C ATOM 548 C LYS A 196 13.037 -15.016 -0.510 0.48 0.02 C ATOM 549 O LYS A 196 13.739 -16.021 -0.395 -0.48 0.02 O ATOM 550 CB LYS A 196 12.689 -13.394 1.338 -0.20 0.02 C ATOM 551 CG LYS A 196 13.354 -12.370 2.232 -0.20 0.02 C ATOM 552 CD LYS A 196 12.951 -10.953 1.858 -0.20 0.02 C ATOM 553 CE LYS A 196 12.689 -10.104 3.091 0.30 5.02 C ATOM 554 NZ LYS A 196 13.919 -9.920 3.909 -0.81 0.02 N ATOM 0 H LYS A 196 12.614 -11.892 -0.599 -0.36 0.02 H new ATOM 0 HA LYS A 196 14.538 -13.724 0.295 1.00 0.02 H new ATOM 0 HB2 LYS A 196 11.693 -13.041 1.071 -0.20 0.02 H new ATOM 0 HB3 LYS A 196 12.560 -14.322 1.894 -0.20 0.02 H new ATOM 0 HG2 LYS A 196 13.084 -12.563 3.270 -0.20 0.02 H new ATOM 0 HG3 LYS A 196 14.437 -12.472 2.160 -0.20 0.02 H new ATOM 0 HD2 LYS A 196 13.739 -10.495 1.261 -0.20 0.02 H new ATOM 0 HD3 LYS A 196 12.056 -10.980 1.237 -0.20 0.02 H new ATOM 0 HE2 LYS A 196 12.306 -9.130 2.787 0.30 5.02 H new ATOM 0 HE3 LYS A 196 11.916 -10.575 3.698 0.30 5.02 H new ATOM 0 HZ1 LYS A 196 13.707 -9.308 4.722 -0.81 0.02 H new ATOM 0 HZ2 LYS A 196 14.251 -10.845 4.249 -0.81 0.02 H new ATOM 0 HZ3 LYS A 196 14.660 -9.479 3.328 -0.81 0.02 H new ATOM 568 N SER A 197 11.865 -15.010 -1.123 -0.36 0.02 N ATOM 569 CA SER A 197 11.312 -16.218 -1.715 1.00 0.02 C ATOM 570 C SER A 197 11.142 -16.090 -3.224 0.48 0.02 C ATOM 571 O SER A 197 10.730 -17.041 -3.889 -0.48 0.02 O ATOM 572 CB SER A 197 9.971 -16.563 -1.065 0.08 0.02 C ATOM 573 OG SER A 197 10.149 -17.431 0.040 -0.68 0.02 O ATOM 0 H SER A 197 11.278 -14.182 -1.224 -0.36 0.02 H new ATOM 0 HA SER A 197 12.023 -17.023 -1.530 1.00 0.02 H new ATOM 0 HB2 SER A 197 9.476 -15.649 -0.737 0.08 0.02 H new ATOM 0 HB3 SER A 197 9.317 -17.034 -1.800 0.08 0.02 H new ATOM 0 HG SER A 197 9.278 -17.635 0.439 -0.68 0.02 H new ATOM 579 N LYS A 198 11.435 -14.914 -3.762 -0.36 0.02 N ATOM 580 CA LYS A 198 11.286 -14.675 -5.179 1.00 0.02 C ATOM 581 C LYS A 198 9.893 -15.021 -5.632 0.48 0.02 C ATOM 582 O LYS A 198 9.667 -15.908 -6.454 -0.48 0.02 O ATOM 583 CB LYS A 198 12.336 -15.414 -5.974 -0.20 0.02 C ATOM 584 CG LYS A 198 13.489 -14.501 -6.264 -0.20 0.02 C ATOM 585 CD LYS A 198 14.255 -14.198 -4.997 -0.20 0.02 C ATOM 586 CE LYS A 198 15.197 -15.331 -4.624 0.30 5.02 C ATOM 587 NZ LYS A 198 16.596 -15.055 -5.053 -0.81 0.02 N ATOM 0 H LYS A 198 11.778 -14.113 -3.232 -0.36 0.02 H new ATOM 0 HA LYS A 198 11.439 -13.612 -5.363 1.00 0.02 H new ATOM 0 HB2 LYS A 198 12.681 -16.285 -5.417 -0.20 0.02 H new ATOM 0 HB3 LYS A 198 11.908 -15.781 -6.907 -0.20 0.02 H new ATOM 0 HG2 LYS A 198 14.152 -14.964 -6.995 -0.20 0.02 H new ATOM 0 HG3 LYS A 198 13.124 -13.574 -6.706 -0.20 0.02 H new ATOM 0 HD2 LYS A 198 14.826 -13.279 -5.128 -0.20 0.02 H new ATOM 0 HD3 LYS A 198 13.554 -14.024 -4.181 -0.20 0.02 H new ATOM 0 HE2 LYS A 198 15.172 -15.484 -3.545 0.30 5.02 H new ATOM 0 HE3 LYS A 198 14.852 -16.256 -5.085 0.30 5.02 H new ATOM 0 HZ1 LYS A 198 17.206 -15.852 -4.780 -0.81 0.02 H new ATOM 0 HZ2 LYS A 198 16.625 -14.935 -6.086 -0.81 0.02 H new ATOM 0 HZ3 LYS A 198 16.935 -14.186 -4.593 -0.81 0.02 H new ATOM 601 N SER A 199 8.975 -14.279 -5.067 -0.36 0.02 N ATOM 602 CA SER A 199 7.557 -14.430 -5.360 1.00 0.02 C ATOM 603 C SER A 199 6.836 -13.104 -5.172 0.48 0.02 C ATOM 604 O SER A 199 7.329 -12.215 -4.477 -0.48 0.02 O ATOM 605 CB SER A 199 6.937 -15.497 -4.457 0.08 0.02 C ATOM 606 OG SER A 199 7.250 -15.259 -3.096 -0.68 0.02 O ATOM 0 H SER A 199 9.182 -13.548 -4.387 -0.36 0.02 H new ATOM 0 HA SER A 199 7.450 -14.745 -6.398 1.00 0.02 H new ATOM 0 HB2 SER A 199 5.855 -15.505 -4.588 0.08 0.02 H new ATOM 0 HB3 SER A 199 7.301 -16.482 -4.750 0.08 0.02 H new ATOM 0 HG SER A 199 6.840 -15.954 -2.540 -0.68 0.02 H new ATOM 612 N CYS A 200 5.665 -12.972 -5.782 -0.36 0.02 N ATOM 613 CA CYS A 200 4.888 -11.748 -5.660 1.00 0.02 C ATOM 614 C CYS A 200 4.000 -11.813 -4.426 0.48 0.02 C ATOM 615 O CYS A 200 3.463 -12.870 -4.094 -0.48 0.02 O ATOM 616 CB CYS A 200 4.037 -11.522 -6.909 0.20 0.02 C ATOM 617 SG CYS A 200 4.830 -10.464 -8.160 -0.20 0.02 S ATOM 0 H CYS A 200 5.236 -13.693 -6.362 -0.36 0.02 H new ATOM 0 HA CYS A 200 5.578 -10.910 -5.557 1.00 0.02 H new ATOM 0 HB2 CYS A 200 3.805 -12.488 -7.358 0.20 0.02 H new ATOM 0 HB3 CYS A 200 3.089 -11.072 -6.614 0.20 0.02 H new ATOM 622 N GLU A 201 3.852 -10.686 -3.741 -0.36 0.02 N ATOM 623 CA GLU A 201 3.032 -10.639 -2.538 1.00 0.02 C ATOM 624 C GLU A 201 2.338 -9.290 -2.377 0.48 0.02 C ATOM 625 O GLU A 201 2.994 -8.265 -2.210 -0.48 0.02 O ATOM 626 CB GLU A 201 3.890 -10.930 -1.305 -0.20 0.02 C ATOM 627 CG GLU A 201 4.336 -12.379 -1.202 -0.45 0.02 C ATOM 628 CD GLU A 201 5.502 -12.564 -0.251 0.49 0.02 C ATOM 629 OE1 GLU A 201 5.584 -11.809 0.741 -0.62 0.02 O ATOM 630 OE2 GLU A 201 6.333 -13.462 -0.498 -0.62 0.02 O ATOM 0 H GLU A 201 4.286 -9.799 -3.996 -0.36 0.02 H new ATOM 0 HA GLU A 201 2.260 -11.403 -2.637 1.00 0.02 H new ATOM 0 HB2 GLU A 201 4.771 -10.288 -1.326 -0.20 0.02 H new ATOM 0 HB3 GLU A 201 3.326 -10.668 -0.410 -0.20 0.02 H new ATOM 0 HG2 GLU A 201 3.498 -12.990 -0.867 -0.45 0.02 H new ATOM 0 HG3 GLU A 201 4.618 -12.740 -2.191 -0.45 0.02 H new ATOM 637 N ASP A 202 1.002 -9.321 -2.437 -0.36 0.02 N ATOM 638 CA ASP A 202 0.157 -8.137 -2.300 1.00 0.02 C ATOM 639 C ASP A 202 0.892 -6.985 -1.626 0.48 0.02 C ATOM 640 O ASP A 202 1.726 -7.178 -0.741 -0.48 0.02 O ATOM 641 CB ASP A 202 -1.125 -8.484 -1.530 -0.45 0.02 C ATOM 642 CG ASP A 202 -1.000 -8.281 -0.030 0.49 0.02 C ATOM 643 OD1 ASP A 202 -0.369 -9.131 0.634 -0.62 0.02 O ATOM 644 OD2 ASP A 202 -1.533 -7.272 0.477 -0.62 0.02 O ATOM 0 H ASP A 202 0.474 -10.181 -2.584 -0.36 0.02 H new ATOM 0 HA ASP A 202 -0.109 -7.806 -3.304 1.00 0.02 H new ATOM 0 HB2 ASP A 202 -1.943 -7.870 -1.906 -0.45 0.02 H new ATOM 0 HB3 ASP A 202 -1.389 -9.523 -1.728 -0.45 0.02 H new ATOM 649 N ILE A 203 0.574 -5.794 -2.075 -0.36 0.02 N ATOM 650 CA ILE A 203 1.189 -4.582 -1.578 1.00 0.02 C ATOM 651 C ILE A 203 0.592 -4.118 -0.245 0.48 0.02 C ATOM 652 O ILE A 203 -0.479 -4.573 0.171 -0.48 0.02 O ATOM 653 CB ILE A 203 1.050 -3.490 -2.640 -0.10 0.02 C ATOM 654 CG1 ILE A 203 1.902 -2.272 -2.317 -0.20 0.02 C ATOM 655 CG2 ILE A 203 -0.398 -3.106 -2.807 -0.30 0.02 C ATOM 656 CD1 ILE A 203 2.337 -1.545 -3.561 -0.30 0.02 C ATOM 0 H ILE A 203 -0.124 -5.636 -2.801 -0.36 0.02 H new ATOM 0 HA ILE A 203 2.241 -4.790 -1.383 1.00 0.02 H new ATOM 0 HB ILE A 203 1.417 -3.895 -3.583 -0.10 0.02 H new ATOM 0 HG12 ILE A 203 1.337 -1.593 -1.679 -0.20 0.02 H new ATOM 0 HG13 ILE A 203 2.781 -2.583 -1.752 -0.20 0.02 H new ATOM 0 HG21 ILE A 203 -0.483 -2.328 -3.566 -0.30 0.02 H new ATOM 0 HG22 ILE A 203 -0.973 -3.979 -3.117 -0.30 0.02 H new ATOM 0 HG23 ILE A 203 -0.787 -2.733 -1.860 -0.30 0.02 H new ATOM 0 HD11 ILE A 203 2.943 -0.682 -3.285 -0.30 0.02 H new ATOM 0 HD12 ILE A 203 2.925 -2.216 -4.188 -0.30 0.02 H new ATOM 0 HD13 ILE A 203 1.459 -1.210 -4.113 -0.30 0.02 H new ATOM 668 N ASP A 204 1.304 -3.192 0.396 -0.36 0.02 N ATOM 669 CA ASP A 204 0.887 -2.617 1.673 1.00 0.02 C ATOM 670 C ASP A 204 0.359 -1.196 1.469 0.48 0.02 C ATOM 671 O ASP A 204 0.893 -0.231 2.016 -0.48 0.02 O ATOM 672 CB ASP A 204 2.061 -2.615 2.656 -0.45 0.02 C ATOM 673 CG ASP A 204 1.914 -3.670 3.735 0.49 0.02 C ATOM 674 OD1 ASP A 204 0.808 -3.786 4.305 -0.62 0.02 O ATOM 675 OD2 ASP A 204 2.904 -4.380 4.010 -0.62 0.02 O ATOM 0 H ASP A 204 2.186 -2.820 0.044 -0.36 0.02 H new ATOM 0 HA ASP A 204 0.084 -3.227 2.088 1.00 0.02 H new ATOM 0 HB2 ASP A 204 2.989 -2.785 2.110 -0.45 0.02 H new ATOM 0 HB3 ASP A 204 2.140 -1.632 3.121 -0.45 0.02 H new ATOM 680 N GLU A 205 -0.682 -1.084 0.653 -0.36 0.02 N ATOM 681 CA GLU A 205 -1.293 0.201 0.330 1.00 0.02 C ATOM 682 C GLU A 205 -1.620 1.044 1.561 0.48 0.02 C ATOM 683 O GLU A 205 -1.554 2.266 1.500 -0.48 0.02 O ATOM 684 CB GLU A 205 -2.571 -0.015 -0.476 -0.20 0.02 C ATOM 685 CG GLU A 205 -2.377 -0.861 -1.723 -0.45 0.02 C ATOM 686 CD GLU A 205 -3.118 -2.188 -1.660 0.49 0.02 C ATOM 687 OE1 GLU A 205 -2.633 -3.114 -0.978 -0.62 0.02 O ATOM 688 OE2 GLU A 205 -4.184 -2.301 -2.297 -0.62 0.02 O ATOM 0 H GLU A 205 -1.127 -1.880 0.196 -0.36 0.02 H new ATOM 0 HA GLU A 205 -0.554 0.750 -0.253 1.00 0.02 H new ATOM 0 HB2 GLU A 205 -3.315 -0.491 0.162 -0.20 0.02 H new ATOM 0 HB3 GLU A 205 -2.974 0.955 -0.766 -0.20 0.02 H new ATOM 0 HG2 GLU A 205 -2.719 -0.301 -2.593 -0.45 0.02 H new ATOM 0 HG3 GLU A 205 -1.313 -1.051 -1.865 -0.45 0.02 H new ATOM 695 N CYS A 206 -1.999 0.412 2.664 -0.36 0.02 N ATOM 696 CA CYS A 206 -2.354 1.167 3.864 1.00 0.02 C ATOM 697 C CYS A 206 -1.188 1.288 4.837 0.48 0.02 C ATOM 698 O CYS A 206 -1.120 2.236 5.619 -0.48 0.02 O ATOM 699 CB CYS A 206 -3.576 0.549 4.549 0.20 0.02 C ATOM 700 SG CYS A 206 -3.216 -0.666 5.861 -0.20 0.02 S ATOM 0 H CYS A 206 -2.069 -0.601 2.756 -0.36 0.02 H new ATOM 0 HA CYS A 206 -2.607 2.178 3.545 1.00 0.02 H new ATOM 0 HB2 CYS A 206 -4.175 1.353 4.978 0.20 0.02 H new ATOM 0 HB3 CYS A 206 -4.190 0.065 3.789 0.20 0.02 H new ATOM 705 N SER A 207 -0.267 0.339 4.780 -0.36 0.02 N ATOM 706 CA SER A 207 0.897 0.369 5.657 1.00 0.02 C ATOM 707 C SER A 207 1.702 1.637 5.403 0.48 0.02 C ATOM 708 O SER A 207 2.435 2.111 6.272 -0.48 0.02 O ATOM 709 CB SER A 207 1.771 -0.865 5.433 0.08 0.02 C ATOM 710 OG SER A 207 2.311 -1.335 6.656 -0.68 0.02 O ATOM 0 H SER A 207 -0.300 -0.456 4.142 -0.36 0.02 H new ATOM 0 HA SER A 207 0.556 0.364 6.692 1.00 0.02 H new ATOM 0 HB2 SER A 207 1.180 -1.653 4.966 0.08 0.02 H new ATOM 0 HB3 SER A 207 2.580 -0.622 4.744 0.08 0.02 H new ATOM 0 HG SER A 207 2.865 -2.126 6.487 -0.68 0.02 H new ATOM 716 N GLU A 208 1.576 2.161 4.189 -0.36 0.02 N ATOM 717 CA GLU A 208 2.300 3.352 3.775 1.00 0.02 C ATOM 718 C GLU A 208 1.661 4.627 4.326 0.48 0.02 C ATOM 719 O GLU A 208 2.237 5.709 4.213 -0.48 0.02 O ATOM 720 CB GLU A 208 2.325 3.405 2.250 -0.20 0.02 C ATOM 721 CG GLU A 208 3.281 2.404 1.628 -0.45 0.02 C ATOM 722 CD GLU A 208 4.477 3.066 0.973 0.49 0.02 C ATOM 723 OE1 GLU A 208 5.471 3.332 1.681 -0.62 0.02 O ATOM 724 OE2 GLU A 208 4.421 3.319 -0.249 -0.62 0.02 O ATOM 0 H GLU A 208 0.970 1.771 3.467 -0.36 0.02 H new ATOM 0 HA GLU A 208 3.313 3.296 4.174 1.00 0.02 H new ATOM 0 HB2 GLU A 208 1.320 3.220 1.871 -0.20 0.02 H new ATOM 0 HB3 GLU A 208 2.606 4.410 1.933 -0.20 0.02 H new ATOM 0 HG2 GLU A 208 3.629 1.714 2.397 -0.45 0.02 H new ATOM 0 HG3 GLU A 208 2.747 1.811 0.885 -0.45 0.02 H new ATOM 731 N ASN A 209 0.476 4.493 4.924 -0.36 0.02 N ATOM 732 CA ASN A 209 -0.244 5.632 5.506 1.00 0.02 C ATOM 733 C ASN A 209 -1.122 6.331 4.471 0.48 0.02 C ATOM 734 O ASN A 209 -0.897 7.492 4.129 -0.48 0.02 O ATOM 735 CB ASN A 209 0.727 6.640 6.134 -0.20 0.02 C ATOM 736 CG ASN A 209 0.058 7.515 7.176 0.48 0.02 C ATOM 737 OD1 ASN A 209 -0.057 7.135 8.342 -0.48 0.02 O ATOM 738 ND2 ASN A 209 -0.389 8.694 6.760 -0.52 0.02 N ATOM 0 H ASN A 209 -0.010 3.601 5.019 -0.36 0.02 H new ATOM 0 HA ASN A 209 -0.889 5.233 6.289 1.00 0.02 H new ATOM 0 HB2 ASN A 209 1.557 6.103 6.593 -0.20 0.02 H new ATOM 0 HB3 ASN A 209 1.149 7.270 5.351 -0.20 0.02 H new ATOM 0 HD21 ASN A 209 -0.849 9.325 7.416 -0.52 0.02 H new ATOM 0 HD22 ASN A 209 -0.272 8.968 5.785 -0.52 0.02 H new ATOM 745 N MET A 210 -2.134 5.617 3.988 -0.36 0.02 N ATOM 746 CA MET A 210 -3.066 6.167 3.002 1.00 0.02 C ATOM 747 C MET A 210 -4.500 5.954 3.420 0.48 0.02 C ATOM 748 O MET A 210 -5.418 6.511 2.817 -0.48 0.02 O ATOM 749 CB MET A 210 -2.833 5.552 1.619 -0.20 0.02 C ATOM 750 CG MET A 210 -1.385 5.184 1.347 -0.11 5.02 C ATOM 751 SD MET A 210 -0.749 5.927 -0.168 -0.17 0.02 S ATOM 752 CE MET A 210 -1.723 5.065 -1.400 -0.21 5.02 C ATOM 0 H MET A 210 -2.332 4.655 4.262 -0.36 0.02 H new ATOM 0 HA MET A 210 -2.877 7.239 2.947 1.00 0.02 H new ATOM 0 HB2 MET A 210 -3.450 4.659 1.521 -0.20 0.02 H new ATOM 0 HB3 MET A 210 -3.168 6.256 0.858 -0.20 0.02 H new ATOM 0 HG2 MET A 210 -0.770 5.502 2.189 -0.11 5.02 H new ATOM 0 HG3 MET A 210 -1.297 4.100 1.280 -0.11 5.02 H new ATOM 0 HE1 MET A 210 -1.445 5.415 -2.394 -0.21 5.02 H new ATOM 0 HE2 MET A 210 -1.536 3.994 -1.327 -0.21 5.02 H new ATOM 0 HE3 MET A 210 -2.782 5.261 -1.229 -0.21 5.02 H new ATOM 762 N CYS A 211 -4.703 5.149 4.444 -0.36 0.02 N ATOM 763 CA CYS A 211 -6.048 4.882 4.909 1.00 0.02 C ATOM 764 C CYS A 211 -6.335 5.559 6.234 0.48 0.02 C ATOM 765 O CYS A 211 -5.423 5.943 6.966 -0.48 0.02 O ATOM 766 CB CYS A 211 -6.296 3.381 5.011 0.20 0.02 C ATOM 767 SG CYS A 211 -6.557 2.564 3.409 -0.20 0.02 S ATOM 0 H CYS A 211 -3.965 4.674 4.963 -0.36 0.02 H new ATOM 0 HA CYS A 211 -6.733 5.302 4.172 1.00 0.02 H new ATOM 0 HB2 CYS A 211 -5.446 2.916 5.510 0.20 0.02 H new ATOM 0 HB3 CYS A 211 -7.169 3.209 5.641 0.20 0.02 H new ATOM 772 N ALA A 212 -7.620 5.720 6.518 -0.36 0.02 N ATOM 773 CA ALA A 212 -8.054 6.371 7.734 1.00 0.02 C ATOM 774 C ALA A 212 -7.725 5.532 8.976 0.48 0.02 C ATOM 775 O ALA A 212 -6.717 4.825 9.003 -0.48 0.02 O ATOM 776 CB ALA A 212 -9.545 6.684 7.652 -0.30 0.02 C ATOM 0 H ALA A 212 -8.380 5.405 5.915 -0.36 0.02 H new ATOM 0 HA ALA A 212 -7.506 7.308 7.835 1.00 0.02 H new ATOM 0 HB1 ALA A 212 -9.865 7.174 8.571 -0.30 0.02 H new ATOM 0 HB2 ALA A 212 -9.732 7.344 6.805 -0.30 0.02 H new ATOM 0 HB3 ALA A 212 -10.105 5.758 7.521 -0.30 0.02 H new ATOM 782 N GLN A 213 -8.570 5.624 10.007 -0.36 0.02 N ATOM 783 CA GLN A 213 -8.355 4.886 11.251 1.00 0.02 C ATOM 784 C GLN A 213 -8.145 3.397 11.008 0.48 0.02 C ATOM 785 O GLN A 213 -7.225 2.793 11.560 -0.48 0.02 O ATOM 786 CB GLN A 213 -9.531 5.086 12.207 -0.20 0.02 C ATOM 787 CG GLN A 213 -9.236 4.643 13.631 -0.20 0.02 C ATOM 788 CD GLN A 213 -8.035 5.352 14.227 0.48 0.02 C ATOM 789 OE1 GLN A 213 -7.159 4.721 14.819 -0.48 0.02 O ATOM 790 NE2 GLN A 213 -7.987 6.670 14.072 -0.52 0.02 N ATOM 0 H GLN A 213 -9.410 6.203 10.003 -0.36 0.02 H new ATOM 0 HA GLN A 213 -7.446 5.285 11.700 1.00 0.02 H new ATOM 0 HB2 GLN A 213 -9.809 6.140 12.213 -0.20 0.02 H new ATOM 0 HB3 GLN A 213 -10.392 4.531 11.833 -0.20 0.02 H new ATOM 0 HG2 GLN A 213 -10.110 4.831 14.254 -0.20 0.02 H new ATOM 0 HG3 GLN A 213 -9.061 3.567 13.644 -0.20 0.02 H new ATOM 0 HE21 GLN A 213 -8.735 7.153 13.574 -0.52 0.02 H new ATOM 0 HE22 GLN A 213 -7.202 7.200 14.451 -0.52 0.02 H new ATOM 799 N LEU A 214 -9.010 2.807 10.199 -0.36 0.02 N ATOM 800 CA LEU A 214 -8.929 1.386 9.905 1.00 0.02 C ATOM 801 C LEU A 214 -8.651 1.144 8.429 0.48 0.02 C ATOM 802 O LEU A 214 -9.353 1.663 7.579 -0.48 0.02 O ATOM 803 CB LEU A 214 -10.243 0.725 10.294 -0.20 0.02 C ATOM 804 CG LEU A 214 -10.261 0.066 11.671 -0.10 0.02 C ATOM 805 CD1 LEU A 214 -9.473 -1.237 11.655 -0.30 0.02 C ATOM 806 CD2 LEU A 214 -9.712 1.015 12.725 -0.30 0.02 C ATOM 0 H LEU A 214 -9.778 3.291 9.734 -0.36 0.02 H new ATOM 0 HA LEU A 214 -8.106 0.957 10.477 1.00 0.02 H new ATOM 0 HB2 LEU A 214 -11.032 1.476 10.259 -0.20 0.02 H new ATOM 0 HB3 LEU A 214 -10.487 -0.029 9.546 -0.20 0.02 H new ATOM 0 HG LEU A 214 -11.295 -0.166 11.926 -0.10 0.02 H new ATOM 0 HD11 LEU A 214 -9.499 -1.690 12.646 -0.30 0.02 H new ATOM 0 HD12 LEU A 214 -9.916 -1.921 10.932 -0.30 0.02 H new ATOM 0 HD13 LEU A 214 -8.439 -1.034 11.376 -0.30 0.02 H new ATOM 0 HD21 LEU A 214 -9.733 0.528 13.700 -0.30 0.02 H new ATOM 0 HD22 LEU A 214 -8.685 1.282 12.475 -0.30 0.02 H new ATOM 0 HD23 LEU A 214 -10.324 1.917 12.757 -0.30 0.02 H new ATOM 818 N CYS A 215 -7.601 0.396 8.119 -0.36 0.02 N ATOM 819 CA CYS A 215 -7.243 0.148 6.732 1.00 0.02 C ATOM 820 C CYS A 215 -7.245 -1.342 6.374 0.48 0.02 C ATOM 821 O CYS A 215 -6.232 -2.020 6.542 -0.48 0.02 O ATOM 822 CB CYS A 215 -5.854 0.722 6.485 0.20 0.02 C ATOM 823 SG CYS A 215 -4.495 -0.141 7.351 -0.20 0.02 S ATOM 0 H CYS A 215 -6.988 -0.046 8.804 -0.36 0.02 H new ATOM 0 HA CYS A 215 -7.992 0.627 6.102 1.00 0.02 H new ATOM 0 HB2 CYS A 215 -5.654 0.700 5.414 0.20 0.02 H new ATOM 0 HB3 CYS A 215 -5.851 1.769 6.788 0.20 0.02 H new ATOM 828 N VAL A 216 -8.349 -1.858 5.831 -0.36 0.02 N ATOM 829 CA VAL A 216 -8.360 -3.257 5.423 1.00 0.02 C ATOM 830 C VAL A 216 -7.849 -3.338 4.008 0.48 0.02 C ATOM 831 O VAL A 216 -8.607 -3.251 3.043 -0.48 0.02 O ATOM 832 CB VAL A 216 -9.743 -3.931 5.482 -0.10 0.02 C ATOM 833 CG1 VAL A 216 -9.838 -5.092 4.482 -0.30 0.02 C ATOM 834 CG2 VAL A 216 -10.049 -4.427 6.888 -0.30 0.02 C ATOM 0 H VAL A 216 -9.217 -1.347 5.669 -0.36 0.02 H new ATOM 0 HA VAL A 216 -7.729 -3.793 6.133 1.00 0.02 H new ATOM 0 HB VAL A 216 -10.484 -3.180 5.209 -0.10 0.02 H new ATOM 0 HG11 VAL A 216 -10.826 -5.548 4.547 -0.30 0.02 H new ATOM 0 HG12 VAL A 216 -9.678 -4.716 3.472 -0.30 0.02 H new ATOM 0 HG13 VAL A 216 -9.078 -5.837 4.717 -0.30 0.02 H new ATOM 0 HG21 VAL A 216 -11.032 -4.899 6.902 -0.30 0.02 H new ATOM 0 HG22 VAL A 216 -9.294 -5.153 7.190 -0.30 0.02 H new ATOM 0 HG23 VAL A 216 -10.041 -3.585 7.581 -0.30 0.02 H new ATOM 844 N ASN A 217 -6.563 -3.503 3.895 -0.36 0.02 N ATOM 845 CA ASN A 217 -5.940 -3.599 2.605 1.00 0.02 C ATOM 846 C ASN A 217 -5.962 -5.052 2.147 0.48 0.02 C ATOM 847 O ASN A 217 -5.180 -5.860 2.649 -0.48 0.02 O ATOM 848 CB ASN A 217 -4.510 -3.060 2.683 -0.20 0.02 C ATOM 849 CG ASN A 217 -3.664 -3.447 1.492 0.48 0.02 C ATOM 850 OD1 ASN A 217 -4.153 -4.030 0.525 -0.48 0.02 O ATOM 851 ND2 ASN A 217 -2.387 -3.106 1.550 -0.52 0.02 N ATOM 0 H ASN A 217 -5.921 -3.574 4.685 -0.36 0.02 H new ATOM 0 HA ASN A 217 -6.486 -2.999 1.877 1.00 0.02 H new ATOM 0 HB2 ASN A 217 -4.542 -1.973 2.761 -0.20 0.02 H new ATOM 0 HB3 ASN A 217 -4.037 -3.431 3.593 -0.20 0.02 H new ATOM 0 HD21 ASN A 217 -1.765 -3.326 0.772 -0.52 0.02 H new ATOM 0 HD22 ASN A 217 -2.025 -2.623 2.372 -0.52 0.02 H new ATOM 858 N TYR A 218 -6.860 -5.417 1.218 -0.36 0.02 N ATOM 859 CA TYR A 218 -6.909 -6.805 0.793 1.00 0.02 C ATOM 860 C TYR A 218 -5.915 -7.070 -0.310 0.48 0.02 C ATOM 861 O TYR A 218 -5.365 -6.140 -0.909 -0.48 0.02 O ATOM 862 CB TYR A 218 -8.324 -7.250 0.376 -0.20 0.02 C ATOM 863 CG TYR A 218 -9.138 -6.254 -0.424 1.00 0.02 C ATOM 864 CD1 TYR A 218 -9.946 -5.322 0.214 -0.14 0.02 C ATOM 865 CD2 TYR A 218 -9.140 -6.281 -1.817 -0.14 0.02 C ATOM 866 CE1 TYR A 218 -10.724 -4.437 -0.509 -0.14 0.02 C ATOM 867 CE2 TYR A 218 -9.922 -5.403 -2.547 -0.14 0.02 C ATOM 868 CZ TYR A 218 -10.710 -4.483 -1.887 0.20 0.02 C ATOM 869 OH TYR A 218 -11.491 -3.609 -2.609 -0.60 0.02 O ATOM 0 H TYR A 218 -7.531 -4.793 0.769 -0.36 0.02 H new ATOM 0 HA TYR A 218 -6.633 -7.405 1.660 1.00 0.02 H new ATOM 0 HB2 TYR A 218 -8.235 -8.166 -0.209 -0.20 0.02 H new ATOM 0 HB3 TYR A 218 -8.882 -7.501 1.278 -0.20 0.02 H new ATOM 0 HD1 TYR A 218 -9.967 -5.288 1.293 -0.14 0.02 H new ATOM 0 HD2 TYR A 218 -8.521 -6.999 -2.335 -0.14 0.02 H new ATOM 0 HE1 TYR A 218 -11.340 -3.713 0.003 -0.14 0.02 H new ATOM 0 HE2 TYR A 218 -9.915 -5.438 -3.626 -0.14 0.02 H new ATOM 0 HH TYR A 218 -11.365 -3.772 -3.567 -0.60 0.02 H new ATOM 879 N PRO A 219 -5.634 -8.350 -0.581 -0.36 0.02 N ATOM 880 CA PRO A 219 -4.679 -8.716 -1.602 1.00 0.02 C ATOM 881 C PRO A 219 -4.953 -7.984 -2.910 0.48 0.02 C ATOM 882 O PRO A 219 -5.819 -8.384 -3.687 -0.48 0.02 O ATOM 883 CB PRO A 219 -4.861 -10.234 -1.771 -0.20 0.02 C ATOM 884 CG PRO A 219 -6.075 -10.585 -0.973 -0.20 0.02 C ATOM 885 CD PRO A 219 -6.186 -9.535 0.091 0.06 0.02 C ATOM 0 HA PRO A 219 -3.660 -8.447 -1.324 1.00 0.02 H new ATOM 0 HB2 PRO A 219 -4.992 -10.499 -2.820 -0.20 0.02 H new ATOM 0 HB3 PRO A 219 -3.986 -10.776 -1.412 -0.20 0.02 H new ATOM 0 HG2 PRO A 219 -6.965 -10.599 -1.602 -0.20 0.02 H new ATOM 0 HG3 PRO A 219 -5.980 -11.578 -0.533 -0.20 0.02 H new ATOM 0 HD2 PRO A 219 -7.219 -9.381 0.404 0.06 0.02 H new ATOM 0 HD3 PRO A 219 -5.618 -9.798 0.983 0.06 0.02 H new ATOM 893 N GLY A 220 -4.206 -6.914 -3.147 -0.36 0.02 N ATOM 894 CA GLY A 220 -4.376 -6.146 -4.358 -0.10 0.02 C ATOM 895 C GLY A 220 -5.018 -4.796 -4.114 0.48 0.02 C ATOM 896 O GLY A 220 -4.353 -3.765 -4.190 -0.48 0.02 O ATOM 0 H GLY A 220 -3.483 -6.565 -2.517 -0.36 0.02 H new ATOM 0 HA2 GLY A 220 -3.404 -6.001 -4.830 -0.10 0.02 H new ATOM 0 HA3 GLY A 220 -4.989 -6.713 -5.059 -0.10 0.02 H new ATOM 900 N GLY A 221 -6.318 -4.802 -3.843 -0.36 0.02 N ATOM 901 CA GLY A 221 -7.037 -3.560 -3.612 -0.10 0.02 C ATOM 902 C GLY A 221 -7.319 -3.267 -2.155 0.48 0.02 C ATOM 903 O GLY A 221 -8.109 -3.956 -1.509 -0.48 0.02 O ATOM 0 H GLY A 221 -6.889 -5.645 -3.779 -0.36 0.02 H new ATOM 0 HA2 GLY A 221 -6.460 -2.736 -4.031 -0.10 0.02 H new ATOM 0 HA3 GLY A 221 -7.982 -3.595 -4.153 -0.10 0.02 H new ATOM 907 N TYR A 222 -6.649 -2.286 -1.594 -0.36 0.02 N ATOM 908 CA TYR A 222 -6.851 -1.979 -0.198 1.00 0.02 C ATOM 909 C TYR A 222 -8.204 -1.316 0.066 0.48 0.02 C ATOM 910 O TYR A 222 -8.983 -1.068 -0.854 -0.48 0.02 O ATOM 911 CB TYR A 222 -5.733 -1.082 0.297 -0.20 0.02 C ATOM 912 CG TYR A 222 -5.766 0.284 -0.333 1.00 0.02 C ATOM 913 CD1 TYR A 222 -5.221 0.505 -1.586 -0.14 0.02 C ATOM 914 CD2 TYR A 222 -6.347 1.346 0.329 -0.14 0.02 C ATOM 915 CE1 TYR A 222 -5.250 1.759 -2.165 -0.14 0.02 C ATOM 916 CE2 TYR A 222 -6.384 2.607 -0.236 -0.14 0.02 C ATOM 917 CZ TYR A 222 -5.832 2.809 -1.484 0.20 0.02 C ATOM 918 OH TYR A 222 -5.864 4.061 -2.054 -0.60 0.02 O ATOM 0 H TYR A 222 -5.970 -1.696 -2.074 -0.36 0.02 H new ATOM 0 HA TYR A 222 -6.842 -2.923 0.346 1.00 0.02 H new ATOM 0 HB2 TYR A 222 -5.806 -0.981 1.380 -0.20 0.02 H new ATOM 0 HB3 TYR A 222 -4.773 -1.553 0.085 -0.20 0.02 H new ATOM 0 HD1 TYR A 222 -4.766 -0.316 -2.120 -0.14 0.02 H new ATOM 0 HD2 TYR A 222 -6.780 1.189 1.306 -0.14 0.02 H new ATOM 0 HE1 TYR A 222 -4.820 1.917 -3.143 -0.14 0.02 H new ATOM 0 HE2 TYR A 222 -6.842 3.428 0.296 -0.14 0.02 H new ATOM 0 HH TYR A 222 -6.309 4.686 -1.445 -0.60 0.02 H new ATOM 928 N THR A 223 -8.459 -1.020 1.342 -0.36 0.02 N ATOM 929 CA THR A 223 -9.697 -0.369 1.763 1.00 0.02 C ATOM 930 C THR A 223 -9.466 0.391 3.057 0.48 0.02 C ATOM 931 O THR A 223 -8.671 -0.024 3.899 -0.48 0.02 O ATOM 932 CB THR A 223 -10.823 -1.397 1.926 0.18 0.02 C ATOM 933 OG1 THR A 223 -11.371 -1.733 0.666 -0.68 0.02 O ATOM 934 CG2 THR A 223 -11.967 -0.928 2.803 -0.30 0.02 C ATOM 0 H THR A 223 -7.816 -1.224 2.107 -0.36 0.02 H new ATOM 0 HA THR A 223 -10.002 0.339 0.992 1.00 0.02 H new ATOM 0 HB THR A 223 -10.352 -2.253 2.409 0.18 0.02 H new ATOM 0 HG1 THR A 223 -10.726 -1.516 -0.039 -0.68 0.02 H new ATOM 0 HG21 THR A 223 -12.721 -1.712 2.867 -0.30 0.02 H new ATOM 0 HG22 THR A 223 -11.592 -0.703 3.801 -0.30 0.02 H new ATOM 0 HG23 THR A 223 -12.412 -0.031 2.372 -0.30 0.02 H new ATOM 942 N CYS A 224 -10.138 1.524 3.197 -0.36 0.02 N ATOM 943 CA CYS A 224 -9.970 2.351 4.377 1.00 0.02 C ATOM 944 C CYS A 224 -11.288 2.627 5.088 0.48 0.02 C ATOM 945 O CYS A 224 -12.084 3.457 4.648 -0.48 0.02 O ATOM 946 CB CYS A 224 -9.311 3.677 3.998 0.20 0.02 C ATOM 947 SG CYS A 224 -8.130 3.566 2.614 -0.20 0.02 S ATOM 0 H CYS A 224 -10.800 1.888 2.512 -0.36 0.02 H new ATOM 0 HA CYS A 224 -9.333 1.796 5.066 1.00 0.02 H new ATOM 0 HB2 CYS A 224 -10.090 4.394 3.738 0.20 0.02 H new ATOM 0 HB3 CYS A 224 -8.792 4.073 4.871 0.20 0.02 H new ATOM 952 N TYR A 225 -11.480 1.966 6.222 -0.36 0.02 N ATOM 953 CA TYR A 225 -12.659 2.177 7.039 1.00 0.02 C ATOM 954 C TYR A 225 -12.260 2.994 8.276 0.48 0.02 C ATOM 955 O TYR A 225 -11.420 3.888 8.166 -0.48 0.02 O ATOM 956 CB TYR A 225 -13.363 0.850 7.393 -0.20 0.02 C ATOM 957 CG TYR A 225 -12.506 -0.224 8.040 1.00 0.02 C ATOM 958 CD1 TYR A 225 -11.402 -0.772 7.390 -0.14 0.02 C ATOM 959 CD2 TYR A 225 -12.833 -0.717 9.298 -0.14 0.02 C ATOM 960 CE1 TYR A 225 -10.656 -1.771 7.977 -0.14 0.02 C ATOM 961 CE2 TYR A 225 -12.085 -1.717 9.893 -0.14 0.02 C ATOM 962 CZ TYR A 225 -10.999 -2.241 9.227 0.20 0.02 C ATOM 963 OH TYR A 225 -10.253 -3.239 9.812 -0.60 0.02 O ATOM 0 H TYR A 225 -10.828 1.276 6.595 -0.36 0.02 H new ATOM 0 HA TYR A 225 -13.398 2.744 6.474 1.00 0.02 H new ATOM 0 HB2 TYR A 225 -14.193 1.073 8.063 -0.20 0.02 H new ATOM 0 HB3 TYR A 225 -13.793 0.438 6.480 -0.20 0.02 H new ATOM 0 HD1 TYR A 225 -11.127 -0.408 6.411 -0.14 0.02 H new ATOM 0 HD2 TYR A 225 -13.687 -0.312 9.820 -0.14 0.02 H new ATOM 0 HE1 TYR A 225 -9.804 -2.185 7.459 -0.14 0.02 H new ATOM 0 HE2 TYR A 225 -12.351 -2.084 10.873 -0.14 0.02 H new ATOM 0 HH TYR A 225 -9.302 -3.011 9.758 -0.60 0.02 H new ATOM 973 N CYS A 226 -12.825 2.713 9.448 -0.36 0.02 N ATOM 974 CA CYS A 226 -12.456 3.480 10.638 1.00 0.02 C ATOM 975 C CYS A 226 -12.797 2.763 11.932 0.48 0.02 C ATOM 976 O CYS A 226 -11.916 2.282 12.635 -0.48 0.02 O ATOM 977 CB CYS A 226 -13.136 4.826 10.634 0.20 0.02 C ATOM 978 SG CYS A 226 -11.975 6.238 10.631 -0.20 0.02 S ATOM 0 H CYS A 226 -13.520 1.982 9.600 -0.36 0.02 H new ATOM 0 HA CYS A 226 -11.374 3.601 10.596 1.00 0.02 H new ATOM 0 HB2 CYS A 226 -13.780 4.895 9.757 0.20 0.02 H new ATOM 0 HB3 CYS A 226 -13.781 4.900 11.510 0.20 0.02 H new ATOM 983 N ASP A 227 -14.090 2.725 12.243 -0.36 0.02 N ATOM 984 CA ASP A 227 -14.605 2.099 13.457 1.00 0.02 C ATOM 985 C ASP A 227 -13.549 1.289 14.205 0.48 0.02 C ATOM 986 O ASP A 227 -13.146 0.208 13.776 -0.48 0.02 O ATOM 987 CB ASP A 227 -15.822 1.243 13.104 -0.45 0.02 C ATOM 988 CG ASP A 227 -15.454 -0.108 12.516 0.49 0.02 C ATOM 989 OD1 ASP A 227 -15.236 -1.057 13.298 -0.62 0.02 O ATOM 990 OD2 ASP A 227 -15.384 -0.215 11.274 -0.62 0.02 O ATOM 0 H ASP A 227 -14.816 3.132 11.654 -0.36 0.02 H new ATOM 0 HA ASP A 227 -14.903 2.892 14.143 1.00 0.02 H new ATOM 0 HB2 ASP A 227 -16.423 1.090 14.001 -0.45 0.02 H new ATOM 0 HB3 ASP A 227 -16.444 1.784 12.392 -0.45 0.02 H new ATOM 995 N GLY A 228 -13.104 1.838 15.328 -0.36 0.02 N ATOM 996 CA GLY A 228 -12.098 1.181 16.131 -0.10 0.02 C ATOM 997 C GLY A 228 -11.495 2.110 17.167 0.48 0.02 C ATOM 998 O GLY A 228 -11.089 1.673 18.244 -0.48 0.02 O ATOM 0 H GLY A 228 -13.426 2.733 15.697 -0.36 0.02 H new ATOM 0 HA2 GLY A 228 -12.541 0.320 16.632 -0.10 0.02 H new ATOM 0 HA3 GLY A 228 -11.308 0.802 15.482 -0.10 0.02 H new ATOM 1002 N LYS A 229 -11.454 3.400 16.846 -0.36 0.02 N ATOM 1003 CA LYS A 229 -10.918 4.402 17.760 1.00 0.02 C ATOM 1004 C LYS A 229 -12.059 5.213 18.363 0.48 0.02 C ATOM 1005 O LYS A 229 -12.014 5.608 19.528 -0.48 0.02 O ATOM 1006 CB LYS A 229 -9.927 5.322 17.036 -0.20 0.02 C ATOM 1007 CG LYS A 229 -10.586 6.369 16.149 -0.20 0.02 C ATOM 1008 CD LYS A 229 -10.755 7.692 16.879 -0.20 0.02 C ATOM 1009 CE LYS A 229 -10.595 8.872 15.934 0.30 5.02 C ATOM 1010 NZ LYS A 229 -11.856 9.171 15.200 -0.81 0.02 N ATOM 0 H LYS A 229 -11.786 3.776 15.958 -0.36 0.02 H new ATOM 0 HA LYS A 229 -10.382 3.895 18.562 1.00 0.02 H new ATOM 0 HB2 LYS A 229 -9.308 5.827 17.778 -0.20 0.02 H new ATOM 0 HB3 LYS A 229 -9.260 4.712 16.426 -0.20 0.02 H new ATOM 0 HG2 LYS A 229 -9.983 6.521 15.254 -0.20 0.02 H new ATOM 0 HG3 LYS A 229 -11.560 6.007 15.819 -0.20 0.02 H new ATOM 0 HD2 LYS A 229 -11.739 7.729 17.346 -0.20 0.02 H new ATOM 0 HD3 LYS A 229 -10.020 7.764 17.680 -0.20 0.02 H new ATOM 0 HE2 LYS A 229 -10.287 9.751 16.500 0.30 5.02 H new ATOM 0 HE3 LYS A 229 -9.800 8.659 15.219 0.30 5.02 H new ATOM 0 HZ1 LYS A 229 -11.696 9.960 14.542 -0.81 0.02 H new ATOM 0 HZ2 LYS A 229 -12.155 8.330 14.666 -0.81 0.02 H new ATOM 0 HZ3 LYS A 229 -12.599 9.432 15.879 -0.81 0.02 H new ATOM 1024 N LYS A 230 -13.090 5.441 17.555 -0.36 0.02 N ATOM 1025 CA LYS A 230 -14.263 6.185 17.991 1.00 0.02 C ATOM 1026 C LYS A 230 -15.496 5.291 17.967 0.48 0.02 C ATOM 1027 O LYS A 230 -16.438 5.498 18.732 -0.48 0.02 O ATOM 1028 CB LYS A 230 -14.478 7.417 17.116 -0.20 0.02 C ATOM 1029 CG LYS A 230 -14.836 8.669 17.902 -0.20 0.02 C ATOM 1030 CD LYS A 230 -16.292 9.061 17.699 -0.20 0.02 C ATOM 1031 CE LYS A 230 -16.988 9.331 19.024 0.30 5.02 C ATOM 1032 NZ LYS A 230 -17.084 10.788 19.315 -0.81 0.02 N ATOM 0 H LYS A 230 -13.135 5.118 16.589 -0.36 0.02 H new ATOM 0 HA LYS A 230 -14.096 6.520 19.015 1.00 0.02 H new ATOM 0 HB2 LYS A 230 -13.572 7.606 16.541 -0.20 0.02 H new ATOM 0 HB3 LYS A 230 -15.272 7.209 16.399 -0.20 0.02 H new ATOM 0 HG2 LYS A 230 -14.649 8.499 18.962 -0.20 0.02 H new ATOM 0 HG3 LYS A 230 -14.191 9.491 17.592 -0.20 0.02 H new ATOM 0 HD2 LYS A 230 -16.346 9.950 17.071 -0.20 0.02 H new ATOM 0 HD3 LYS A 230 -16.814 8.264 17.169 -0.20 0.02 H new ATOM 0 HE2 LYS A 230 -17.988 8.898 19.003 0.30 5.02 H new ATOM 0 HE3 LYS A 230 -16.443 8.836 19.828 0.30 5.02 H new ATOM 0 HZ1 LYS A 230 -17.565 10.929 20.226 -0.81 0.02 H new ATOM 0 HZ2 LYS A 230 -16.129 11.197 19.360 -0.81 0.02 H new ATOM 0 HZ3 LYS A 230 -17.626 11.258 18.562 -0.81 0.02 H new ATOM 1046 N GLY A 231 -15.483 4.293 17.088 -0.36 0.02 N ATOM 1047 CA GLY A 231 -16.603 3.383 16.989 -0.10 0.02 C ATOM 1048 C GLY A 231 -17.649 3.863 16.008 0.48 0.02 C ATOM 1049 O GLY A 231 -18.700 4.361 16.411 -0.48 0.02 O ATOM 0 H GLY A 231 -14.716 4.101 16.444 -0.36 0.02 H new ATOM 0 HA2 GLY A 231 -16.244 2.401 16.682 -0.10 0.02 H new ATOM 0 HA3 GLY A 231 -17.058 3.263 17.972 -0.10 0.02 H new ATOM 1053 N PHE A 232 -17.374 3.707 14.716 -0.36 0.02 N ATOM 1054 CA PHE A 232 -18.327 4.130 13.699 1.00 0.02 C ATOM 1055 C PHE A 232 -18.310 3.238 12.452 0.48 0.02 C ATOM 1056 O PHE A 232 -18.461 2.021 12.564 -0.48 0.02 O ATOM 1057 CB PHE A 232 -18.153 5.601 13.345 -0.16 0.02 C ATOM 1058 CG PHE A 232 -16.759 6.114 13.130 0.03 0.02 C ATOM 1059 CD1 PHE A 232 -16.173 6.073 11.873 -0.16 0.02 C ATOM 1060 CD2 PHE A 232 -16.082 6.753 14.159 -0.16 0.02 C ATOM 1061 CE1 PHE A 232 -14.950 6.657 11.655 -0.15 0.02 C ATOM 1062 CE2 PHE A 232 -14.841 7.316 13.942 -0.15 0.02 C ATOM 1063 CZ PHE A 232 -14.278 7.274 12.687 -0.15 0.02 C ATOM 0 H PHE A 232 -16.513 3.297 14.354 -0.36 0.02 H new ATOM 0 HA PHE A 232 -19.317 4.011 14.140 1.00 0.02 H new ATOM 0 HB2 PHE A 232 -18.724 5.796 12.437 -0.16 0.02 H new ATOM 0 HB3 PHE A 232 -18.607 6.192 14.140 -0.16 0.02 H new ATOM 0 HD1 PHE A 232 -16.683 5.578 11.060 -0.16 0.02 H new ATOM 0 HD2 PHE A 232 -16.531 6.810 15.140 -0.16 0.02 H new ATOM 0 HE1 PHE A 232 -14.512 6.633 10.668 -0.15 0.02 H new ATOM 0 HE2 PHE A 232 -14.312 7.789 14.756 -0.15 0.02 H new ATOM 0 HZ PHE A 232 -13.312 7.724 12.512 -0.15 0.02 H new ATOM 1073 N LYS A 233 -18.190 3.835 11.261 -0.36 0.02 N ATOM 1074 CA LYS A 233 -18.227 3.065 10.025 1.00 0.02 C ATOM 1075 C LYS A 233 -17.420 3.713 8.900 0.48 0.02 C ATOM 1076 O LYS A 233 -16.814 4.769 9.071 -0.48 0.02 O ATOM 1077 CB LYS A 233 -19.675 2.935 9.584 -0.20 0.02 C ATOM 1078 CG LYS A 233 -20.074 1.528 9.165 -0.20 0.02 C ATOM 1079 CD LYS A 233 -19.767 0.512 10.254 -0.20 0.02 C ATOM 1080 CE LYS A 233 -20.511 -0.794 10.024 0.30 5.02 C ATOM 1081 NZ LYS A 233 -19.626 -1.977 10.213 -0.81 0.02 N ATOM 0 H LYS A 233 -18.068 4.840 11.133 -0.36 0.02 H new ATOM 0 HA LYS A 233 -17.778 2.092 10.224 1.00 0.02 H new ATOM 0 HB2 LYS A 233 -20.322 3.257 10.400 -0.20 0.02 H new ATOM 0 HB3 LYS A 233 -19.852 3.614 8.750 -0.20 0.02 H new ATOM 0 HG2 LYS A 233 -21.139 1.505 8.934 -0.20 0.02 H new ATOM 0 HG3 LYS A 233 -19.544 1.255 8.252 -0.20 0.02 H new ATOM 0 HD2 LYS A 233 -18.694 0.321 10.282 -0.20 0.02 H new ATOM 0 HD3 LYS A 233 -20.043 0.923 11.225 -0.20 0.02 H new ATOM 0 HE2 LYS A 233 -21.354 -0.858 10.712 0.30 5.02 H new ATOM 0 HE3 LYS A 233 -20.922 -0.805 9.014 0.30 5.02 H new ATOM 0 HZ1 LYS A 233 -20.170 -2.848 10.047 -0.81 0.02 H new ATOM 0 HZ2 LYS A 233 -18.835 -1.930 9.540 -0.81 0.02 H new ATOM 0 HZ3 LYS A 233 -19.254 -1.981 11.184 -0.81 0.02 H new ATOM 1095 N LEU A 234 -17.438 3.057 7.741 -0.36 0.02 N ATOM 1096 CA LEU A 234 -16.733 3.538 6.558 1.00 0.02 C ATOM 1097 C LEU A 234 -17.711 4.185 5.577 0.48 0.02 C ATOM 1098 O LEU A 234 -18.570 3.510 5.010 -0.48 0.02 O ATOM 1099 CB LEU A 234 -16.003 2.371 5.881 -0.20 0.02 C ATOM 1100 CG LEU A 234 -15.613 2.587 4.414 -0.10 0.02 C ATOM 1101 CD1 LEU A 234 -14.766 3.839 4.265 -0.30 0.02 C ATOM 1102 CD2 LEU A 234 -14.871 1.373 3.875 -0.30 0.02 C ATOM 0 H LEU A 234 -17.940 2.181 7.597 -0.36 0.02 H new ATOM 0 HA LEU A 234 -16.005 4.289 6.864 1.00 0.02 H new ATOM 0 HB2 LEU A 234 -15.098 2.155 6.449 -0.20 0.02 H new ATOM 0 HB3 LEU A 234 -16.637 1.486 5.942 -0.20 0.02 H new ATOM 0 HG LEU A 234 -16.525 2.719 3.832 -0.10 0.02 H new ATOM 0 HD11 LEU A 234 -14.499 3.975 3.217 -0.30 0.02 H new ATOM 0 HD12 LEU A 234 -15.332 4.704 4.611 -0.30 0.02 H new ATOM 0 HD13 LEU A 234 -13.858 3.737 4.860 -0.30 0.02 H new ATOM 0 HD21 LEU A 234 -14.602 1.544 2.833 -0.30 0.02 H new ATOM 0 HD22 LEU A 234 -13.967 1.210 4.461 -0.30 0.02 H new ATOM 0 HD23 LEU A 234 -15.512 0.494 3.945 -0.30 0.02 H new ATOM 1114 N ALA A 235 -17.573 5.493 5.376 -0.36 0.02 N ATOM 1115 CA ALA A 235 -18.446 6.220 4.457 1.00 0.02 C ATOM 1116 C ALA A 235 -18.430 5.588 3.074 0.48 0.02 C ATOM 1117 O ALA A 235 -17.748 4.589 2.844 -0.48 0.02 O ATOM 1118 CB ALA A 235 -18.025 7.676 4.359 -0.30 0.02 C ATOM 0 H ALA A 235 -16.868 6.070 5.835 -0.36 0.02 H new ATOM 0 HA ALA A 235 -19.460 6.168 4.852 1.00 0.02 H new ATOM 0 HB1 ALA A 235 -18.687 8.201 3.670 -0.30 0.02 H new ATOM 0 HB2 ALA A 235 -18.085 8.139 5.344 -0.30 0.02 H new ATOM 0 HB3 ALA A 235 -17.000 7.735 3.993 -0.30 0.02 H new ATOM 1124 N GLN A 236 -19.191 6.171 2.153 -0.36 0.02 N ATOM 1125 CA GLN A 236 -19.264 5.658 0.793 1.00 0.02 C ATOM 1126 C GLN A 236 -18.077 6.119 -0.055 0.48 0.02 C ATOM 1127 O GLN A 236 -18.049 5.889 -1.265 -0.48 0.02 O ATOM 1128 CB GLN A 236 -20.574 6.092 0.134 -0.20 0.02 C ATOM 1129 CG GLN A 236 -20.943 5.267 -1.087 -0.20 0.02 C ATOM 1130 CD GLN A 236 -21.858 4.106 -0.751 0.48 0.02 C ATOM 1131 OE1 GLN A 236 -21.421 2.957 -0.678 -0.48 0.02 O ATOM 1132 NE2 GLN A 236 -23.136 4.401 -0.545 -0.52 0.02 N ATOM 0 H GLN A 236 -19.764 6.997 2.325 -0.36 0.02 H new ATOM 0 HA GLN A 236 -19.229 4.570 0.852 1.00 0.02 H new ATOM 0 HB2 GLN A 236 -21.379 6.023 0.865 -0.20 0.02 H new ATOM 0 HB3 GLN A 236 -20.495 7.140 -0.156 -0.20 0.02 H new ATOM 0 HG2 GLN A 236 -21.431 5.909 -1.821 -0.20 0.02 H new ATOM 0 HG3 GLN A 236 -20.034 4.886 -1.552 -0.20 0.02 H new ATOM 0 HE21 GLN A 236 -23.454 5.368 -0.616 -0.52 0.02 H new ATOM 0 HE22 GLN A 236 -23.800 3.661 -0.316 -0.52 0.02 H new ATOM 1141 N ASP A 237 -17.093 6.754 0.577 -0.36 0.02 N ATOM 1142 CA ASP A 237 -15.909 7.221 -0.141 1.00 0.02 C ATOM 1143 C ASP A 237 -14.945 6.063 -0.368 0.48 0.02 C ATOM 1144 O ASP A 237 -14.283 5.990 -1.402 -0.48 0.02 O ATOM 1145 CB ASP A 237 -15.204 8.345 0.631 -0.45 0.02 C ATOM 1146 CG ASP A 237 -16.164 9.194 1.442 0.49 0.02 C ATOM 1147 OD1 ASP A 237 -16.816 10.081 0.853 -0.62 0.02 O ATOM 1148 OD2 ASP A 237 -16.264 8.972 2.667 -0.62 0.02 O ATOM 0 H ASP A 237 -17.091 6.956 1.577 -0.36 0.02 H new ATOM 0 HA ASP A 237 -16.230 7.617 -1.104 1.00 0.02 H new ATOM 0 HB2 ASP A 237 -14.459 7.910 1.297 -0.45 0.02 H new ATOM 0 HB3 ASP A 237 -14.668 8.982 -0.073 -0.45 0.02 H new ATOM 1153 N GLN A 238 -14.875 5.170 0.625 -0.36 0.02 N ATOM 1154 CA GLN A 238 -13.999 3.992 0.592 1.00 0.02 C ATOM 1155 C GLN A 238 -12.686 4.277 1.311 0.48 0.02 C ATOM 1156 O GLN A 238 -12.248 3.492 2.152 -0.48 0.02 O ATOM 1157 CB GLN A 238 -13.722 3.518 -0.841 -0.20 0.02 C ATOM 1158 CG GLN A 238 -14.976 3.385 -1.692 -0.20 0.02 C ATOM 1159 CD GLN A 238 -15.083 2.030 -2.364 0.48 0.02 C ATOM 1160 OE1 GLN A 238 -15.178 1.937 -3.588 -0.48 0.02 O ATOM 1161 NE2 GLN A 238 -15.069 0.971 -1.565 -0.52 0.02 N ATOM 0 H GLN A 238 -15.427 5.244 1.479 -0.36 0.02 H new ATOM 0 HA GLN A 238 -14.524 3.190 1.110 1.00 0.02 H new ATOM 0 HB2 GLN A 238 -13.040 4.220 -1.321 -0.20 0.02 H new ATOM 0 HB3 GLN A 238 -13.214 2.554 -0.804 -0.20 0.02 H new ATOM 0 HG2 GLN A 238 -15.854 3.547 -1.067 -0.20 0.02 H new ATOM 0 HG3 GLN A 238 -14.979 4.165 -2.453 -0.20 0.02 H new ATOM 0 HE21 GLN A 238 -14.989 1.095 -0.556 -0.52 0.02 H new ATOM 0 HE22 GLN A 238 -15.139 0.033 -1.960 -0.52 0.02 H new ATOM 1170 N LYS A 239 -12.062 5.404 0.984 -0.36 0.02 N ATOM 1171 CA LYS A 239 -10.803 5.783 1.612 1.00 0.02 C ATOM 1172 C LYS A 239 -11.057 6.587 2.886 0.48 0.02 C ATOM 1173 O LYS A 239 -10.267 6.544 3.828 -0.48 0.02 O ATOM 1174 CB LYS A 239 -9.944 6.594 0.640 -0.20 0.02 C ATOM 1175 CG LYS A 239 -10.570 7.919 0.236 -0.20 0.02 C ATOM 1176 CD LYS A 239 -10.139 8.336 -1.161 -0.20 0.02 C ATOM 1177 CE LYS A 239 -10.332 9.827 -1.383 0.30 5.02 C ATOM 1178 NZ LYS A 239 -10.208 10.197 -2.820 -0.81 0.02 N ATOM 0 H LYS A 239 -12.406 6.068 0.290 -0.36 0.02 H new ATOM 0 HA LYS A 239 -10.267 4.872 1.878 1.00 0.02 H new ATOM 0 HB2 LYS A 239 -8.973 6.785 1.098 -0.20 0.02 H new ATOM 0 HB3 LYS A 239 -9.763 5.999 -0.255 -0.20 0.02 H new ATOM 0 HG2 LYS A 239 -11.656 7.836 0.273 -0.20 0.02 H new ATOM 0 HG3 LYS A 239 -10.285 8.690 0.951 -0.20 0.02 H new ATOM 0 HD2 LYS A 239 -9.091 8.078 -1.312 -0.20 0.02 H new ATOM 0 HD3 LYS A 239 -10.714 7.780 -1.901 -0.20 0.02 H new ATOM 0 HE2 LYS A 239 -11.314 10.124 -1.015 0.30 5.02 H new ATOM 0 HE3 LYS A 239 -9.594 10.379 -0.801 0.30 5.02 H new ATOM 0 HZ1 LYS A 239 -10.346 11.222 -2.928 -0.81 0.02 H new ATOM 0 HZ2 LYS A 239 -9.262 9.937 -3.165 -0.81 0.02 H new ATOM 0 HZ3 LYS A 239 -10.929 9.691 -3.372 -0.81 0.02 H new ATOM 1192 N SER A 240 -12.171 7.314 2.909 -0.36 0.02 N ATOM 1193 CA SER A 240 -12.537 8.118 4.070 1.00 0.02 C ATOM 1194 C SER A 240 -13.529 7.358 4.941 0.48 0.02 C ATOM 1195 O SER A 240 -14.165 6.414 4.483 -0.48 0.02 O ATOM 1196 CB SER A 240 -13.141 9.453 3.631 0.08 0.02 C ATOM 1197 OG SER A 240 -12.291 10.122 2.715 -0.68 0.02 O ATOM 0 H SER A 240 -12.835 7.362 2.137 -0.36 0.02 H new ATOM 0 HA SER A 240 -11.636 8.319 4.649 1.00 0.02 H new ATOM 0 HB2 SER A 240 -14.114 9.281 3.170 0.08 0.02 H new ATOM 0 HB3 SER A 240 -13.309 10.084 4.504 0.08 0.02 H new ATOM 0 HG SER A 240 -12.701 10.971 2.449 -0.68 0.02 H new ATOM 1203 N CYS A 241 -13.651 7.763 6.200 -0.36 0.02 N ATOM 1204 CA CYS A 241 -14.562 7.095 7.123 1.00 0.02 C ATOM 1205 C CYS A 241 -15.518 8.080 7.789 0.48 0.02 C ATOM 1206 O CYS A 241 -15.162 9.228 8.055 -0.48 0.02 O ATOM 1207 CB CYS A 241 -13.767 6.356 8.190 0.20 0.02 C ATOM 1208 SG CYS A 241 -12.571 7.399 9.077 -0.20 0.02 S ATOM 0 H CYS A 241 -13.135 8.545 6.603 -0.36 0.02 H new ATOM 0 HA CYS A 241 -15.157 6.388 6.545 1.00 0.02 H new ATOM 0 HB2 CYS A 241 -14.461 5.923 8.911 0.20 0.02 H new ATOM 0 HB3 CYS A 241 -13.235 5.527 7.723 0.20 0.02 H new ATOM 1213 N GLU A 242 -16.734 7.612 8.064 -0.36 0.02 N ATOM 1214 CA GLU A 242 -17.749 8.436 8.710 1.00 0.02 C ATOM 1215 C GLU A 242 -18.577 7.609 9.692 0.48 0.02 C ATOM 1216 O GLU A 242 -18.710 6.395 9.538 -0.48 0.02 O ATOM 1217 CB GLU A 242 -18.664 9.072 7.662 -0.20 0.02 C ATOM 1218 CG GLU A 242 -18.001 10.193 6.877 -0.45 0.02 C ATOM 1219 CD GLU A 242 -18.916 11.384 6.674 0.49 0.02 C ATOM 1220 OE1 GLU A 242 -19.293 12.022 7.679 -0.62 0.02 O ATOM 1221 OE2 GLU A 242 -19.257 11.678 5.509 -0.62 0.02 O ATOM 0 H GLU A 242 -17.039 6.663 7.848 -0.36 0.02 H new ATOM 0 HA GLU A 242 -17.241 9.225 9.265 1.00 0.02 H new ATOM 0 HB2 GLU A 242 -18.998 8.301 6.967 -0.20 0.02 H new ATOM 0 HB3 GLU A 242 -19.553 9.462 8.157 -0.20 0.02 H new ATOM 0 HG2 GLU A 242 -17.102 10.516 7.401 -0.45 0.02 H new ATOM 0 HG3 GLU A 242 -17.684 9.813 5.906 -0.45 0.02 H new ATOM 1228 N VAL A 243 -19.134 8.276 10.698 -0.36 0.02 N ATOM 1229 CA VAL A 243 -19.953 7.608 11.706 1.00 0.02 C ATOM 1230 C VAL A 243 -21.427 7.637 11.314 0.48 0.02 C ATOM 1231 O VAL A 243 -21.851 8.468 10.511 -0.48 0.02 O ATOM 1232 CB VAL A 243 -19.777 8.267 13.090 -0.10 0.02 C ATOM 1233 CG1 VAL A 243 -20.095 9.753 13.024 -0.30 0.02 C ATOM 1234 CG2 VAL A 243 -20.639 7.572 14.136 -0.30 0.02 C ATOM 0 H VAL A 243 -19.033 9.281 10.838 -0.36 0.02 H new ATOM 0 HA VAL A 243 -19.619 6.572 11.764 1.00 0.02 H new ATOM 0 HB VAL A 243 -18.734 8.157 13.388 -0.10 0.02 H new ATOM 0 HG11 VAL A 243 -19.964 10.197 14.011 -0.30 0.02 H new ATOM 0 HG12 VAL A 243 -19.423 10.238 12.316 -0.30 0.02 H new ATOM 0 HG13 VAL A 243 -21.126 9.890 12.698 -0.30 0.02 H new ATOM 0 HG21 VAL A 243 -20.498 8.055 15.103 -0.30 0.02 H new ATOM 0 HG22 VAL A 243 -21.688 7.640 13.847 -0.30 0.02 H new ATOM 0 HG23 VAL A 243 -20.349 6.524 14.208 -0.30 0.02 H new ATOM 1244 N VAL A 244 -22.203 6.721 11.884 -0.36 0.02 N ATOM 1245 CA VAL A 244 -23.626 6.638 11.593 1.00 0.02 C ATOM 1246 C VAL A 244 -24.392 6.061 12.777 0.48 0.02 C ATOM 1247 O VAL A 244 -23.964 5.087 13.396 -0.48 0.02 O ATOM 1248 CB VAL A 244 -23.894 5.773 10.347 -0.10 0.02 C ATOM 1249 CG1 VAL A 244 -23.340 4.370 10.540 -0.30 0.02 C ATOM 1250 CG2 VAL A 244 -25.382 5.729 10.030 -0.30 0.02 C ATOM 0 H VAL A 244 -21.868 6.026 12.551 -0.36 0.02 H new ATOM 0 HA VAL A 244 -23.972 7.653 11.400 1.00 0.02 H new ATOM 0 HB VAL A 244 -23.382 6.228 9.499 -0.10 0.02 H new ATOM 0 HG11 VAL A 244 -23.539 3.774 9.649 -0.30 0.02 H new ATOM 0 HG12 VAL A 244 -22.264 4.423 10.708 -0.30 0.02 H new ATOM 0 HG13 VAL A 244 -23.819 3.905 11.402 -0.30 0.02 H new ATOM 0 HG21 VAL A 244 -25.548 5.113 9.146 -0.30 0.02 H new ATOM 0 HG22 VAL A 244 -25.922 5.303 10.876 -0.30 0.02 H new ATOM 0 HG23 VAL A 244 -25.744 6.740 9.840 -0.30 0.02 H new ATOM 1260 N SER A 245 -25.527 6.673 13.083 -0.36 0.02 N ATOM 1261 CA SER A 245 -26.364 6.229 14.191 1.00 0.02 C ATOM 1262 C SER A 245 -27.462 5.291 13.702 0.14 0.02 C ATOM 1263 O SER A 245 -28.375 5.768 12.994 -0.57 0.02 O ATOM 1264 CB SER A 245 -26.984 7.433 14.902 0.08 0.02 C ATOM 1265 OG SER A 245 -25.999 8.181 15.594 -0.68 0.02 O ATOM 1266 OXT SER A 245 -27.401 4.087 14.029 -0.57 0.02 O ATOM 0 H SER A 245 -25.891 7.481 12.578 -0.36 0.02 H new ATOM 0 HA SER A 245 -25.734 5.685 14.895 1.00 0.02 H new ATOM 0 HB2 SER A 245 -27.484 8.071 14.174 0.08 0.02 H new ATOM 0 HB3 SER A 245 -27.746 7.092 15.604 0.08 0.02 H new ATOM 0 HG SER A 245 -26.421 8.946 16.038 -0.68 0.02 H new TER 1272 SER A 245 HETATM 1273 CA CA A 246 13.470 6.405 -7.810 2.00 0.02 CA HETATM 1274 CA CA A 247 -2.783 -5.514 -0.602 2.00 0.02 CA HETATM 1275 O HOH A 248 14.802 7.390 -6.019 -0.83 4.02 O HETATM 1278 O HOH A 249 -2.604 -6.164 1.745 -0.83 4.02 O