USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 646 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 221 TYR OH : rot -150:sc= 1.26 USER MOD Set 1.2: B 245 THR OG1 : rot 85:sc= 1.84 USER MOD Set 2.1: A 6 TYR OH : rot 180:sc= -0.0317 USER MOD Set 2.2: B 212 ASN : amide:sc= -6.89! C(o=-6.9!,f=-12!) USER MOD Set 3.1: A 21 TYR OH : rot 79:sc= 0.74 USER MOD Set 3.2: A 45 THR OG1 : rot 88:sc= 1.06 USER MOD Set 4.1: A 12 ASN : amide:sc= -8.37! C(o=-10!,f=-12!) USER MOD Set 4.2: B 206 TYR OH : rot 165:sc= -1.83! USER MOD Set 5.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 140:sc= -3.7! USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.134 USER MOD Single : A 11 THR OG1 : rot 163:sc= -2.95! USER MOD Single : A 13 ASN : amide:sc= -0.0234 X(o=-0.023,f=0) USER MOD Single : A 14 SER OG : rot 43:sc= -0.572 USER MOD Single : A 15 ASN : amide:sc= -0.439 X(o=-0.44,f=-0.62) USER MOD Single : A 18 SER OG : rot 180:sc= 0.00127 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.681 USER MOD Single : A 27 MET CE :methyl -129:sc= -1.71 (180deg=-4.93!) USER MOD Single : A 28 THR OG1 : rot -93:sc= -0.708 USER MOD Single : A 40 LYS NZ :NH3+ -161:sc= -0.997 (180deg=-1.79!) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.618 F(o=-1.3!,f=-0.62) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.77! USER MOD Single : B 207 THR OG1 : rot 180:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 211 THR OG1 : rot 166:sc= -2.92! USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN :FLIP amide:sc= -0.577 F(o=-1.1,f=-0.58) USER MOD Single : B 218 SER OG : rot 180:sc= 0 USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.928 USER MOD Single : B 227 MET CE :methyl -134:sc= -1.62 (180deg=-4.75!) USER MOD Single : B 228 THR OG1 : rot -170:sc= -1.23! USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.552 F(o=-1.1,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.174 -19.983 -6.530 1.00 0.00 N ATOM 26 CA LYS A 3 -0.097 -19.676 -5.604 1.00 0.00 C ATOM 27 C LYS A 3 -0.571 -18.614 -4.610 1.00 0.00 C ATOM 28 O LYS A 3 -1.633 -18.020 -4.790 1.00 0.00 O ATOM 29 CB LYS A 3 1.169 -19.282 -6.367 1.00 0.00 C ATOM 30 CG LYS A 3 1.886 -20.517 -6.915 1.00 0.00 C ATOM 31 CD LYS A 3 0.882 -21.588 -7.344 1.00 0.00 C ATOM 32 CE LYS A 3 1.574 -22.707 -8.127 1.00 0.00 C ATOM 33 NZ LYS A 3 1.343 -24.015 -7.475 1.00 0.00 N ATOM 0 HA LYS A 3 0.170 -20.559 -5.024 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.910 -18.614 -7.188 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.839 -18.731 -5.707 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.507 -20.234 -7.765 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.553 -20.922 -6.154 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.391 -22.005 -6.464 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.104 -21.136 -7.959 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.196 -22.732 -9.149 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.644 -22.508 -8.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.819 -24.763 -8.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 1.725 -23.993 -6.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.322 -24.210 -7.439 1.00 0.00 H new ATOM 47 N ALA A 4 0.238 -18.408 -3.582 1.00 0.00 N ATOM 48 CA ALA A 4 -0.085 -17.429 -2.558 1.00 0.00 C ATOM 49 C ALA A 4 0.830 -16.214 -2.715 1.00 0.00 C ATOM 50 O ALA A 4 1.937 -16.193 -2.180 1.00 0.00 O ATOM 51 CB ALA A 4 0.035 -18.075 -1.177 1.00 0.00 C ATOM 0 H ALA A 4 1.118 -18.903 -3.436 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.113 -17.084 -2.667 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.207 -17.340 -0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.656 -18.915 -1.107 1.00 0.00 H new ATOM 0 HB3 ALA A 4 1.055 -18.431 -1.029 1.00 0.00 H new ATOM 57 N THR A 5 0.334 -15.229 -3.451 1.00 0.00 N ATOM 58 CA THR A 5 1.092 -14.012 -3.684 1.00 0.00 C ATOM 59 C THR A 5 0.161 -12.799 -3.711 1.00 0.00 C ATOM 60 O THR A 5 -1.047 -12.943 -3.896 1.00 0.00 O ATOM 61 CB THR A 5 1.891 -14.194 -4.976 1.00 0.00 C ATOM 62 OG1 THR A 5 0.897 -14.447 -5.965 1.00 0.00 O ATOM 63 CG2 THR A 5 2.740 -15.467 -4.966 1.00 0.00 C ATOM 0 H THR A 5 -0.585 -15.250 -3.894 1.00 0.00 H new ATOM 0 HA THR A 5 1.795 -13.823 -2.873 1.00 0.00 H new ATOM 0 HB THR A 5 2.537 -13.329 -5.128 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.131 -13.976 -6.792 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.286 -15.547 -5.906 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.447 -15.426 -4.138 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.092 -16.336 -4.848 1.00 0.00 H new ATOM 71 N TYR A 6 0.757 -11.632 -3.524 1.00 0.00 N ATOM 72 CA TYR A 6 -0.005 -10.394 -3.523 1.00 0.00 C ATOM 73 C TYR A 6 0.710 -9.310 -4.335 1.00 0.00 C ATOM 74 O TYR A 6 1.929 -9.173 -4.255 1.00 0.00 O ATOM 75 CB TYR A 6 -0.087 -9.948 -2.062 1.00 0.00 C ATOM 76 CG TYR A 6 -1.305 -10.492 -1.314 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.442 -11.850 -1.112 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.268 -9.624 -0.840 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.589 -12.361 -0.408 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.415 -10.135 -0.136 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.519 -11.479 0.046 1.00 0.00 C ATOM 82 OH TYR A 6 -4.602 -11.962 0.712 1.00 0.00 O ATOM 0 H TYR A 6 1.759 -11.516 -3.372 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.988 -10.549 -3.968 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.817 -10.267 -1.544 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -0.108 -8.859 -2.026 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -0.689 -12.530 -1.482 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -2.161 -8.561 -0.997 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -2.708 -13.422 -0.244 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.176 -9.466 0.239 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.181 -11.218 0.978 1.00 0.00 H new ATOM 92 N THR A 7 -0.081 -8.570 -5.098 1.00 0.00 N ATOM 93 CA THR A 7 0.461 -7.504 -5.923 1.00 0.00 C ATOM 94 C THR A 7 0.005 -6.141 -5.400 1.00 0.00 C ATOM 95 O THR A 7 -1.168 -5.790 -5.510 1.00 0.00 O ATOM 96 CB THR A 7 0.045 -7.768 -7.371 1.00 0.00 C ATOM 97 OG1 THR A 7 0.460 -9.110 -7.612 1.00 0.00 O ATOM 98 CG2 THR A 7 0.853 -6.942 -8.373 1.00 0.00 C ATOM 0 H THR A 7 -1.092 -8.688 -5.162 1.00 0.00 H new ATOM 0 HA THR A 7 1.550 -7.486 -5.880 1.00 0.00 H new ATOM 0 HB THR A 7 -1.015 -7.546 -7.490 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.227 -9.365 -8.529 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.517 -7.168 -9.385 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.708 -5.881 -8.171 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.911 -7.188 -8.278 1.00 0.00 H new ATOM 106 N VAL A 8 0.958 -5.409 -4.840 1.00 0.00 N ATOM 107 CA VAL A 8 0.668 -4.092 -4.298 1.00 0.00 C ATOM 108 C VAL A 8 1.152 -3.023 -5.282 1.00 0.00 C ATOM 109 O VAL A 8 2.304 -3.047 -5.712 1.00 0.00 O ATOM 110 CB VAL A 8 1.291 -3.949 -2.907 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.129 -2.523 -2.378 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.695 -4.968 -1.933 1.00 0.00 C ATOM 0 H VAL A 8 1.931 -5.703 -4.750 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.407 -3.958 -4.174 1.00 0.00 H new ATOM 0 HB VAL A 8 2.358 -4.154 -2.994 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.580 -2.449 -1.389 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.622 -1.826 -3.055 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.069 -2.277 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.154 -4.846 -0.952 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.380 -4.809 -1.853 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.886 -5.977 -2.300 1.00 0.00 H new ATOM 122 N THR A 9 0.247 -2.112 -5.608 1.00 0.00 N ATOM 123 CA THR A 9 0.567 -1.038 -6.532 1.00 0.00 C ATOM 124 C THR A 9 0.378 0.321 -5.856 1.00 0.00 C ATOM 125 O THR A 9 -0.706 0.626 -5.359 1.00 0.00 O ATOM 126 CB THR A 9 -0.294 -1.219 -7.785 1.00 0.00 C ATOM 127 OG1 THR A 9 -0.127 -2.593 -8.124 1.00 0.00 O ATOM 128 CG2 THR A 9 0.264 -0.466 -8.993 1.00 0.00 C ATOM 0 H THR A 9 -0.707 -2.096 -5.249 1.00 0.00 H new ATOM 0 HA THR A 9 1.614 -1.074 -6.832 1.00 0.00 H new ATOM 0 HB THR A 9 -1.308 -0.876 -7.581 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.653 -2.798 -8.925 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.384 -0.628 -9.854 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.309 0.600 -8.768 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.266 -0.832 -9.219 1.00 0.00 H new ATOM 136 N VAL A 10 1.448 1.103 -5.860 1.00 0.00 N ATOM 137 CA VAL A 10 1.413 2.423 -5.254 1.00 0.00 C ATOM 138 C VAL A 10 1.750 3.475 -6.312 1.00 0.00 C ATOM 139 O VAL A 10 2.830 3.446 -6.899 1.00 0.00 O ATOM 140 CB VAL A 10 2.351 2.468 -4.045 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.791 3.902 -3.747 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.698 1.828 -2.819 1.00 0.00 C ATOM 0 H VAL A 10 2.345 0.847 -6.274 1.00 0.00 H new ATOM 0 HA VAL A 10 0.413 2.646 -4.882 1.00 0.00 H new ATOM 0 HB VAL A 10 3.241 1.888 -4.290 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.457 3.906 -2.884 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.315 4.309 -4.612 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.915 4.514 -3.533 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.386 1.874 -1.975 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.783 2.367 -2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.459 0.787 -3.036 1.00 0.00 H new ATOM 152 N THR A 11 0.804 4.378 -6.523 1.00 0.00 N ATOM 153 CA THR A 11 0.986 5.438 -7.501 1.00 0.00 C ATOM 154 C THR A 11 0.700 6.802 -6.869 1.00 0.00 C ATOM 155 O THR A 11 -0.189 6.925 -6.027 1.00 0.00 O ATOM 156 CB THR A 11 0.098 5.128 -8.706 1.00 0.00 C ATOM 157 OG1 THR A 11 0.655 3.933 -9.250 1.00 0.00 O ATOM 158 CG2 THR A 11 0.254 6.156 -9.829 1.00 0.00 C ATOM 0 H THR A 11 -0.091 4.398 -6.034 1.00 0.00 H new ATOM 0 HA THR A 11 2.019 5.485 -7.845 1.00 0.00 H new ATOM 0 HB THR A 11 -0.944 5.092 -8.389 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.004 3.512 -9.849 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.398 5.889 -10.660 1.00 0.00 H new ATOM 0 HG22 THR A 11 -0.017 7.144 -9.458 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.289 6.168 -10.170 1.00 0.00 H new ATOM 166 N ASN A 12 1.469 7.791 -7.299 1.00 0.00 N ATOM 167 CA ASN A 12 1.308 9.141 -6.787 1.00 0.00 C ATOM 168 C ASN A 12 0.485 9.965 -7.780 1.00 0.00 C ATOM 169 O ASN A 12 0.864 10.101 -8.942 1.00 0.00 O ATOM 170 CB ASN A 12 2.663 9.829 -6.611 1.00 0.00 C ATOM 171 CG ASN A 12 3.652 8.913 -5.886 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.383 7.754 -5.618 1.00 0.00 O ATOM 173 ND2 ASN A 12 4.809 9.498 -5.585 1.00 0.00 N ATOM 0 H ASN A 12 2.206 7.684 -7.996 1.00 0.00 H new ATOM 0 HA ASN A 12 0.808 9.077 -5.821 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.065 10.105 -7.586 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.536 10.752 -6.046 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.536 8.971 -5.101 1.00 0.00 H new ATOM 0 HD22 ASN A 12 4.969 10.473 -5.839 1.00 0.00 H new ATOM 180 N ASN A 13 -0.626 10.492 -7.285 1.00 0.00 N ATOM 181 CA ASN A 13 -1.505 11.299 -8.114 1.00 0.00 C ATOM 182 C ASN A 13 -0.966 12.730 -8.181 1.00 0.00 C ATOM 183 O ASN A 13 -1.368 13.508 -9.044 1.00 0.00 O ATOM 184 CB ASN A 13 -2.917 11.352 -7.530 1.00 0.00 C ATOM 185 CG ASN A 13 -3.913 10.623 -8.434 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.153 11.001 -9.569 1.00 0.00 O ATOM 187 ND2 ASN A 13 -4.478 9.559 -7.870 1.00 0.00 N ATOM 0 H ASN A 13 -0.937 10.376 -6.321 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.542 10.847 -9.105 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.921 10.899 -6.539 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -3.225 12.390 -7.407 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -5.157 9.005 -8.392 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.232 9.297 -6.915 1.00 0.00 H new ATOM 194 N SER A 14 -0.064 13.031 -7.259 1.00 0.00 N ATOM 195 CA SER A 14 0.535 14.354 -7.202 1.00 0.00 C ATOM 196 C SER A 14 1.691 14.448 -8.199 1.00 0.00 C ATOM 197 O SER A 14 1.913 15.499 -8.800 1.00 0.00 O ATOM 198 CB SER A 14 1.025 14.677 -5.789 1.00 0.00 C ATOM 199 OG SER A 14 0.767 16.031 -5.430 1.00 0.00 O ATOM 0 H SER A 14 0.267 12.382 -6.545 1.00 0.00 H new ATOM 0 HA SER A 14 -0.227 15.086 -7.469 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.536 14.014 -5.076 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.095 14.482 -5.723 1.00 0.00 H new ATOM 0 HG SER A 14 -0.137 16.279 -5.716 1.00 0.00 H new ATOM 205 N ASN A 15 2.398 13.338 -8.345 1.00 0.00 N ATOM 206 CA ASN A 15 3.526 13.283 -9.258 1.00 0.00 C ATOM 207 C ASN A 15 3.173 12.379 -10.443 1.00 0.00 C ATOM 208 O ASN A 15 3.896 12.344 -11.437 1.00 0.00 O ATOM 209 CB ASN A 15 4.763 12.701 -8.572 1.00 0.00 C ATOM 210 CG ASN A 15 6.009 13.527 -8.898 1.00 0.00 C ATOM 211 OD1 ASN A 15 5.987 14.745 -8.933 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.095 12.795 -9.134 1.00 0.00 N ATOM 0 H ASN A 15 2.211 12.468 -7.846 1.00 0.00 H new ATOM 0 HA ASN A 15 3.742 14.299 -9.589 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.609 12.679 -7.493 1.00 0.00 H new ATOM 0 HB3 ASN A 15 4.911 11.670 -8.894 1.00 0.00 H new ATOM 0 HD21 ASN A 15 7.978 13.252 -9.361 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.044 11.777 -9.088 1.00 0.00 H new ATOM 219 N GLY A 16 2.062 11.672 -10.297 1.00 0.00 N ATOM 220 CA GLY A 16 1.606 10.772 -11.341 1.00 0.00 C ATOM 221 C GLY A 16 2.587 9.614 -11.535 1.00 0.00 C ATOM 222 O GLY A 16 2.619 8.994 -12.596 1.00 0.00 O ATOM 0 H GLY A 16 1.464 11.705 -9.471 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.622 10.380 -11.084 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.496 11.321 -12.276 1.00 0.00 H new ATOM 226 N VAL A 17 3.363 9.357 -10.492 1.00 0.00 N ATOM 227 CA VAL A 17 4.342 8.286 -10.534 1.00 0.00 C ATOM 228 C VAL A 17 3.699 6.993 -10.031 1.00 0.00 C ATOM 229 O VAL A 17 3.199 6.940 -8.908 1.00 0.00 O ATOM 230 CB VAL A 17 5.588 8.683 -9.739 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.424 7.453 -9.380 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.423 9.710 -10.505 1.00 0.00 C ATOM 0 H VAL A 17 3.333 9.873 -9.613 1.00 0.00 H new ATOM 0 HA VAL A 17 4.670 8.109 -11.558 1.00 0.00 H new ATOM 0 HB VAL A 17 5.259 9.147 -8.809 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.303 7.763 -8.815 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.826 6.771 -8.775 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.739 6.948 -10.293 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.302 9.975 -9.918 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.738 9.285 -11.458 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.825 10.603 -10.686 1.00 0.00 H new ATOM 242 N SER A 18 3.730 5.981 -10.886 1.00 0.00 N ATOM 243 CA SER A 18 3.156 4.691 -10.542 1.00 0.00 C ATOM 244 C SER A 18 4.269 3.665 -10.321 1.00 0.00 C ATOM 245 O SER A 18 5.270 3.665 -11.036 1.00 0.00 O ATOM 246 CB SER A 18 2.196 4.208 -11.631 1.00 0.00 C ATOM 247 OG SER A 18 2.463 4.821 -12.889 1.00 0.00 O ATOM 0 H SER A 18 4.144 6.028 -11.817 1.00 0.00 H new ATOM 0 HA SER A 18 2.588 4.804 -9.619 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.276 3.126 -11.731 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.170 4.425 -11.332 1.00 0.00 H new ATOM 0 HG SER A 18 1.830 4.485 -13.558 1.00 0.00 H new ATOM 253 N VAL A 19 4.057 2.815 -9.327 1.00 0.00 N ATOM 254 CA VAL A 19 5.030 1.785 -9.003 1.00 0.00 C ATOM 255 C VAL A 19 4.313 0.595 -8.362 1.00 0.00 C ATOM 256 O VAL A 19 3.609 0.753 -7.366 1.00 0.00 O ATOM 257 CB VAL A 19 6.132 2.367 -8.116 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.701 1.302 -7.178 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.239 3.000 -8.961 1.00 0.00 C ATOM 0 H VAL A 19 3.226 2.818 -8.735 1.00 0.00 H new ATOM 0 HA VAL A 19 5.517 1.422 -9.908 1.00 0.00 H new ATOM 0 HB VAL A 19 5.688 3.151 -7.503 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.482 1.742 -6.559 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.906 0.917 -6.539 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.121 0.486 -7.766 1.00 0.00 H new ATOM 0 HG21 VAL A 19 8.010 3.406 -8.306 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.678 2.244 -9.612 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.820 3.802 -9.568 1.00 0.00 H new ATOM 269 N ASP A 20 4.516 -0.569 -8.961 1.00 0.00 N ATOM 270 CA ASP A 20 3.897 -1.786 -8.460 1.00 0.00 C ATOM 271 C ASP A 20 4.989 -2.770 -8.035 1.00 0.00 C ATOM 272 O ASP A 20 6.055 -2.823 -8.647 1.00 0.00 O ATOM 273 CB ASP A 20 3.049 -2.457 -9.542 1.00 0.00 C ATOM 274 CG ASP A 20 2.738 -1.581 -10.757 1.00 0.00 C ATOM 275 OD1 ASP A 20 3.707 -1.028 -11.320 1.00 0.00 O ATOM 276 OD2 ASP A 20 1.539 -1.484 -11.095 1.00 0.00 O ATOM 0 H ASP A 20 5.100 -0.696 -9.788 1.00 0.00 H new ATOM 0 HA ASP A 20 3.260 -1.519 -7.617 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.566 -3.354 -9.883 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.108 -2.781 -9.096 1.00 0.00 H new ATOM 281 N TYR A 21 4.684 -3.526 -6.990 1.00 0.00 N ATOM 282 CA TYR A 21 5.626 -4.507 -6.476 1.00 0.00 C ATOM 283 C TYR A 21 4.909 -5.794 -6.068 1.00 0.00 C ATOM 284 O TYR A 21 3.939 -5.756 -5.312 1.00 0.00 O ATOM 285 CB TYR A 21 6.259 -3.873 -5.236 1.00 0.00 C ATOM 286 CG TYR A 21 7.655 -3.294 -5.476 1.00 0.00 C ATOM 287 CD1 TYR A 21 7.828 -2.260 -6.373 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.740 -3.805 -4.794 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.141 -1.715 -6.599 1.00 0.00 C ATOM 290 CE2 TYR A 21 10.054 -3.260 -5.020 1.00 0.00 C ATOM 291 CZ TYR A 21 10.189 -2.242 -5.911 1.00 0.00 C ATOM 292 OH TYR A 21 11.430 -1.727 -6.124 1.00 0.00 O ATOM 0 H TYR A 21 3.799 -3.479 -6.486 1.00 0.00 H new ATOM 0 HA TYR A 21 6.364 -4.766 -7.235 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.606 -3.080 -4.873 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.319 -4.623 -4.447 1.00 0.00 H new ATOM 0 HD1 TYR A 21 6.978 -1.859 -6.906 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.604 -4.613 -4.091 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.290 -0.906 -7.299 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.912 -3.651 -4.494 1.00 0.00 H new ATOM 0 HH TYR A 21 11.527 -0.889 -5.625 1.00 0.00 H new ATOM 302 N GLU A 22 5.413 -6.904 -6.585 1.00 0.00 N ATOM 303 CA GLU A 22 4.833 -8.202 -6.284 1.00 0.00 C ATOM 304 C GLU A 22 5.483 -8.796 -5.032 1.00 0.00 C ATOM 305 O GLU A 22 6.666 -9.132 -5.043 1.00 0.00 O ATOM 306 CB GLU A 22 4.966 -9.153 -7.475 1.00 0.00 C ATOM 307 CG GLU A 22 4.528 -10.570 -7.098 1.00 0.00 C ATOM 308 CD GLU A 22 4.925 -11.573 -8.181 1.00 0.00 C ATOM 309 OE1 GLU A 22 6.106 -11.529 -8.591 1.00 0.00 O ATOM 310 OE2 GLU A 22 4.041 -12.363 -8.577 1.00 0.00 O ATOM 0 H GLU A 22 6.218 -6.932 -7.211 1.00 0.00 H new ATOM 0 HA GLU A 22 3.769 -8.066 -6.088 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.359 -8.790 -8.304 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.000 -9.168 -7.819 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.983 -10.855 -6.149 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.448 -10.594 -6.953 1.00 0.00 H new ATOM 317 N THR A 23 4.680 -8.908 -3.984 1.00 0.00 N ATOM 318 CA THR A 23 5.163 -9.457 -2.728 1.00 0.00 C ATOM 319 C THR A 23 4.127 -10.411 -2.129 1.00 0.00 C ATOM 320 O THR A 23 2.983 -10.023 -1.894 1.00 0.00 O ATOM 321 CB THR A 23 5.515 -8.288 -1.807 1.00 0.00 C ATOM 322 OG1 THR A 23 6.266 -8.888 -0.755 1.00 0.00 O ATOM 323 CG2 THR A 23 4.287 -7.706 -1.102 1.00 0.00 C ATOM 0 H THR A 23 3.699 -8.628 -3.979 1.00 0.00 H new ATOM 0 HA THR A 23 6.062 -10.055 -2.877 1.00 0.00 H new ATOM 0 HB THR A 23 6.006 -7.506 -2.386 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.537 -8.199 -0.112 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.593 -6.879 -0.461 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.578 -7.344 -1.846 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.815 -8.479 -0.496 1.00 0.00 H new ATOM 331 N GLU A 24 4.564 -11.640 -1.902 1.00 0.00 N ATOM 332 CA GLU A 24 3.689 -12.653 -1.336 1.00 0.00 C ATOM 333 C GLU A 24 3.763 -12.625 0.193 1.00 0.00 C ATOM 334 O GLU A 24 4.666 -13.214 0.785 1.00 0.00 O ATOM 335 CB GLU A 24 4.035 -14.041 -1.876 1.00 0.00 C ATOM 336 CG GLU A 24 5.510 -14.372 -1.633 1.00 0.00 C ATOM 337 CD GLU A 24 5.657 -15.673 -0.841 1.00 0.00 C ATOM 338 OE1 GLU A 24 5.017 -16.665 -1.254 1.00 0.00 O ATOM 339 OE2 GLU A 24 6.406 -15.646 0.160 1.00 0.00 O ATOM 0 H GLU A 24 5.513 -11.958 -2.100 1.00 0.00 H new ATOM 0 HA GLU A 24 2.665 -12.428 -1.635 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.406 -14.790 -1.394 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.820 -14.084 -2.944 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.028 -14.463 -2.588 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.985 -13.555 -1.089 1.00 0.00 H new ATOM 346 N THR A 25 2.802 -11.933 0.787 1.00 0.00 N ATOM 347 CA THR A 25 2.747 -11.821 2.234 1.00 0.00 C ATOM 348 C THR A 25 1.328 -12.093 2.738 1.00 0.00 C ATOM 349 O THR A 25 0.416 -11.306 2.488 1.00 0.00 O ATOM 350 CB THR A 25 3.274 -10.437 2.622 1.00 0.00 C ATOM 351 OG1 THR A 25 2.527 -9.540 1.805 1.00 0.00 O ATOM 352 CG2 THR A 25 4.723 -10.219 2.183 1.00 0.00 C ATOM 0 H THR A 25 2.056 -11.444 0.292 1.00 0.00 H new ATOM 0 HA THR A 25 3.377 -12.571 2.712 1.00 0.00 H new ATOM 0 HB THR A 25 3.198 -10.309 3.702 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.804 -8.619 1.993 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.048 -9.223 2.482 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.362 -10.966 2.654 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.793 -10.313 1.099 1.00 0.00 H new ATOM 360 N PRO A 26 1.182 -13.240 3.454 1.00 0.00 N ATOM 361 CA PRO A 26 -0.110 -13.625 3.994 1.00 0.00 C ATOM 362 C PRO A 26 -0.470 -12.776 5.215 1.00 0.00 C ATOM 363 O PRO A 26 -1.163 -11.766 5.090 1.00 0.00 O ATOM 364 CB PRO A 26 0.025 -15.104 4.320 1.00 0.00 C ATOM 365 CG PRO A 26 1.517 -15.381 4.385 1.00 0.00 C ATOM 366 CD PRO A 26 2.241 -14.196 3.768 1.00 0.00 C ATOM 0 HA PRO A 26 -0.926 -13.457 3.291 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.458 -15.341 5.268 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.453 -15.718 3.557 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.833 -15.525 5.418 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.758 -16.298 3.847 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.967 -13.770 4.461 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.789 -14.489 2.872 1.00 0.00 H new ATOM 374 N MET A 27 0.016 -13.216 6.366 1.00 0.00 N ATOM 375 CA MET A 27 -0.246 -12.508 7.608 1.00 0.00 C ATOM 376 C MET A 27 0.561 -11.210 7.681 1.00 0.00 C ATOM 377 O MET A 27 0.134 -10.243 8.309 1.00 0.00 O ATOM 378 CB MET A 27 0.119 -13.404 8.793 1.00 0.00 C ATOM 379 CG MET A 27 -0.449 -14.813 8.611 1.00 0.00 C ATOM 380 SD MET A 27 0.714 -16.023 9.216 1.00 0.00 S ATOM 381 CE MET A 27 2.179 -15.514 8.333 1.00 0.00 C ATOM 0 H MET A 27 0.590 -14.054 6.465 1.00 0.00 H new ATOM 0 HA MET A 27 -1.306 -12.256 7.644 1.00 0.00 H new ATOM 0 HB2 MET A 27 1.203 -13.455 8.894 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.267 -12.969 9.715 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.394 -14.905 9.147 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.661 -14.995 7.557 1.00 0.00 H new ATOM 0 HE1 MET A 27 2.618 -16.375 7.830 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.914 -14.758 7.594 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.901 -15.097 9.035 1.00 0.00 H new ATOM 391 N THR A 28 1.714 -11.230 7.028 1.00 0.00 N ATOM 392 CA THR A 28 2.585 -10.068 7.010 1.00 0.00 C ATOM 393 C THR A 28 1.806 -8.824 6.578 1.00 0.00 C ATOM 394 O THR A 28 2.063 -7.726 7.068 1.00 0.00 O ATOM 395 CB THR A 28 3.777 -10.383 6.105 1.00 0.00 C ATOM 396 OG1 THR A 28 3.431 -11.624 5.494 1.00 0.00 O ATOM 397 CG2 THR A 28 5.048 -10.701 6.897 1.00 0.00 C ATOM 0 H THR A 28 2.065 -12.034 6.507 1.00 0.00 H new ATOM 0 HA THR A 28 2.966 -9.845 8.007 1.00 0.00 H new ATOM 0 HB THR A 28 3.963 -9.536 5.444 1.00 0.00 H new ATOM 0 HG1 THR A 28 3.801 -12.363 6.021 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.863 -10.917 6.206 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.315 -9.844 7.516 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.873 -11.568 7.534 1.00 0.00 H new ATOM 405 N LEU A 29 0.870 -9.040 5.665 1.00 0.00 N ATOM 406 CA LEU A 29 0.053 -7.949 5.161 1.00 0.00 C ATOM 407 C LEU A 29 -0.557 -7.187 6.340 1.00 0.00 C ATOM 408 O LEU A 29 -0.753 -5.976 6.265 1.00 0.00 O ATOM 409 CB LEU A 29 -0.985 -8.474 4.166 1.00 0.00 C ATOM 410 CG LEU A 29 -0.501 -8.655 2.726 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.435 -9.582 1.946 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.324 -7.303 2.032 1.00 0.00 C ATOM 0 H LEU A 29 0.660 -9.953 5.262 1.00 0.00 H new ATOM 0 HA LEU A 29 0.666 -7.239 4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.353 -9.434 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.833 -7.789 4.160 1.00 0.00 H new ATOM 0 HG LEU A 29 0.478 -9.133 2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.068 -9.694 0.926 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.466 -10.558 2.429 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.438 -9.155 1.926 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.021 -7.461 1.010 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.277 -6.775 2.016 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.411 -6.709 2.575 1.00 0.00 H new ATOM 424 N LEU A 30 -0.839 -7.930 7.401 1.00 0.00 N ATOM 425 CA LEU A 30 -1.422 -7.339 8.593 1.00 0.00 C ATOM 426 C LEU A 30 -0.307 -6.758 9.466 1.00 0.00 C ATOM 427 O LEU A 30 -0.547 -5.854 10.266 1.00 0.00 O ATOM 428 CB LEU A 30 -2.303 -8.357 9.319 1.00 0.00 C ATOM 429 CG LEU A 30 -3.236 -9.188 8.435 1.00 0.00 C ATOM 430 CD1 LEU A 30 -3.984 -10.237 9.260 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.192 -8.288 7.649 1.00 0.00 C ATOM 0 H LEU A 30 -0.675 -8.935 7.459 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.082 -6.514 8.326 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.656 -9.038 9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.908 -7.826 10.053 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.628 -9.725 7.707 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.640 -10.813 8.607 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.266 -10.906 9.735 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.580 -9.740 10.026 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.844 -8.903 7.029 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.796 -7.705 8.344 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.617 -7.614 7.014 1.00 0.00 H new ATOM 443 N VAL A 31 0.887 -7.300 9.283 1.00 0.00 N ATOM 444 CA VAL A 31 2.039 -6.847 10.044 1.00 0.00 C ATOM 445 C VAL A 31 2.371 -5.407 9.650 1.00 0.00 C ATOM 446 O VAL A 31 2.372 -5.067 8.468 1.00 0.00 O ATOM 447 CB VAL A 31 3.213 -7.808 9.840 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.473 -7.290 10.535 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.860 -9.216 10.323 1.00 0.00 C ATOM 0 H VAL A 31 1.082 -8.049 8.619 1.00 0.00 H new ATOM 0 HA VAL A 31 1.816 -6.849 11.111 1.00 0.00 H new ATOM 0 HB VAL A 31 3.419 -7.863 8.771 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.292 -7.991 10.374 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.742 -6.318 10.123 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.284 -7.191 11.604 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.711 -9.878 10.166 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.614 -9.186 11.384 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.003 -9.589 9.763 1.00 0.00 H new ATOM 459 N PRO A 32 2.650 -4.576 10.690 1.00 0.00 N ATOM 460 CA PRO A 32 2.982 -3.179 10.464 1.00 0.00 C ATOM 461 C PRO A 32 4.406 -3.035 9.921 1.00 0.00 C ATOM 462 O PRO A 32 4.643 -2.268 8.989 1.00 0.00 O ATOM 463 CB PRO A 32 2.790 -2.506 11.813 1.00 0.00 C ATOM 464 CG PRO A 32 2.811 -3.624 12.843 1.00 0.00 C ATOM 465 CD PRO A 32 2.658 -4.943 12.103 1.00 0.00 C ATOM 0 HA PRO A 32 2.350 -2.713 9.708 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.583 -1.783 12.005 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.847 -1.961 11.847 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.745 -3.608 13.405 1.00 0.00 H new ATOM 0 HG3 PRO A 32 2.003 -3.495 13.563 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.479 -5.623 12.331 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.736 -5.451 12.386 1.00 0.00 H new ATOM 473 N GLU A 33 5.315 -3.785 10.526 1.00 0.00 N ATOM 474 CA GLU A 33 6.708 -3.750 10.115 1.00 0.00 C ATOM 475 C GLU A 33 6.837 -4.153 8.644 1.00 0.00 C ATOM 476 O GLU A 33 7.686 -3.627 7.926 1.00 0.00 O ATOM 477 CB GLU A 33 7.566 -4.648 11.008 1.00 0.00 C ATOM 478 CG GLU A 33 7.128 -4.548 12.470 1.00 0.00 C ATOM 479 CD GLU A 33 8.267 -4.943 13.412 1.00 0.00 C ATOM 480 OE1 GLU A 33 9.218 -4.139 13.522 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.161 -6.040 14.001 1.00 0.00 O ATOM 0 H GLU A 33 5.114 -4.421 11.298 1.00 0.00 H new ATOM 0 HA GLU A 33 7.074 -2.729 10.225 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.488 -5.682 10.672 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.614 -4.361 10.918 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.807 -3.529 12.688 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.269 -5.196 12.641 1.00 0.00 H new ATOM 488 N VAL A 34 5.984 -5.082 8.242 1.00 0.00 N ATOM 489 CA VAL A 34 5.992 -5.562 6.870 1.00 0.00 C ATOM 490 C VAL A 34 5.197 -4.594 5.992 1.00 0.00 C ATOM 491 O VAL A 34 5.638 -4.236 4.901 1.00 0.00 O ATOM 492 CB VAL A 34 5.460 -6.996 6.814 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.440 -7.516 5.376 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.277 -7.919 7.720 1.00 0.00 C ATOM 0 H VAL A 34 5.282 -5.516 8.842 1.00 0.00 H new ATOM 0 HA VAL A 34 7.010 -5.592 6.481 1.00 0.00 H new ATOM 0 HB VAL A 34 4.434 -6.988 7.182 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.058 -8.537 5.364 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.796 -6.880 4.768 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.451 -7.502 4.970 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.878 -8.932 7.662 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.318 -7.919 7.396 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.218 -7.564 8.749 1.00 0.00 H new ATOM 504 N ALA A 35 4.039 -4.200 6.499 1.00 0.00 N ATOM 505 CA ALA A 35 3.178 -3.281 5.774 1.00 0.00 C ATOM 506 C ALA A 35 3.901 -1.944 5.596 1.00 0.00 C ATOM 507 O ALA A 35 3.930 -1.393 4.497 1.00 0.00 O ATOM 508 CB ALA A 35 1.849 -3.131 6.518 1.00 0.00 C ATOM 0 H ALA A 35 3.676 -4.500 7.404 1.00 0.00 H new ATOM 0 HA ALA A 35 2.953 -3.669 4.780 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.203 -2.442 5.974 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.362 -4.103 6.592 1.00 0.00 H new ATOM 0 HB3 ALA A 35 2.034 -2.741 7.519 1.00 0.00 H new ATOM 514 N ALA A 36 4.466 -1.464 6.693 1.00 0.00 N ATOM 515 CA ALA A 36 5.188 -0.202 6.672 1.00 0.00 C ATOM 516 C ALA A 36 6.324 -0.286 5.651 1.00 0.00 C ATOM 517 O ALA A 36 6.489 0.611 4.825 1.00 0.00 O ATOM 518 CB ALA A 36 5.692 0.121 8.080 1.00 0.00 C ATOM 0 H ALA A 36 4.439 -1.925 7.602 1.00 0.00 H new ATOM 0 HA ALA A 36 4.530 0.612 6.366 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.233 1.067 8.065 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.844 0.199 8.761 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.358 -0.673 8.419 1.00 0.00 H new ATOM 524 N GLU A 37 7.077 -1.372 5.740 1.00 0.00 N ATOM 525 CA GLU A 37 8.193 -1.585 4.834 1.00 0.00 C ATOM 526 C GLU A 37 7.696 -1.666 3.390 1.00 0.00 C ATOM 527 O GLU A 37 8.379 -1.221 2.468 1.00 0.00 O ATOM 528 CB GLU A 37 8.977 -2.842 5.216 1.00 0.00 C ATOM 529 CG GLU A 37 10.308 -2.907 4.464 1.00 0.00 C ATOM 530 CD GLU A 37 10.186 -3.770 3.206 1.00 0.00 C ATOM 531 OE1 GLU A 37 9.154 -3.625 2.517 1.00 0.00 O ATOM 532 OE2 GLU A 37 11.128 -4.555 2.963 1.00 0.00 O ATOM 0 H GLU A 37 6.936 -2.114 6.426 1.00 0.00 H new ATOM 0 HA GLU A 37 8.871 -0.735 4.917 1.00 0.00 H new ATOM 0 HB2 GLU A 37 9.161 -2.848 6.290 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.384 -3.728 4.990 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.624 -1.901 4.190 1.00 0.00 H new ATOM 0 HG3 GLU A 37 11.079 -3.316 5.117 1.00 0.00 H new ATOM 539 N VAL A 38 6.512 -2.240 3.237 1.00 0.00 N ATOM 540 CA VAL A 38 5.915 -2.386 1.920 1.00 0.00 C ATOM 541 C VAL A 38 5.503 -1.008 1.396 1.00 0.00 C ATOM 542 O VAL A 38 5.830 -0.646 0.267 1.00 0.00 O ATOM 543 CB VAL A 38 4.750 -3.375 1.980 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.554 -2.863 1.174 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.183 -4.762 1.498 1.00 0.00 C ATOM 0 H VAL A 38 5.950 -2.610 4.003 1.00 0.00 H new ATOM 0 HA VAL A 38 6.638 -2.799 1.217 1.00 0.00 H new ATOM 0 HB VAL A 38 4.439 -3.464 3.021 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.739 -3.585 1.233 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.223 -1.908 1.581 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.847 -2.731 0.132 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.336 -5.446 1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.533 -4.696 0.468 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.989 -5.132 2.132 1.00 0.00 H new ATOM 555 N ILE A 39 4.791 -0.277 2.242 1.00 0.00 N ATOM 556 CA ILE A 39 4.332 1.052 1.878 1.00 0.00 C ATOM 557 C ILE A 39 5.540 1.962 1.651 1.00 0.00 C ATOM 558 O ILE A 39 5.587 2.706 0.673 1.00 0.00 O ATOM 559 CB ILE A 39 3.350 1.584 2.924 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.071 0.745 2.955 1.00 0.00 C ATOM 561 CG2 ILE A 39 3.055 3.068 2.695 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.494 0.573 1.548 1.00 0.00 C ATOM 0 H ILE A 39 4.521 -0.580 3.178 1.00 0.00 H new ATOM 0 HA ILE A 39 3.778 1.019 0.940 1.00 0.00 H new ATOM 0 HB ILE A 39 3.817 1.495 3.905 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.284 -0.233 3.387 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.333 1.224 3.599 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.355 3.421 3.452 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.981 3.638 2.764 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.619 3.204 1.705 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.585 -0.027 1.598 1.00 0.00 H new ATOM 0 HD12 ILE A 39 1.260 1.551 1.129 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.225 0.072 0.914 1.00 0.00 H new ATOM 574 N LYS A 40 6.491 1.870 2.571 1.00 0.00 N ATOM 575 CA LYS A 40 7.697 2.675 2.482 1.00 0.00 C ATOM 576 C LYS A 40 8.540 2.195 1.301 1.00 0.00 C ATOM 577 O LYS A 40 9.112 3.003 0.571 1.00 0.00 O ATOM 578 CB LYS A 40 8.445 2.666 3.817 1.00 0.00 C ATOM 579 CG LYS A 40 9.959 2.713 3.597 1.00 0.00 C ATOM 580 CD LYS A 40 10.566 1.310 3.670 1.00 0.00 C ATOM 581 CE LYS A 40 12.027 1.322 3.215 1.00 0.00 C ATOM 582 NZ LYS A 40 12.151 0.746 1.857 1.00 0.00 N ATOM 0 H LYS A 40 6.450 1.251 3.380 1.00 0.00 H new ATOM 0 HA LYS A 40 7.446 3.718 2.290 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.134 3.521 4.418 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.183 1.769 4.379 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.176 3.157 2.625 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.420 3.353 4.350 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.502 0.935 4.691 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.991 0.628 3.043 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.407 2.344 3.219 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.637 0.752 3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.138 0.463 1.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.533 -0.087 1.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 11.869 1.456 1.152 1.00 0.00 H new ATOM 596 N ASP A 41 8.592 0.880 1.148 1.00 0.00 N ATOM 597 CA ASP A 41 9.356 0.281 0.066 1.00 0.00 C ATOM 598 C ASP A 41 8.844 0.816 -1.273 1.00 0.00 C ATOM 599 O ASP A 41 9.633 1.183 -2.142 1.00 0.00 O ATOM 600 CB ASP A 41 9.200 -1.241 0.058 1.00 0.00 C ATOM 601 CG ASP A 41 9.639 -1.928 -1.236 1.00 0.00 C ATOM 602 OD1 ASP A 41 8.801 -1.982 -2.163 1.00 0.00 O ATOM 603 OD2 ASP A 41 10.802 -2.385 -1.269 1.00 0.00 O ATOM 0 H ASP A 41 8.117 0.212 1.755 1.00 0.00 H new ATOM 0 HA ASP A 41 10.406 0.535 0.214 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.777 -1.655 0.885 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.154 -1.485 0.245 1.00 0.00 H new ATOM 608 N LEU A 42 7.525 0.845 -1.396 1.00 0.00 N ATOM 609 CA LEU A 42 6.898 1.330 -2.614 1.00 0.00 C ATOM 610 C LEU A 42 7.264 2.801 -2.821 1.00 0.00 C ATOM 611 O LEU A 42 7.764 3.176 -3.880 1.00 0.00 O ATOM 612 CB LEU A 42 5.390 1.071 -2.580 1.00 0.00 C ATOM 613 CG LEU A 42 4.941 -0.332 -2.997 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.143 -1.006 -1.880 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.161 -0.289 -4.313 1.00 0.00 C ATOM 0 H LEU A 42 6.873 0.541 -0.673 1.00 0.00 H new ATOM 0 HA LEU A 42 7.273 0.783 -3.479 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.032 1.260 -1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.902 1.796 -3.232 1.00 0.00 H new ATOM 0 HG LEU A 42 5.830 -0.939 -3.169 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.836 -2.001 -2.202 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.764 -1.088 -0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.259 -0.409 -1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.854 -1.298 -4.587 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.278 0.339 -4.192 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.795 0.123 -5.098 1.00 0.00 H new ATOM 627 N VAL A 43 7.001 3.593 -1.792 1.00 0.00 N ATOM 628 CA VAL A 43 7.296 5.015 -1.847 1.00 0.00 C ATOM 629 C VAL A 43 8.792 5.211 -2.107 1.00 0.00 C ATOM 630 O VAL A 43 9.178 5.999 -2.969 1.00 0.00 O ATOM 631 CB VAL A 43 6.817 5.700 -0.566 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.774 6.820 -0.153 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.390 6.228 -0.727 1.00 0.00 C ATOM 0 H VAL A 43 6.587 3.277 -0.915 1.00 0.00 H new ATOM 0 HA VAL A 43 6.758 5.485 -2.670 1.00 0.00 H new ATOM 0 HB VAL A 43 6.810 4.955 0.230 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.411 7.291 0.760 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.766 6.404 0.023 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.828 7.564 -0.948 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.074 6.710 0.198 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.359 6.951 -1.542 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.719 5.399 -0.952 1.00 0.00 H new ATOM 643 N ASN A 44 9.593 4.480 -1.344 1.00 0.00 N ATOM 644 CA ASN A 44 11.037 4.563 -1.481 1.00 0.00 C ATOM 645 C ASN A 44 11.426 4.271 -2.932 1.00 0.00 C ATOM 646 O ASN A 44 12.360 4.870 -3.460 1.00 0.00 O ATOM 647 CB ASN A 44 11.734 3.535 -0.588 1.00 0.00 C ATOM 648 CG ASN A 44 12.291 4.194 0.675 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.364 4.750 1.449 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.484 4.198 0.930 1.00 0.00 N flip ATOM 0 H ASN A 44 9.269 3.828 -0.630 1.00 0.00 H new ATOM 0 HA ASN A 44 11.347 5.566 -1.187 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.029 2.750 -0.313 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.543 3.057 -1.140 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.143 3.752 0.292 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.822 4.647 1.781 1.00 0.00 H new ATOM 657 N THR A 45 10.688 3.349 -3.534 1.00 0.00 N ATOM 658 CA THR A 45 10.944 2.970 -4.913 1.00 0.00 C ATOM 659 C THR A 45 10.476 4.072 -5.865 1.00 0.00 C ATOM 660 O THR A 45 11.148 4.374 -6.849 1.00 0.00 O ATOM 661 CB THR A 45 10.268 1.621 -5.166 1.00 0.00 C ATOM 662 OG1 THR A 45 11.149 0.673 -4.570 1.00 0.00 O ATOM 663 CG2 THR A 45 10.257 1.240 -6.648 1.00 0.00 C ATOM 0 H THR A 45 9.913 2.854 -3.092 1.00 0.00 H new ATOM 0 HA THR A 45 12.012 2.855 -5.100 1.00 0.00 H new ATOM 0 HB THR A 45 9.245 1.653 -4.792 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.920 0.564 -3.623 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.766 0.275 -6.772 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.716 1.998 -7.214 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.281 1.176 -7.015 1.00 0.00 H new ATOM 925 N LYS B 203 -3.335 18.118 -7.125 1.00 0.00 N ATOM 926 CA LYS B 203 -3.653 17.658 -5.784 1.00 0.00 C ATOM 927 C LYS B 203 -2.651 16.577 -5.370 1.00 0.00 C ATOM 928 O LYS B 203 -2.064 15.912 -6.221 1.00 0.00 O ATOM 929 CB LYS B 203 -5.113 17.206 -5.703 1.00 0.00 C ATOM 930 CG LYS B 203 -5.713 17.535 -4.335 1.00 0.00 C ATOM 931 CD LYS B 203 -7.241 17.578 -4.403 1.00 0.00 C ATOM 932 CE LYS B 203 -7.742 19.014 -4.565 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.743 19.336 -3.523 1.00 0.00 N ATOM 0 HA LYS B 203 -3.557 18.475 -5.069 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.693 17.695 -6.486 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -5.176 16.133 -5.883 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.399 16.787 -3.607 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -5.334 18.496 -3.989 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.589 16.971 -5.239 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.661 17.142 -3.497 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.904 19.707 -4.498 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -8.184 19.142 -5.553 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -9.072 20.315 -3.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -9.551 18.686 -3.605 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.310 19.234 -2.583 1.00 0.00 H new ATOM 947 N ALA B 204 -2.488 16.437 -4.062 1.00 0.00 N ATOM 948 CA ALA B 204 -1.568 15.449 -3.526 1.00 0.00 C ATOM 949 C ALA B 204 -2.359 14.234 -3.036 1.00 0.00 C ATOM 950 O ALA B 204 -3.035 14.302 -2.010 1.00 0.00 O ATOM 951 CB ALA B 204 -0.728 16.084 -2.415 1.00 0.00 C ATOM 0 H ALA B 204 -2.977 16.991 -3.359 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.881 15.105 -4.299 1.00 0.00 H new ATOM 0 HB1 ALA B 204 -0.037 15.343 -2.012 1.00 0.00 H new ATOM 0 HB2 ALA B 204 -0.163 16.924 -2.820 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -1.384 16.438 -1.620 1.00 0.00 H new ATOM 957 N THR B 205 -2.248 13.152 -3.792 1.00 0.00 N ATOM 958 CA THR B 205 -2.945 11.924 -3.447 1.00 0.00 C ATOM 959 C THR B 205 -2.129 10.707 -3.888 1.00 0.00 C ATOM 960 O THR B 205 -1.229 10.825 -4.718 1.00 0.00 O ATOM 961 CB THR B 205 -4.339 11.980 -4.075 1.00 0.00 C ATOM 962 OG1 THR B 205 -4.097 12.359 -5.427 1.00 0.00 O ATOM 963 CG2 THR B 205 -5.188 13.123 -3.514 1.00 0.00 C ATOM 0 H THR B 205 -1.686 13.100 -4.642 1.00 0.00 H new ATOM 0 HA THR B 205 -3.062 11.825 -2.368 1.00 0.00 H new ATOM 0 HB THR B 205 -4.850 11.032 -3.908 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.949 12.417 -5.908 1.00 0.00 H new ATOM 0 HG21 THR B 205 -6.167 13.118 -3.993 1.00 0.00 H new ATOM 0 HG22 THR B 205 -5.309 12.992 -2.439 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.693 14.074 -3.710 1.00 0.00 H new ATOM 971 N TYR B 206 -2.473 9.564 -3.312 1.00 0.00 N ATOM 972 CA TYR B 206 -1.785 8.326 -3.633 1.00 0.00 C ATOM 973 C TYR B 206 -2.777 7.177 -3.810 1.00 0.00 C ATOM 974 O TYR B 206 -3.766 7.088 -3.084 1.00 0.00 O ATOM 975 CB TYR B 206 -0.880 8.024 -2.437 1.00 0.00 C ATOM 976 CG TYR B 206 0.566 8.490 -2.616 1.00 0.00 C ATOM 977 CD1 TYR B 206 0.875 9.832 -2.523 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.561 7.569 -2.872 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.236 10.272 -2.692 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.923 8.009 -3.041 1.00 0.00 C ATOM 981 CZ TYR B 206 3.192 9.337 -2.942 1.00 0.00 C ATOM 982 OH TYR B 206 4.478 9.753 -3.102 1.00 0.00 O ATOM 0 H TYR B 206 -3.220 9.470 -2.624 1.00 0.00 H new ATOM 0 HA TYR B 206 -1.227 8.428 -4.564 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.297 8.500 -1.550 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.884 6.950 -2.254 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.096 10.553 -2.323 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.319 6.519 -2.946 1.00 0.00 H new ATOM 0 HE1 TYR B 206 2.491 11.319 -2.622 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.712 7.299 -3.242 1.00 0.00 H new ATOM 0 HH TYR B 206 5.081 8.984 -3.036 1.00 0.00 H new ATOM 992 N THR B 207 -2.480 6.324 -4.780 1.00 0.00 N ATOM 993 CA THR B 207 -3.335 5.183 -5.063 1.00 0.00 C ATOM 994 C THR B 207 -2.612 3.879 -4.722 1.00 0.00 C ATOM 995 O THR B 207 -1.683 3.478 -5.422 1.00 0.00 O ATOM 996 CB THR B 207 -3.773 5.271 -6.526 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.084 6.649 -6.713 1.00 0.00 O ATOM 998 CG2 THR B 207 -5.098 4.551 -6.784 1.00 0.00 C ATOM 0 H THR B 207 -1.659 6.400 -5.380 1.00 0.00 H new ATOM 0 HA THR B 207 -4.230 5.195 -4.441 1.00 0.00 H new ATOM 0 HB THR B 207 -2.998 4.845 -7.163 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.376 6.796 -7.637 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.363 4.644 -7.837 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.995 3.497 -6.527 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.881 4.999 -6.172 1.00 0.00 H new ATOM 1006 N VAL B 208 -3.066 3.252 -3.646 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.474 2.001 -3.204 1.00 0.00 C ATOM 1008 C VAL B 208 -3.423 0.847 -3.537 1.00 0.00 C ATOM 1009 O VAL B 208 -4.531 0.777 -3.008 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.131 2.081 -1.716 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.784 0.700 -1.157 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.994 3.075 -1.468 1.00 0.00 C ATOM 0 H VAL B 208 -3.837 3.587 -3.068 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.538 1.815 -3.730 1.00 0.00 H new ATOM 0 HB VAL B 208 -3.014 2.443 -1.188 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.544 0.786 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.636 0.032 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.924 0.297 -1.692 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.770 3.113 -0.402 1.00 0.00 H new ATOM 0 HG22 VAL B 208 -0.106 2.756 -2.014 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.295 4.065 -1.811 1.00 0.00 H new ATOM 1022 N THR B 209 -2.953 -0.029 -4.413 1.00 0.00 N ATOM 1023 CA THR B 209 -3.745 -1.176 -4.823 1.00 0.00 C ATOM 1024 C THR B 209 -3.225 -2.450 -4.155 1.00 0.00 C ATOM 1025 O THR B 209 -2.025 -2.589 -3.925 1.00 0.00 O ATOM 1026 CB THR B 209 -3.729 -1.241 -6.351 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.711 0.125 -6.756 1.00 0.00 O ATOM 1028 CG2 THR B 209 -5.036 -1.784 -6.929 1.00 0.00 C ATOM 0 H THR B 209 -2.034 0.033 -4.850 1.00 0.00 H new ATOM 0 HA THR B 209 -4.781 -1.077 -4.499 1.00 0.00 H new ATOM 0 HB THR B 209 -2.900 -1.869 -6.678 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.698 0.176 -7.735 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.970 -1.809 -8.017 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.209 -2.792 -6.553 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.862 -1.139 -6.630 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.154 -3.349 -3.863 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.804 -4.606 -3.226 1.00 0.00 C ATOM 1038 C VAL B 210 -4.629 -5.736 -3.848 1.00 0.00 C ATOM 1039 O VAL B 210 -5.850 -5.769 -3.704 1.00 0.00 O ATOM 1040 CB VAL B 210 -3.989 -4.496 -1.711 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.400 -5.841 -1.109 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.722 -3.960 -1.041 1.00 0.00 C ATOM 0 H VAL B 210 -5.149 -3.231 -4.056 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.753 -4.839 -3.395 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.794 -3.785 -1.523 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.525 -5.734 -0.031 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.341 -6.166 -1.553 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.627 -6.582 -1.313 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -2.881 -3.892 0.035 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.890 -4.635 -1.243 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.491 -2.971 -1.437 1.00 0.00 H new ATOM 1052 N THR B 211 -3.929 -6.633 -4.526 1.00 0.00 N ATOM 1053 CA THR B 211 -4.581 -7.759 -5.170 1.00 0.00 C ATOM 1054 C THR B 211 -3.984 -9.077 -4.672 1.00 0.00 C ATOM 1055 O THR B 211 -2.766 -9.213 -4.572 1.00 0.00 O ATOM 1056 CB THR B 211 -4.462 -7.573 -6.684 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.392 -6.534 -6.979 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.988 -8.778 -7.466 1.00 0.00 C ATOM 0 H THR B 211 -2.916 -6.602 -4.643 1.00 0.00 H new ATOM 0 HA THR B 211 -5.640 -7.800 -4.915 1.00 0.00 H new ATOM 0 HB THR B 211 -3.419 -7.398 -6.948 1.00 0.00 H new ATOM 0 HG1 THR B 211 -5.226 -6.193 -7.883 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.880 -8.593 -8.535 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.419 -9.666 -7.192 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.040 -8.934 -7.229 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.871 -10.016 -4.371 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.447 -11.318 -3.886 1.00 0.00 C ATOM 1068 C ASN B 212 -4.392 -12.300 -5.057 1.00 0.00 C ATOM 1069 O ASN B 212 -5.411 -12.578 -5.688 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.432 -11.867 -2.853 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.819 -10.792 -1.836 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.274 -9.701 -1.810 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.788 -11.158 -1.002 1.00 0.00 N ATOM 0 H ASN B 212 -5.881 -9.900 -4.454 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.466 -11.204 -3.424 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.326 -12.234 -3.357 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.986 -12.717 -2.337 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.117 -10.510 -0.287 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.202 -12.087 -1.078 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.192 -12.801 -5.312 1.00 0.00 N ATOM 1081 CA ASN B 213 -2.990 -13.747 -6.397 1.00 0.00 C ATOM 1082 C ASN B 213 -3.482 -15.129 -5.960 1.00 0.00 C ATOM 1083 O ASN B 213 -3.660 -16.019 -6.789 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.509 -13.865 -6.757 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.261 -13.437 -8.205 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.488 -14.179 -9.146 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.784 -12.202 -8.330 1.00 0.00 N ATOM 0 H ASN B 213 -2.349 -12.570 -4.786 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.544 -13.388 -7.265 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.917 -13.245 -6.084 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.178 -14.894 -6.616 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.586 -11.823 -9.256 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.617 -11.634 -7.500 1.00 0.00 H new ATOM 1094 N SER B 214 -3.687 -15.264 -4.658 1.00 0.00 N ATOM 1095 CA SER B 214 -4.154 -16.523 -4.101 1.00 0.00 C ATOM 1096 C SER B 214 -5.672 -16.628 -4.249 1.00 0.00 C ATOM 1097 O SER B 214 -6.204 -17.713 -4.482 1.00 0.00 O ATOM 1098 CB SER B 214 -3.753 -16.656 -2.630 1.00 0.00 C ATOM 1099 OG SER B 214 -3.615 -18.019 -2.237 1.00 0.00 O ATOM 0 H SER B 214 -3.539 -14.523 -3.973 1.00 0.00 H new ATOM 0 HA SER B 214 -3.684 -17.337 -4.653 1.00 0.00 H new ATOM 0 HB2 SER B 214 -2.812 -16.133 -2.462 1.00 0.00 H new ATOM 0 HB3 SER B 214 -4.503 -16.172 -2.004 1.00 0.00 H new ATOM 0 HG SER B 214 -3.357 -18.063 -1.293 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.330 -15.487 -4.108 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.778 -15.438 -4.222 1.00 0.00 C ATOM 1107 C ASN B 215 -8.158 -14.697 -5.506 1.00 0.00 C ATOM 1108 O ASN B 215 -9.335 -14.620 -5.857 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.399 -14.689 -3.042 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.596 -15.454 -2.475 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -10.629 -14.681 -2.149 1.00 0.00 O flip ATOM 1112 ND2 ASN B 215 -9.584 -16.668 -2.343 1.00 0.00 N flip ATOM 0 H ASN B 215 -5.887 -14.589 -3.916 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.151 -16.462 -4.234 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.651 -14.548 -2.262 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.716 -13.697 -3.363 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -8.758 -17.202 -2.613 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.400 -17.148 -1.963 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.141 -14.171 -6.171 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.353 -13.439 -7.408 1.00 0.00 C ATOM 1121 C GLY B 216 -8.266 -12.232 -7.181 1.00 0.00 C ATOM 1122 O GLY B 216 -8.857 -11.710 -8.125 1.00 0.00 O ATOM 0 H GLY B 216 -6.167 -14.237 -5.876 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.395 -13.105 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.795 -14.099 -8.154 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.353 -11.824 -5.924 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.184 -10.690 -5.560 1.00 0.00 C ATOM 1128 C VAL B 217 -8.348 -9.410 -5.626 1.00 0.00 C ATOM 1129 O VAL B 217 -7.253 -9.349 -5.068 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.814 -10.921 -4.185 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.500 -9.652 -3.676 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.795 -12.096 -4.223 1.00 0.00 C ATOM 0 H VAL B 217 -7.861 -12.259 -5.144 1.00 0.00 H new ATOM 0 HA VAL B 217 -10.008 -10.579 -6.265 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.015 -11.173 -3.488 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.939 -9.844 -2.697 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.767 -8.850 -3.594 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.284 -9.357 -4.374 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.229 -12.240 -3.234 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.588 -11.885 -4.940 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.267 -13.001 -4.522 1.00 0.00 H new ATOM 1142 N SER B 218 -8.896 -8.418 -6.313 1.00 0.00 N ATOM 1143 CA SER B 218 -8.215 -7.142 -6.459 1.00 0.00 C ATOM 1144 C SER B 218 -8.955 -6.061 -5.669 1.00 0.00 C ATOM 1145 O SER B 218 -10.178 -6.102 -5.547 1.00 0.00 O ATOM 1146 CB SER B 218 -8.104 -6.742 -7.932 1.00 0.00 C ATOM 1147 OG SER B 218 -9.068 -7.412 -8.740 1.00 0.00 O ATOM 0 H SER B 218 -9.804 -8.472 -6.775 1.00 0.00 H new ATOM 0 HA SER B 218 -7.205 -7.246 -6.062 1.00 0.00 H new ATOM 0 HB2 SER B 218 -8.238 -5.664 -8.026 1.00 0.00 H new ATOM 0 HB3 SER B 218 -7.103 -6.972 -8.296 1.00 0.00 H new ATOM 0 HG SER B 218 -8.966 -7.129 -9.673 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.181 -5.116 -5.154 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.747 -4.025 -4.379 1.00 0.00 C ATOM 1155 C VAL B 219 -7.832 -2.803 -4.483 1.00 0.00 C ATOM 1156 O VAL B 219 -6.628 -2.904 -4.252 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.982 -4.476 -2.936 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.244 -3.275 -2.023 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.128 -5.486 -2.856 1.00 0.00 C ATOM 0 H VAL B 219 -7.167 -5.084 -5.258 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.720 -3.737 -4.778 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.076 -4.971 -2.588 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.408 -3.622 -1.003 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.383 -2.607 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.128 -2.740 -2.370 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.274 -5.790 -1.819 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -11.043 -5.028 -3.232 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.885 -6.360 -3.460 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.439 -1.678 -4.831 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.693 -0.438 -4.969 1.00 0.00 C ATOM 1171 C ASP B 220 -8.242 0.593 -3.980 1.00 0.00 C ATOM 1172 O ASP B 220 -9.441 0.622 -3.708 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.836 0.137 -6.379 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.347 -0.850 -7.431 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -7.955 -2.033 -7.337 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -9.117 -0.398 -8.305 1.00 0.00 O ATOM 0 H ASP B 220 -9.438 -1.599 -5.021 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.642 -0.652 -4.772 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.516 0.988 -6.341 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.866 0.517 -6.700 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.336 1.415 -3.469 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.713 2.446 -2.517 1.00 0.00 C ATOM 1183 C TYR B 221 -6.938 3.740 -2.772 1.00 0.00 C ATOM 1184 O TYR B 221 -5.711 3.727 -2.850 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.336 1.903 -1.137 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.517 1.327 -0.351 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.517 2.162 0.102 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.580 -0.028 -0.096 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.628 1.620 0.842 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.691 -0.570 0.644 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.659 0.281 1.076 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.707 -0.231 1.775 1.00 0.00 O ATOM 0 H TYR B 221 -6.342 1.388 -3.697 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.775 2.675 -2.601 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.580 1.127 -1.257 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.881 2.704 -0.554 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -9.467 3.222 -0.098 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.797 -0.682 -0.451 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -11.418 2.262 1.202 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.753 -1.628 0.851 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.414 -1.024 2.270 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.687 4.826 -2.896 1.00 0.00 N ATOM 1203 CA GLU B 222 -7.084 6.125 -3.141 1.00 0.00 C ATOM 1204 C GLU B 222 -7.038 6.941 -1.848 1.00 0.00 C ATOM 1205 O GLU B 222 -8.079 7.307 -1.303 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.836 6.880 -4.239 1.00 0.00 C ATOM 1207 CG GLU B 222 -7.192 8.241 -4.509 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.642 8.802 -5.860 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -7.485 8.067 -6.859 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -8.129 9.952 -5.863 1.00 0.00 O ATOM 0 H GLU B 222 -8.705 4.833 -2.831 1.00 0.00 H new ATOM 0 HA GLU B 222 -6.062 5.970 -3.487 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.841 6.288 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.876 7.018 -3.943 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.459 8.938 -3.715 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -6.107 8.143 -4.495 1.00 0.00 H new ATOM 1217 N THR B 223 -5.821 7.202 -1.393 1.00 0.00 N ATOM 1218 CA THR B 223 -5.626 7.969 -0.175 1.00 0.00 C ATOM 1219 C THR B 223 -4.477 8.965 -0.348 1.00 0.00 C ATOM 1220 O THR B 223 -3.551 8.720 -1.120 1.00 0.00 O ATOM 1221 CB THR B 223 -5.407 6.982 0.974 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.576 7.772 2.148 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.959 6.495 1.059 1.00 0.00 C ATOM 0 H THR B 223 -4.960 6.896 -1.846 1.00 0.00 H new ATOM 0 HA THR B 223 -6.504 8.572 0.057 1.00 0.00 H new ATOM 0 HB THR B 223 -6.071 6.127 0.849 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.453 7.210 2.941 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.858 5.797 1.890 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.689 5.994 0.130 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.297 7.347 1.217 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.575 10.065 0.382 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.555 11.099 0.319 1.00 0.00 C ATOM 1233 C GLU B 224 -2.703 11.084 1.590 1.00 0.00 C ATOM 1234 O GLU B 224 -3.066 11.699 2.591 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.183 12.476 0.095 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.631 12.504 0.588 1.00 0.00 C ATOM 1237 CD GLU B 224 -5.699 12.305 2.103 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.378 11.180 2.543 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -6.071 13.282 2.787 1.00 0.00 O ATOM 0 H GLU B 224 -5.345 10.264 1.021 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.906 10.890 -0.531 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.602 13.235 0.619 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -4.151 12.726 -0.965 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -6.091 13.456 0.322 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -6.204 11.722 0.089 1.00 0.00 H new ATOM 1246 N THR B 225 -1.588 10.373 1.509 1.00 0.00 N ATOM 1247 CA THR B 225 -0.683 10.270 2.640 1.00 0.00 C ATOM 1248 C THR B 225 0.762 10.491 2.190 1.00 0.00 C ATOM 1249 O THR B 225 1.345 9.638 1.522 1.00 0.00 O ATOM 1250 CB THR B 225 -0.910 8.910 3.306 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.846 7.981 2.228 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.333 8.755 3.847 1.00 0.00 C ATOM 0 H THR B 225 -1.291 9.863 0.677 1.00 0.00 H new ATOM 0 HA THR B 225 -0.883 11.047 3.377 1.00 0.00 H new ATOM 0 HB THR B 225 -0.196 8.779 4.119 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.981 7.073 2.570 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.442 7.774 4.309 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.526 9.529 4.589 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.046 8.851 3.028 1.00 0.00 H new ATOM 1260 N PRO B 226 1.313 11.670 2.583 1.00 0.00 N ATOM 1261 CA PRO B 226 2.679 12.013 2.226 1.00 0.00 C ATOM 1262 C PRO B 226 3.682 11.224 3.071 1.00 0.00 C ATOM 1263 O PRO B 226 4.186 10.189 2.635 1.00 0.00 O ATOM 1264 CB PRO B 226 2.775 13.515 2.440 1.00 0.00 C ATOM 1265 CG PRO B 226 1.611 13.883 3.346 1.00 0.00 C ATOM 1266 CD PRO B 226 0.653 12.704 3.375 1.00 0.00 C ATOM 0 HA PRO B 226 2.922 11.753 1.196 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.727 13.784 2.898 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.716 14.049 1.492 1.00 0.00 H new ATOM 0 HG2 PRO B 226 1.967 14.111 4.351 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.107 14.776 2.976 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.472 12.366 4.395 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.315 12.970 2.951 1.00 0.00 H new ATOM 1274 N MET B 227 3.941 11.742 4.262 1.00 0.00 N ATOM 1275 CA MET B 227 4.875 11.099 5.171 1.00 0.00 C ATOM 1276 C MET B 227 4.252 9.853 5.804 1.00 0.00 C ATOM 1277 O MET B 227 4.960 8.910 6.154 1.00 0.00 O ATOM 1278 CB MET B 227 5.278 12.083 6.270 1.00 0.00 C ATOM 1279 CG MET B 227 5.641 13.447 5.678 1.00 0.00 C ATOM 1280 SD MET B 227 5.089 14.751 6.766 1.00 0.00 S ATOM 1281 CE MET B 227 3.370 14.302 6.939 1.00 0.00 C ATOM 0 H MET B 227 3.520 12.600 4.619 1.00 0.00 H new ATOM 0 HA MET B 227 5.755 10.795 4.604 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.459 12.197 6.980 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.128 11.686 6.825 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.719 13.515 5.534 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.180 13.561 4.697 1.00 0.00 H new ATOM 0 HE1 MET B 227 2.748 15.189 6.817 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.107 13.568 6.178 1.00 0.00 H new ATOM 0 HE3 MET B 227 3.203 13.875 7.928 1.00 0.00 H new ATOM 1291 N THR B 228 2.933 9.888 5.931 1.00 0.00 N ATOM 1292 CA THR B 228 2.208 8.774 6.515 1.00 0.00 C ATOM 1293 C THR B 228 2.587 7.465 5.819 1.00 0.00 C ATOM 1294 O THR B 228 2.698 6.424 6.464 1.00 0.00 O ATOM 1295 CB THR B 228 0.713 9.090 6.439 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.635 10.176 5.520 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.171 9.671 7.748 1.00 0.00 C ATOM 0 H THR B 228 2.348 10.671 5.639 1.00 0.00 H new ATOM 0 HA THR B 228 2.474 8.637 7.563 1.00 0.00 H new ATOM 0 HB THR B 228 0.162 8.184 6.187 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.272 10.548 5.529 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.894 9.878 7.641 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.322 8.954 8.555 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.698 10.596 7.981 1.00 0.00 H new ATOM 1305 N LEU B 229 2.777 7.562 4.511 1.00 0.00 N ATOM 1306 CA LEU B 229 3.141 6.399 3.719 1.00 0.00 C ATOM 1307 C LEU B 229 4.363 5.724 4.347 1.00 0.00 C ATOM 1308 O LEU B 229 4.468 4.499 4.344 1.00 0.00 O ATOM 1309 CB LEU B 229 3.339 6.790 2.253 1.00 0.00 C ATOM 1310 CG LEU B 229 2.067 6.900 1.412 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.325 7.698 0.131 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.482 5.517 1.117 1.00 0.00 C ATOM 0 H LEU B 229 2.686 8.428 3.980 1.00 0.00 H new ATOM 0 HA LEU B 229 2.334 5.666 3.722 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.857 7.748 2.220 1.00 0.00 H new ATOM 0 HB3 LEU B 229 3.997 6.056 1.787 1.00 0.00 H new ATOM 0 HG LEU B 229 1.322 7.448 1.989 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.405 7.762 -0.450 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.661 8.702 0.389 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.093 7.199 -0.460 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.578 5.625 0.517 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.213 4.922 0.569 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.238 5.018 2.055 1.00 0.00 H new ATOM 1324 N LEU B 230 5.254 6.553 4.869 1.00 0.00 N ATOM 1325 CA LEU B 230 6.464 6.051 5.498 1.00 0.00 C ATOM 1326 C LEU B 230 6.133 5.553 6.906 1.00 0.00 C ATOM 1327 O LEU B 230 6.845 4.715 7.456 1.00 0.00 O ATOM 1328 CB LEU B 230 7.565 7.112 5.465 1.00 0.00 C ATOM 1329 CG LEU B 230 7.793 7.802 4.117 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.951 8.798 4.198 1.00 0.00 C ATOM 1331 CD2 LEU B 230 7.998 6.773 3.003 1.00 0.00 C ATOM 0 H LEU B 230 5.163 7.569 4.870 1.00 0.00 H new ATOM 0 HA LEU B 230 6.857 5.200 4.942 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.328 7.876 6.206 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.500 6.646 5.775 1.00 0.00 H new ATOM 0 HG LEU B 230 6.897 8.371 3.869 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.091 9.273 3.227 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.725 9.559 4.945 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.864 8.273 4.480 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.158 7.289 2.056 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.868 6.157 3.232 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.115 6.139 2.926 1.00 0.00 H new ATOM 1343 N VAL B 231 5.051 6.093 7.451 1.00 0.00 N ATOM 1344 CA VAL B 231 4.617 5.714 8.785 1.00 0.00 C ATOM 1345 C VAL B 231 4.107 4.271 8.759 1.00 0.00 C ATOM 1346 O VAL B 231 3.369 3.885 7.854 1.00 0.00 O ATOM 1347 CB VAL B 231 3.573 6.708 9.296 1.00 0.00 C ATOM 1348 CG1 VAL B 231 3.115 6.343 10.711 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.108 8.140 9.246 1.00 0.00 C ATOM 0 H VAL B 231 4.463 6.789 6.993 1.00 0.00 H new ATOM 0 HA VAL B 231 5.452 5.751 9.485 1.00 0.00 H new ATOM 0 HB VAL B 231 2.706 6.651 8.637 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.373 7.065 11.051 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.675 5.346 10.705 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.971 6.358 11.386 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.346 8.826 9.615 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.999 8.218 9.870 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.362 8.398 8.218 1.00 0.00 H new ATOM 1359 N PRO B 232 4.532 3.493 9.791 1.00 0.00 N ATOM 1360 CA PRO B 232 4.126 2.102 9.896 1.00 0.00 C ATOM 1361 C PRO B 232 2.674 1.988 10.363 1.00 0.00 C ATOM 1362 O PRO B 232 1.910 1.181 9.835 1.00 0.00 O ATOM 1363 CB PRO B 232 5.114 1.477 10.868 1.00 0.00 C ATOM 1364 CG PRO B 232 5.743 2.635 11.625 1.00 0.00 C ATOM 1365 CD PRO B 232 5.407 3.916 10.881 1.00 0.00 C ATOM 0 HA PRO B 232 4.148 1.584 8.937 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.611 0.792 11.550 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.871 0.900 10.338 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.362 2.675 12.646 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.823 2.505 11.693 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.909 4.634 11.533 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.306 4.401 10.501 1.00 0.00 H new ATOM 1373 N GLU B 233 2.336 2.808 11.347 1.00 0.00 N ATOM 1374 CA GLU B 233 0.989 2.809 11.892 1.00 0.00 C ATOM 1375 C GLU B 233 -0.024 3.151 10.798 1.00 0.00 C ATOM 1376 O GLU B 233 -1.141 2.633 10.797 1.00 0.00 O ATOM 1377 CB GLU B 233 0.873 3.780 13.069 1.00 0.00 C ATOM 1378 CG GLU B 233 2.126 3.729 13.946 1.00 0.00 C ATOM 1379 CD GLU B 233 1.821 4.214 15.365 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.870 3.663 15.961 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.545 5.124 15.822 1.00 0.00 O ATOM 0 H GLU B 233 2.972 3.477 11.781 1.00 0.00 H new ATOM 0 HA GLU B 233 0.769 1.809 12.266 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.727 4.794 12.696 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.004 3.530 13.666 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.509 2.709 13.981 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.908 4.348 13.506 1.00 0.00 H new ATOM 1388 N VAL B 234 0.399 4.020 9.892 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.456 4.437 8.795 1.00 0.00 C ATOM 1390 C VAL B 234 -0.393 3.392 7.678 1.00 0.00 C ATOM 1391 O VAL B 234 -1.423 2.990 7.140 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.062 5.839 8.326 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.993 6.327 7.214 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.043 6.823 9.497 1.00 0.00 C ATOM 0 H VAL B 234 1.325 4.447 9.896 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.494 4.499 9.123 1.00 0.00 H new ATOM 0 HB VAL B 234 0.947 5.785 7.918 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.691 7.326 6.899 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.935 5.646 6.365 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.018 6.358 7.585 1.00 0.00 H new ATOM 0 HG21 VAL B 234 0.240 7.812 9.137 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.034 6.871 9.948 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.679 6.488 10.242 1.00 0.00 H new ATOM 1404 N ALA B 235 0.828 2.983 7.364 1.00 0.00 N ATOM 1405 CA ALA B 235 1.039 1.993 6.321 1.00 0.00 C ATOM 1406 C ALA B 235 0.431 0.660 6.759 1.00 0.00 C ATOM 1407 O ALA B 235 -0.255 0.000 5.978 1.00 0.00 O ATOM 1408 CB ALA B 235 2.536 1.881 6.020 1.00 0.00 C ATOM 0 H ALA B 235 1.680 3.319 7.813 1.00 0.00 H new ATOM 0 HA ALA B 235 0.542 2.294 5.399 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.695 1.139 5.238 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.913 2.847 5.685 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.067 1.577 6.922 1.00 0.00 H new ATOM 1414 N ALA B 236 0.703 0.302 8.005 1.00 0.00 N ATOM 1415 CA ALA B 236 0.191 -0.942 8.556 1.00 0.00 C ATOM 1416 C ALA B 236 -1.330 -0.979 8.391 1.00 0.00 C ATOM 1417 O ALA B 236 -1.885 -1.978 7.938 1.00 0.00 O ATOM 1418 CB ALA B 236 0.622 -1.069 10.018 1.00 0.00 C ATOM 0 H ALA B 236 1.272 0.852 8.649 1.00 0.00 H new ATOM 0 HA ALA B 236 0.602 -1.797 8.020 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.238 -2.002 10.431 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.710 -1.067 10.078 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.225 -0.229 10.589 1.00 0.00 H new ATOM 1424 N GLU B 237 -1.961 0.124 8.769 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.407 0.230 8.668 1.00 0.00 C ATOM 1426 C GLU B 237 -3.838 0.236 7.200 1.00 0.00 C ATOM 1427 O GLU B 237 -4.888 -0.304 6.856 1.00 0.00 O ATOM 1428 CB GLU B 237 -3.916 1.476 9.395 1.00 0.00 C ATOM 1429 CG GLU B 237 -3.863 1.286 10.912 1.00 0.00 C ATOM 1430 CD GLU B 237 -4.294 2.562 11.639 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -5.410 3.037 11.340 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -3.495 3.033 12.479 1.00 0.00 O ATOM 0 H GLU B 237 -1.498 0.951 9.145 1.00 0.00 H new ATOM 0 HA GLU B 237 -3.851 -0.640 9.152 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.313 2.338 9.112 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -4.940 1.688 9.087 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.513 0.461 11.202 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -2.851 1.015 11.213 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.006 0.853 6.375 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.288 0.937 4.951 1.00 0.00 C ATOM 1441 C VAL B 238 -3.237 -0.466 4.342 1.00 0.00 C ATOM 1442 O VAL B 238 -4.158 -0.873 3.636 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.319 1.914 4.283 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.930 1.429 2.884 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.912 3.323 4.229 1.00 0.00 C ATOM 0 H VAL B 238 -2.136 1.300 6.665 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.291 1.328 4.782 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.413 1.955 4.888 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.241 2.141 2.431 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.448 0.454 2.958 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.824 1.346 2.266 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.203 3.998 3.749 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.840 3.306 3.657 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.116 3.671 5.242 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.152 -1.167 4.639 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.970 -2.515 4.130 1.00 0.00 C ATOM 1457 C ILE B 239 -3.066 -3.421 4.693 1.00 0.00 C ATOM 1458 O ILE B 239 -3.739 -4.126 3.943 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.552 -3.011 4.423 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.485 -2.187 3.657 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.423 -4.507 4.130 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.112 -2.072 2.178 1.00 0.00 C ATOM 0 H ILE B 239 -1.390 -0.826 5.226 1.00 0.00 H new ATOM 0 HA ILE B 239 -2.071 -2.529 3.045 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.354 -2.872 5.486 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.559 -1.192 4.095 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.466 -2.652 3.753 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.594 -4.834 4.347 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.123 -5.062 4.755 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.648 -4.693 3.080 1.00 0.00 H new ATOM 0 HD11 ILE B 239 0.866 -1.481 1.657 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.063 -3.067 1.737 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.859 -1.585 2.084 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.211 -3.373 6.009 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.215 -4.181 6.682 1.00 0.00 C ATOM 1476 C LYS B 240 -5.605 -3.779 6.183 1.00 0.00 C ATOM 1477 O LYS B 240 -6.445 -4.637 5.916 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.053 -4.081 8.200 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.413 -4.145 8.900 1.00 0.00 C ATOM 1480 CD LYS B 240 -5.934 -2.741 9.215 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.405 -2.783 9.630 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.813 -1.491 10.225 1.00 0.00 N ATOM 0 H LYS B 240 -2.650 -2.787 6.628 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.082 -5.235 6.439 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.418 -4.892 8.556 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.552 -3.148 8.456 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.128 -4.668 8.266 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.325 -4.719 9.822 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.339 -2.299 10.015 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.817 -2.101 8.340 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.027 -3.003 8.763 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.563 -3.587 10.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.815 -1.537 10.501 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.231 -1.296 11.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.681 -0.731 9.528 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.804 -2.474 6.072 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.077 -1.949 5.609 1.00 0.00 C ATOM 1498 C ASP B 241 -7.375 -2.498 4.214 1.00 0.00 C ATOM 1499 O ASP B 241 -8.493 -2.931 3.938 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.043 -0.421 5.519 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.220 0.209 4.773 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.368 -0.114 5.148 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -7.945 1.000 3.844 1.00 0.00 O ATOM 0 H ASP B 241 -5.105 -1.765 6.295 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.845 -2.252 6.321 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.013 -0.013 6.529 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.118 -0.122 5.026 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.355 -2.462 3.368 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.494 -2.952 2.008 1.00 0.00 C ATOM 1510 C LEU B 242 -6.824 -4.445 2.038 1.00 0.00 C ATOM 1511 O LEU B 242 -7.790 -4.883 1.414 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.246 -2.614 1.188 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.271 -1.277 0.446 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.084 -0.401 0.852 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.336 -1.489 -1.067 1.00 0.00 C ATOM 0 H LEU B 242 -5.429 -2.101 3.599 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.323 -2.453 1.506 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.385 -2.620 1.856 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.089 -3.409 0.458 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.177 -0.745 0.735 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.126 0.543 0.309 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.125 -0.206 1.924 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.153 -0.915 0.613 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.353 -0.522 -1.570 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.462 -2.052 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.240 -2.044 -1.318 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.004 -5.185 2.770 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.197 -6.620 2.889 1.00 0.00 C ATOM 1529 C VAL B 243 -7.557 -6.895 3.535 1.00 0.00 C ATOM 1530 O VAL B 243 -8.301 -7.762 3.079 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.032 -7.243 3.662 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.508 -8.420 4.516 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.912 -7.672 2.712 1.00 0.00 C ATOM 0 H VAL B 243 -5.205 -4.818 3.286 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.203 -7.087 1.904 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.630 -6.484 4.333 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.661 -8.845 5.055 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.255 -8.073 5.230 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.948 -9.182 3.873 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.096 -8.111 3.286 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.296 -8.408 2.005 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.545 -6.803 2.167 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.840 -6.141 4.587 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.097 -6.292 5.300 1.00 0.00 C ATOM 1545 C ASN B 244 -10.258 -6.126 4.318 1.00 0.00 C ATOM 1546 O ASN B 244 -11.277 -6.805 4.436 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.244 -5.229 6.390 1.00 0.00 C ATOM 1548 CG ASN B 244 -8.951 -5.815 7.773 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.724 -6.314 7.899 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -9.782 -5.816 8.665 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.220 -5.423 4.963 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.108 -7.281 5.758 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.563 -4.402 6.190 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.255 -4.821 6.371 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.706 -5.416 8.502 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.553 -6.216 9.575 1.00 0.00 H new ATOM 1557 N THR B 245 -10.066 -5.219 3.371 1.00 0.00 N ATOM 1558 CA THR B 245 -11.086 -4.956 2.370 1.00 0.00 C ATOM 1559 C THR B 245 -11.139 -6.096 1.350 1.00 0.00 C ATOM 1560 O THR B 245 -12.219 -6.533 0.959 1.00 0.00 O ATOM 1561 CB THR B 245 -10.790 -3.592 1.742 1.00 0.00 C ATOM 1562 OG1 THR B 245 -11.066 -2.662 2.785 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.788 -3.225 0.642 1.00 0.00 C ATOM 0 H THR B 245 -9.220 -4.657 3.276 1.00 0.00 H new ATOM 0 HA THR B 245 -12.079 -4.916 2.818 1.00 0.00 H new ATOM 0 HB THR B 245 -9.781 -3.594 1.331 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.278 -2.574 3.361 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.533 -2.249 0.230 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.749 -3.974 -0.149 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.794 -3.191 1.060 1.00 0.00 H new