USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=28 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 -141:sc= 1.27 USER MOD Set 1.2: B 245 THR OG1 : rot 82:sc= 2.06 USER MOD Set 2.1: B 211 THR OG1 : rot 180:sc= 0.384 USER MOD Set 2.2: B 218 SER OG : rot 67:sc= 0.415 USER MOD Set 3.1: A 21 TYR OH : rot 72:sc= 1.17 USER MOD Set 3.2: A 45 THR OG1 : rot 85:sc= 1.62 USER MOD Set 4.1: A 12 ASN : amide:sc= -8.6! C(o=-10!,f=-12!) USER MOD Set 4.2: B 206 TYR OH : rot 100:sc= -1.84! USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.74 USER MOD Single : A 6 TYR OH : rot 180:sc= -0.0124 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= -1.12 USER MOD Single : A 11 THR OG1 : rot 150:sc= -2.67 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.0297 K(o=-0.03,f=-0.74) USER MOD Single : A 18 SER OG : rot 180:sc= 0.00484 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.319 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.991 F(o=-1.8!,f=-0.99) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.85! USER MOD Single : B 207 THR OG1 : rot 180:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc=-0.00323 USER MOD Single : B 212 ASN : amide:sc= -11.7! C(o=-12!,f=-21!) USER MOD Single : B 213 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN :FLIP amide:sc= -0.292 F(o=-4.2!,f=-0.29) USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.712 USER MOD Single : B 227 MET CE :methyl -140:sc= -1.62 (180deg=-4.34!) USER MOD Single : B 228 THR OG1 : rot 180:sc= -1.04! USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.606 F(o=-1.3,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.612 -19.918 -6.639 1.00 0.00 N ATOM 26 CA LYS A 3 -0.502 -19.657 -5.738 1.00 0.00 C ATOM 27 C LYS A 3 -0.921 -18.601 -4.712 1.00 0.00 C ATOM 28 O LYS A 3 -1.971 -17.978 -4.851 1.00 0.00 O ATOM 29 CB LYS A 3 0.753 -19.281 -6.529 1.00 0.00 C ATOM 30 CG LYS A 3 1.417 -20.524 -7.126 1.00 0.00 C ATOM 31 CD LYS A 3 0.371 -21.573 -7.510 1.00 0.00 C ATOM 32 CE LYS A 3 1.016 -22.739 -8.263 1.00 0.00 C ATOM 33 NZ LYS A 3 0.261 -23.990 -8.025 1.00 0.00 N ATOM 0 HA LYS A 3 -0.243 -20.558 -5.182 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.490 -18.586 -7.327 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.458 -18.766 -5.877 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.997 -20.244 -8.006 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.116 -20.949 -6.406 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.124 -21.944 -6.613 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.398 -21.115 -8.132 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.042 -22.520 -9.331 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.049 -22.863 -7.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.712 -24.771 -8.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.258 -24.205 -7.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -0.718 -23.873 -8.357 1.00 0.00 H new ATOM 47 N ALA A 4 -0.076 -18.434 -3.704 1.00 0.00 N ATOM 48 CA ALA A 4 -0.345 -17.465 -2.656 1.00 0.00 C ATOM 49 C ALA A 4 0.576 -16.257 -2.834 1.00 0.00 C ATOM 50 O ALA A 4 1.707 -16.257 -2.351 1.00 0.00 O ATOM 51 CB ALA A 4 -0.175 -18.131 -1.289 1.00 0.00 C ATOM 0 H ALA A 4 0.795 -18.954 -3.592 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.373 -17.107 -2.719 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.377 -17.404 -0.502 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.872 -18.964 -1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.846 -18.500 -1.189 1.00 0.00 H new ATOM 57 N THR A 5 0.059 -15.256 -3.531 1.00 0.00 N ATOM 58 CA THR A 5 0.820 -14.045 -3.781 1.00 0.00 C ATOM 59 C THR A 5 -0.103 -12.825 -3.783 1.00 0.00 C ATOM 60 O THR A 5 -1.316 -12.961 -3.930 1.00 0.00 O ATOM 61 CB THR A 5 1.587 -14.229 -5.091 1.00 0.00 C ATOM 62 OG1 THR A 5 0.566 -14.407 -6.069 1.00 0.00 O ATOM 63 CG2 THR A 5 2.374 -15.541 -5.130 1.00 0.00 C ATOM 0 H THR A 5 -0.879 -15.259 -3.931 1.00 0.00 H new ATOM 0 HA THR A 5 1.544 -13.863 -2.987 1.00 0.00 H new ATOM 0 HB THR A 5 2.271 -13.392 -5.232 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.976 -14.532 -6.951 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.900 -15.622 -6.081 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.096 -15.557 -4.314 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.687 -16.381 -5.023 1.00 0.00 H new ATOM 71 N TYR A 6 0.508 -11.660 -3.618 1.00 0.00 N ATOM 72 CA TYR A 6 -0.245 -10.417 -3.600 1.00 0.00 C ATOM 73 C TYR A 6 0.473 -9.329 -4.401 1.00 0.00 C ATOM 74 O TYR A 6 1.700 -9.246 -4.379 1.00 0.00 O ATOM 75 CB TYR A 6 -0.318 -9.990 -2.132 1.00 0.00 C ATOM 76 CG TYR A 6 -1.675 -10.246 -1.476 1.00 0.00 C ATOM 77 CD1 TYR A 6 -2.728 -9.384 -1.709 1.00 0.00 C ATOM 78 CD2 TYR A 6 -1.848 -11.338 -0.651 1.00 0.00 C ATOM 79 CE1 TYR A 6 -4.006 -9.625 -1.091 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.126 -11.579 -0.032 1.00 0.00 C ATOM 81 CZ TYR A 6 -4.142 -10.710 -0.283 1.00 0.00 C ATOM 82 OH TYR A 6 -5.349 -10.938 0.300 1.00 0.00 O ATOM 0 H TYR A 6 1.515 -11.551 -3.496 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.230 -10.558 -4.044 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.451 -10.521 -1.571 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -0.087 -8.927 -2.062 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -2.593 -8.529 -2.355 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.025 -12.013 -0.469 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -4.838 -8.959 -1.265 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -3.274 -12.430 0.616 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.299 -11.748 0.849 1.00 0.00 H new ATOM 92 N THR A 7 -0.322 -8.523 -5.088 1.00 0.00 N ATOM 93 CA THR A 7 0.223 -7.444 -5.894 1.00 0.00 C ATOM 94 C THR A 7 -0.186 -6.087 -5.317 1.00 0.00 C ATOM 95 O THR A 7 -1.349 -5.695 -5.408 1.00 0.00 O ATOM 96 CB THR A 7 -0.238 -7.653 -7.338 1.00 0.00 C ATOM 97 OG1 THR A 7 -0.009 -9.039 -7.577 1.00 0.00 O ATOM 98 CG2 THR A 7 0.667 -6.946 -8.350 1.00 0.00 C ATOM 0 H THR A 7 -1.339 -8.595 -5.103 1.00 0.00 H new ATOM 0 HA THR A 7 1.313 -7.453 -5.880 1.00 0.00 H new ATOM 0 HB THR A 7 -1.260 -7.290 -7.449 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.282 -9.263 -8.491 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.295 -7.126 -9.359 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.669 -5.874 -8.150 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.682 -7.333 -8.263 1.00 0.00 H new ATOM 106 N VAL A 8 0.792 -5.409 -4.735 1.00 0.00 N ATOM 107 CA VAL A 8 0.548 -4.105 -4.142 1.00 0.00 C ATOM 108 C VAL A 8 1.094 -3.017 -5.070 1.00 0.00 C ATOM 109 O VAL A 8 2.304 -2.906 -5.257 1.00 0.00 O ATOM 110 CB VAL A 8 1.148 -4.047 -2.737 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.158 -2.614 -2.202 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.402 -4.983 -1.783 1.00 0.00 C ATOM 0 H VAL A 8 1.755 -5.738 -4.661 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.522 -3.932 -4.031 1.00 0.00 H new ATOM 0 HB VAL A 8 2.182 -4.387 -2.801 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.590 -2.602 -1.201 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.754 -1.983 -2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.137 -2.234 -2.161 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.849 -4.923 -0.791 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.646 -4.687 -1.728 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.471 -6.007 -2.150 1.00 0.00 H new ATOM 122 N THR A 9 0.174 -2.244 -5.628 1.00 0.00 N ATOM 123 CA THR A 9 0.548 -1.169 -6.533 1.00 0.00 C ATOM 124 C THR A 9 0.353 0.189 -5.857 1.00 0.00 C ATOM 125 O THR A 9 -0.743 0.505 -5.397 1.00 0.00 O ATOM 126 CB THR A 9 -0.263 -1.330 -7.819 1.00 0.00 C ATOM 127 OG1 THR A 9 0.113 -2.615 -8.309 1.00 0.00 O ATOM 128 CG2 THR A 9 0.185 -0.366 -8.919 1.00 0.00 C ATOM 0 H THR A 9 -0.829 -2.340 -5.471 1.00 0.00 H new ATOM 0 HA THR A 9 1.606 -1.219 -6.791 1.00 0.00 H new ATOM 0 HB THR A 9 -1.319 -1.169 -7.604 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.369 -2.801 -9.142 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.423 -0.522 -9.810 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.065 0.661 -8.574 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.233 -0.549 -9.158 1.00 0.00 H new ATOM 136 N VAL A 10 1.432 0.955 -5.816 1.00 0.00 N ATOM 137 CA VAL A 10 1.393 2.272 -5.205 1.00 0.00 C ATOM 138 C VAL A 10 1.781 3.325 -6.244 1.00 0.00 C ATOM 139 O VAL A 10 2.860 3.257 -6.831 1.00 0.00 O ATOM 140 CB VAL A 10 2.289 2.300 -3.964 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.713 3.731 -3.626 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.596 1.637 -2.772 1.00 0.00 C ATOM 0 H VAL A 10 2.340 0.689 -6.197 1.00 0.00 H new ATOM 0 HA VAL A 10 0.383 2.505 -4.867 1.00 0.00 H new ATOM 0 HB VAL A 10 3.189 1.728 -4.188 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.349 3.723 -2.741 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.265 4.155 -4.465 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.828 4.336 -3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.254 1.670 -1.904 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.671 2.168 -2.547 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.368 0.599 -3.015 1.00 0.00 H new ATOM 152 N THR A 11 0.879 4.276 -6.441 1.00 0.00 N ATOM 153 CA THR A 11 1.113 5.342 -7.401 1.00 0.00 C ATOM 154 C THR A 11 0.835 6.704 -6.762 1.00 0.00 C ATOM 155 O THR A 11 -0.065 6.834 -5.934 1.00 0.00 O ATOM 156 CB THR A 11 0.254 5.064 -8.636 1.00 0.00 C ATOM 157 OG1 THR A 11 0.764 3.834 -9.144 1.00 0.00 O ATOM 158 CG2 THR A 11 0.506 6.066 -9.763 1.00 0.00 C ATOM 0 H THR A 11 -0.015 4.330 -5.952 1.00 0.00 H new ATOM 0 HA THR A 11 2.157 5.371 -7.714 1.00 0.00 H new ATOM 0 HB THR A 11 -0.800 5.089 -8.358 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.045 3.342 -9.592 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.129 5.823 -10.615 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.275 7.072 -9.414 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.552 6.018 -10.065 1.00 0.00 H new ATOM 166 N ASN A 12 1.626 7.686 -7.172 1.00 0.00 N ATOM 167 CA ASN A 12 1.476 9.035 -6.650 1.00 0.00 C ATOM 168 C ASN A 12 0.682 9.878 -7.650 1.00 0.00 C ATOM 169 O ASN A 12 1.081 10.016 -8.805 1.00 0.00 O ATOM 170 CB ASN A 12 2.838 9.700 -6.447 1.00 0.00 C ATOM 171 CG ASN A 12 3.786 8.783 -5.671 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.517 7.613 -5.449 1.00 0.00 O ATOM 173 ND2 ASN A 12 4.906 9.377 -5.270 1.00 0.00 N ATOM 0 H ASN A 12 2.372 7.575 -7.859 1.00 0.00 H new ATOM 0 HA ASN A 12 0.959 8.972 -5.692 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.275 9.945 -7.415 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.712 10.639 -5.907 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.602 8.850 -4.743 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.069 10.360 -5.489 1.00 0.00 H new ATOM 180 N ASN A 13 -0.426 10.422 -7.169 1.00 0.00 N ATOM 181 CA ASN A 13 -1.279 11.248 -8.005 1.00 0.00 C ATOM 182 C ASN A 13 -0.688 12.657 -8.093 1.00 0.00 C ATOM 183 O ASN A 13 -1.049 13.430 -8.979 1.00 0.00 O ATOM 184 CB ASN A 13 -2.685 11.362 -7.414 1.00 0.00 C ATOM 185 CG ASN A 13 -3.715 10.673 -8.312 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.184 11.220 -9.296 1.00 0.00 O ATOM 187 ND2 ASN A 13 -4.038 9.444 -7.920 1.00 0.00 N ATOM 0 H ASN A 13 -0.753 10.306 -6.210 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.338 10.784 -8.990 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.704 10.912 -6.421 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.948 12.413 -7.293 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.716 8.900 -8.454 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.608 9.045 -7.086 1.00 0.00 H new ATOM 194 N SER A 14 0.211 12.946 -7.164 1.00 0.00 N ATOM 195 CA SER A 14 0.854 14.248 -7.126 1.00 0.00 C ATOM 196 C SER A 14 2.043 14.272 -8.089 1.00 0.00 C ATOM 197 O SER A 14 2.318 15.294 -8.716 1.00 0.00 O ATOM 198 CB SER A 14 1.314 14.595 -5.709 1.00 0.00 C ATOM 199 OG SER A 14 2.733 14.559 -5.583 1.00 0.00 O ATOM 0 H SER A 14 0.509 12.301 -6.432 1.00 0.00 H new ATOM 0 HA SER A 14 0.126 14.997 -7.437 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.952 15.588 -5.444 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.870 13.894 -5.002 1.00 0.00 H new ATOM 0 HG SER A 14 2.986 14.788 -4.664 1.00 0.00 H new ATOM 205 N ASN A 15 2.716 13.134 -8.176 1.00 0.00 N ATOM 206 CA ASN A 15 3.869 13.011 -9.053 1.00 0.00 C ATOM 207 C ASN A 15 3.524 12.078 -10.215 1.00 0.00 C ATOM 208 O ASN A 15 4.338 11.873 -11.113 1.00 0.00 O ATOM 209 CB ASN A 15 5.066 12.417 -8.308 1.00 0.00 C ATOM 210 CG ASN A 15 6.384 12.932 -8.890 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.447 13.446 -9.995 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.432 12.766 -8.088 1.00 0.00 N ATOM 0 H ASN A 15 2.485 12.289 -7.654 1.00 0.00 H new ATOM 0 HA ASN A 15 4.127 14.007 -9.413 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.006 12.675 -7.251 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.036 11.329 -8.373 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.357 13.077 -8.386 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.311 12.328 -7.175 1.00 0.00 H new ATOM 219 N GLY A 16 2.316 11.536 -10.158 1.00 0.00 N ATOM 220 CA GLY A 16 1.854 10.629 -11.194 1.00 0.00 C ATOM 221 C GLY A 16 2.829 9.464 -11.379 1.00 0.00 C ATOM 222 O GLY A 16 2.866 8.843 -12.440 1.00 0.00 O ATOM 0 H GLY A 16 1.644 11.708 -9.410 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.868 10.245 -10.932 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.746 11.170 -12.134 1.00 0.00 H new ATOM 226 N VAL A 17 3.594 9.203 -10.330 1.00 0.00 N ATOM 227 CA VAL A 17 4.567 8.125 -10.362 1.00 0.00 C ATOM 228 C VAL A 17 3.907 6.833 -9.875 1.00 0.00 C ATOM 229 O VAL A 17 3.419 6.768 -8.749 1.00 0.00 O ATOM 230 CB VAL A 17 5.803 8.509 -9.546 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.586 7.266 -9.118 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.695 9.478 -10.324 1.00 0.00 C ATOM 0 H VAL A 17 3.560 9.720 -9.451 1.00 0.00 H new ATOM 0 HA VAL A 17 4.910 7.951 -11.382 1.00 0.00 H new ATOM 0 HB VAL A 17 5.463 9.018 -8.644 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.459 7.567 -8.540 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.949 6.627 -8.507 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.909 6.717 -10.003 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.566 9.735 -9.721 1.00 0.00 H new ATOM 0 HG22 VAL A 17 7.021 9.007 -11.251 1.00 0.00 H new ATOM 0 HG23 VAL A 17 6.134 10.384 -10.555 1.00 0.00 H new ATOM 242 N SER A 18 3.914 5.837 -10.749 1.00 0.00 N ATOM 243 CA SER A 18 3.321 4.551 -10.422 1.00 0.00 C ATOM 244 C SER A 18 4.420 3.520 -10.161 1.00 0.00 C ATOM 245 O SER A 18 5.448 3.516 -10.838 1.00 0.00 O ATOM 246 CB SER A 18 2.398 4.069 -11.544 1.00 0.00 C ATOM 247 OG SER A 18 2.610 4.787 -12.755 1.00 0.00 O ATOM 0 H SER A 18 4.321 5.894 -11.683 1.00 0.00 H new ATOM 0 HA SER A 18 2.721 4.670 -9.520 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.565 3.006 -11.719 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.360 4.182 -11.233 1.00 0.00 H new ATOM 0 HG SER A 18 2.003 4.449 -13.446 1.00 0.00 H new ATOM 253 N VAL A 19 4.168 2.670 -9.176 1.00 0.00 N ATOM 254 CA VAL A 19 5.124 1.637 -8.816 1.00 0.00 C ATOM 255 C VAL A 19 4.379 0.453 -8.197 1.00 0.00 C ATOM 256 O VAL A 19 3.648 0.615 -7.220 1.00 0.00 O ATOM 257 CB VAL A 19 6.198 2.215 -7.892 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.697 1.161 -6.903 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.357 2.802 -8.700 1.00 0.00 C ATOM 0 H VAL A 19 3.315 2.676 -8.616 1.00 0.00 H new ATOM 0 HA VAL A 19 5.641 1.270 -9.703 1.00 0.00 H new ATOM 0 HB VAL A 19 5.746 3.024 -7.318 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.459 1.599 -6.259 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.864 0.811 -6.293 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.124 0.321 -7.451 1.00 0.00 H new ATOM 0 HG21 VAL A 19 8.107 3.206 -8.020 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.806 2.020 -9.312 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.985 3.598 -9.344 1.00 0.00 H new ATOM 269 N ASP A 20 4.589 -0.714 -8.790 1.00 0.00 N ATOM 270 CA ASP A 20 3.946 -1.925 -8.309 1.00 0.00 C ATOM 271 C ASP A 20 5.016 -2.916 -7.848 1.00 0.00 C ATOM 272 O ASP A 20 6.107 -2.967 -8.415 1.00 0.00 O ATOM 273 CB ASP A 20 3.130 -2.593 -9.418 1.00 0.00 C ATOM 274 CG ASP A 20 2.812 -1.696 -10.616 1.00 0.00 C ATOM 275 OD1 ASP A 20 2.682 -0.473 -10.392 1.00 0.00 O ATOM 276 OD2 ASP A 20 2.706 -2.254 -11.730 1.00 0.00 O ATOM 0 H ASP A 20 5.196 -0.846 -9.599 1.00 0.00 H new ATOM 0 HA ASP A 20 3.283 -1.652 -7.488 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.675 -3.468 -9.773 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.193 -2.952 -8.993 1.00 0.00 H new ATOM 281 N TYR A 21 4.667 -3.679 -6.822 1.00 0.00 N ATOM 282 CA TYR A 21 5.584 -4.665 -6.277 1.00 0.00 C ATOM 283 C TYR A 21 4.846 -5.952 -5.904 1.00 0.00 C ATOM 284 O TYR A 21 3.849 -5.915 -5.184 1.00 0.00 O ATOM 285 CB TYR A 21 6.170 -4.041 -5.009 1.00 0.00 C ATOM 286 CG TYR A 21 7.565 -3.444 -5.197 1.00 0.00 C ATOM 287 CD1 TYR A 21 7.753 -2.387 -6.065 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.638 -3.960 -4.499 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.066 -1.824 -6.242 1.00 0.00 C ATOM 290 CE2 TYR A 21 9.952 -3.398 -4.676 1.00 0.00 C ATOM 291 CZ TYR A 21 10.101 -2.357 -5.539 1.00 0.00 C ATOM 292 OH TYR A 21 11.341 -1.826 -5.707 1.00 0.00 O ATOM 0 H TYR A 21 3.762 -3.634 -6.354 1.00 0.00 H new ATOM 0 HA TYR A 21 6.350 -4.922 -7.008 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.496 -3.260 -4.656 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.213 -4.801 -4.229 1.00 0.00 H new ATOM 0 HD1 TYR A 21 6.914 -1.982 -6.612 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.492 -4.786 -3.819 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.226 -0.997 -6.918 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.800 -3.794 -4.136 1.00 0.00 H new ATOM 0 HH TYR A 21 11.381 -0.946 -5.278 1.00 0.00 H new ATOM 302 N GLU A 22 5.365 -7.062 -6.409 1.00 0.00 N ATOM 303 CA GLU A 22 4.767 -8.359 -6.138 1.00 0.00 C ATOM 304 C GLU A 22 5.441 -9.011 -4.930 1.00 0.00 C ATOM 305 O GLU A 22 6.614 -9.377 -4.992 1.00 0.00 O ATOM 306 CB GLU A 22 4.845 -9.266 -7.367 1.00 0.00 C ATOM 307 CG GLU A 22 4.366 -10.680 -7.035 1.00 0.00 C ATOM 308 CD GLU A 22 4.750 -11.664 -8.143 1.00 0.00 C ATOM 309 OE1 GLU A 22 5.947 -11.676 -8.502 1.00 0.00 O ATOM 310 OE2 GLU A 22 3.836 -12.381 -8.607 1.00 0.00 O ATOM 0 H GLU A 22 6.193 -7.090 -7.004 1.00 0.00 H new ATOM 0 HA GLU A 22 3.713 -8.211 -5.904 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.235 -8.851 -8.169 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.871 -9.302 -7.732 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.802 -11.003 -6.090 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.284 -10.680 -6.903 1.00 0.00 H new ATOM 317 N THR A 23 4.671 -9.138 -3.859 1.00 0.00 N ATOM 318 CA THR A 23 5.180 -9.740 -2.639 1.00 0.00 C ATOM 319 C THR A 23 4.130 -10.667 -2.024 1.00 0.00 C ATOM 320 O THR A 23 2.990 -10.261 -1.805 1.00 0.00 O ATOM 321 CB THR A 23 5.619 -8.613 -1.702 1.00 0.00 C ATOM 322 OG1 THR A 23 6.642 -9.203 -0.904 1.00 0.00 O ATOM 323 CG2 THR A 23 4.532 -8.233 -0.695 1.00 0.00 C ATOM 0 H THR A 23 3.698 -8.834 -3.811 1.00 0.00 H new ATOM 0 HA THR A 23 6.046 -10.370 -2.841 1.00 0.00 H new ATOM 0 HB THR A 23 5.891 -7.737 -2.290 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.985 -8.540 -0.269 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.895 -7.429 -0.054 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.642 -7.898 -1.229 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.283 -9.100 -0.083 1.00 0.00 H new ATOM 331 N GLU A 24 4.552 -11.896 -1.763 1.00 0.00 N ATOM 332 CA GLU A 24 3.661 -12.884 -1.177 1.00 0.00 C ATOM 333 C GLU A 24 3.720 -12.812 0.350 1.00 0.00 C ATOM 334 O GLU A 24 4.609 -13.395 0.969 1.00 0.00 O ATOM 335 CB GLU A 24 4.002 -14.291 -1.673 1.00 0.00 C ATOM 336 CG GLU A 24 3.550 -15.351 -0.667 1.00 0.00 C ATOM 337 CD GLU A 24 2.152 -15.037 -0.129 1.00 0.00 C ATOM 338 OE1 GLU A 24 1.442 -14.269 -0.812 1.00 0.00 O ATOM 339 OE2 GLU A 24 1.827 -15.572 0.952 1.00 0.00 O ATOM 0 H GLU A 24 5.498 -12.230 -1.946 1.00 0.00 H new ATOM 0 HA GLU A 24 2.642 -12.659 -1.493 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.520 -14.468 -2.635 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.077 -14.373 -1.835 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.548 -16.332 -1.143 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.259 -15.399 0.159 1.00 0.00 H new ATOM 346 N THR A 25 2.760 -12.093 0.914 1.00 0.00 N ATOM 347 CA THR A 25 2.691 -11.938 2.357 1.00 0.00 C ATOM 348 C THR A 25 1.260 -12.157 2.849 1.00 0.00 C ATOM 349 O THR A 25 0.371 -11.358 2.559 1.00 0.00 O ATOM 350 CB THR A 25 3.251 -10.558 2.711 1.00 0.00 C ATOM 351 OG1 THR A 25 2.728 -9.701 1.700 1.00 0.00 O ATOM 352 CG2 THR A 25 4.768 -10.476 2.522 1.00 0.00 C ATOM 0 H THR A 25 2.024 -11.612 0.398 1.00 0.00 H new ATOM 0 HA THR A 25 3.294 -12.690 2.865 1.00 0.00 H new ATOM 0 HB THR A 25 3.000 -10.319 3.744 1.00 0.00 H new ATOM 0 HG1 THR A 25 3.040 -8.785 1.854 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.114 -9.477 2.787 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.255 -11.211 3.164 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.017 -10.682 1.481 1.00 0.00 H new ATOM 360 N PRO A 26 1.076 -13.273 3.604 1.00 0.00 N ATOM 361 CA PRO A 26 -0.233 -13.607 4.139 1.00 0.00 C ATOM 362 C PRO A 26 -0.587 -12.706 5.323 1.00 0.00 C ATOM 363 O PRO A 26 -1.236 -11.675 5.151 1.00 0.00 O ATOM 364 CB PRO A 26 -0.139 -15.077 4.518 1.00 0.00 C ATOM 365 CG PRO A 26 1.346 -15.388 4.616 1.00 0.00 C ATOM 366 CD PRO A 26 2.106 -14.242 3.967 1.00 0.00 C ATOM 0 HA PRO A 26 -1.036 -13.445 3.420 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.642 -15.269 5.466 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.621 -15.705 3.769 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.644 -15.502 5.658 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.573 -16.329 4.115 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.832 -13.809 4.655 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.659 -14.580 3.090 1.00 0.00 H new ATOM 374 N MET A 27 -0.146 -13.127 6.500 1.00 0.00 N ATOM 375 CA MET A 27 -0.409 -12.371 7.712 1.00 0.00 C ATOM 376 C MET A 27 0.455 -11.109 7.770 1.00 0.00 C ATOM 377 O MET A 27 0.071 -10.117 8.386 1.00 0.00 O ATOM 378 CB MET A 27 -0.118 -13.246 8.933 1.00 0.00 C ATOM 379 CG MET A 27 -1.028 -14.475 8.957 1.00 0.00 C ATOM 380 SD MET A 27 -1.906 -14.555 10.507 1.00 0.00 S ATOM 381 CE MET A 27 -3.580 -14.718 9.908 1.00 0.00 C ATOM 0 H MET A 27 0.392 -13.982 6.639 1.00 0.00 H new ATOM 0 HA MET A 27 -1.457 -12.071 7.710 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.925 -13.562 8.918 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.262 -12.665 9.844 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.737 -14.429 8.130 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.435 -15.379 8.818 1.00 0.00 H new ATOM 0 HE1 MET A 27 -4.265 -14.781 10.754 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.835 -13.850 9.299 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.664 -15.622 9.305 1.00 0.00 H new ATOM 391 N THR A 28 1.605 -11.188 7.118 1.00 0.00 N ATOM 392 CA THR A 28 2.528 -10.066 7.087 1.00 0.00 C ATOM 393 C THR A 28 1.806 -8.797 6.627 1.00 0.00 C ATOM 394 O THR A 28 2.166 -7.693 7.033 1.00 0.00 O ATOM 395 CB THR A 28 3.710 -10.449 6.196 1.00 0.00 C ATOM 396 OG1 THR A 28 3.342 -11.715 5.655 1.00 0.00 O ATOM 397 CG2 THR A 28 4.978 -10.744 7.000 1.00 0.00 C ATOM 0 H THR A 28 1.919 -12.012 6.606 1.00 0.00 H new ATOM 0 HA THR A 28 2.913 -9.843 8.082 1.00 0.00 H new ATOM 0 HB THR A 28 3.907 -9.643 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.053 -12.037 5.063 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.787 -11.011 6.319 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.261 -9.860 7.571 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.791 -11.572 7.683 1.00 0.00 H new ATOM 405 N LEU A 29 0.802 -8.997 5.787 1.00 0.00 N ATOM 406 CA LEU A 29 0.028 -7.882 5.268 1.00 0.00 C ATOM 407 C LEU A 29 -0.574 -7.098 6.435 1.00 0.00 C ATOM 408 O LEU A 29 -0.665 -5.872 6.382 1.00 0.00 O ATOM 409 CB LEU A 29 -1.010 -8.376 4.258 1.00 0.00 C ATOM 410 CG LEU A 29 -0.495 -8.646 2.843 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.465 -9.539 2.067 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.204 -7.338 2.105 1.00 0.00 C ATOM 0 H LEU A 29 0.506 -9.914 5.453 1.00 0.00 H new ATOM 0 HA LEU A 29 0.671 -7.194 4.719 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.454 -9.294 4.643 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.809 -7.637 4.197 1.00 0.00 H new ATOM 0 HG LEU A 29 0.448 -9.187 2.921 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.075 -9.715 1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.577 -10.491 2.585 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.435 -9.048 1.997 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.161 -7.560 1.102 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.118 -6.748 2.037 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.553 -6.774 2.650 1.00 0.00 H new ATOM 424 N LEU A 30 -0.970 -7.835 7.461 1.00 0.00 N ATOM 425 CA LEU A 30 -1.560 -7.224 8.639 1.00 0.00 C ATOM 426 C LEU A 30 -0.452 -6.623 9.507 1.00 0.00 C ATOM 427 O LEU A 30 -0.681 -5.652 10.227 1.00 0.00 O ATOM 428 CB LEU A 30 -2.444 -8.231 9.380 1.00 0.00 C ATOM 429 CG LEU A 30 -3.420 -9.030 8.514 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.278 -9.962 9.374 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.272 -8.102 7.648 1.00 0.00 C ATOM 0 H LEU A 30 -0.894 -8.851 7.501 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.220 -6.405 8.353 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.798 -8.933 9.907 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.016 -7.694 10.137 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.841 -9.658 7.837 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.963 -10.519 8.735 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.633 -10.659 9.909 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.849 -9.372 10.091 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.957 -8.696 7.043 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.843 -7.430 8.288 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.624 -7.517 6.995 1.00 0.00 H new ATOM 443 N VAL A 31 0.724 -7.225 9.409 1.00 0.00 N ATOM 444 CA VAL A 31 1.867 -6.761 10.175 1.00 0.00 C ATOM 445 C VAL A 31 2.171 -5.309 9.801 1.00 0.00 C ATOM 446 O VAL A 31 2.196 -4.960 8.622 1.00 0.00 O ATOM 447 CB VAL A 31 3.058 -7.697 9.957 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.291 -7.200 10.713 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.708 -9.132 10.357 1.00 0.00 C ATOM 0 H VAL A 31 0.910 -8.030 8.811 1.00 0.00 H new ATOM 0 HA VAL A 31 1.646 -6.782 11.242 1.00 0.00 H new ATOM 0 HB VAL A 31 3.296 -7.696 8.893 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.123 -7.883 10.541 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.559 -6.205 10.358 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.071 -7.157 11.780 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.571 -9.777 10.192 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.431 -9.159 11.411 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.872 -9.484 9.753 1.00 0.00 H new ATOM 459 N PRO A 32 2.402 -4.480 10.855 1.00 0.00 N ATOM 460 CA PRO A 32 2.704 -3.074 10.649 1.00 0.00 C ATOM 461 C PRO A 32 4.137 -2.889 10.145 1.00 0.00 C ATOM 462 O PRO A 32 4.379 -2.109 9.224 1.00 0.00 O ATOM 463 CB PRO A 32 2.459 -2.418 11.997 1.00 0.00 C ATOM 464 CG PRO A 32 2.479 -3.543 13.019 1.00 0.00 C ATOM 465 CD PRO A 32 2.381 -4.858 12.264 1.00 0.00 C ATOM 0 HA PRO A 32 2.081 -2.618 9.880 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.228 -1.678 12.216 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.502 -1.896 12.009 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.396 -3.508 13.608 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.648 -3.440 13.717 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.213 -5.518 12.509 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.465 -5.392 12.517 1.00 0.00 H new ATOM 473 N GLU A 33 5.048 -3.618 10.770 1.00 0.00 N ATOM 474 CA GLU A 33 6.451 -3.543 10.398 1.00 0.00 C ATOM 475 C GLU A 33 6.630 -3.924 8.926 1.00 0.00 C ATOM 476 O GLU A 33 7.411 -3.298 8.211 1.00 0.00 O ATOM 477 CB GLU A 33 7.307 -4.434 11.301 1.00 0.00 C ATOM 478 CG GLU A 33 6.852 -4.334 12.758 1.00 0.00 C ATOM 479 CD GLU A 33 8.025 -4.556 13.715 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.741 -3.564 13.974 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.179 -5.711 14.167 1.00 0.00 O ATOM 0 H GLU A 33 4.843 -4.264 11.532 1.00 0.00 H new ATOM 0 HA GLU A 33 6.788 -2.515 10.532 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.241 -5.469 10.966 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.354 -4.140 11.222 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.411 -3.354 12.939 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.075 -5.073 12.952 1.00 0.00 H new ATOM 488 N VAL A 34 5.893 -4.946 8.518 1.00 0.00 N ATOM 489 CA VAL A 34 5.959 -5.416 7.145 1.00 0.00 C ATOM 490 C VAL A 34 5.173 -4.461 6.244 1.00 0.00 C ATOM 491 O VAL A 34 5.637 -4.097 5.164 1.00 0.00 O ATOM 492 CB VAL A 34 5.463 -6.861 7.061 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.494 -7.368 5.618 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.276 -7.774 7.982 1.00 0.00 C ATOM 0 H VAL A 34 5.247 -5.462 9.115 1.00 0.00 H new ATOM 0 HA VAL A 34 6.991 -5.420 6.793 1.00 0.00 H new ATOM 0 HB VAL A 34 4.427 -6.881 7.400 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.137 -8.397 5.586 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.852 -6.742 4.998 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.515 -7.327 5.240 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.903 -8.795 7.903 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.325 -7.747 7.687 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.179 -7.431 9.012 1.00 0.00 H new ATOM 504 N ALA A 35 3.997 -4.081 6.722 1.00 0.00 N ATOM 505 CA ALA A 35 3.142 -3.176 5.974 1.00 0.00 C ATOM 506 C ALA A 35 3.864 -1.839 5.786 1.00 0.00 C ATOM 507 O ALA A 35 3.873 -1.283 4.689 1.00 0.00 O ATOM 508 CB ALA A 35 1.805 -3.020 6.699 1.00 0.00 C ATOM 0 H ALA A 35 3.616 -4.384 7.619 1.00 0.00 H new ATOM 0 HA ALA A 35 2.930 -3.579 4.984 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.164 -2.341 6.137 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.320 -3.993 6.781 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.977 -2.615 7.696 1.00 0.00 H new ATOM 514 N ALA A 36 4.450 -1.361 6.874 1.00 0.00 N ATOM 515 CA ALA A 36 5.171 -0.101 6.843 1.00 0.00 C ATOM 516 C ALA A 36 6.309 -0.194 5.824 1.00 0.00 C ATOM 517 O ALA A 36 6.468 0.692 4.984 1.00 0.00 O ATOM 518 CB ALA A 36 5.675 0.235 8.249 1.00 0.00 C ATOM 0 H ALA A 36 4.440 -1.824 7.783 1.00 0.00 H new ATOM 0 HA ALA A 36 4.512 0.709 6.530 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.216 1.181 8.225 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.827 0.319 8.929 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.341 -0.555 8.595 1.00 0.00 H new ATOM 524 N GLU A 37 7.068 -1.273 5.930 1.00 0.00 N ATOM 525 CA GLU A 37 8.186 -1.494 5.027 1.00 0.00 C ATOM 526 C GLU A 37 7.689 -1.605 3.584 1.00 0.00 C ATOM 527 O GLU A 37 8.369 -1.170 2.655 1.00 0.00 O ATOM 528 CB GLU A 37 8.980 -2.738 5.430 1.00 0.00 C ATOM 529 CG GLU A 37 10.484 -2.462 5.398 1.00 0.00 C ATOM 530 CD GLU A 37 11.122 -3.050 4.137 1.00 0.00 C ATOM 531 OE1 GLU A 37 10.773 -2.558 3.043 1.00 0.00 O ATOM 532 OE2 GLU A 37 11.944 -3.978 4.297 1.00 0.00 O ATOM 0 H GLU A 37 6.932 -2.005 6.627 1.00 0.00 H new ATOM 0 HA GLU A 37 8.857 -0.638 5.095 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.686 -3.053 6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.743 -3.560 4.754 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.661 -1.387 5.432 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.955 -2.891 6.282 1.00 0.00 H new ATOM 539 N VAL A 38 6.508 -2.186 3.442 1.00 0.00 N ATOM 540 CA VAL A 38 5.912 -2.359 2.128 1.00 0.00 C ATOM 541 C VAL A 38 5.492 -0.995 1.580 1.00 0.00 C ATOM 542 O VAL A 38 5.857 -0.631 0.463 1.00 0.00 O ATOM 543 CB VAL A 38 4.753 -3.356 2.206 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.605 -2.933 1.287 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.226 -4.773 1.878 1.00 0.00 C ATOM 0 H VAL A 38 5.947 -2.543 4.215 1.00 0.00 H new ATOM 0 HA VAL A 38 6.638 -2.779 1.432 1.00 0.00 H new ATOM 0 HB VAL A 38 4.379 -3.357 3.230 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.794 -3.658 1.361 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.242 -1.950 1.587 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.960 -2.889 0.257 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.383 -5.462 1.941 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.638 -4.795 0.869 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.994 -5.074 2.590 1.00 0.00 H new ATOM 555 N ILE A 39 4.728 -0.276 2.391 1.00 0.00 N ATOM 556 CA ILE A 39 4.255 1.040 2.001 1.00 0.00 C ATOM 557 C ILE A 39 5.454 1.958 1.755 1.00 0.00 C ATOM 558 O ILE A 39 5.476 2.710 0.782 1.00 0.00 O ATOM 559 CB ILE A 39 3.268 1.584 3.037 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.005 0.721 3.096 1.00 0.00 C ATOM 561 CG2 ILE A 39 2.945 3.055 2.769 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.093 1.002 1.900 1.00 0.00 C ATOM 0 H ILE A 39 4.426 -0.581 3.316 1.00 0.00 H new ATOM 0 HA ILE A 39 3.700 0.982 1.065 1.00 0.00 H new ATOM 0 HB ILE A 39 3.740 1.533 4.018 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.281 -0.333 3.108 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.467 0.920 4.023 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.242 3.416 3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.861 3.643 2.818 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.501 3.155 1.778 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.203 0.376 1.966 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.799 2.052 1.905 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.626 0.779 0.976 1.00 0.00 H new ATOM 574 N LYS A 40 6.423 1.866 2.654 1.00 0.00 N ATOM 575 CA LYS A 40 7.624 2.678 2.546 1.00 0.00 C ATOM 576 C LYS A 40 8.469 2.177 1.373 1.00 0.00 C ATOM 577 O LYS A 40 9.024 2.974 0.618 1.00 0.00 O ATOM 578 CB LYS A 40 8.375 2.702 3.879 1.00 0.00 C ATOM 579 CG LYS A 40 9.886 2.777 3.656 1.00 0.00 C ATOM 580 CD LYS A 40 10.524 1.391 3.760 1.00 0.00 C ATOM 581 CE LYS A 40 11.979 1.419 3.287 1.00 0.00 C ATOM 582 NZ LYS A 40 12.825 2.151 4.255 1.00 0.00 N ATOM 0 H LYS A 40 6.401 1.242 3.460 1.00 0.00 H new ATOM 0 HA LYS A 40 7.365 3.715 2.333 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.048 3.558 4.469 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.133 1.808 4.453 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.092 3.203 2.674 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.334 3.444 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.480 1.043 4.792 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.957 0.680 3.160 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.349 0.400 3.169 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.040 1.895 2.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.809 2.160 3.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.481 3.128 4.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.780 1.680 5.181 1.00 0.00 H new ATOM 596 N ASP A 41 8.542 0.859 1.258 1.00 0.00 N ATOM 597 CA ASP A 41 9.311 0.244 0.189 1.00 0.00 C ATOM 598 C ASP A 41 8.796 0.747 -1.160 1.00 0.00 C ATOM 599 O ASP A 41 9.583 1.100 -2.037 1.00 0.00 O ATOM 600 CB ASP A 41 9.166 -1.279 0.213 1.00 0.00 C ATOM 601 CG ASP A 41 9.605 -1.992 -1.067 1.00 0.00 C ATOM 602 OD1 ASP A 41 10.782 -1.805 -1.445 1.00 0.00 O ATOM 603 OD2 ASP A 41 8.755 -2.706 -1.640 1.00 0.00 O ATOM 0 H ASP A 41 8.082 0.200 1.887 1.00 0.00 H new ATOM 0 HA ASP A 41 10.359 0.509 0.332 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.748 -1.671 1.047 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.123 -1.526 0.409 1.00 0.00 H new ATOM 608 N LEU A 42 7.476 0.761 -1.285 1.00 0.00 N ATOM 609 CA LEU A 42 6.846 1.216 -2.513 1.00 0.00 C ATOM 610 C LEU A 42 7.196 2.687 -2.746 1.00 0.00 C ATOM 611 O LEU A 42 7.680 3.051 -3.817 1.00 0.00 O ATOM 612 CB LEU A 42 5.342 0.938 -2.477 1.00 0.00 C ATOM 613 CG LEU A 42 4.912 -0.476 -2.870 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.187 -1.170 -1.715 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.068 -0.459 -4.147 1.00 0.00 C ATOM 0 H LEU A 42 6.826 0.465 -0.556 1.00 0.00 H new ATOM 0 HA LEU A 42 7.229 0.659 -3.368 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.979 1.140 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.846 1.645 -3.142 1.00 0.00 H new ATOM 0 HG LEU A 42 5.809 -1.057 -3.084 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.892 -2.174 -2.021 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.852 -1.234 -0.854 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.299 -0.597 -1.446 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.776 -1.477 -4.404 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.175 0.145 -3.985 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.651 -0.032 -4.963 1.00 0.00 H new ATOM 627 N VAL A 43 6.935 3.492 -1.728 1.00 0.00 N ATOM 628 CA VAL A 43 7.215 4.916 -1.808 1.00 0.00 C ATOM 629 C VAL A 43 8.712 5.124 -2.049 1.00 0.00 C ATOM 630 O VAL A 43 9.103 5.943 -2.879 1.00 0.00 O ATOM 631 CB VAL A 43 6.708 5.622 -0.550 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.660 6.743 -0.129 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.288 6.154 -0.753 1.00 0.00 C ATOM 0 H VAL A 43 6.532 3.186 -0.842 1.00 0.00 H new ATOM 0 HA VAL A 43 6.685 5.362 -2.649 1.00 0.00 H new ATOM 0 HB VAL A 43 6.678 4.889 0.256 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.276 7.229 0.768 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.645 6.325 0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.738 7.475 -0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.952 6.651 0.157 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.280 6.865 -1.579 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.618 5.325 -0.982 1.00 0.00 H new ATOM 643 N ASN A 44 9.508 4.367 -1.308 1.00 0.00 N ATOM 644 CA ASN A 44 10.953 4.458 -1.431 1.00 0.00 C ATOM 645 C ASN A 44 11.355 4.199 -2.883 1.00 0.00 C ATOM 646 O ASN A 44 12.275 4.833 -3.399 1.00 0.00 O ATOM 647 CB ASN A 44 11.647 3.413 -0.554 1.00 0.00 C ATOM 648 CG ASN A 44 12.215 4.052 0.715 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.314 4.706 1.441 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.394 3.956 1.015 1.00 0.00 N flip ATOM 0 H ASN A 44 9.180 3.688 -0.621 1.00 0.00 H new ATOM 0 HA ASN A 44 11.256 5.455 -1.112 1.00 0.00 H new ATOM 0 HB2 ASN A 44 10.938 2.630 -0.285 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.450 2.937 -1.116 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.033 3.438 0.412 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.740 4.393 1.869 1.00 0.00 H new ATOM 657 N THR A 45 10.646 3.266 -3.503 1.00 0.00 N ATOM 658 CA THR A 45 10.917 2.916 -4.887 1.00 0.00 C ATOM 659 C THR A 45 10.469 4.042 -5.820 1.00 0.00 C ATOM 660 O THR A 45 11.164 4.371 -6.780 1.00 0.00 O ATOM 661 CB THR A 45 10.235 1.578 -5.178 1.00 0.00 C ATOM 662 OG1 THR A 45 11.023 0.625 -4.470 1.00 0.00 O ATOM 663 CG2 THR A 45 10.370 1.159 -6.643 1.00 0.00 C ATOM 0 H THR A 45 9.884 2.742 -3.072 1.00 0.00 H new ATOM 0 HA THR A 45 11.986 2.798 -5.063 1.00 0.00 H new ATOM 0 HB THR A 45 9.179 1.644 -4.915 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.724 0.581 -3.538 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.869 0.203 -6.796 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.912 1.915 -7.281 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.425 1.060 -6.897 1.00 0.00 H new ATOM 925 N LYS B 203 -2.974 18.036 -7.144 1.00 0.00 N ATOM 926 CA LYS B 203 -3.306 17.587 -5.803 1.00 0.00 C ATOM 927 C LYS B 203 -2.312 16.507 -5.371 1.00 0.00 C ATOM 928 O LYS B 203 -1.724 15.827 -6.211 1.00 0.00 O ATOM 929 CB LYS B 203 -4.767 17.141 -5.733 1.00 0.00 C ATOM 930 CG LYS B 203 -5.377 17.473 -4.370 1.00 0.00 C ATOM 931 CD LYS B 203 -6.904 17.541 -4.453 1.00 0.00 C ATOM 932 CE LYS B 203 -7.395 18.985 -4.341 1.00 0.00 C ATOM 933 NZ LYS B 203 -7.918 19.250 -2.982 1.00 0.00 N ATOM 0 HA LYS B 203 -3.214 18.409 -5.093 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.339 17.632 -6.521 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.832 16.068 -5.913 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.082 16.717 -3.642 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.986 18.427 -4.015 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.240 17.111 -5.397 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.342 16.941 -3.655 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.578 19.672 -4.563 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -8.175 19.169 -5.080 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.247 20.235 -2.923 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.711 18.607 -2.784 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -7.164 19.095 -2.283 1.00 0.00 H new ATOM 947 N ALA B 204 -2.155 16.382 -4.061 1.00 0.00 N ATOM 948 CA ALA B 204 -1.243 15.395 -3.508 1.00 0.00 C ATOM 949 C ALA B 204 -2.043 14.198 -2.992 1.00 0.00 C ATOM 950 O ALA B 204 -2.718 14.293 -1.967 1.00 0.00 O ATOM 951 CB ALA B 204 -0.393 16.044 -2.412 1.00 0.00 C ATOM 0 H ALA B 204 -2.644 16.948 -3.367 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.562 15.029 -4.277 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.291 15.304 -1.997 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.179 16.870 -2.836 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -1.043 16.421 -1.622 1.00 0.00 H new ATOM 957 N THR B 205 -1.943 13.100 -3.726 1.00 0.00 N ATOM 958 CA THR B 205 -2.650 11.886 -3.355 1.00 0.00 C ATOM 959 C THR B 205 -1.845 10.653 -3.769 1.00 0.00 C ATOM 960 O THR B 205 -0.899 10.758 -4.548 1.00 0.00 O ATOM 961 CB THR B 205 -4.044 11.940 -3.983 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.811 12.408 -5.308 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.927 13.023 -3.357 1.00 0.00 C ATOM 0 H THR B 205 -1.383 13.025 -4.576 1.00 0.00 H new ATOM 0 HA THR B 205 -2.767 11.811 -2.274 1.00 0.00 H new ATOM 0 HB THR B 205 -4.527 10.969 -3.875 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.663 12.471 -5.787 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.905 13.019 -3.839 1.00 0.00 H new ATOM 0 HG22 THR B 205 -5.046 12.824 -2.292 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.459 13.998 -3.494 1.00 0.00 H new ATOM 971 N TYR B 206 -2.251 9.512 -3.230 1.00 0.00 N ATOM 972 CA TYR B 206 -1.578 8.260 -3.533 1.00 0.00 C ATOM 973 C TYR B 206 -2.592 7.138 -3.769 1.00 0.00 C ATOM 974 O TYR B 206 -3.618 7.071 -3.095 1.00 0.00 O ATOM 975 CB TYR B 206 -0.739 7.922 -2.301 1.00 0.00 C ATOM 976 CG TYR B 206 0.737 8.302 -2.430 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.140 9.600 -2.190 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.666 7.346 -2.786 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.530 9.957 -2.311 1.00 0.00 C ATOM 980 CE2 TYR B 206 3.056 7.703 -2.909 1.00 0.00 C ATOM 981 CZ TYR B 206 3.419 8.991 -2.664 1.00 0.00 C ATOM 982 OH TYR B 206 4.731 9.328 -2.780 1.00 0.00 O ATOM 0 H TYR B 206 -3.037 9.429 -2.586 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.974 8.357 -4.435 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.161 8.433 -1.436 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.812 6.852 -2.106 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.413 10.348 -1.911 1.00 0.00 H new ATOM 0 HD2 TYR B 206 1.351 6.330 -2.972 1.00 0.00 H new ATOM 0 HE1 TYR B 206 2.859 10.969 -2.126 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.793 6.965 -3.189 1.00 0.00 H new ATOM 0 HH TYR B 206 5.211 9.056 -1.970 1.00 0.00 H new ATOM 992 N THR B 207 -2.268 6.284 -4.729 1.00 0.00 N ATOM 993 CA THR B 207 -3.136 5.167 -5.062 1.00 0.00 C ATOM 994 C THR B 207 -2.462 3.841 -4.704 1.00 0.00 C ATOM 995 O THR B 207 -1.525 3.416 -5.378 1.00 0.00 O ATOM 996 CB THR B 207 -3.505 5.280 -6.542 1.00 0.00 C ATOM 997 OG1 THR B 207 -3.789 6.666 -6.725 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.826 4.583 -6.872 1.00 0.00 C ATOM 0 H THR B 207 -1.416 6.343 -5.287 1.00 0.00 H new ATOM 0 HA THR B 207 -4.057 5.195 -4.479 1.00 0.00 H new ATOM 0 HB THR B 207 -2.707 4.851 -7.148 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.036 6.829 -7.659 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.040 4.694 -7.935 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.750 3.524 -6.626 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.630 5.034 -6.291 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.964 3.226 -3.644 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.422 1.957 -3.188 1.00 0.00 C ATOM 1008 C VAL B 208 -3.451 0.851 -3.431 1.00 0.00 C ATOM 1009 O VAL B 208 -4.522 0.850 -2.827 1.00 0.00 O ATOM 1010 CB VAL B 208 -1.998 2.066 -1.722 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.678 0.688 -1.140 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.810 3.017 -1.565 1.00 0.00 C ATOM 0 H VAL B 208 -3.741 3.583 -3.087 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.527 1.699 -3.754 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.835 2.480 -1.161 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.379 0.794 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.562 0.053 -1.202 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.865 0.234 -1.706 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.528 3.077 -0.514 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.034 2.644 -2.146 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.088 4.008 -1.923 1.00 0.00 H new ATOM 1022 N THR B 209 -3.090 -0.063 -4.319 1.00 0.00 N ATOM 1023 CA THR B 209 -3.967 -1.173 -4.651 1.00 0.00 C ATOM 1024 C THR B 209 -3.417 -2.479 -4.075 1.00 0.00 C ATOM 1025 O THR B 209 -2.216 -2.600 -3.838 1.00 0.00 O ATOM 1026 CB THR B 209 -4.139 -1.203 -6.171 1.00 0.00 C ATOM 1027 OG1 THR B 209 -4.551 0.121 -6.500 1.00 0.00 O ATOM 1028 CG2 THR B 209 -5.313 -2.080 -6.611 1.00 0.00 C ATOM 0 H THR B 209 -2.201 -0.058 -4.819 1.00 0.00 H new ATOM 0 HA THR B 209 -4.952 -1.046 -4.201 1.00 0.00 H new ATOM 0 HB THR B 209 -3.222 -1.568 -6.633 1.00 0.00 H new ATOM 0 HG1 THR B 209 -4.684 0.191 -7.468 1.00 0.00 H new ATOM 0 HG21 THR B 209 -5.390 -2.066 -7.698 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.150 -3.103 -6.272 1.00 0.00 H new ATOM 0 HG23 THR B 209 -6.236 -1.697 -6.177 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.321 -3.425 -3.867 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.942 -4.718 -3.324 1.00 0.00 C ATOM 1038 C VAL B 210 -4.723 -5.819 -4.044 1.00 0.00 C ATOM 1039 O VAL B 210 -5.947 -5.887 -3.936 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.149 -4.730 -1.809 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.384 -6.154 -1.299 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.968 -4.078 -1.088 1.00 0.00 C ATOM 0 H VAL B 210 -5.316 -3.321 -4.065 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.882 -4.908 -3.495 1.00 0.00 H new ATOM 0 HB VAL B 210 -5.041 -4.143 -1.589 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.528 -6.134 -0.219 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.272 -6.570 -1.776 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.520 -6.773 -1.538 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.141 -4.100 -0.012 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -2.054 -4.624 -1.319 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.866 -3.044 -1.418 1.00 0.00 H new ATOM 1052 N THR B 211 -3.985 -6.651 -4.763 1.00 0.00 N ATOM 1053 CA THR B 211 -4.594 -7.746 -5.499 1.00 0.00 C ATOM 1054 C THR B 211 -4.112 -9.090 -4.953 1.00 0.00 C ATOM 1055 O THR B 211 -2.910 -9.320 -4.831 1.00 0.00 O ATOM 1056 CB THR B 211 -4.285 -7.545 -6.984 1.00 0.00 C ATOM 1057 OG1 THR B 211 -4.798 -6.248 -7.274 1.00 0.00 O ATOM 1058 CG2 THR B 211 -5.099 -8.479 -7.883 1.00 0.00 C ATOM 0 H THR B 211 -2.971 -6.589 -4.852 1.00 0.00 H new ATOM 0 HA THR B 211 -5.677 -7.753 -5.375 1.00 0.00 H new ATOM 0 HB THR B 211 -3.222 -7.709 -7.159 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.638 -6.036 -8.217 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.842 -8.295 -8.926 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.873 -9.515 -7.631 1.00 0.00 H new ATOM 0 HG23 THR B 211 -6.162 -8.293 -7.733 1.00 0.00 H new ATOM 1066 N ASN B 212 -5.074 -9.946 -4.640 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.762 -11.262 -4.110 1.00 0.00 C ATOM 1068 C ASN B 212 -4.771 -12.282 -5.251 1.00 0.00 C ATOM 1069 O ASN B 212 -5.832 -12.636 -5.763 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.803 -11.700 -3.077 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.757 -13.215 -2.862 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -4.706 -13.819 -2.730 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.955 -13.793 -2.835 1.00 0.00 N ATOM 0 H ASN B 212 -6.070 -9.753 -4.743 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.782 -11.211 -3.636 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -5.620 -11.189 -2.132 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -6.798 -11.406 -3.411 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.032 -14.801 -2.697 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.796 -13.228 -2.952 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.577 -12.725 -5.614 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.433 -13.697 -6.685 1.00 0.00 C ATOM 1082 C ASN B 213 -3.939 -15.058 -6.204 1.00 0.00 C ATOM 1083 O ASN B 213 -4.149 -15.966 -7.007 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.968 -13.855 -7.094 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.736 -13.343 -8.517 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.990 -14.023 -9.498 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -1.241 -12.109 -8.574 1.00 0.00 N ATOM 0 H ASN B 213 -2.700 -12.429 -5.186 1.00 0.00 H new ATOM 0 HA ASN B 213 -4.009 -13.343 -7.540 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -1.332 -13.307 -6.399 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.680 -14.904 -7.030 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -1.051 -11.677 -9.478 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -1.051 -11.595 -7.713 1.00 0.00 H new ATOM 1094 N SER B 214 -4.120 -15.157 -4.895 1.00 0.00 N ATOM 1095 CA SER B 214 -4.599 -16.392 -4.297 1.00 0.00 C ATOM 1096 C SER B 214 -6.043 -16.657 -4.725 1.00 0.00 C ATOM 1097 O SER B 214 -6.407 -17.793 -5.024 1.00 0.00 O ATOM 1098 CB SER B 214 -4.497 -16.340 -2.772 1.00 0.00 C ATOM 1099 OG SER B 214 -4.359 -17.638 -2.201 1.00 0.00 O ATOM 0 H SER B 214 -3.944 -14.402 -4.232 1.00 0.00 H new ATOM 0 HA SER B 214 -3.969 -17.209 -4.649 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.643 -15.726 -2.487 1.00 0.00 H new ATOM 0 HB3 SER B 214 -5.386 -15.858 -2.366 1.00 0.00 H new ATOM 0 HG SER B 214 -4.295 -17.561 -1.226 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.827 -15.588 -4.740 1.00 0.00 N ATOM 1106 CA ASN B 215 -8.223 -15.690 -5.126 1.00 0.00 C ATOM 1107 C ASN B 215 -8.471 -14.827 -6.365 1.00 0.00 C ATOM 1108 O ASN B 215 -9.568 -14.831 -6.920 1.00 0.00 O ATOM 1109 CB ASN B 215 -9.142 -15.190 -4.010 1.00 0.00 C ATOM 1110 CG ASN B 215 -10.566 -15.720 -4.191 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -11.435 -14.804 -4.607 1.00 0.00 O flip ATOM 1112 ND2 ASN B 215 -10.856 -16.884 -3.968 1.00 0.00 N flip ATOM 0 H ASN B 215 -6.521 -14.647 -4.491 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.440 -16.739 -5.329 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -8.752 -15.509 -3.043 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -9.154 -14.100 -4.005 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -10.139 -17.536 -3.650 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -11.815 -17.205 -4.099 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.432 -14.107 -6.762 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.522 -13.240 -7.924 1.00 0.00 C ATOM 1121 C GLY B 216 -8.360 -11.997 -7.618 1.00 0.00 C ATOM 1122 O GLY B 216 -8.862 -11.341 -8.529 1.00 0.00 O ATOM 0 H GLY B 216 -6.523 -14.107 -6.299 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.522 -12.940 -8.237 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.966 -13.786 -8.756 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.486 -11.710 -6.330 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.254 -10.557 -5.892 1.00 0.00 C ATOM 1128 C VAL B 217 -8.384 -9.303 -5.988 1.00 0.00 C ATOM 1129 O VAL B 217 -7.174 -9.365 -5.772 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.801 -10.798 -4.483 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -9.907 -9.486 -3.704 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -11.153 -11.515 -4.535 1.00 0.00 C ATOM 0 H VAL B 217 -8.069 -12.256 -5.576 1.00 0.00 H new ATOM 0 HA VAL B 217 -10.117 -10.404 -6.541 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.098 -11.444 -3.957 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.298 -9.686 -2.706 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -8.920 -9.031 -3.622 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -10.578 -8.805 -4.227 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.520 -11.674 -3.521 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.867 -10.905 -5.088 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -11.036 -12.477 -5.034 1.00 0.00 H new ATOM 1142 N SER B 218 -9.033 -8.195 -6.312 1.00 0.00 N ATOM 1143 CA SER B 218 -8.333 -6.928 -6.440 1.00 0.00 C ATOM 1144 C SER B 218 -9.042 -5.853 -5.614 1.00 0.00 C ATOM 1145 O SER B 218 -10.251 -5.928 -5.396 1.00 0.00 O ATOM 1146 CB SER B 218 -8.239 -6.495 -7.904 1.00 0.00 C ATOM 1147 OG SER B 218 -7.527 -5.271 -8.054 1.00 0.00 O ATOM 0 H SER B 218 -10.036 -8.148 -6.490 1.00 0.00 H new ATOM 0 HA SER B 218 -7.319 -7.059 -6.062 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.744 -7.275 -8.482 1.00 0.00 H new ATOM 0 HB3 SER B 218 -9.243 -6.383 -8.314 1.00 0.00 H new ATOM 0 HG SER B 218 -6.587 -5.408 -7.814 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.261 -4.876 -5.175 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.799 -3.788 -4.378 1.00 0.00 C ATOM 1155 C VAL B 219 -7.884 -2.568 -4.505 1.00 0.00 C ATOM 1156 O VAL B 219 -6.667 -2.683 -4.369 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.989 -4.244 -2.931 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -8.944 -3.054 -1.970 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.293 -5.028 -2.770 1.00 0.00 C ATOM 0 H VAL B 219 -7.259 -4.816 -5.357 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.783 -3.496 -4.745 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.164 -4.910 -2.679 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.082 -3.406 -0.948 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -7.979 -2.554 -2.055 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -9.739 -2.352 -2.222 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.404 -5.341 -1.732 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -11.135 -4.395 -3.050 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -10.270 -5.908 -3.413 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.504 -1.426 -4.764 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.761 -0.187 -4.911 1.00 0.00 C ATOM 1171 C ASP B 220 -8.257 0.825 -3.875 1.00 0.00 C ATOM 1172 O ASP B 220 -9.448 0.881 -3.577 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.969 0.419 -6.300 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.566 -0.534 -7.338 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.720 -0.962 -7.117 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.856 -0.811 -8.329 1.00 0.00 O ATOM 0 H ASP B 220 -9.514 -1.333 -4.876 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.703 -0.409 -4.769 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.622 1.287 -6.207 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -7.009 0.780 -6.670 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.315 1.600 -3.355 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.641 2.606 -2.359 1.00 0.00 C ATOM 1183 C TYR B 221 -6.833 3.885 -2.587 1.00 0.00 C ATOM 1184 O TYR B 221 -5.609 3.837 -2.704 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.251 2.004 -1.008 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.417 1.369 -0.248 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.370 2.169 0.347 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.516 -0.005 -0.159 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.468 1.571 1.062 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.613 -0.603 0.555 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.535 0.214 1.130 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.572 -0.350 1.805 1.00 0.00 O ATOM 0 H TYR B 221 -6.327 1.551 -3.605 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.698 2.868 -2.410 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.481 1.249 -1.167 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.809 2.784 -0.388 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -9.293 3.244 0.277 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.770 -0.631 -0.625 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -11.221 2.186 1.533 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.702 -1.677 0.632 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.251 -1.129 2.306 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.549 4.998 -2.644 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.914 6.287 -2.856 1.00 0.00 C ATOM 1204 C GLU B 222 -6.923 7.104 -1.562 1.00 0.00 C ATOM 1205 O GLU B 222 -7.986 7.479 -1.069 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.594 7.053 -3.993 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.832 8.338 -4.321 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.192 8.849 -5.718 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -6.937 8.094 -6.681 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -7.716 9.982 -5.790 1.00 0.00 O ATOM 0 H GLU B 222 -8.564 5.034 -2.547 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.877 6.115 -3.146 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.648 6.422 -4.880 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.619 7.295 -3.711 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.065 9.102 -3.579 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.759 8.154 -4.263 1.00 0.00 H new ATOM 1217 N THR B 223 -5.728 7.354 -1.049 1.00 0.00 N ATOM 1218 CA THR B 223 -5.586 8.118 0.179 1.00 0.00 C ATOM 1219 C THR B 223 -4.419 9.101 0.062 1.00 0.00 C ATOM 1220 O THR B 223 -3.358 8.753 -0.453 1.00 0.00 O ATOM 1221 CB THR B 223 -5.434 7.129 1.337 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.524 7.945 2.503 1.00 0.00 O ATOM 1223 CG2 THR B 223 -4.030 6.526 1.411 1.00 0.00 C ATOM 0 H THR B 223 -4.849 7.041 -1.461 1.00 0.00 H new ATOM 0 HA THR B 223 -6.468 8.729 0.369 1.00 0.00 H new ATOM 0 HB THR B 223 -6.167 6.329 1.231 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.437 7.384 3.302 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.976 5.832 2.249 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.813 5.994 0.485 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.299 7.322 1.552 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.656 10.310 0.549 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.638 11.347 0.506 1.00 0.00 C ATOM 1233 C GLU B 224 -2.771 11.291 1.765 1.00 0.00 C ATOM 1234 O GLU B 224 -3.117 11.880 2.788 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.270 12.730 0.336 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.023 13.148 1.601 1.00 0.00 C ATOM 1237 CD GLU B 224 -6.346 13.831 1.251 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -6.425 14.373 0.128 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -7.248 13.797 2.115 1.00 0.00 O ATOM 0 H GLU B 224 -5.538 10.595 0.975 1.00 0.00 H new ATOM 0 HA GLU B 224 -3.000 11.167 -0.359 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.495 13.463 0.111 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -4.955 12.719 -0.512 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.215 12.272 2.221 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -4.404 13.826 2.190 1.00 0.00 H new ATOM 1246 N THR B 225 -1.659 10.579 1.649 1.00 0.00 N ATOM 1247 CA THR B 225 -0.740 10.439 2.765 1.00 0.00 C ATOM 1248 C THR B 225 0.702 10.646 2.297 1.00 0.00 C ATOM 1249 O THR B 225 1.263 9.797 1.606 1.00 0.00 O ATOM 1250 CB THR B 225 -0.980 9.072 3.407 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.899 8.158 2.316 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.411 8.910 3.923 1.00 0.00 C ATOM 0 H THR B 225 -1.374 10.093 0.799 1.00 0.00 H new ATOM 0 HA THR B 225 -0.916 11.204 3.521 1.00 0.00 H new ATOM 0 HB THR B 225 -0.280 8.929 4.230 1.00 0.00 H new ATOM 0 HG1 THR B 225 -1.041 7.245 2.643 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.527 7.922 4.369 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.616 9.673 4.674 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.111 9.019 3.095 1.00 0.00 H new ATOM 1260 N PRO B 226 1.277 11.810 2.703 1.00 0.00 N ATOM 1261 CA PRO B 226 2.642 12.141 2.333 1.00 0.00 C ATOM 1262 C PRO B 226 3.645 11.321 3.149 1.00 0.00 C ATOM 1263 O PRO B 226 4.136 10.293 2.685 1.00 0.00 O ATOM 1264 CB PRO B 226 2.764 13.636 2.572 1.00 0.00 C ATOM 1265 CG PRO B 226 1.619 14.006 3.500 1.00 0.00 C ATOM 1266 CD PRO B 226 0.643 12.840 3.522 1.00 0.00 C ATOM 0 HA PRO B 226 2.867 11.898 1.294 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.726 13.882 3.022 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.700 14.188 1.634 1.00 0.00 H new ATOM 0 HG2 PRO B 226 1.992 14.211 4.504 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.123 14.913 3.153 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.471 12.487 4.539 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.327 13.128 3.116 1.00 0.00 H new ATOM 1274 N MET B 227 3.917 11.806 4.352 1.00 0.00 N ATOM 1275 CA MET B 227 4.852 11.131 5.236 1.00 0.00 C ATOM 1276 C MET B 227 4.221 9.880 5.849 1.00 0.00 C ATOM 1277 O MET B 227 4.921 8.921 6.169 1.00 0.00 O ATOM 1278 CB MET B 227 5.278 12.087 6.352 1.00 0.00 C ATOM 1279 CG MET B 227 5.664 13.455 5.786 1.00 0.00 C ATOM 1280 SD MET B 227 5.172 14.745 6.917 1.00 0.00 S ATOM 1281 CE MET B 227 3.442 14.347 7.107 1.00 0.00 C ATOM 0 H MET B 227 3.507 12.658 4.735 1.00 0.00 H new ATOM 0 HA MET B 227 5.721 10.828 4.653 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.464 12.202 7.067 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.122 11.663 6.896 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.740 13.498 5.619 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.185 13.606 4.819 1.00 0.00 H new ATOM 0 HE1 MET B 227 2.857 15.267 7.126 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.117 13.728 6.271 1.00 0.00 H new ATOM 0 HE3 MET B 227 3.294 13.803 8.040 1.00 0.00 H new ATOM 1291 N THR B 228 2.905 9.930 5.993 1.00 0.00 N ATOM 1292 CA THR B 228 2.171 8.811 6.561 1.00 0.00 C ATOM 1293 C THR B 228 2.541 7.511 5.844 1.00 0.00 C ATOM 1294 O THR B 228 2.640 6.458 6.471 1.00 0.00 O ATOM 1295 CB THR B 228 0.679 9.140 6.492 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.615 10.285 5.646 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.125 9.634 7.830 1.00 0.00 C ATOM 0 H THR B 228 2.328 10.728 5.726 1.00 0.00 H new ATOM 0 HA THR B 228 2.436 8.655 7.607 1.00 0.00 H new ATOM 0 HB THR B 228 0.127 8.255 6.175 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.319 10.565 5.545 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.938 9.853 7.725 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.263 8.863 8.588 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.654 10.538 8.131 1.00 0.00 H new ATOM 1305 N LEU B 229 2.735 7.628 4.539 1.00 0.00 N ATOM 1306 CA LEU B 229 3.092 6.475 3.729 1.00 0.00 C ATOM 1307 C LEU B 229 4.300 5.773 4.353 1.00 0.00 C ATOM 1308 O LEU B 229 4.393 4.547 4.322 1.00 0.00 O ATOM 1309 CB LEU B 229 3.306 6.890 2.271 1.00 0.00 C ATOM 1310 CG LEU B 229 2.040 7.046 1.425 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.311 7.905 0.188 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.455 5.681 1.059 1.00 0.00 C ATOM 0 H LEU B 229 2.652 8.503 4.022 1.00 0.00 H new ATOM 0 HA LEU B 229 2.276 5.752 3.714 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.846 7.837 2.259 1.00 0.00 H new ATOM 0 HB3 LEU B 229 3.949 6.150 1.794 1.00 0.00 H new ATOM 0 HG LEU B 229 1.291 7.568 2.021 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.396 8.001 -0.396 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.648 8.894 0.499 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.082 7.433 -0.421 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.556 5.820 0.458 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.189 5.112 0.488 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.202 5.137 1.969 1.00 0.00 H new ATOM 1324 N LEU B 230 5.193 6.580 4.903 1.00 0.00 N ATOM 1325 CA LEU B 230 6.392 6.053 5.534 1.00 0.00 C ATOM 1326 C LEU B 230 6.052 5.577 6.948 1.00 0.00 C ATOM 1327 O LEU B 230 6.744 4.726 7.504 1.00 0.00 O ATOM 1328 CB LEU B 230 7.521 7.084 5.486 1.00 0.00 C ATOM 1329 CG LEU B 230 7.728 7.790 4.145 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.978 8.672 4.177 1.00 0.00 C ATOM 1331 CD2 LEU B 230 7.767 6.783 2.994 1.00 0.00 C ATOM 0 H LEU B 230 5.111 7.596 4.925 1.00 0.00 H new ATOM 0 HA LEU B 230 6.761 5.186 4.986 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.328 7.841 6.246 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.452 6.587 5.760 1.00 0.00 H new ATOM 0 HG LEU B 230 6.875 8.446 3.970 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.102 9.162 3.211 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.871 9.427 4.956 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.853 8.056 4.386 1.00 0.00 H new ATOM 0 HD21 LEU B 230 7.915 7.312 2.053 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.588 6.083 3.150 1.00 0.00 H new ATOM 0 HD23 LEU B 230 6.825 6.235 2.958 1.00 0.00 H new ATOM 1343 N VAL B 231 4.985 6.148 7.489 1.00 0.00 N ATOM 1344 CA VAL B 231 4.545 5.792 8.828 1.00 0.00 C ATOM 1345 C VAL B 231 4.033 4.351 8.826 1.00 0.00 C ATOM 1346 O VAL B 231 3.306 3.947 7.919 1.00 0.00 O ATOM 1347 CB VAL B 231 3.501 6.798 9.318 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.988 6.420 10.710 1.00 0.00 C ATOM 1349 CG2 VAL B 231 4.062 8.221 9.308 1.00 0.00 C ATOM 0 H VAL B 231 4.413 6.854 7.025 1.00 0.00 H new ATOM 0 HA VAL B 231 5.378 5.839 9.530 1.00 0.00 H new ATOM 0 HB VAL B 231 2.657 6.767 8.629 1.00 0.00 H new ATOM 0 HG11 VAL B 231 2.247 7.150 11.036 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.531 5.431 10.673 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.820 6.409 11.414 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.299 8.915 9.661 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.932 8.274 9.963 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.355 8.489 8.293 1.00 0.00 H new ATOM 1359 N PRO B 232 4.442 3.595 9.879 1.00 0.00 N ATOM 1360 CA PRO B 232 4.032 2.206 10.008 1.00 0.00 C ATOM 1361 C PRO B 232 2.574 2.104 10.457 1.00 0.00 C ATOM 1362 O PRO B 232 1.813 1.293 9.931 1.00 0.00 O ATOM 1363 CB PRO B 232 5.005 1.600 11.006 1.00 0.00 C ATOM 1364 CG PRO B 232 5.627 2.773 11.747 1.00 0.00 C ATOM 1365 CD PRO B 232 5.303 4.039 10.971 1.00 0.00 C ATOM 0 HA PRO B 232 4.067 1.668 9.061 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.491 0.931 11.696 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.768 1.010 10.498 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.233 2.836 12.761 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.706 2.642 11.831 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.798 4.771 11.601 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.208 4.514 10.593 1.00 0.00 H new ATOM 1373 N GLU B 233 2.226 2.940 11.425 1.00 0.00 N ATOM 1374 CA GLU B 233 0.872 2.955 11.951 1.00 0.00 C ATOM 1375 C GLU B 233 -0.127 3.276 10.837 1.00 0.00 C ATOM 1376 O GLU B 233 -1.241 2.755 10.827 1.00 0.00 O ATOM 1377 CB GLU B 233 0.743 3.949 13.106 1.00 0.00 C ATOM 1378 CG GLU B 233 1.981 3.908 14.005 1.00 0.00 C ATOM 1379 CD GLU B 233 1.662 4.440 15.403 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.528 4.183 15.863 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.558 5.093 15.981 1.00 0.00 O ATOM 0 H GLU B 233 2.859 3.612 11.859 1.00 0.00 H new ATOM 0 HA GLU B 233 0.644 1.963 12.342 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.609 4.956 12.711 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.145 3.716 13.693 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.349 2.884 14.077 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.778 4.503 13.559 1.00 0.00 H new ATOM 1388 N VAL B 234 0.308 4.134 9.925 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.533 4.532 8.810 1.00 0.00 C ATOM 1390 C VAL B 234 -0.452 3.470 7.711 1.00 0.00 C ATOM 1391 O VAL B 234 -1.473 3.056 7.165 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.135 5.927 8.325 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -0.886 6.297 7.043 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.364 6.974 9.416 1.00 0.00 C ATOM 0 H VAL B 234 1.233 4.564 9.936 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.575 4.597 9.122 1.00 0.00 H new ATOM 0 HB VAL B 234 0.931 5.910 8.096 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.585 7.293 6.720 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.650 5.575 6.262 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -1.959 6.287 7.234 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.073 7.956 9.044 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.419 6.988 9.691 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.236 6.725 10.291 1.00 0.00 H new ATOM 1404 N ALA B 235 0.774 3.060 7.419 1.00 0.00 N ATOM 1405 CA ALA B 235 1.002 2.055 6.395 1.00 0.00 C ATOM 1406 C ALA B 235 0.381 0.729 6.840 1.00 0.00 C ATOM 1407 O ALA B 235 -0.262 0.043 6.048 1.00 0.00 O ATOM 1408 CB ALA B 235 2.503 1.933 6.125 1.00 0.00 C ATOM 0 H ALA B 235 1.619 3.406 7.874 1.00 0.00 H new ATOM 0 HA ALA B 235 0.524 2.346 5.459 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.674 1.179 5.357 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.891 2.893 5.784 1.00 0.00 H new ATOM 0 HB3 ALA B 235 3.015 1.640 7.042 1.00 0.00 H new ATOM 1414 N ALA B 236 0.596 0.407 8.108 1.00 0.00 N ATOM 1415 CA ALA B 236 0.066 -0.824 8.668 1.00 0.00 C ATOM 1416 C ALA B 236 -1.450 -0.861 8.463 1.00 0.00 C ATOM 1417 O ALA B 236 -1.993 -1.864 8.003 1.00 0.00 O ATOM 1418 CB ALA B 236 0.456 -0.924 10.144 1.00 0.00 C ATOM 0 H ALA B 236 1.130 0.978 8.763 1.00 0.00 H new ATOM 0 HA ALA B 236 0.490 -1.690 8.159 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.058 -1.848 10.564 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.542 -0.923 10.234 1.00 0.00 H new ATOM 0 HB3 ALA B 236 0.046 -0.073 10.687 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.090 0.245 8.814 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.533 0.351 8.674 1.00 0.00 C ATOM 1426 C GLU B 237 -3.923 0.349 7.194 1.00 0.00 C ATOM 1427 O GLU B 237 -4.958 -0.202 6.823 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.061 1.602 9.379 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.140 1.387 10.891 1.00 0.00 C ATOM 1430 CD GLU B 237 -4.982 2.477 11.558 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -4.476 3.618 11.629 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -6.111 2.146 11.979 1.00 0.00 O ATOM 0 H GLU B 237 -1.636 1.075 9.195 1.00 0.00 H new ATOM 0 HA GLU B 237 -3.991 -0.515 9.152 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.409 2.448 9.162 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -5.049 1.853 8.992 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.573 0.409 11.100 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -3.136 1.388 11.315 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.075 0.972 6.390 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.319 1.049 4.960 1.00 0.00 C ATOM 1441 C VAL B 238 -3.230 -0.354 4.355 1.00 0.00 C ATOM 1442 O VAL B 238 -4.100 -0.759 3.586 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.347 2.040 4.316 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.983 1.605 2.894 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.923 3.457 4.325 1.00 0.00 C ATOM 0 H VAL B 238 -2.218 1.428 6.702 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.323 1.425 4.764 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.433 2.046 4.909 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.291 2.326 2.459 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.512 0.622 2.923 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.886 1.556 2.286 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.212 4.142 3.862 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.859 3.473 3.767 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.109 3.768 5.353 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.170 -1.058 4.727 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.956 -2.406 4.230 1.00 0.00 C ATOM 1457 C ILE B 239 -3.068 -3.319 4.751 1.00 0.00 C ATOM 1458 O ILE B 239 -3.707 -4.030 3.976 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.548 -2.890 4.583 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.515 -2.036 3.890 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.384 -4.377 4.267 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.613 -2.383 2.403 1.00 0.00 C ATOM 0 H ILE B 239 -1.451 -0.720 5.366 1.00 0.00 H new ATOM 0 HA ILE B 239 -2.011 -2.424 3.142 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.406 -2.772 5.657 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.270 -0.980 4.005 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.482 -2.193 4.368 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.626 -4.695 4.527 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.106 -4.954 4.845 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.554 -4.544 3.203 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.376 -1.762 1.934 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.882 -3.433 2.291 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.349 -2.201 1.923 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.267 -3.268 6.060 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.291 -4.081 6.694 1.00 0.00 C ATOM 1476 C LYS B 240 -5.664 -3.677 6.153 1.00 0.00 C ATOM 1477 O LYS B 240 -6.502 -4.533 5.872 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.180 -3.993 8.217 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.561 -4.047 8.872 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.090 -2.639 9.155 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.573 -2.674 9.526 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.761 -2.307 10.947 1.00 0.00 N ATOM 0 H LYS B 240 -2.736 -2.676 6.699 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.148 -5.133 6.448 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.565 -4.813 8.588 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.678 -3.067 8.496 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.256 -4.576 8.220 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.504 -4.612 9.803 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.519 -2.189 9.967 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.946 -2.009 8.277 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.129 -1.985 8.890 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.976 -3.671 9.345 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.774 -2.336 11.182 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.246 -2.980 11.550 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.395 -1.347 11.109 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.852 -2.372 6.022 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.109 -1.844 5.520 1.00 0.00 C ATOM 1498 C ASP B 241 -7.379 -2.417 4.127 1.00 0.00 C ATOM 1499 O ASP B 241 -8.496 -2.837 3.831 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.058 -0.319 5.401 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.199 0.306 4.596 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -8.187 0.124 3.361 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -9.058 0.951 5.237 1.00 0.00 O ATOM 0 H ASP B 241 -5.155 -1.665 6.255 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.896 -2.126 6.220 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.064 0.109 6.403 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.111 -0.037 4.940 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.336 -2.417 3.311 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.447 -2.932 1.957 1.00 0.00 C ATOM 1510 C LEU B 242 -6.743 -4.432 2.009 1.00 0.00 C ATOM 1511 O LEU B 242 -7.695 -4.902 1.388 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.198 -2.580 1.145 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.197 -1.205 0.477 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.077 -0.324 1.034 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.121 -1.335 -1.046 1.00 0.00 C ATOM 0 H LEU B 242 -5.410 -2.069 3.561 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.281 -2.459 1.438 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.332 -2.642 1.803 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.066 -3.337 0.372 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.140 -0.712 0.711 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.100 0.648 0.541 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.218 -0.191 2.107 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.114 -0.801 0.852 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.122 -0.342 -1.496 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.205 -1.858 -1.321 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -5.982 -1.898 -1.407 1.00 0.00 H new ATOM 1527 N VAL B 243 -5.910 -5.142 2.755 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.070 -6.579 2.897 1.00 0.00 C ATOM 1529 C VAL B 243 -7.448 -6.877 3.493 1.00 0.00 C ATOM 1530 O VAL B 243 -8.140 -7.789 3.043 1.00 0.00 O ATOM 1531 CB VAL B 243 -4.922 -7.155 3.726 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.407 -8.309 4.608 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.765 -7.601 2.829 1.00 0.00 C ATOM 0 H VAL B 243 -5.121 -4.748 3.268 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.024 -7.067 1.923 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.553 -6.364 4.380 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.571 -8.701 5.187 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.181 -7.949 5.286 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.815 -9.101 3.980 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -2.962 -8.006 3.445 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.115 -8.368 2.138 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.392 -6.747 2.264 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.805 -6.092 4.499 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.087 -6.260 5.162 1.00 0.00 C ATOM 1545 C ASN B 244 -10.208 -6.157 4.127 1.00 0.00 C ATOM 1546 O ASN B 244 -11.211 -6.864 4.220 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.311 -5.170 6.212 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.074 -5.713 7.623 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.851 -6.198 7.819 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -9.945 -5.693 8.478 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.228 -5.337 4.871 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.090 -7.235 5.649 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.639 -4.333 6.022 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.328 -4.786 6.132 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.864 -5.306 8.261 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.754 -6.063 9.409 1.00 0.00 H new ATOM 1557 N THR B 245 -10.002 -5.270 3.163 1.00 0.00 N ATOM 1558 CA THR B 245 -10.984 -5.065 2.113 1.00 0.00 C ATOM 1559 C THR B 245 -10.994 -6.256 1.153 1.00 0.00 C ATOM 1560 O THR B 245 -12.057 -6.746 0.775 1.00 0.00 O ATOM 1561 CB THR B 245 -10.671 -3.734 1.426 1.00 0.00 C ATOM 1562 OG1 THR B 245 -10.922 -2.758 2.433 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.672 -3.396 0.320 1.00 0.00 C ATOM 0 H THR B 245 -9.169 -4.686 3.088 1.00 0.00 H new ATOM 0 HA THR B 245 -11.993 -5.007 2.521 1.00 0.00 H new ATOM 0 HB THR B 245 -9.666 -3.769 1.006 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.143 -2.689 3.023 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.404 -2.442 -0.134 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.653 -4.178 -0.439 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.674 -3.327 0.744 1.00 0.00 H new