USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=27 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 -129:sc= 0.636 USER MOD Set 1.2: B 245 THR OG1 : rot 83:sc= 2.23 USER MOD Set 2.1: B 211 THR OG1 : rot 140:sc= -3.58! USER MOD Set 2.2: B 218 SER OG : rot 39:sc= 0.671 USER MOD Set 3.1: A 6 TYR OH : rot 180:sc= -2.43! USER MOD Set 3.2: B 212 ASN : amide:sc= -11.2! C(o=-14!,f=-18!) USER MOD Set 4.1: A 21 TYR OH : rot 73:sc= 0.0932 USER MOD Set 4.2: A 45 THR OG1 : rot 88:sc= 0.326 USER MOD Set 5.1: A 13 ASN : amide:sc= 0.0124 X(o=0.029,f=0) USER MOD Set 5.2: B 207 THR OG1 : rot -170:sc= 0.0162 USER MOD Set 6.1: A 12 ASN : amide:sc= -8.76! C(o=-10!,f=-13!) USER MOD Set 6.2: B 206 TYR OH : rot 180:sc= -1.38! USER MOD Set 7.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: B 213 ASN : amide:sc= 0 X(o=0,f=0.023) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.54! USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.126 USER MOD Single : A 11 THR OG1 : rot 160:sc= -2.18 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= -0.445 X(o=-0.44,f=-0.48) USER MOD Single : A 18 SER OG : rot 180:sc= 0.00533 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.118 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.645 F(o=-1.4!,f=-0.64) USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.69! USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 214 SER OG : rot 42:sc= -0.158 USER MOD Single : B 215 ASN : amide:sc= -0.741 X(o=-0.74,f=-0.42) USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -0.756 USER MOD Single : B 227 MET CE :methyl -134:sc= -1.7 (180deg=-4.63!) USER MOD Single : B 228 THR OG1 : rot 180:sc= 0.0454 USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 ASN :FLIP amide:sc= -1.1 F(o=-1.8,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -0.866 -20.137 -6.378 1.00 0.00 N ATOM 26 CA LYS A 3 0.095 -19.849 -5.326 1.00 0.00 C ATOM 27 C LYS A 3 -0.455 -18.738 -4.429 1.00 0.00 C ATOM 28 O LYS A 3 -1.475 -18.127 -4.747 1.00 0.00 O ATOM 29 CB LYS A 3 1.467 -19.531 -5.926 1.00 0.00 C ATOM 30 CG LYS A 3 2.046 -20.752 -6.645 1.00 0.00 C ATOM 31 CD LYS A 3 1.605 -22.050 -5.964 1.00 0.00 C ATOM 32 CE LYS A 3 2.386 -23.248 -6.508 1.00 0.00 C ATOM 33 NZ LYS A 3 3.624 -23.459 -5.726 1.00 0.00 N ATOM 0 HA LYS A 3 0.243 -20.726 -4.695 1.00 0.00 H new ATOM 0 HB2 LYS A 3 1.378 -18.700 -6.626 1.00 0.00 H new ATOM 0 HB3 LYS A 3 2.148 -19.212 -5.137 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.720 -20.754 -7.685 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.134 -20.692 -6.652 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.758 -21.970 -4.888 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.538 -22.204 -6.124 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.766 -24.143 -6.466 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.635 -23.082 -7.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.141 -24.276 -6.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 4.222 -22.610 -5.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 3.380 -23.639 -4.731 1.00 0.00 H new ATOM 47 N ALA A 4 0.244 -18.511 -3.327 1.00 0.00 N ATOM 48 CA ALA A 4 -0.162 -17.485 -2.382 1.00 0.00 C ATOM 49 C ALA A 4 0.780 -16.285 -2.502 1.00 0.00 C ATOM 50 O ALA A 4 1.830 -16.249 -1.862 1.00 0.00 O ATOM 51 CB ALA A 4 -0.181 -18.071 -0.969 1.00 0.00 C ATOM 0 H ALA A 4 1.089 -19.020 -3.067 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.170 -17.136 -2.605 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.486 -17.301 -0.260 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -0.886 -18.901 -0.929 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.815 -18.429 -0.710 1.00 0.00 H new ATOM 57 N THR A 5 0.371 -15.333 -3.328 1.00 0.00 N ATOM 58 CA THR A 5 1.165 -14.135 -3.541 1.00 0.00 C ATOM 59 C THR A 5 0.269 -12.896 -3.553 1.00 0.00 C ATOM 60 O THR A 5 -0.947 -13.006 -3.702 1.00 0.00 O ATOM 61 CB THR A 5 1.963 -14.320 -4.833 1.00 0.00 C ATOM 62 OG1 THR A 5 0.966 -14.382 -5.851 1.00 0.00 O ATOM 63 CG2 THR A 5 2.654 -15.683 -4.905 1.00 0.00 C ATOM 0 H THR A 5 -0.500 -15.367 -3.858 1.00 0.00 H new ATOM 0 HA THR A 5 1.871 -13.979 -2.725 1.00 0.00 H new ATOM 0 HB THR A 5 2.710 -13.530 -4.914 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.396 -14.500 -6.724 1.00 0.00 H new ATOM 0 HG21 THR A 5 3.206 -15.762 -5.842 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.344 -15.786 -4.067 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.905 -16.474 -4.858 1.00 0.00 H new ATOM 71 N TYR A 6 0.903 -11.744 -3.392 1.00 0.00 N ATOM 72 CA TYR A 6 0.178 -10.485 -3.382 1.00 0.00 C ATOM 73 C TYR A 6 0.917 -9.420 -4.197 1.00 0.00 C ATOM 74 O TYR A 6 2.145 -9.360 -4.177 1.00 0.00 O ATOM 75 CB TYR A 6 0.121 -10.042 -1.919 1.00 0.00 C ATOM 76 CG TYR A 6 -1.248 -10.232 -1.264 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.684 -11.498 -0.932 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.047 -9.137 -1.005 1.00 0.00 C ATOM 79 CE1 TYR A 6 -2.974 -11.677 -0.316 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.335 -9.314 -0.389 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.736 -10.576 -0.074 1.00 0.00 C ATOM 82 OH TYR A 6 -4.953 -10.744 0.508 1.00 0.00 O ATOM 0 H TYR A 6 1.912 -11.656 -3.267 1.00 0.00 H new ATOM 0 HA TYR A 6 -0.813 -10.609 -3.820 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.865 -10.602 -1.351 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.399 -8.990 -1.858 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -1.058 -12.355 -1.134 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.705 -8.146 -1.265 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.328 -12.663 -0.052 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -3.969 -8.465 -0.181 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.385 -9.872 0.620 1.00 0.00 H new ATOM 92 N THR A 7 0.136 -8.607 -4.893 1.00 0.00 N ATOM 93 CA THR A 7 0.701 -7.548 -5.713 1.00 0.00 C ATOM 94 C THR A 7 0.227 -6.180 -5.216 1.00 0.00 C ATOM 95 O THR A 7 -0.941 -5.829 -5.373 1.00 0.00 O ATOM 96 CB THR A 7 0.328 -7.828 -7.169 1.00 0.00 C ATOM 97 OG1 THR A 7 0.689 -9.192 -7.365 1.00 0.00 O ATOM 98 CG2 THR A 7 1.211 -7.063 -8.158 1.00 0.00 C ATOM 0 H THR A 7 -0.883 -8.660 -4.906 1.00 0.00 H new ATOM 0 HA THR A 7 1.788 -7.527 -5.640 1.00 0.00 H new ATOM 0 HB THR A 7 -0.716 -7.561 -7.333 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.479 -9.457 -8.285 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.904 -7.298 -9.177 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.107 -5.992 -7.985 1.00 0.00 H new ATOM 0 HG23 THR A 7 2.252 -7.354 -8.017 1.00 0.00 H new ATOM 106 N VAL A 8 1.160 -5.446 -4.627 1.00 0.00 N ATOM 107 CA VAL A 8 0.853 -4.123 -4.108 1.00 0.00 C ATOM 108 C VAL A 8 1.397 -3.063 -5.067 1.00 0.00 C ATOM 109 O VAL A 8 2.602 -2.998 -5.308 1.00 0.00 O ATOM 110 CB VAL A 8 1.402 -3.980 -2.687 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.342 -2.524 -2.219 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.656 -4.898 -1.716 1.00 0.00 C ATOM 0 H VAL A 8 2.128 -5.742 -4.498 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.226 -3.979 -4.044 1.00 0.00 H new ATOM 0 HB VAL A 8 2.448 -4.285 -2.701 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.738 -2.451 -1.206 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.937 -1.902 -2.887 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.308 -2.181 -2.230 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.066 -4.777 -0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.402 -4.638 -1.709 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.773 -5.934 -2.033 1.00 0.00 H new ATOM 122 N THR A 9 0.482 -2.260 -5.590 1.00 0.00 N ATOM 123 CA THR A 9 0.855 -1.206 -6.518 1.00 0.00 C ATOM 124 C THR A 9 0.636 0.167 -5.882 1.00 0.00 C ATOM 125 O THR A 9 -0.471 0.487 -5.452 1.00 0.00 O ATOM 126 CB THR A 9 0.060 -1.411 -7.810 1.00 0.00 C ATOM 127 OG1 THR A 9 0.342 -2.758 -8.181 1.00 0.00 O ATOM 128 CG2 THR A 9 0.609 -0.581 -8.973 1.00 0.00 C ATOM 0 H THR A 9 -0.516 -2.318 -5.389 1.00 0.00 H new ATOM 0 HA THR A 9 1.917 -1.251 -6.761 1.00 0.00 H new ATOM 0 HB THR A 9 -0.984 -1.150 -7.639 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.135 -2.976 -9.009 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.009 -0.763 -9.865 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.566 0.478 -8.717 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.643 -0.865 -9.167 1.00 0.00 H new ATOM 136 N VAL A 10 1.709 0.943 -5.840 1.00 0.00 N ATOM 137 CA VAL A 10 1.649 2.275 -5.263 1.00 0.00 C ATOM 138 C VAL A 10 1.995 3.308 -6.337 1.00 0.00 C ATOM 139 O VAL A 10 3.057 3.235 -6.953 1.00 0.00 O ATOM 140 CB VAL A 10 2.563 2.356 -4.039 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.980 3.803 -3.761 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.893 1.734 -2.812 1.00 0.00 C ATOM 0 H VAL A 10 2.626 0.674 -6.197 1.00 0.00 H new ATOM 0 HA VAL A 10 0.640 2.495 -4.914 1.00 0.00 H new ATOM 0 HB VAL A 10 3.464 1.783 -4.256 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.629 3.833 -2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.515 4.200 -4.624 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.093 4.408 -3.575 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.564 1.805 -1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.968 2.267 -2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.669 0.686 -3.012 1.00 0.00 H new ATOM 152 N THR A 11 1.079 4.245 -6.528 1.00 0.00 N ATOM 153 CA THR A 11 1.274 5.292 -7.517 1.00 0.00 C ATOM 154 C THR A 11 0.969 6.663 -6.910 1.00 0.00 C ATOM 155 O THR A 11 0.062 6.795 -6.090 1.00 0.00 O ATOM 156 CB THR A 11 0.408 4.960 -8.734 1.00 0.00 C ATOM 157 OG1 THR A 11 0.937 3.726 -9.211 1.00 0.00 O ATOM 158 CG2 THR A 11 0.629 5.934 -9.894 1.00 0.00 C ATOM 0 H THR A 11 0.199 4.302 -6.015 1.00 0.00 H new ATOM 0 HA THR A 11 2.313 5.340 -7.843 1.00 0.00 H new ATOM 0 HB THR A 11 -0.643 4.972 -8.445 1.00 0.00 H new ATOM 0 HG1 THR A 11 0.269 3.279 -9.772 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.009 5.653 -10.732 1.00 0.00 H new ATOM 0 HG22 THR A 11 0.381 6.945 -9.572 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.673 5.898 -10.206 1.00 0.00 H new ATOM 166 N ASN A 12 1.745 7.649 -7.337 1.00 0.00 N ATOM 167 CA ASN A 12 1.569 9.005 -6.845 1.00 0.00 C ATOM 168 C ASN A 12 0.761 9.811 -7.864 1.00 0.00 C ATOM 169 O ASN A 12 1.163 9.942 -9.018 1.00 0.00 O ATOM 170 CB ASN A 12 2.919 9.701 -6.657 1.00 0.00 C ATOM 171 CG ASN A 12 3.884 8.820 -5.861 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.677 7.631 -5.684 1.00 0.00 O ATOM 173 ND2 ASN A 12 4.947 9.468 -5.394 1.00 0.00 N ATOM 0 H ASN A 12 2.496 7.536 -8.018 1.00 0.00 H new ATOM 0 HA ASN A 12 1.053 8.952 -5.887 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.351 9.933 -7.630 1.00 0.00 H new ATOM 0 HB3 ASN A 12 2.774 10.649 -6.139 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.651 8.968 -4.851 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.059 10.465 -5.579 1.00 0.00 H new ATOM 180 N ASN A 13 -0.367 10.329 -7.399 1.00 0.00 N ATOM 181 CA ASN A 13 -1.237 11.118 -8.254 1.00 0.00 C ATOM 182 C ASN A 13 -0.706 12.551 -8.332 1.00 0.00 C ATOM 183 O ASN A 13 -1.099 13.315 -9.211 1.00 0.00 O ATOM 184 CB ASN A 13 -2.660 11.171 -7.694 1.00 0.00 C ATOM 185 CG ASN A 13 -3.638 10.433 -8.611 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.067 10.936 -9.636 1.00 0.00 O ATOM 187 ND2 ASN A 13 -3.965 9.217 -8.185 1.00 0.00 N ATOM 0 H ASN A 13 -0.698 10.217 -6.441 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.254 10.651 -9.239 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.680 10.724 -6.700 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.973 12.209 -7.583 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.612 8.644 -8.726 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.569 8.857 -7.317 1.00 0.00 H new ATOM 194 N SER A 14 0.181 12.871 -7.399 1.00 0.00 N ATOM 195 CA SER A 14 0.770 14.197 -7.352 1.00 0.00 C ATOM 196 C SER A 14 1.950 14.281 -8.322 1.00 0.00 C ATOM 197 O SER A 14 2.178 15.320 -8.939 1.00 0.00 O ATOM 198 CB SER A 14 1.223 14.548 -5.932 1.00 0.00 C ATOM 199 OG SER A 14 2.641 14.515 -5.801 1.00 0.00 O ATOM 0 H SER A 14 0.505 12.234 -6.671 1.00 0.00 H new ATOM 0 HA SER A 14 0.011 14.919 -7.651 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.858 15.541 -5.670 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.777 13.848 -5.226 1.00 0.00 H new ATOM 0 HG SER A 14 2.890 14.746 -4.882 1.00 0.00 H new ATOM 205 N ASN A 15 2.670 13.174 -8.424 1.00 0.00 N ATOM 206 CA ASN A 15 3.821 13.109 -9.308 1.00 0.00 C ATOM 207 C ASN A 15 3.505 12.182 -10.483 1.00 0.00 C ATOM 208 O ASN A 15 4.264 12.117 -11.449 1.00 0.00 O ATOM 209 CB ASN A 15 5.045 12.548 -8.579 1.00 0.00 C ATOM 210 CG ASN A 15 6.292 13.381 -8.881 1.00 0.00 C ATOM 211 OD1 ASN A 15 6.266 14.602 -8.895 1.00 0.00 O ATOM 212 ND2 ASN A 15 7.381 12.657 -9.121 1.00 0.00 N ATOM 0 H ASN A 15 2.479 12.315 -7.909 1.00 0.00 H new ATOM 0 HA ASN A 15 4.038 14.120 -9.653 1.00 0.00 H new ATOM 0 HB2 ASN A 15 4.861 12.539 -7.505 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.211 11.514 -8.882 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.265 13.120 -9.333 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.333 11.639 -9.093 1.00 0.00 H new ATOM 219 N GLY A 16 2.383 11.488 -10.362 1.00 0.00 N ATOM 220 CA GLY A 16 1.958 10.567 -11.403 1.00 0.00 C ATOM 221 C GLY A 16 2.950 9.413 -11.555 1.00 0.00 C ATOM 222 O GLY A 16 3.022 8.785 -12.610 1.00 0.00 O ATOM 0 H GLY A 16 1.756 11.545 -9.560 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.971 10.173 -11.163 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.867 11.100 -12.350 1.00 0.00 H new ATOM 226 N VAL A 17 3.694 9.169 -10.485 1.00 0.00 N ATOM 227 CA VAL A 17 4.681 8.103 -10.486 1.00 0.00 C ATOM 228 C VAL A 17 4.029 6.812 -9.987 1.00 0.00 C ATOM 229 O VAL A 17 3.506 6.765 -8.875 1.00 0.00 O ATOM 230 CB VAL A 17 5.899 8.516 -9.659 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.715 7.293 -9.237 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.767 9.518 -10.423 1.00 0.00 C ATOM 0 H VAL A 17 3.632 9.692 -9.611 1.00 0.00 H new ATOM 0 HA VAL A 17 5.041 7.916 -11.498 1.00 0.00 H new ATOM 0 HB VAL A 17 5.539 9.007 -8.755 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.575 7.615 -8.650 1.00 0.00 H new ATOM 0 HG12 VAL A 17 6.093 6.630 -8.636 1.00 0.00 H new ATOM 0 HG13 VAL A 17 7.059 6.761 -10.124 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.626 9.795 -9.812 1.00 0.00 H new ATOM 0 HG22 VAL A 17 7.113 9.065 -11.352 1.00 0.00 H new ATOM 0 HG23 VAL A 17 6.181 10.409 -10.650 1.00 0.00 H new ATOM 242 N SER A 18 4.083 5.794 -10.834 1.00 0.00 N ATOM 243 CA SER A 18 3.504 4.505 -10.494 1.00 0.00 C ATOM 244 C SER A 18 4.613 3.511 -10.142 1.00 0.00 C ATOM 245 O SER A 18 5.703 3.566 -10.709 1.00 0.00 O ATOM 246 CB SER A 18 2.650 3.964 -11.641 1.00 0.00 C ATOM 247 OG SER A 18 2.845 4.700 -12.846 1.00 0.00 O ATOM 0 H SER A 18 4.519 5.836 -11.755 1.00 0.00 H new ATOM 0 HA SER A 18 2.856 4.639 -9.628 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.896 2.916 -11.813 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.598 4.003 -11.359 1.00 0.00 H new ATOM 0 HG SER A 18 2.283 4.322 -13.555 1.00 0.00 H new ATOM 253 N VAL A 19 4.295 2.625 -9.210 1.00 0.00 N ATOM 254 CA VAL A 19 5.252 1.620 -8.776 1.00 0.00 C ATOM 255 C VAL A 19 4.496 0.389 -8.271 1.00 0.00 C ATOM 256 O VAL A 19 3.651 0.495 -7.385 1.00 0.00 O ATOM 257 CB VAL A 19 6.196 2.213 -7.729 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.756 1.122 -6.815 1.00 0.00 C ATOM 259 CG2 VAL A 19 7.325 3.004 -8.394 1.00 0.00 C ATOM 0 H VAL A 19 3.389 2.582 -8.743 1.00 0.00 H new ATOM 0 HA VAL A 19 5.876 1.300 -9.611 1.00 0.00 H new ATOM 0 HB VAL A 19 5.621 2.904 -7.112 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.424 1.571 -6.080 1.00 0.00 H new ATOM 0 HG12 VAL A 19 5.935 0.621 -6.301 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.308 0.396 -7.411 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.982 3.415 -7.627 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.897 2.344 -9.046 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.901 3.817 -8.983 1.00 0.00 H new ATOM 269 N ASP A 20 4.829 -0.751 -8.857 1.00 0.00 N ATOM 270 CA ASP A 20 4.192 -2.001 -8.478 1.00 0.00 C ATOM 271 C ASP A 20 5.258 -2.981 -7.982 1.00 0.00 C ATOM 272 O ASP A 20 6.353 -3.045 -8.537 1.00 0.00 O ATOM 273 CB ASP A 20 3.480 -2.642 -9.671 1.00 0.00 C ATOM 274 CG ASP A 20 3.333 -1.739 -10.897 1.00 0.00 C ATOM 275 OD1 ASP A 20 4.353 -1.120 -11.271 1.00 0.00 O ATOM 276 OD2 ASP A 20 2.206 -1.687 -11.433 1.00 0.00 O ATOM 0 H ASP A 20 5.532 -0.836 -9.592 1.00 0.00 H new ATOM 0 HA ASP A 20 3.463 -1.784 -7.697 1.00 0.00 H new ATOM 0 HB2 ASP A 20 4.027 -3.539 -9.962 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.488 -2.963 -9.353 1.00 0.00 H new ATOM 281 N TYR A 21 4.899 -3.719 -6.942 1.00 0.00 N ATOM 282 CA TYR A 21 5.810 -4.693 -6.366 1.00 0.00 C ATOM 283 C TYR A 21 5.068 -5.969 -5.963 1.00 0.00 C ATOM 284 O TYR A 21 4.055 -5.909 -5.268 1.00 0.00 O ATOM 285 CB TYR A 21 6.389 -4.037 -5.110 1.00 0.00 C ATOM 286 CG TYR A 21 7.827 -3.541 -5.273 1.00 0.00 C ATOM 287 CD1 TYR A 21 8.118 -2.561 -6.199 1.00 0.00 C ATOM 288 CD2 TYR A 21 8.834 -4.076 -4.494 1.00 0.00 C ATOM 289 CE1 TYR A 21 9.472 -2.095 -6.352 1.00 0.00 C ATOM 290 CE2 TYR A 21 10.188 -3.609 -4.648 1.00 0.00 C ATOM 291 CZ TYR A 21 10.440 -2.642 -5.569 1.00 0.00 C ATOM 292 OH TYR A 21 11.719 -2.202 -5.714 1.00 0.00 O ATOM 0 H TYR A 21 3.990 -3.662 -6.483 1.00 0.00 H new ATOM 0 HA TYR A 21 6.579 -4.971 -7.087 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.756 -3.196 -4.827 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.354 -4.753 -4.289 1.00 0.00 H new ATOM 0 HD1 TYR A 21 7.331 -2.143 -6.809 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.607 -4.844 -3.770 1.00 0.00 H new ATOM 0 HE1 TYR A 21 9.713 -1.328 -7.073 1.00 0.00 H new ATOM 0 HE2 TYR A 21 10.985 -4.018 -4.045 1.00 0.00 H new ATOM 0 HH TYR A 21 11.802 -1.305 -5.328 1.00 0.00 H new ATOM 302 N GLU A 22 5.601 -7.094 -6.418 1.00 0.00 N ATOM 303 CA GLU A 22 5.001 -8.382 -6.114 1.00 0.00 C ATOM 304 C GLU A 22 5.603 -8.959 -4.832 1.00 0.00 C ATOM 305 O GLU A 22 6.789 -9.283 -4.789 1.00 0.00 O ATOM 306 CB GLU A 22 5.169 -9.354 -7.284 1.00 0.00 C ATOM 307 CG GLU A 22 4.735 -10.768 -6.889 1.00 0.00 C ATOM 308 CD GLU A 22 5.188 -11.791 -7.932 1.00 0.00 C ATOM 309 OE1 GLU A 22 4.708 -11.682 -9.080 1.00 0.00 O ATOM 310 OE2 GLU A 22 6.006 -12.659 -7.556 1.00 0.00 O ATOM 0 H GLU A 22 6.441 -7.140 -6.994 1.00 0.00 H new ATOM 0 HA GLU A 22 3.933 -8.235 -5.956 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.577 -9.012 -8.133 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.211 -9.366 -7.605 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.156 -11.023 -5.917 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.650 -10.804 -6.786 1.00 0.00 H new ATOM 317 N THR A 23 4.759 -9.069 -3.817 1.00 0.00 N ATOM 318 CA THR A 23 5.192 -9.602 -2.537 1.00 0.00 C ATOM 319 C THR A 23 4.161 -10.593 -1.994 1.00 0.00 C ATOM 320 O THR A 23 3.013 -10.228 -1.748 1.00 0.00 O ATOM 321 CB THR A 23 5.453 -8.421 -1.598 1.00 0.00 C ATOM 322 OG1 THR A 23 6.103 -9.009 -0.474 1.00 0.00 O ATOM 323 CG2 THR A 23 4.163 -7.837 -1.020 1.00 0.00 C ATOM 0 H THR A 23 3.776 -8.798 -3.855 1.00 0.00 H new ATOM 0 HA THR A 23 6.118 -10.168 -2.638 1.00 0.00 H new ATOM 0 HB THR A 23 5.995 -7.642 -2.135 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.310 -8.314 0.185 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.404 -7.003 -0.361 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.527 -7.486 -1.832 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.637 -8.606 -0.454 1.00 0.00 H new ATOM 331 N GLU A 24 4.608 -11.829 -1.824 1.00 0.00 N ATOM 332 CA GLU A 24 3.739 -12.875 -1.315 1.00 0.00 C ATOM 333 C GLU A 24 3.786 -12.909 0.214 1.00 0.00 C ATOM 334 O GLU A 24 4.676 -13.526 0.798 1.00 0.00 O ATOM 335 CB GLU A 24 4.115 -14.236 -1.905 1.00 0.00 C ATOM 336 CG GLU A 24 5.621 -14.481 -1.801 1.00 0.00 C ATOM 337 CD GLU A 24 5.928 -15.976 -1.691 1.00 0.00 C ATOM 338 OE1 GLU A 24 5.956 -16.629 -2.756 1.00 0.00 O ATOM 339 OE2 GLU A 24 6.128 -16.431 -0.544 1.00 0.00 O ATOM 0 H GLU A 24 5.561 -12.129 -2.030 1.00 0.00 H new ATOM 0 HA GLU A 24 2.717 -12.652 -1.622 1.00 0.00 H new ATOM 0 HB2 GLU A 24 3.577 -15.025 -1.380 1.00 0.00 H new ATOM 0 HB3 GLU A 24 3.807 -14.281 -2.950 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.122 -14.067 -2.676 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.018 -13.960 -0.930 1.00 0.00 H new ATOM 346 N THR A 25 2.817 -12.238 0.819 1.00 0.00 N ATOM 347 CA THR A 25 2.737 -12.182 2.269 1.00 0.00 C ATOM 348 C THR A 25 1.308 -12.460 2.735 1.00 0.00 C ATOM 349 O THR A 25 0.386 -11.717 2.401 1.00 0.00 O ATOM 350 CB THR A 25 3.270 -10.821 2.720 1.00 0.00 C ATOM 351 OG1 THR A 25 2.621 -9.890 1.857 1.00 0.00 O ATOM 352 CG2 THR A 25 4.758 -10.641 2.410 1.00 0.00 C ATOM 0 H THR A 25 2.080 -11.728 0.331 1.00 0.00 H new ATOM 0 HA THR A 25 3.351 -12.956 2.729 1.00 0.00 H new ATOM 0 HB THR A 25 3.106 -10.705 3.791 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.908 -8.980 2.082 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.084 -9.658 2.751 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.332 -11.412 2.923 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.918 -10.724 1.335 1.00 0.00 H new ATOM 360 N PRO A 26 1.163 -13.560 3.522 1.00 0.00 N ATOM 361 CA PRO A 26 -0.140 -13.946 4.037 1.00 0.00 C ATOM 362 C PRO A 26 -0.568 -13.028 5.184 1.00 0.00 C ATOM 363 O PRO A 26 -1.198 -11.996 4.955 1.00 0.00 O ATOM 364 CB PRO A 26 0.020 -15.396 4.465 1.00 0.00 C ATOM 365 CG PRO A 26 1.515 -15.627 4.605 1.00 0.00 C ATOM 366 CD PRO A 26 2.232 -14.464 3.938 1.00 0.00 C ATOM 0 HA PRO A 26 -0.932 -13.849 3.295 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.494 -15.584 5.408 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -0.412 -16.071 3.726 1.00 0.00 H new ATOM 0 HG2 PRO A 26 1.794 -15.695 5.657 1.00 0.00 H new ATOM 0 HG3 PRO A 26 1.801 -16.570 4.138 1.00 0.00 H new ATOM 0 HD2 PRO A 26 2.919 -13.974 4.628 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.822 -14.799 3.085 1.00 0.00 H new ATOM 374 N MET A 27 -0.211 -13.437 6.392 1.00 0.00 N ATOM 375 CA MET A 27 -0.552 -12.665 7.574 1.00 0.00 C ATOM 376 C MET A 27 0.350 -11.435 7.704 1.00 0.00 C ATOM 377 O MET A 27 -0.051 -10.424 8.280 1.00 0.00 O ATOM 378 CB MET A 27 -0.401 -13.542 8.819 1.00 0.00 C ATOM 379 CG MET A 27 -1.351 -14.739 8.765 1.00 0.00 C ATOM 380 SD MET A 27 -2.456 -14.706 10.167 1.00 0.00 S ATOM 381 CE MET A 27 -3.988 -15.147 9.365 1.00 0.00 C ATOM 0 H MET A 27 0.311 -14.293 6.578 1.00 0.00 H new ATOM 0 HA MET A 27 -1.584 -12.328 7.479 1.00 0.00 H new ATOM 0 HB2 MET A 27 0.628 -13.893 8.898 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.606 -12.951 9.712 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.925 -14.717 7.839 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.780 -15.667 8.764 1.00 0.00 H new ATOM 0 HE1 MET A 27 -4.790 -15.173 10.102 1.00 0.00 H new ATOM 0 HE2 MET A 27 -4.223 -14.409 8.598 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.888 -16.129 8.904 1.00 0.00 H new ATOM 391 N THR A 28 1.550 -11.560 7.159 1.00 0.00 N ATOM 392 CA THR A 28 2.512 -10.472 7.206 1.00 0.00 C ATOM 393 C THR A 28 1.881 -9.181 6.682 1.00 0.00 C ATOM 394 O THR A 28 2.366 -8.087 6.968 1.00 0.00 O ATOM 395 CB THR A 28 3.753 -10.903 6.422 1.00 0.00 C ATOM 396 OG1 THR A 28 3.551 -12.294 6.190 1.00 0.00 O ATOM 397 CG2 THR A 28 5.027 -10.848 7.268 1.00 0.00 C ATOM 0 H THR A 28 1.879 -12.399 6.682 1.00 0.00 H new ATOM 0 HA THR A 28 2.816 -10.257 8.230 1.00 0.00 H new ATOM 0 HB THR A 28 3.870 -10.264 5.547 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.309 -12.655 5.685 1.00 0.00 H new ATOM 0 HG21 THR A 28 5.878 -11.163 6.665 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.188 -9.828 7.618 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.924 -11.513 8.125 1.00 0.00 H new ATOM 405 N LEU A 29 0.808 -9.349 5.923 1.00 0.00 N ATOM 406 CA LEU A 29 0.105 -8.210 5.356 1.00 0.00 C ATOM 407 C LEU A 29 -0.494 -7.371 6.487 1.00 0.00 C ATOM 408 O LEU A 29 -0.466 -6.143 6.436 1.00 0.00 O ATOM 409 CB LEU A 29 -0.925 -8.675 4.325 1.00 0.00 C ATOM 410 CG LEU A 29 -0.374 -9.034 2.944 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.396 -9.840 2.138 1.00 0.00 C ATOM 412 CD2 LEU A 29 0.088 -7.784 2.194 1.00 0.00 C ATOM 0 H LEU A 29 0.408 -10.257 5.687 1.00 0.00 H new ATOM 0 HA LEU A 29 0.798 -7.567 4.813 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.443 -9.546 4.726 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.670 -7.888 4.204 1.00 0.00 H new ATOM 0 HG LEU A 29 0.502 -9.668 3.082 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.979 -10.082 1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.634 -10.761 2.670 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.304 -9.251 2.009 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.475 -8.069 1.216 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.754 -7.104 2.067 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.873 -7.287 2.764 1.00 0.00 H new ATOM 424 N LEU A 30 -1.021 -8.068 7.483 1.00 0.00 N ATOM 425 CA LEU A 30 -1.625 -7.403 8.625 1.00 0.00 C ATOM 426 C LEU A 30 -0.523 -6.817 9.510 1.00 0.00 C ATOM 427 O LEU A 30 -0.750 -5.843 10.227 1.00 0.00 O ATOM 428 CB LEU A 30 -2.566 -8.356 9.364 1.00 0.00 C ATOM 429 CG LEU A 30 -3.484 -9.209 8.485 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.447 -10.036 9.339 1.00 0.00 C ATOM 431 CD2 LEU A 30 -4.222 -8.345 7.461 1.00 0.00 C ATOM 0 H LEU A 30 -1.042 -9.087 7.523 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.247 -6.570 8.296 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.964 -9.023 9.981 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -3.187 -7.769 10.041 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.866 -9.911 7.926 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -5.088 -10.633 8.690 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.878 -10.696 9.993 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -5.062 -9.369 9.943 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.867 -8.976 6.850 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.828 -7.602 7.981 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.498 -7.840 6.822 1.00 0.00 H new ATOM 443 N VAL A 31 0.646 -7.435 9.432 1.00 0.00 N ATOM 444 CA VAL A 31 1.783 -6.987 10.217 1.00 0.00 C ATOM 445 C VAL A 31 2.123 -5.544 9.838 1.00 0.00 C ATOM 446 O VAL A 31 2.183 -5.207 8.657 1.00 0.00 O ATOM 447 CB VAL A 31 2.960 -7.947 10.028 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.191 -7.465 10.799 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.578 -9.370 10.442 1.00 0.00 C ATOM 0 H VAL A 31 0.830 -8.243 8.837 1.00 0.00 H new ATOM 0 HA VAL A 31 1.540 -6.996 11.280 1.00 0.00 H new ATOM 0 HB VAL A 31 3.213 -7.962 8.968 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.012 -8.165 10.647 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.483 -6.479 10.438 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.955 -7.407 11.862 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.432 -10.032 10.298 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.286 -9.377 11.492 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.744 -9.715 9.831 1.00 0.00 H new ATOM 459 N PRO A 32 2.341 -4.710 10.889 1.00 0.00 N ATOM 460 CA PRO A 32 2.674 -3.311 10.678 1.00 0.00 C ATOM 461 C PRO A 32 4.121 -3.156 10.210 1.00 0.00 C ATOM 462 O PRO A 32 4.401 -2.387 9.292 1.00 0.00 O ATOM 463 CB PRO A 32 2.405 -2.638 12.014 1.00 0.00 C ATOM 464 CG PRO A 32 2.380 -3.753 13.046 1.00 0.00 C ATOM 465 CD PRO A 32 2.278 -5.075 12.301 1.00 0.00 C ATOM 0 HA PRO A 32 2.080 -2.851 9.888 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.180 -1.908 12.247 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.457 -2.101 11.997 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.282 -3.728 13.657 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.534 -3.629 13.722 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.092 -5.747 12.573 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.347 -5.591 12.536 1.00 0.00 H new ATOM 473 N GLU A 33 5.003 -3.898 10.862 1.00 0.00 N ATOM 474 CA GLU A 33 6.416 -3.853 10.525 1.00 0.00 C ATOM 475 C GLU A 33 6.622 -4.222 9.054 1.00 0.00 C ATOM 476 O GLU A 33 7.483 -3.655 8.383 1.00 0.00 O ATOM 477 CB GLU A 33 7.229 -4.772 11.439 1.00 0.00 C ATOM 478 CG GLU A 33 6.731 -4.687 12.883 1.00 0.00 C ATOM 479 CD GLU A 33 7.830 -5.094 13.867 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.745 -4.268 14.069 1.00 0.00 O ATOM 481 OE2 GLU A 33 7.731 -6.224 14.394 1.00 0.00 O ATOM 0 H GLU A 33 4.767 -4.535 11.623 1.00 0.00 H new ATOM 0 HA GLU A 33 6.773 -2.835 10.679 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.156 -5.800 11.085 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.282 -4.494 11.397 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.403 -3.670 13.099 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.864 -5.336 13.011 1.00 0.00 H new ATOM 488 N VAL A 34 5.817 -5.169 8.595 1.00 0.00 N ATOM 489 CA VAL A 34 5.900 -5.619 7.217 1.00 0.00 C ATOM 490 C VAL A 34 5.143 -4.640 6.318 1.00 0.00 C ATOM 491 O VAL A 34 5.639 -4.249 5.263 1.00 0.00 O ATOM 492 CB VAL A 34 5.384 -7.055 7.104 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.082 -7.416 5.648 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.377 -8.044 7.718 1.00 0.00 C ATOM 0 H VAL A 34 5.104 -5.637 9.154 1.00 0.00 H new ATOM 0 HA VAL A 34 6.937 -5.632 6.882 1.00 0.00 H new ATOM 0 HB VAL A 34 4.453 -7.121 7.666 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.717 -8.442 5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.322 -6.740 5.256 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.991 -7.324 5.054 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.986 -9.057 7.625 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.331 -7.973 7.196 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.522 -7.807 8.772 1.00 0.00 H new ATOM 504 N ALA A 35 3.953 -4.270 6.770 1.00 0.00 N ATOM 505 CA ALA A 35 3.122 -3.344 6.019 1.00 0.00 C ATOM 506 C ALA A 35 3.850 -2.006 5.888 1.00 0.00 C ATOM 507 O ALA A 35 3.874 -1.411 4.811 1.00 0.00 O ATOM 508 CB ALA A 35 1.763 -3.204 6.708 1.00 0.00 C ATOM 0 H ALA A 35 3.545 -4.595 7.647 1.00 0.00 H new ATOM 0 HA ALA A 35 2.939 -3.720 5.012 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.139 -2.510 6.145 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.275 -4.178 6.751 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.905 -2.825 7.720 1.00 0.00 H new ATOM 514 N ALA A 36 4.426 -1.569 6.998 1.00 0.00 N ATOM 515 CA ALA A 36 5.152 -0.311 7.021 1.00 0.00 C ATOM 516 C ALA A 36 6.307 -0.377 6.019 1.00 0.00 C ATOM 517 O ALA A 36 6.482 0.531 5.207 1.00 0.00 O ATOM 518 CB ALA A 36 5.631 -0.023 8.444 1.00 0.00 C ATOM 0 H ALA A 36 4.404 -2.065 7.889 1.00 0.00 H new ATOM 0 HA ALA A 36 4.503 0.513 6.724 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.176 0.921 8.461 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.771 0.042 9.111 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.288 -0.827 8.776 1.00 0.00 H new ATOM 524 N GLU A 37 7.067 -1.459 6.111 1.00 0.00 N ATOM 525 CA GLU A 37 8.201 -1.655 5.223 1.00 0.00 C ATOM 526 C GLU A 37 7.729 -1.736 3.770 1.00 0.00 C ATOM 527 O GLU A 37 8.422 -1.280 2.861 1.00 0.00 O ATOM 528 CB GLU A 37 8.993 -2.903 5.613 1.00 0.00 C ATOM 529 CG GLU A 37 10.482 -2.584 5.762 1.00 0.00 C ATOM 530 CD GLU A 37 11.275 -3.090 4.556 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.217 -2.406 3.510 1.00 0.00 O ATOM 532 OE2 GLU A 37 11.921 -4.149 4.706 1.00 0.00 O ATOM 0 H GLU A 37 6.920 -2.209 6.787 1.00 0.00 H new ATOM 0 HA GLU A 37 8.867 -0.798 5.321 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.608 -3.304 6.551 1.00 0.00 H new ATOM 0 HB3 GLU A 37 8.857 -3.675 4.856 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.618 -1.508 5.865 1.00 0.00 H new ATOM 0 HG3 GLU A 37 10.866 -3.043 6.673 1.00 0.00 H new ATOM 539 N VAL A 38 6.552 -2.320 3.595 1.00 0.00 N ATOM 540 CA VAL A 38 5.979 -2.467 2.268 1.00 0.00 C ATOM 541 C VAL A 38 5.567 -1.092 1.740 1.00 0.00 C ATOM 542 O VAL A 38 5.952 -0.705 0.637 1.00 0.00 O ATOM 543 CB VAL A 38 4.821 -3.466 2.306 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.655 -2.984 1.440 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.284 -4.859 1.877 1.00 0.00 C ATOM 0 H VAL A 38 5.980 -2.697 4.351 1.00 0.00 H new ATOM 0 HA VAL A 38 6.717 -2.872 1.576 1.00 0.00 H new ATOM 0 HB VAL A 38 4.469 -3.533 3.335 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.844 -3.711 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.300 -2.022 1.810 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.989 -2.874 0.408 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.441 -5.550 1.913 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.674 -4.816 0.860 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.067 -5.206 2.552 1.00 0.00 H new ATOM 555 N ILE A 39 4.789 -0.390 2.552 1.00 0.00 N ATOM 556 CA ILE A 39 4.321 0.934 2.180 1.00 0.00 C ATOM 557 C ILE A 39 5.524 1.854 1.962 1.00 0.00 C ATOM 558 O ILE A 39 5.560 2.617 0.997 1.00 0.00 O ATOM 559 CB ILE A 39 3.325 1.460 3.215 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.074 0.580 3.269 1.00 0.00 C ATOM 561 CG2 ILE A 39 2.982 2.927 2.950 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.172 0.836 2.060 1.00 0.00 C ATOM 0 H ILE A 39 4.471 -0.714 3.466 1.00 0.00 H new ATOM 0 HA ILE A 39 3.775 0.894 1.237 1.00 0.00 H new ATOM 0 HB ILE A 39 3.796 1.412 4.197 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.364 -0.470 3.295 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.523 0.781 4.188 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.272 3.276 3.700 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.890 3.528 3.002 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.539 3.024 1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.290 0.198 2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.864 1.881 2.051 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.718 0.611 1.144 1.00 0.00 H new ATOM 574 N LYS A 40 6.480 1.752 2.873 1.00 0.00 N ATOM 575 CA LYS A 40 7.682 2.564 2.792 1.00 0.00 C ATOM 576 C LYS A 40 8.543 2.078 1.625 1.00 0.00 C ATOM 577 O LYS A 40 9.117 2.885 0.895 1.00 0.00 O ATOM 578 CB LYS A 40 8.414 2.574 4.136 1.00 0.00 C ATOM 579 CG LYS A 40 9.929 2.636 3.934 1.00 0.00 C ATOM 580 CD LYS A 40 10.549 1.239 3.993 1.00 0.00 C ATOM 581 CE LYS A 40 12.002 1.263 3.514 1.00 0.00 C ATOM 582 NZ LYS A 40 12.857 1.974 4.491 1.00 0.00 N ATOM 0 H LYS A 40 6.447 1.119 3.672 1.00 0.00 H new ATOM 0 HA LYS A 40 7.426 3.604 2.588 1.00 0.00 H new ATOM 0 HB2 LYS A 40 8.087 3.430 4.726 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.155 1.679 4.702 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.152 3.096 2.971 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.376 3.268 4.701 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.505 0.861 5.014 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.970 0.554 3.374 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.364 0.244 3.379 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.063 1.754 2.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.840 1.982 4.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.521 2.952 4.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.812 1.489 5.410 1.00 0.00 H new ATOM 596 N ASP A 41 8.607 0.762 1.486 1.00 0.00 N ATOM 597 CA ASP A 41 9.390 0.159 0.421 1.00 0.00 C ATOM 598 C ASP A 41 8.882 0.668 -0.930 1.00 0.00 C ATOM 599 O ASP A 41 9.674 1.020 -1.803 1.00 0.00 O ATOM 600 CB ASP A 41 9.255 -1.365 0.433 1.00 0.00 C ATOM 601 CG ASP A 41 9.732 -2.066 -0.840 1.00 0.00 C ATOM 602 OD1 ASP A 41 10.957 -2.025 -1.086 1.00 0.00 O ATOM 603 OD2 ASP A 41 8.861 -2.628 -1.539 1.00 0.00 O ATOM 0 H ASP A 41 8.129 0.096 2.093 1.00 0.00 H new ATOM 0 HA ASP A 41 10.435 0.430 0.576 1.00 0.00 H new ATOM 0 HB2 ASP A 41 9.819 -1.758 1.279 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.209 -1.621 0.600 1.00 0.00 H new ATOM 608 N LEU A 42 7.563 0.691 -1.059 1.00 0.00 N ATOM 609 CA LEU A 42 6.940 1.151 -2.289 1.00 0.00 C ATOM 610 C LEU A 42 7.264 2.631 -2.497 1.00 0.00 C ATOM 611 O LEU A 42 7.730 3.024 -3.566 1.00 0.00 O ATOM 612 CB LEU A 42 5.440 0.846 -2.275 1.00 0.00 C ATOM 613 CG LEU A 42 5.032 -0.535 -2.792 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.186 -1.279 -1.757 1.00 0.00 C ATOM 615 CD2 LEU A 42 4.322 -0.428 -4.142 1.00 0.00 C ATOM 0 H LEU A 42 6.909 0.399 -0.333 1.00 0.00 H new ATOM 0 HA LEU A 42 7.344 0.612 -3.146 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.078 0.951 -1.252 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.930 1.601 -2.873 1.00 0.00 H new ATOM 0 HG LEU A 42 5.937 -1.121 -2.951 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.909 -2.258 -2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.761 -1.405 -0.840 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.284 -0.705 -1.544 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.043 -1.424 -4.486 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.426 0.183 -4.034 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.990 0.033 -4.869 1.00 0.00 H new ATOM 627 N VAL A 43 7.007 3.413 -1.459 1.00 0.00 N ATOM 628 CA VAL A 43 7.267 4.842 -1.515 1.00 0.00 C ATOM 629 C VAL A 43 8.756 5.076 -1.774 1.00 0.00 C ATOM 630 O VAL A 43 9.123 5.877 -2.632 1.00 0.00 O ATOM 631 CB VAL A 43 6.770 5.514 -0.234 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.687 6.670 0.170 1.00 0.00 C ATOM 633 CG2 VAL A 43 5.324 5.989 -0.389 1.00 0.00 C ATOM 0 H VAL A 43 6.621 3.084 -0.574 1.00 0.00 H new ATOM 0 HA VAL A 43 6.719 5.298 -2.339 1.00 0.00 H new ATOM 0 HB VAL A 43 6.795 4.772 0.564 1.00 0.00 H new ATOM 0 HG11 VAL A 43 7.311 7.130 1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.695 6.292 0.342 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.710 7.412 -0.628 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.996 6.463 0.536 1.00 0.00 H new ATOM 0 HG22 VAL A 43 5.263 6.707 -1.206 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.682 5.136 -0.607 1.00 0.00 H new ATOM 643 N ASN A 44 9.576 4.361 -1.017 1.00 0.00 N ATOM 644 CA ASN A 44 11.017 4.480 -1.153 1.00 0.00 C ATOM 645 C ASN A 44 11.412 4.203 -2.605 1.00 0.00 C ATOM 646 O ASN A 44 12.326 4.833 -3.135 1.00 0.00 O ATOM 647 CB ASN A 44 11.741 3.466 -0.265 1.00 0.00 C ATOM 648 CG ASN A 44 12.306 4.140 0.986 1.00 0.00 C ATOM 649 OD1 ASN A 44 11.379 4.648 1.793 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.506 4.194 1.206 1.00 0.00 N flip ATOM 0 H ASN A 44 9.269 3.697 -0.307 1.00 0.00 H new ATOM 0 HA ASN A 44 11.301 5.489 -0.853 1.00 0.00 H new ATOM 0 HB2 ASN A 44 11.052 2.673 0.025 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.549 2.997 -0.826 1.00 0.00 H new ATOM 0 HD21 ASN A 44 14.165 3.783 0.544 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.849 4.650 2.051 1.00 0.00 H new ATOM 657 N THR A 45 10.703 3.260 -3.208 1.00 0.00 N ATOM 658 CA THR A 45 10.968 2.891 -4.589 1.00 0.00 C ATOM 659 C THR A 45 10.489 3.992 -5.536 1.00 0.00 C ATOM 660 O THR A 45 11.169 4.320 -6.506 1.00 0.00 O ATOM 661 CB THR A 45 10.309 1.535 -4.851 1.00 0.00 C ATOM 662 OG1 THR A 45 11.226 0.591 -4.303 1.00 0.00 O ATOM 663 CG2 THR A 45 10.260 1.186 -6.339 1.00 0.00 C ATOM 0 H THR A 45 9.945 2.740 -2.766 1.00 0.00 H new ATOM 0 HA THR A 45 12.038 2.790 -4.773 1.00 0.00 H new ATOM 0 HB THR A 45 9.297 1.539 -4.446 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.027 0.455 -3.353 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.783 0.215 -6.469 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.688 1.945 -6.872 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.274 1.149 -6.738 1.00 0.00 H new ATOM 925 N LYS B 203 -3.037 17.969 -7.408 1.00 0.00 N ATOM 926 CA LYS B 203 -3.401 17.508 -6.079 1.00 0.00 C ATOM 927 C LYS B 203 -2.394 16.452 -5.616 1.00 0.00 C ATOM 928 O LYS B 203 -1.772 15.780 -6.438 1.00 0.00 O ATOM 929 CB LYS B 203 -4.852 17.025 -6.059 1.00 0.00 C ATOM 930 CG LYS B 203 -5.516 17.341 -4.717 1.00 0.00 C ATOM 931 CD LYS B 203 -7.040 17.372 -4.854 1.00 0.00 C ATOM 932 CE LYS B 203 -7.551 18.809 -4.971 1.00 0.00 C ATOM 933 NZ LYS B 203 -7.923 19.338 -3.639 1.00 0.00 N ATOM 0 HA LYS B 203 -3.353 18.329 -5.364 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -5.409 17.502 -6.866 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.884 15.951 -6.241 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -5.229 16.592 -3.979 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -5.161 18.303 -4.349 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -7.341 16.802 -5.733 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.496 16.889 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.782 19.439 -5.417 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -8.414 18.841 -5.636 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.268 20.314 -3.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.672 18.746 -3.227 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -7.091 19.326 -3.016 1.00 0.00 H new ATOM 947 N ALA B 204 -2.266 16.338 -4.303 1.00 0.00 N ATOM 948 CA ALA B 204 -1.346 15.376 -3.721 1.00 0.00 C ATOM 949 C ALA B 204 -2.134 14.168 -3.212 1.00 0.00 C ATOM 950 O ALA B 204 -2.835 14.259 -2.205 1.00 0.00 O ATOM 951 CB ALA B 204 -0.533 16.051 -2.614 1.00 0.00 C ATOM 0 H ALA B 204 -2.784 16.896 -3.625 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.640 15.018 -4.470 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.157 15.329 -2.178 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.031 16.884 -3.033 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -1.207 16.421 -1.842 1.00 0.00 H new ATOM 957 N THR B 205 -1.992 13.063 -3.931 1.00 0.00 N ATOM 958 CA THR B 205 -2.682 11.838 -3.564 1.00 0.00 C ATOM 959 C THR B 205 -1.844 10.618 -3.954 1.00 0.00 C ATOM 960 O THR B 205 -0.882 10.737 -4.710 1.00 0.00 O ATOM 961 CB THR B 205 -4.065 11.860 -4.218 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.802 12.209 -5.574 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.938 13.005 -3.701 1.00 0.00 C ATOM 0 H THR B 205 -1.410 12.991 -4.765 1.00 0.00 H new ATOM 0 HA THR B 205 -2.819 11.768 -2.485 1.00 0.00 H new ATOM 0 HB THR B 205 -4.568 10.910 -4.037 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.645 12.244 -6.072 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.908 12.975 -4.197 1.00 0.00 H new ATOM 0 HG22 THR B 205 -5.077 12.899 -2.625 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.452 13.957 -3.912 1.00 0.00 H new ATOM 971 N TYR B 206 -2.243 9.472 -3.420 1.00 0.00 N ATOM 972 CA TYR B 206 -1.542 8.231 -3.703 1.00 0.00 C ATOM 973 C TYR B 206 -2.528 7.092 -3.964 1.00 0.00 C ATOM 974 O TYR B 206 -3.596 7.039 -3.356 1.00 0.00 O ATOM 975 CB TYR B 206 -0.731 7.910 -2.447 1.00 0.00 C ATOM 976 CG TYR B 206 0.782 8.061 -2.627 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.528 7.003 -3.108 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.400 9.253 -2.309 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.951 7.144 -3.277 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.822 9.394 -2.479 1.00 0.00 C ATOM 981 CZ TYR B 206 3.528 8.334 -2.955 1.00 0.00 C ATOM 982 OH TYR B 206 4.872 8.467 -3.115 1.00 0.00 O ATOM 0 H TYR B 206 -3.042 9.377 -2.793 1.00 0.00 H new ATOM 0 HA TYR B 206 -0.916 8.337 -4.589 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.058 8.565 -1.639 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -0.949 6.888 -2.137 1.00 0.00 H new ATOM 0 HD1 TYR B 206 1.044 6.070 -3.357 1.00 0.00 H new ATOM 0 HD2 TYR B 206 0.817 10.080 -1.933 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.547 6.324 -3.651 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.318 10.322 -2.234 1.00 0.00 H new ATOM 0 HH TYR B 206 5.146 9.369 -2.847 1.00 0.00 H new ATOM 992 N THR B 207 -2.135 6.206 -4.868 1.00 0.00 N ATOM 993 CA THR B 207 -2.971 5.071 -5.216 1.00 0.00 C ATOM 994 C THR B 207 -2.280 3.761 -4.832 1.00 0.00 C ATOM 995 O THR B 207 -1.309 3.358 -5.471 1.00 0.00 O ATOM 996 CB THR B 207 -3.303 5.168 -6.706 1.00 0.00 C ATOM 997 OG1 THR B 207 -3.545 6.556 -6.918 1.00 0.00 O ATOM 998 CG2 THR B 207 -4.635 4.501 -7.054 1.00 0.00 C ATOM 0 H THR B 207 -1.248 6.252 -5.370 1.00 0.00 H new ATOM 0 HA THR B 207 -3.907 5.084 -4.658 1.00 0.00 H new ATOM 0 HB THR B 207 -2.504 4.707 -7.286 1.00 0.00 H new ATOM 0 HG1 THR B 207 -3.919 6.690 -7.814 1.00 0.00 H new ATOM 0 HG21 THR B 207 -4.822 4.599 -8.123 1.00 0.00 H new ATOM 0 HG22 THR B 207 -4.594 3.445 -6.788 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.440 4.984 -6.499 1.00 0.00 H new ATOM 1006 N VAL B 208 -2.806 3.134 -3.790 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.251 1.879 -3.314 1.00 0.00 C ATOM 1008 C VAL B 208 -3.228 0.743 -3.624 1.00 0.00 C ATOM 1009 O VAL B 208 -4.342 0.718 -3.104 1.00 0.00 O ATOM 1010 CB VAL B 208 -1.915 1.987 -1.825 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.604 0.611 -1.231 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.756 2.959 -1.594 1.00 0.00 C ATOM 0 H VAL B 208 -3.611 3.472 -3.262 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.317 1.655 -3.830 1.00 0.00 H new ATOM 0 HB VAL B 208 -2.791 2.382 -1.312 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.369 0.717 -0.172 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.471 -0.040 -1.347 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.751 0.175 -1.751 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.537 3.018 -0.528 1.00 0.00 H new ATOM 0 HG22 VAL B 208 0.127 2.606 -2.127 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.031 3.947 -1.963 1.00 0.00 H new ATOM 1022 N THR B 209 -2.776 -0.168 -4.474 1.00 0.00 N ATOM 1023 CA THR B 209 -3.596 -1.303 -4.860 1.00 0.00 C ATOM 1024 C THR B 209 -3.110 -2.575 -4.163 1.00 0.00 C ATOM 1025 O THR B 209 -1.924 -2.708 -3.864 1.00 0.00 O ATOM 1026 CB THR B 209 -3.577 -1.402 -6.387 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.597 -0.045 -6.823 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.871 -1.993 -6.951 1.00 0.00 C ATOM 0 H THR B 209 -1.852 -0.143 -4.906 1.00 0.00 H new ATOM 0 HA THR B 209 -4.630 -1.170 -4.541 1.00 0.00 H new ATOM 0 HB THR B 209 -2.731 -2.014 -6.701 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.585 -0.016 -7.802 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.805 -2.041 -8.038 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.017 -2.996 -6.551 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.713 -1.363 -6.666 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.050 -3.478 -3.924 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.732 -4.734 -3.268 1.00 0.00 C ATOM 1038 C VAL B 210 -4.512 -5.867 -3.940 1.00 0.00 C ATOM 1039 O VAL B 210 -5.740 -5.902 -3.877 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.009 -4.625 -1.767 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.412 -5.982 -1.185 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.801 -4.047 -1.028 1.00 0.00 C ATOM 0 H VAL B 210 -5.032 -3.364 -4.173 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.671 -4.963 -3.373 1.00 0.00 H new ATOM 0 HB VAL B 210 -4.845 -3.940 -1.628 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.603 -5.878 -0.117 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.314 -6.338 -1.682 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.606 -6.699 -1.341 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.024 -3.980 0.037 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -1.938 -4.696 -1.178 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.579 -3.053 -1.416 1.00 0.00 H new ATOM 1052 N THR B 211 -3.766 -6.765 -4.567 1.00 0.00 N ATOM 1053 CA THR B 211 -4.372 -7.896 -5.249 1.00 0.00 C ATOM 1054 C THR B 211 -3.779 -9.209 -4.735 1.00 0.00 C ATOM 1055 O THR B 211 -2.561 -9.346 -4.635 1.00 0.00 O ATOM 1056 CB THR B 211 -4.188 -7.694 -6.754 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.175 -6.727 -7.098 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.580 -8.931 -7.564 1.00 0.00 C ATOM 0 H THR B 211 -2.748 -6.732 -4.617 1.00 0.00 H new ATOM 0 HA THR B 211 -5.441 -7.956 -5.043 1.00 0.00 H new ATOM 0 HB THR B 211 -3.148 -7.440 -6.961 1.00 0.00 H new ATOM 0 HG1 THR B 211 -4.801 -6.093 -7.745 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.430 -8.733 -8.625 1.00 0.00 H new ATOM 0 HG22 THR B 211 -3.961 -9.775 -7.261 1.00 0.00 H new ATOM 0 HG23 THR B 211 -5.629 -9.167 -7.383 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.668 -10.140 -4.423 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.247 -11.438 -3.921 1.00 0.00 C ATOM 1068 C ASN B 212 -4.209 -12.439 -5.078 1.00 0.00 C ATOM 1069 O ASN B 212 -5.243 -12.976 -5.472 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.227 -11.966 -2.870 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.768 -10.827 -2.004 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.302 -9.700 -2.052 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.774 -11.183 -1.211 1.00 0.00 N ATOM 0 H ASN B 212 -5.678 -10.022 -4.508 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.262 -11.322 -3.469 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.054 -12.477 -3.363 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.728 -12.702 -2.239 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.204 -10.495 -0.593 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.116 -12.144 -1.221 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.007 -12.659 -5.589 1.00 0.00 N ATOM 1081 CA ASN B 213 -2.821 -13.586 -6.691 1.00 0.00 C ATOM 1082 C ASN B 213 -3.280 -14.981 -6.263 1.00 0.00 C ATOM 1083 O ASN B 213 -3.431 -15.872 -7.097 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.347 -13.676 -7.093 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.120 -13.076 -8.481 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.312 -13.716 -9.502 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -0.701 -11.813 -8.464 1.00 0.00 N ATOM 0 H ASN B 213 -2.152 -12.211 -5.260 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.404 -13.224 -7.537 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -0.734 -13.150 -6.361 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.028 -14.718 -7.087 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.521 -11.324 -9.341 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.560 -11.334 -7.574 1.00 0.00 H new ATOM 1094 N SER B 214 -3.488 -15.127 -4.963 1.00 0.00 N ATOM 1095 CA SER B 214 -3.928 -16.399 -4.413 1.00 0.00 C ATOM 1096 C SER B 214 -5.438 -16.553 -4.593 1.00 0.00 C ATOM 1097 O SER B 214 -5.931 -17.656 -4.828 1.00 0.00 O ATOM 1098 CB SER B 214 -3.554 -16.517 -2.934 1.00 0.00 C ATOM 1099 OG SER B 214 -3.275 -17.864 -2.561 1.00 0.00 O ATOM 0 H SER B 214 -3.360 -14.386 -4.274 1.00 0.00 H new ATOM 0 HA SER B 214 -3.422 -17.199 -4.953 1.00 0.00 H new ATOM 0 HB2 SER B 214 -2.682 -15.896 -2.730 1.00 0.00 H new ATOM 0 HB3 SER B 214 -4.370 -16.133 -2.322 1.00 0.00 H new ATOM 0 HG SER B 214 -2.745 -18.295 -3.264 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.134 -15.431 -4.476 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.579 -15.427 -4.623 1.00 0.00 C ATOM 1107 C ASN B 215 -7.955 -14.704 -5.917 1.00 0.00 C ATOM 1108 O ASN B 215 -9.131 -14.623 -6.268 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.249 -14.694 -3.459 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.427 -15.499 -2.908 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.358 -16.704 -2.726 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.511 -14.769 -2.654 1.00 0.00 N ATOM 0 H ASN B 215 -5.723 -14.518 -4.281 1.00 0.00 H new ATOM 0 HA ASN B 215 -7.918 -16.463 -4.640 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.521 -14.520 -2.667 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.597 -13.716 -3.792 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.351 -15.215 -2.284 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.502 -13.764 -2.829 1.00 0.00 H new ATOM 1119 N GLY B 216 -6.933 -14.196 -6.591 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.141 -13.481 -7.839 1.00 0.00 C ATOM 1121 C GLY B 216 -8.006 -12.238 -7.622 1.00 0.00 C ATOM 1122 O GLY B 216 -8.492 -11.639 -8.580 1.00 0.00 O ATOM 0 H GLY B 216 -5.959 -14.265 -6.296 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.179 -13.190 -8.260 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.620 -14.139 -8.564 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.169 -11.884 -6.355 1.00 0.00 N ATOM 1127 CA VAL B 217 -8.967 -10.722 -6.000 1.00 0.00 C ATOM 1128 C VAL B 217 -8.070 -9.483 -5.976 1.00 0.00 C ATOM 1129 O VAL B 217 -6.903 -9.564 -5.598 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.684 -10.967 -4.671 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.383 -9.696 -4.183 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.675 -12.128 -4.787 1.00 0.00 C ATOM 0 H VAL B 217 -7.762 -12.381 -5.562 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.743 -10.548 -6.745 1.00 0.00 H new ATOM 0 HB VAL B 217 -8.932 -11.242 -3.931 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -10.885 -9.897 -3.237 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.645 -8.906 -4.042 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.118 -9.378 -4.923 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.171 -12.280 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.420 -11.896 -5.548 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.141 -13.036 -5.068 1.00 0.00 H new ATOM 1142 N SER B 218 -8.652 -8.365 -6.385 1.00 0.00 N ATOM 1143 CA SER B 218 -7.920 -7.109 -6.415 1.00 0.00 C ATOM 1144 C SER B 218 -8.697 -6.032 -5.656 1.00 0.00 C ATOM 1145 O SER B 218 -9.919 -6.112 -5.535 1.00 0.00 O ATOM 1146 CB SER B 218 -7.657 -6.660 -7.854 1.00 0.00 C ATOM 1147 OG SER B 218 -6.997 -5.397 -7.906 1.00 0.00 O ATOM 0 H SER B 218 -9.621 -8.302 -6.698 1.00 0.00 H new ATOM 0 HA SER B 218 -6.957 -7.262 -5.929 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.049 -7.408 -8.362 1.00 0.00 H new ATOM 0 HB3 SER B 218 -8.602 -6.598 -8.393 1.00 0.00 H new ATOM 0 HG SER B 218 -6.326 -5.349 -7.193 1.00 0.00 H new ATOM 1153 N VAL B 219 -7.958 -5.048 -5.165 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.562 -3.957 -4.422 1.00 0.00 C ATOM 1155 C VAL B 219 -7.662 -2.723 -4.514 1.00 0.00 C ATOM 1156 O VAL B 219 -6.482 -2.784 -4.175 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.834 -4.392 -2.980 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.187 -3.191 -2.101 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -9.935 -5.454 -2.926 1.00 0.00 C ATOM 0 H VAL B 219 -6.945 -4.984 -5.268 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.526 -3.689 -4.854 1.00 0.00 H new ATOM 0 HB VAL B 219 -7.920 -4.837 -2.587 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.375 -3.529 -1.082 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.358 -2.484 -2.101 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.080 -2.704 -2.492 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.109 -5.746 -1.890 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.854 -5.047 -3.347 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.627 -6.327 -3.502 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.255 -1.630 -4.974 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.522 -0.384 -5.115 1.00 0.00 C ATOM 1171 C ASP B 220 -8.068 0.639 -4.116 1.00 0.00 C ATOM 1172 O ASP B 220 -9.268 0.674 -3.851 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.685 0.195 -6.521 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.286 -0.765 -7.550 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -9.482 -1.092 -7.391 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -7.535 -1.152 -8.472 1.00 0.00 O ATOM 0 H ASP B 220 -9.235 -1.582 -5.254 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.468 -0.590 -4.930 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.316 1.082 -6.462 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.709 0.522 -6.878 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.159 1.448 -3.591 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.534 2.469 -2.628 1.00 0.00 C ATOM 1183 C TYR B 221 -6.753 3.762 -2.867 1.00 0.00 C ATOM 1184 O TYR B 221 -5.525 3.744 -2.943 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.163 1.910 -1.254 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.342 1.306 -0.488 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.292 2.132 0.079 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -8.456 -0.064 -0.365 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.402 1.564 0.800 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -9.566 -0.631 0.356 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.484 0.210 0.902 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.533 -0.326 1.583 1.00 0.00 O ATOM 0 H TYR B 221 -6.164 1.417 -3.814 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.595 2.703 -2.711 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.395 1.147 -1.379 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.724 2.708 -0.655 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -9.203 3.204 -0.018 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -7.713 -0.710 -0.809 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -11.152 2.198 1.249 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -9.667 -1.701 0.461 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.200 -0.963 2.249 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.496 4.854 -2.979 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.886 6.153 -3.208 1.00 0.00 C ATOM 1204 C GLU B 222 -6.834 6.952 -1.905 1.00 0.00 C ATOM 1205 O GLU B 222 -7.871 7.334 -1.364 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.637 6.927 -4.295 1.00 0.00 C ATOM 1207 CG GLU B 222 -6.875 8.191 -4.694 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.175 8.580 -6.142 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -6.888 7.743 -7.026 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -7.688 9.704 -6.334 1.00 0.00 O ATOM 0 H GLU B 222 -8.514 4.866 -2.915 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.865 5.997 -3.557 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.776 6.291 -5.169 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.630 7.195 -3.935 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.150 9.010 -4.030 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -5.804 8.028 -4.572 1.00 0.00 H new ATOM 1217 N THR B 223 -5.616 7.181 -1.436 1.00 0.00 N ATOM 1218 CA THR B 223 -5.414 7.927 -0.206 1.00 0.00 C ATOM 1219 C THR B 223 -4.244 8.901 -0.359 1.00 0.00 C ATOM 1220 O THR B 223 -3.300 8.631 -1.100 1.00 0.00 O ATOM 1221 CB THR B 223 -5.224 6.922 0.931 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.690 7.613 2.087 1.00 0.00 O ATOM 1223 CG2 THR B 223 -3.748 6.648 1.229 1.00 0.00 C ATOM 0 H THR B 223 -4.758 6.862 -1.887 1.00 0.00 H new ATOM 0 HA THR B 223 -6.281 8.544 0.029 1.00 0.00 H new ATOM 0 HB THR B 223 -5.722 5.987 0.676 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.604 7.032 2.872 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.669 5.928 2.044 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.266 6.243 0.339 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.256 7.577 1.517 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.344 10.012 0.355 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.306 11.028 0.308 1.00 0.00 C ATOM 1233 C GLU B 224 -2.485 11.008 1.599 1.00 0.00 C ATOM 1234 O GLU B 224 -2.868 11.626 2.591 1.00 0.00 O ATOM 1235 CB GLU B 224 -3.905 12.413 0.060 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.389 12.445 0.434 1.00 0.00 C ATOM 1237 CD GLU B 224 -5.578 12.273 1.942 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -4.920 13.030 2.687 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -6.377 11.386 2.316 1.00 0.00 O ATOM 0 H GLU B 224 -5.128 10.231 0.970 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.641 10.802 -0.526 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.363 13.157 0.644 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.785 12.682 -0.989 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.828 13.390 0.114 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -5.918 11.653 -0.095 1.00 0.00 H new ATOM 1246 N THR B 225 -1.373 10.290 1.544 1.00 0.00 N ATOM 1247 CA THR B 225 -0.495 10.182 2.698 1.00 0.00 C ATOM 1248 C THR B 225 0.961 10.399 2.281 1.00 0.00 C ATOM 1249 O THR B 225 1.557 9.546 1.625 1.00 0.00 O ATOM 1250 CB THR B 225 -0.743 8.823 3.354 1.00 0.00 C ATOM 1251 OG1 THR B 225 -0.704 7.900 2.269 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.165 8.689 3.905 1.00 0.00 C ATOM 0 H THR B 225 -1.060 9.778 0.720 1.00 0.00 H new ATOM 0 HA THR B 225 -0.709 10.958 3.433 1.00 0.00 H new ATOM 0 HB THR B 225 -0.025 8.674 4.160 1.00 0.00 H new ATOM 0 HG1 THR B 225 -0.854 6.992 2.606 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.288 7.706 4.360 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.339 9.460 4.655 1.00 0.00 H new ATOM 0 HG23 THR B 225 -2.882 8.805 3.093 1.00 0.00 H new ATOM 1260 N PRO B 226 1.507 11.574 2.691 1.00 0.00 N ATOM 1261 CA PRO B 226 2.882 11.914 2.368 1.00 0.00 C ATOM 1262 C PRO B 226 3.862 11.118 3.233 1.00 0.00 C ATOM 1263 O PRO B 226 4.365 10.079 2.812 1.00 0.00 O ATOM 1264 CB PRO B 226 2.980 13.416 2.588 1.00 0.00 C ATOM 1265 CG PRO B 226 1.795 13.785 3.466 1.00 0.00 C ATOM 1266 CD PRO B 226 0.832 12.609 3.470 1.00 0.00 C ATOM 0 HA PRO B 226 3.148 11.657 1.343 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.921 13.680 3.071 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.946 13.953 1.640 1.00 0.00 H new ATOM 0 HG2 PRO B 226 2.127 14.010 4.480 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.303 14.680 3.086 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.626 12.269 4.485 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.125 12.879 3.024 1.00 0.00 H new ATOM 1274 N MET B 227 4.102 11.639 4.428 1.00 0.00 N ATOM 1275 CA MET B 227 5.013 10.990 5.356 1.00 0.00 C ATOM 1276 C MET B 227 4.365 9.753 5.986 1.00 0.00 C ATOM 1277 O MET B 227 5.055 8.797 6.336 1.00 0.00 O ATOM 1278 CB MET B 227 5.407 11.975 6.457 1.00 0.00 C ATOM 1279 CG MET B 227 5.797 13.331 5.865 1.00 0.00 C ATOM 1280 SD MET B 227 5.240 14.647 6.936 1.00 0.00 S ATOM 1281 CE MET B 227 3.512 14.221 7.077 1.00 0.00 C ATOM 0 H MET B 227 3.682 12.502 4.774 1.00 0.00 H new ATOM 0 HA MET B 227 5.899 10.673 4.805 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.576 12.102 7.151 1.00 0.00 H new ATOM 0 HB3 MET B 227 6.241 11.571 7.030 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.878 13.385 5.740 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.356 13.445 4.875 1.00 0.00 H new ATOM 0 HE1 MET B 227 2.904 15.115 6.939 1.00 0.00 H new ATOM 0 HE2 MET B 227 3.255 13.486 6.314 1.00 0.00 H new ATOM 0 HE3 MET B 227 3.320 13.801 8.064 1.00 0.00 H new ATOM 1291 N THR B 228 3.048 9.814 6.109 1.00 0.00 N ATOM 1292 CA THR B 228 2.300 8.712 6.689 1.00 0.00 C ATOM 1293 C THR B 228 2.657 7.398 5.991 1.00 0.00 C ATOM 1294 O THR B 228 2.724 6.349 6.631 1.00 0.00 O ATOM 1295 CB THR B 228 0.811 9.056 6.610 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.784 10.335 5.981 1.00 0.00 O ATOM 1297 CG2 THR B 228 0.192 9.305 7.986 1.00 0.00 C ATOM 0 H THR B 228 2.480 10.609 5.817 1.00 0.00 H new ATOM 0 HA THR B 228 2.560 8.568 7.738 1.00 0.00 H new ATOM 0 HB THR B 228 0.278 8.245 6.115 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.145 10.634 5.888 1.00 0.00 H new ATOM 0 HG21 THR B 228 -0.865 9.545 7.871 1.00 0.00 H new ATOM 0 HG22 THR B 228 0.297 8.410 8.599 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.703 10.138 8.469 1.00 0.00 H new ATOM 1305 N LEU B 229 2.879 7.498 4.689 1.00 0.00 N ATOM 1306 CA LEU B 229 3.228 6.331 3.898 1.00 0.00 C ATOM 1307 C LEU B 229 4.395 5.599 4.565 1.00 0.00 C ATOM 1308 O LEU B 229 4.493 4.376 4.482 1.00 0.00 O ATOM 1309 CB LEU B 229 3.503 6.730 2.446 1.00 0.00 C ATOM 1310 CG LEU B 229 2.277 6.827 1.535 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.609 7.589 0.250 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.698 5.440 1.246 1.00 0.00 C ATOM 0 H LEU B 229 2.824 8.370 4.162 1.00 0.00 H new ATOM 0 HA LEU B 229 2.392 5.633 3.860 1.00 0.00 H new ATOM 0 HB2 LEU B 229 4.010 7.695 2.445 1.00 0.00 H new ATOM 0 HB3 LEU B 229 4.195 6.006 2.016 1.00 0.00 H new ATOM 0 HG LEU B 229 1.507 7.395 2.057 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.721 7.644 -0.380 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.940 8.597 0.500 1.00 0.00 H new ATOM 0 HD13 LEU B 229 3.403 7.069 -0.286 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.828 5.537 0.597 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.452 4.826 0.753 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.401 4.967 2.182 1.00 0.00 H new ATOM 1324 N LEU B 230 5.250 6.378 5.210 1.00 0.00 N ATOM 1325 CA LEU B 230 6.406 5.818 5.891 1.00 0.00 C ATOM 1326 C LEU B 230 5.984 5.315 7.273 1.00 0.00 C ATOM 1327 O LEU B 230 6.609 4.413 7.825 1.00 0.00 O ATOM 1328 CB LEU B 230 7.548 6.835 5.929 1.00 0.00 C ATOM 1329 CG LEU B 230 7.872 7.530 4.605 1.00 0.00 C ATOM 1330 CD1 LEU B 230 9.053 8.489 4.765 1.00 0.00 C ATOM 1331 CD2 LEU B 230 8.111 6.508 3.493 1.00 0.00 C ATOM 0 H LEU B 230 5.166 7.392 5.276 1.00 0.00 H new ATOM 0 HA LEU B 230 6.793 4.959 5.343 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.303 7.599 6.667 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.447 6.329 6.280 1.00 0.00 H new ATOM 0 HG LEU B 230 7.008 8.127 4.313 1.00 0.00 H new ATOM 0 HD11 LEU B 230 9.263 8.970 3.810 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.807 9.248 5.507 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.932 7.933 5.092 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.339 7.029 2.563 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.948 5.865 3.764 1.00 0.00 H new ATOM 0 HD23 LEU B 230 7.216 5.901 3.358 1.00 0.00 H new ATOM 1343 N VAL B 231 4.924 5.920 7.789 1.00 0.00 N ATOM 1344 CA VAL B 231 4.412 5.544 9.097 1.00 0.00 C ATOM 1345 C VAL B 231 3.918 4.097 9.049 1.00 0.00 C ATOM 1346 O VAL B 231 3.225 3.704 8.112 1.00 0.00 O ATOM 1347 CB VAL B 231 3.330 6.531 9.538 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.704 6.101 10.866 1.00 0.00 C ATOM 1349 CG2 VAL B 231 3.887 7.952 9.628 1.00 0.00 C ATOM 0 H VAL B 231 4.406 6.667 7.326 1.00 0.00 H new ATOM 0 HA VAL B 231 5.202 5.593 9.846 1.00 0.00 H new ATOM 0 HB VAL B 231 2.545 6.527 8.782 1.00 0.00 H new ATOM 0 HG11 VAL B 231 1.938 6.820 11.157 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.253 5.115 10.753 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.475 6.061 11.636 1.00 0.00 H new ATOM 0 HG21 VAL B 231 3.097 8.633 9.944 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.700 7.979 10.353 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.262 8.258 8.651 1.00 0.00 H new ATOM 1359 N PRO B 232 4.305 3.323 10.097 1.00 0.00 N ATOM 1360 CA PRO B 232 3.909 1.927 10.185 1.00 0.00 C ATOM 1361 C PRO B 232 2.439 1.798 10.586 1.00 0.00 C ATOM 1362 O PRO B 232 1.705 0.991 10.019 1.00 0.00 O ATOM 1363 CB PRO B 232 4.858 1.311 11.198 1.00 0.00 C ATOM 1364 CG PRO B 232 5.442 2.474 11.984 1.00 0.00 C ATOM 1365 CD PRO B 232 5.127 3.754 11.225 1.00 0.00 C ATOM 0 HA PRO B 232 3.979 1.409 9.228 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.332 0.620 11.856 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.644 0.742 10.701 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.016 2.510 12.986 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.519 2.354 12.100 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.594 4.467 11.854 1.00 0.00 H new ATOM 0 HD3 PRO B 232 6.038 4.248 10.886 1.00 0.00 H new ATOM 1373 N GLU B 233 2.052 2.607 11.562 1.00 0.00 N ATOM 1374 CA GLU B 233 0.683 2.594 12.047 1.00 0.00 C ATOM 1375 C GLU B 233 -0.286 2.932 10.912 1.00 0.00 C ATOM 1376 O GLU B 233 -1.391 2.397 10.853 1.00 0.00 O ATOM 1377 CB GLU B 233 0.508 3.557 13.223 1.00 0.00 C ATOM 1378 CG GLU B 233 1.712 3.497 14.164 1.00 0.00 C ATOM 1379 CD GLU B 233 1.345 4.009 15.559 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.433 3.404 16.163 1.00 0.00 O ATOM 1381 OE2 GLU B 233 1.984 4.994 15.988 1.00 0.00 O ATOM 0 H GLU B 233 2.664 3.276 12.030 1.00 0.00 H new ATOM 0 HA GLU B 233 0.455 1.590 12.406 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.384 4.574 12.850 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.400 3.306 13.772 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.073 2.471 14.233 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.527 4.095 13.756 1.00 0.00 H new ATOM 1388 N VAL B 234 0.165 3.821 10.039 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.648 4.238 8.909 1.00 0.00 C ATOM 1390 C VAL B 234 -0.527 3.203 7.789 1.00 0.00 C ATOM 1391 O VAL B 234 -1.529 2.798 7.202 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.246 5.647 8.466 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -1.092 6.111 7.279 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.345 6.636 9.630 1.00 0.00 C ATOM 0 H VAL B 234 1.082 4.264 10.091 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.699 4.288 9.193 1.00 0.00 H new ATOM 0 HB VAL B 234 0.794 5.613 8.142 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.786 7.115 6.984 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.950 5.428 6.442 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.144 6.121 7.564 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.054 7.630 9.289 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.371 6.664 9.997 1.00 0.00 H new ATOM 0 HG23 VAL B 234 0.319 6.319 10.434 1.00 0.00 H new ATOM 1404 N ALA B 235 0.709 2.804 7.527 1.00 0.00 N ATOM 1405 CA ALA B 235 0.974 1.823 6.489 1.00 0.00 C ATOM 1406 C ALA B 235 0.337 0.488 6.878 1.00 0.00 C ATOM 1407 O ALA B 235 -0.258 -0.188 6.040 1.00 0.00 O ATOM 1408 CB ALA B 235 2.484 1.707 6.269 1.00 0.00 C ATOM 0 H ALA B 235 1.538 3.142 8.016 1.00 0.00 H new ATOM 0 HA ALA B 235 0.530 2.136 5.544 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.683 0.971 5.490 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.883 2.675 5.964 1.00 0.00 H new ATOM 0 HB3 ALA B 235 2.964 1.393 7.196 1.00 0.00 H new ATOM 1414 N ALA B 236 0.484 0.148 8.151 1.00 0.00 N ATOM 1415 CA ALA B 236 -0.070 -1.094 8.662 1.00 0.00 C ATOM 1416 C ALA B 236 -1.581 -1.111 8.421 1.00 0.00 C ATOM 1417 O ALA B 236 -2.124 -2.099 7.928 1.00 0.00 O ATOM 1418 CB ALA B 236 0.286 -1.240 10.144 1.00 0.00 C ATOM 0 H ALA B 236 0.979 0.711 8.843 1.00 0.00 H new ATOM 0 HA ALA B 236 0.357 -1.949 8.138 1.00 0.00 H new ATOM 0 HB1 ALA B 236 -0.129 -2.172 10.528 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.370 -1.252 10.258 1.00 0.00 H new ATOM 0 HB3 ALA B 236 -0.129 -0.401 10.702 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.218 -0.006 8.781 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.655 0.118 8.609 1.00 0.00 C ATOM 1426 C GLU B 237 -4.010 0.178 7.122 1.00 0.00 C ATOM 1427 O GLU B 237 -5.045 -0.341 6.706 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.192 1.344 9.351 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.542 0.999 10.799 1.00 0.00 C ATOM 1430 CD GLU B 237 -3.328 0.431 11.536 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -2.889 -0.670 11.141 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -2.867 1.111 12.479 1.00 0.00 O ATOM 0 H GLU B 237 -1.765 0.811 9.191 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.130 -0.764 9.040 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.447 2.139 9.333 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -5.077 1.724 8.840 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.899 1.891 11.313 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -5.355 0.273 10.817 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.131 0.814 6.362 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.338 0.949 4.930 1.00 0.00 C ATOM 1441 C VAL B 238 -3.204 -0.424 4.269 1.00 0.00 C ATOM 1442 O VAL B 238 -3.956 -0.753 3.353 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.370 1.986 4.356 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.920 1.594 2.948 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -2.996 3.382 4.363 1.00 0.00 C ATOM 0 H VAL B 238 -2.273 1.242 6.711 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.344 1.314 4.722 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.487 2.011 4.995 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.233 2.347 2.563 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.417 0.628 2.983 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.789 1.527 2.294 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.288 4.100 3.950 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.903 3.377 3.758 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.244 3.664 5.386 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.240 -1.191 4.759 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.998 -2.521 4.228 1.00 0.00 C ATOM 1457 C ILE B 239 -3.085 -3.473 4.731 1.00 0.00 C ATOM 1458 O ILE B 239 -3.624 -4.269 3.963 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.577 -2.980 4.559 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.460 -2.125 3.830 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.399 -4.471 4.265 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.609 -2.568 2.373 1.00 0.00 C ATOM 0 H ILE B 239 -1.617 -0.916 5.519 1.00 0.00 H new ATOM 0 HA ILE B 239 -2.060 -2.513 3.140 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.415 -2.841 5.628 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.163 -1.077 3.867 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.422 -2.202 4.337 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.620 -4.771 4.509 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -1.101 -5.047 4.868 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.589 -4.659 3.208 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.352 -1.944 1.877 1.00 0.00 H new ATOM 0 HD12 ILE B 239 0.929 -3.609 2.340 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.349 -2.467 1.862 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.376 -3.360 6.020 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.389 -4.200 6.635 1.00 0.00 C ATOM 1476 C LYS B 240 -5.765 -3.812 6.092 1.00 0.00 C ATOM 1477 O LYS B 240 -6.595 -4.678 5.816 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.287 -4.133 8.160 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.665 -4.277 8.808 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.257 -2.907 9.147 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.736 -3.027 9.521 1.00 0.00 C ATOM 1482 NZ LYS B 240 -7.882 -3.417 10.941 1.00 0.00 N ATOM 0 H LYS B 240 -2.927 -2.699 6.654 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.227 -5.246 6.374 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.628 -4.923 8.519 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.839 -3.185 8.457 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.335 -4.810 8.133 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.584 -4.877 9.715 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.704 -2.462 9.974 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -6.147 -2.238 8.294 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -8.240 -2.077 9.345 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -8.220 -3.767 8.883 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -8.892 -3.494 11.178 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.419 -4.335 11.098 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -7.438 -2.697 11.546 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.967 -2.509 5.955 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.229 -1.997 5.451 1.00 0.00 C ATOM 1498 C ASP B 241 -7.472 -2.545 4.044 1.00 0.00 C ATOM 1499 O ASP B 241 -8.572 -2.998 3.731 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.208 -0.468 5.365 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.394 0.155 4.626 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.536 -0.189 4.996 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -8.130 0.961 3.709 1.00 0.00 O ATOM 0 H ASP B 241 -5.277 -1.793 6.184 1.00 0.00 H new ATOM 0 HA ASP B 241 -8.017 -2.310 6.136 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.176 -0.063 6.376 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.288 -0.160 4.869 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.426 -2.487 3.231 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.513 -2.973 1.865 1.00 0.00 C ATOM 1510 C LEU B 242 -6.848 -4.465 1.879 1.00 0.00 C ATOM 1511 O LEU B 242 -7.756 -4.908 1.178 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.233 -2.636 1.096 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.240 -1.312 0.328 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.035 -0.451 0.710 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.317 -1.553 -1.181 1.00 0.00 C ATOM 0 H LEU B 242 -5.515 -2.111 3.493 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.320 -2.471 1.332 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.403 -2.619 1.802 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -5.035 -3.442 0.389 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.135 -0.758 0.611 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.064 0.484 0.150 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.066 -0.236 1.778 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.116 -0.987 0.474 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.320 -0.596 -1.703 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.454 -2.137 -1.501 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.231 -2.098 -1.416 1.00 0.00 H new ATOM 1527 N VAL B 243 -6.095 -5.201 2.684 1.00 0.00 N ATOM 1528 CA VAL B 243 -6.301 -6.634 2.799 1.00 0.00 C ATOM 1529 C VAL B 243 -7.681 -6.901 3.404 1.00 0.00 C ATOM 1530 O VAL B 243 -8.419 -7.757 2.921 1.00 0.00 O ATOM 1531 CB VAL B 243 -5.162 -7.264 3.605 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.671 -8.435 4.448 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -4.020 -7.704 2.688 1.00 0.00 C ATOM 0 H VAL B 243 -5.341 -4.831 3.263 1.00 0.00 H new ATOM 0 HA VAL B 243 -6.282 -7.102 1.815 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.772 -6.506 4.284 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.843 -8.865 5.011 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.435 -8.080 5.140 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -6.099 -9.195 3.794 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -3.224 -8.148 3.286 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -4.390 -8.439 1.973 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.631 -6.839 2.151 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.986 -6.151 4.453 1.00 0.00 N ATOM 1544 CA ASN B 244 -9.263 -6.295 5.130 1.00 0.00 C ATOM 1545 C ASN B 244 -10.395 -6.093 4.121 1.00 0.00 C ATOM 1546 O ASN B 244 -11.428 -6.757 4.201 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.422 -5.249 6.235 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.199 -5.870 7.615 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.985 -6.388 7.785 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -10.070 -5.880 8.468 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.370 -5.442 4.850 1.00 0.00 H new ATOM 0 HA ASN B 244 -9.301 -7.292 5.569 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.711 -4.438 6.078 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.419 -4.812 6.186 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -10.981 -5.465 8.272 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -9.888 -6.304 9.378 1.00 0.00 H new ATOM 1557 N THR B 245 -10.164 -5.174 3.196 1.00 0.00 N ATOM 1558 CA THR B 245 -11.151 -4.877 2.172 1.00 0.00 C ATOM 1559 C THR B 245 -11.236 -6.024 1.163 1.00 0.00 C ATOM 1560 O THR B 245 -12.329 -6.433 0.774 1.00 0.00 O ATOM 1561 CB THR B 245 -10.784 -3.535 1.536 1.00 0.00 C ATOM 1562 OG1 THR B 245 -10.877 -2.603 2.611 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.835 -3.054 0.534 1.00 0.00 C ATOM 0 H THR B 245 -9.307 -4.625 3.134 1.00 0.00 H new ATOM 0 HA THR B 245 -12.149 -4.788 2.600 1.00 0.00 H new ATOM 0 HB THR B 245 -9.820 -3.623 1.036 1.00 0.00 H new ATOM 0 HG1 THR B 245 -10.049 -2.624 3.135 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.525 -2.098 0.113 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.937 -3.787 -0.266 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.793 -2.934 1.041 1.00 0.00 H new