USER MOD reduce.3.24.130724 H: found=0, std=0, add=644, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 646 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 221 TYR OH : rot 68:sc= 0.0121 USER MOD Set 1.2: B 245 THR OG1 : rot 83:sc= 1.2 USER MOD Set 2.1: B 211 THR OG1 : rot 22:sc= -3.95! USER MOD Set 2.2: B 218 SER OG : rot 82:sc= 0.812 USER MOD Set 3.1: A 6 TYR OH : rot 180:sc= -0.866 USER MOD Set 3.2: B 212 ASN : amide:sc= -9.18! C(o=-10!,f=-15!) USER MOD Set 4.1: A 13 ASN : amide:sc= 0 X(o=-0.027,f=-0.027) USER MOD Set 4.2: B 207 THR OG1 : rot 180:sc= -0.0271 USER MOD Set 5.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: B 213 ASN : amide:sc= 0 X(o=0,f=0.07) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -2.58! USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 150:sc= -3.64! USER MOD Single : A 12 ASN : amide:sc= -7.23! C(o=-7.2!,f=-24!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 ASN :FLIP amide:sc= 0.485 F(o=-0.22,f=0.48) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 56:sc= -2.19! USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 39:sc= 0.218 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.273 USER MOD Single : A 40 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00161) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.697 F(o=-1.5!,f=-0.7) USER MOD Single : A 45 THR OG1 : rot 93:sc= 0.722 USER MOD Single : B 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 205 THR OG1 : rot 180:sc= -3.59! USER MOD Single : B 206 TYR OH : rot 180:sc= -0.619 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 214 SER OG : rot 180:sc= 0 USER MOD Single : B 215 ASN : amide:sc= -0.225 X(o=-0.22,f=-0.49) USER MOD Single : B 223 THR OG1 : rot 180:sc= 0 USER MOD Single : B 225 THR OG1 : rot 180:sc= -1.15 USER MOD Single : B 227 MET CE :methyl -134:sc= -1.58 (180deg=-4.53!) USER MOD Single : B 228 THR OG1 : rot 180:sc= 0.157 USER MOD Single : B 240 LYS NZ :NH3+ -132:sc= -0.0431 (180deg=-1.91!) USER MOD Single : B 244 ASN :FLIP amide:sc= -0.0713 F(o=-0.72,f=-0.071) USER MOD ----------------------------------------------------------------- ATOM 25 N LYS A 3 -1.308 -20.040 -6.678 1.00 0.00 N ATOM 26 CA LYS A 3 -0.333 -19.788 -5.630 1.00 0.00 C ATOM 27 C LYS A 3 -0.857 -18.683 -4.710 1.00 0.00 C ATOM 28 O LYS A 3 -1.852 -18.032 -5.019 1.00 0.00 O ATOM 29 CB LYS A 3 1.039 -19.486 -6.236 1.00 0.00 C ATOM 30 CG LYS A 3 1.587 -20.702 -6.985 1.00 0.00 C ATOM 31 CD LYS A 3 1.112 -22.004 -6.340 1.00 0.00 C ATOM 32 CE LYS A 3 1.836 -23.211 -6.940 1.00 0.00 C ATOM 33 NZ LYS A 3 0.942 -24.389 -6.973 1.00 0.00 N ATOM 0 HA LYS A 3 -0.194 -20.677 -5.015 1.00 0.00 H new ATOM 0 HB2 LYS A 3 0.961 -18.639 -6.918 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.733 -19.197 -5.447 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.264 -20.669 -8.025 1.00 0.00 H new ATOM 0 HG3 LYS A 3 2.677 -20.670 -6.989 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.289 -21.967 -5.265 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.037 -22.113 -6.482 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.173 -22.975 -7.949 1.00 0.00 H new ATOM 0 HE3 LYS A 3 2.725 -23.438 -6.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 1.450 -25.199 -7.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.641 -24.623 -6.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.106 -24.174 -7.554 1.00 0.00 H new ATOM 47 N ALA A 4 -0.161 -18.507 -3.595 1.00 0.00 N ATOM 48 CA ALA A 4 -0.543 -17.494 -2.627 1.00 0.00 C ATOM 49 C ALA A 4 0.426 -16.312 -2.725 1.00 0.00 C ATOM 50 O ALA A 4 1.477 -16.313 -2.087 1.00 0.00 O ATOM 51 CB ALA A 4 -0.571 -18.109 -1.227 1.00 0.00 C ATOM 0 H ALA A 4 0.665 -19.049 -3.342 1.00 0.00 H new ATOM 0 HA ALA A 4 -1.545 -17.120 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -0.858 -17.348 -0.501 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.294 -18.925 -1.202 1.00 0.00 H new ATOM 0 HB3 ALA A 4 0.418 -18.493 -0.978 1.00 0.00 H new ATOM 57 N THR A 5 0.034 -15.333 -3.528 1.00 0.00 N ATOM 58 CA THR A 5 0.855 -14.148 -3.717 1.00 0.00 C ATOM 59 C THR A 5 -0.012 -12.888 -3.674 1.00 0.00 C ATOM 60 O THR A 5 -1.236 -12.968 -3.773 1.00 0.00 O ATOM 61 CB THR A 5 1.626 -14.311 -5.028 1.00 0.00 C ATOM 62 OG1 THR A 5 0.609 -14.341 -6.027 1.00 0.00 O ATOM 63 CG2 THR A 5 2.302 -15.679 -5.145 1.00 0.00 C ATOM 0 H THR A 5 -0.840 -15.336 -4.054 1.00 0.00 H new ATOM 0 HA THR A 5 1.579 -14.035 -2.910 1.00 0.00 H new ATOM 0 HB THR A 5 2.379 -13.526 -5.106 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.021 -14.443 -6.910 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.835 -15.741 -6.094 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.007 -15.808 -4.324 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.546 -16.463 -5.101 1.00 0.00 H new ATOM 71 N TYR A 6 0.656 -11.754 -3.525 1.00 0.00 N ATOM 72 CA TYR A 6 -0.037 -10.479 -3.468 1.00 0.00 C ATOM 73 C TYR A 6 0.691 -9.420 -4.300 1.00 0.00 C ATOM 74 O TYR A 6 1.919 -9.410 -4.360 1.00 0.00 O ATOM 75 CB TYR A 6 -0.019 -10.055 -1.998 1.00 0.00 C ATOM 76 CG TYR A 6 -1.363 -10.222 -1.285 1.00 0.00 C ATOM 77 CD1 TYR A 6 -1.809 -11.481 -0.940 1.00 0.00 C ATOM 78 CD2 TYR A 6 -2.129 -9.113 -0.988 1.00 0.00 C ATOM 79 CE1 TYR A 6 -3.074 -11.638 -0.270 1.00 0.00 C ATOM 80 CE2 TYR A 6 -3.393 -9.269 -0.319 1.00 0.00 C ATOM 81 CZ TYR A 6 -3.804 -10.524 0.008 1.00 0.00 C ATOM 82 OH TYR A 6 -4.999 -10.672 0.641 1.00 0.00 O ATOM 0 H TYR A 6 1.671 -11.692 -3.442 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.048 -10.574 -3.864 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.735 -10.640 -1.471 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.286 -9.011 -1.936 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -1.210 -12.349 -1.172 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.779 -8.128 -1.258 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -3.435 -12.618 0.006 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -4.002 -8.409 -0.082 1.00 0.00 H new ATOM 0 HH TYR A 6 -5.409 -9.792 0.775 1.00 0.00 H new ATOM 92 N THR A 7 -0.099 -8.557 -4.920 1.00 0.00 N ATOM 93 CA THR A 7 0.455 -7.497 -5.746 1.00 0.00 C ATOM 94 C THR A 7 0.049 -6.127 -5.199 1.00 0.00 C ATOM 95 O THR A 7 -1.113 -5.735 -5.299 1.00 0.00 O ATOM 96 CB THR A 7 0.001 -7.735 -7.188 1.00 0.00 C ATOM 97 OG1 THR A 7 0.337 -9.097 -7.437 1.00 0.00 O ATOM 98 CG2 THR A 7 0.838 -6.954 -8.202 1.00 0.00 C ATOM 0 H THR A 7 -1.118 -8.569 -4.868 1.00 0.00 H new ATOM 0 HA THR A 7 1.545 -7.509 -5.727 1.00 0.00 H new ATOM 0 HB THR A 7 -1.047 -7.454 -7.289 1.00 0.00 H new ATOM 0 HG1 THR A 7 0.075 -9.337 -8.350 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.474 -7.159 -9.209 1.00 0.00 H new ATOM 0 HG22 THR A 7 0.756 -5.887 -7.996 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.882 -7.259 -8.124 1.00 0.00 H new ATOM 106 N VAL A 8 1.028 -5.437 -4.634 1.00 0.00 N ATOM 107 CA VAL A 8 0.787 -4.119 -4.072 1.00 0.00 C ATOM 108 C VAL A 8 1.267 -3.053 -5.057 1.00 0.00 C ATOM 109 O VAL A 8 2.401 -3.106 -5.530 1.00 0.00 O ATOM 110 CB VAL A 8 1.452 -4.006 -2.698 1.00 0.00 C ATOM 111 CG1 VAL A 8 1.362 -2.577 -2.161 1.00 0.00 C ATOM 112 CG2 VAL A 8 0.842 -5.003 -1.711 1.00 0.00 C ATOM 0 H VAL A 8 1.990 -5.766 -4.553 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.280 -3.960 -3.916 1.00 0.00 H new ATOM 0 HB VAL A 8 2.507 -4.253 -2.815 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.842 -2.525 -1.184 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.865 -1.897 -2.849 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.315 -2.289 -2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 8 1.332 -4.902 -0.743 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -0.223 -4.801 -1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.982 -6.017 -2.085 1.00 0.00 H new ATOM 122 N THR A 9 0.380 -2.109 -5.338 1.00 0.00 N ATOM 123 CA THR A 9 0.700 -1.032 -6.259 1.00 0.00 C ATOM 124 C THR A 9 0.491 0.326 -5.585 1.00 0.00 C ATOM 125 O THR A 9 -0.564 0.580 -5.008 1.00 0.00 O ATOM 126 CB THR A 9 -0.146 -1.221 -7.520 1.00 0.00 C ATOM 127 OG1 THR A 9 0.038 -2.593 -7.858 1.00 0.00 O ATOM 128 CG2 THR A 9 0.417 -0.461 -8.723 1.00 0.00 C ATOM 0 H THR A 9 -0.560 -2.068 -4.944 1.00 0.00 H new ATOM 0 HA THR A 9 1.751 -1.058 -6.548 1.00 0.00 H new ATOM 0 HB THR A 9 -1.166 -0.888 -7.326 1.00 0.00 H new ATOM 0 HG1 THR A 9 -0.477 -2.803 -8.665 1.00 0.00 H new ATOM 0 HG21 THR A 9 -0.221 -0.629 -9.591 1.00 0.00 H new ATOM 0 HG22 THR A 9 0.449 0.605 -8.497 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.425 -0.817 -8.939 1.00 0.00 H new ATOM 136 N VAL A 10 1.515 1.162 -5.681 1.00 0.00 N ATOM 137 CA VAL A 10 1.457 2.487 -5.088 1.00 0.00 C ATOM 138 C VAL A 10 1.739 3.536 -6.166 1.00 0.00 C ATOM 139 O VAL A 10 2.752 3.461 -6.859 1.00 0.00 O ATOM 140 CB VAL A 10 2.420 2.572 -3.903 1.00 0.00 C ATOM 141 CG1 VAL A 10 2.854 4.018 -3.653 1.00 0.00 C ATOM 142 CG2 VAL A 10 1.798 1.962 -2.645 1.00 0.00 C ATOM 0 H VAL A 10 2.389 0.947 -6.161 1.00 0.00 H new ATOM 0 HA VAL A 10 0.461 2.687 -4.694 1.00 0.00 H new ATOM 0 HB VAL A 10 3.309 1.992 -4.152 1.00 0.00 H new ATOM 0 HG11 VAL A 10 3.538 4.051 -2.805 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.356 4.406 -4.540 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.978 4.629 -3.436 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.504 2.036 -1.818 1.00 0.00 H new ATOM 0 HG22 VAL A 10 0.885 2.501 -2.392 1.00 0.00 H new ATOM 0 HG23 VAL A 10 1.561 0.914 -2.828 1.00 0.00 H new ATOM 152 N THR A 11 0.825 4.490 -6.272 1.00 0.00 N ATOM 153 CA THR A 11 0.964 5.553 -7.253 1.00 0.00 C ATOM 154 C THR A 11 0.771 6.918 -6.591 1.00 0.00 C ATOM 155 O THR A 11 -0.126 7.092 -5.767 1.00 0.00 O ATOM 156 CB THR A 11 -0.028 5.282 -8.386 1.00 0.00 C ATOM 157 OG1 THR A 11 0.386 4.026 -8.918 1.00 0.00 O ATOM 158 CG2 THR A 11 0.139 6.255 -9.555 1.00 0.00 C ATOM 0 H THR A 11 -0.014 4.549 -5.695 1.00 0.00 H new ATOM 0 HA THR A 11 1.968 5.572 -7.677 1.00 0.00 H new ATOM 0 HB THR A 11 -1.046 5.348 -8.001 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.392 3.551 -9.278 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.589 6.019 -10.332 1.00 0.00 H new ATOM 0 HG22 THR A 11 -0.021 7.275 -9.205 1.00 0.00 H new ATOM 0 HG23 THR A 11 1.146 6.165 -9.962 1.00 0.00 H new ATOM 166 N ASN A 12 1.628 7.852 -6.974 1.00 0.00 N ATOM 167 CA ASN A 12 1.564 9.197 -6.428 1.00 0.00 C ATOM 168 C ASN A 12 0.862 10.117 -7.428 1.00 0.00 C ATOM 169 O ASN A 12 1.479 10.588 -8.383 1.00 0.00 O ATOM 170 CB ASN A 12 2.966 9.756 -6.175 1.00 0.00 C ATOM 171 CG ASN A 12 3.914 9.398 -7.321 1.00 0.00 C ATOM 172 OD1 ASN A 12 3.504 9.112 -8.434 1.00 0.00 O ATOM 173 ND2 ASN A 12 5.202 9.430 -6.989 1.00 0.00 N ATOM 0 H ASN A 12 2.371 7.704 -7.657 1.00 0.00 H new ATOM 0 HA ASN A 12 1.018 9.152 -5.486 1.00 0.00 H new ATOM 0 HB2 ASN A 12 2.915 10.839 -6.065 1.00 0.00 H new ATOM 0 HB3 ASN A 12 3.356 9.359 -5.238 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.914 9.207 -7.685 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.478 9.678 -6.039 1.00 0.00 H new ATOM 180 N ASN A 13 -0.419 10.345 -7.176 1.00 0.00 N ATOM 181 CA ASN A 13 -1.212 11.199 -8.042 1.00 0.00 C ATOM 182 C ASN A 13 -0.554 12.578 -8.134 1.00 0.00 C ATOM 183 O ASN A 13 -0.871 13.364 -9.025 1.00 0.00 O ATOM 184 CB ASN A 13 -2.626 11.386 -7.488 1.00 0.00 C ATOM 185 CG ASN A 13 -3.660 10.695 -8.379 1.00 0.00 C ATOM 186 OD1 ASN A 13 -4.090 11.217 -9.394 1.00 0.00 O ATOM 187 ND2 ASN A 13 -4.032 9.494 -7.944 1.00 0.00 N ATOM 0 H ASN A 13 -0.927 9.952 -6.383 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.269 10.725 -9.022 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.681 10.980 -6.478 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -2.855 12.449 -7.417 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.717 8.951 -8.469 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -3.632 9.116 -7.085 1.00 0.00 H new ATOM 194 N SER A 14 0.351 12.828 -7.199 1.00 0.00 N ATOM 195 CA SER A 14 1.056 14.098 -7.162 1.00 0.00 C ATOM 196 C SER A 14 2.142 14.126 -8.241 1.00 0.00 C ATOM 197 O SER A 14 2.409 15.172 -8.830 1.00 0.00 O ATOM 198 CB SER A 14 1.672 14.347 -5.783 1.00 0.00 C ATOM 199 OG SER A 14 1.895 15.732 -5.541 1.00 0.00 O ATOM 0 H SER A 14 0.612 12.173 -6.462 1.00 0.00 H new ATOM 0 HA SER A 14 0.337 14.893 -7.358 1.00 0.00 H new ATOM 0 HB2 SER A 14 1.012 13.946 -5.013 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.617 13.809 -5.705 1.00 0.00 H new ATOM 0 HG SER A 14 2.287 15.850 -4.651 1.00 0.00 H new ATOM 205 N ASN A 15 2.736 12.963 -8.466 1.00 0.00 N ATOM 206 CA ASN A 15 3.785 12.841 -9.464 1.00 0.00 C ATOM 207 C ASN A 15 3.274 11.998 -10.634 1.00 0.00 C ATOM 208 O ASN A 15 3.972 11.829 -11.633 1.00 0.00 O ATOM 209 CB ASN A 15 5.019 12.147 -8.883 1.00 0.00 C ATOM 210 CG ASN A 15 6.285 12.558 -9.637 1.00 0.00 C ATOM 211 OD1 ASN A 15 7.391 12.514 -8.900 1.00 0.00 O flip ATOM 212 ND2 ASN A 15 6.260 12.893 -10.810 1.00 0.00 N flip ATOM 0 H ASN A 15 2.511 12.098 -7.975 1.00 0.00 H new ATOM 0 HA ASN A 15 4.057 13.844 -9.793 1.00 0.00 H new ATOM 0 HB2 ASN A 15 5.121 12.402 -7.828 1.00 0.00 H new ATOM 0 HB3 ASN A 15 4.893 11.066 -8.939 1.00 0.00 H new ATOM 0 HD21 ASN A 15 5.376 12.905 -11.318 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.123 13.161 -11.282 1.00 0.00 H new ATOM 219 N GLY A 16 2.062 11.490 -10.471 1.00 0.00 N ATOM 220 CA GLY A 16 1.450 10.669 -11.502 1.00 0.00 C ATOM 221 C GLY A 16 2.289 9.419 -11.777 1.00 0.00 C ATOM 222 O GLY A 16 2.089 8.742 -12.784 1.00 0.00 O ATOM 0 H GLY A 16 1.487 11.631 -9.640 1.00 0.00 H new ATOM 0 HA2 GLY A 16 0.447 10.377 -11.192 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.344 11.249 -12.419 1.00 0.00 H new ATOM 226 N VAL A 17 3.210 9.151 -10.863 1.00 0.00 N ATOM 227 CA VAL A 17 4.080 7.995 -10.995 1.00 0.00 C ATOM 228 C VAL A 17 3.434 6.795 -10.301 1.00 0.00 C ATOM 229 O VAL A 17 3.050 6.880 -9.136 1.00 0.00 O ATOM 230 CB VAL A 17 5.472 8.323 -10.449 1.00 0.00 C ATOM 231 CG1 VAL A 17 6.306 7.052 -10.273 1.00 0.00 C ATOM 232 CG2 VAL A 17 6.190 9.329 -11.350 1.00 0.00 C ATOM 0 H VAL A 17 3.373 9.714 -10.028 1.00 0.00 H new ATOM 0 HA VAL A 17 4.210 7.733 -12.045 1.00 0.00 H new ATOM 0 HB VAL A 17 5.348 8.780 -9.467 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.290 7.314 -9.884 1.00 0.00 H new ATOM 0 HG12 VAL A 17 5.806 6.382 -9.574 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.417 6.554 -11.236 1.00 0.00 H new ATOM 0 HG21 VAL A 17 7.177 9.545 -10.940 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.297 8.910 -12.351 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.609 10.250 -11.402 1.00 0.00 H new ATOM 242 N SER A 18 3.336 5.703 -11.045 1.00 0.00 N ATOM 243 CA SER A 18 2.744 4.487 -10.517 1.00 0.00 C ATOM 244 C SER A 18 3.800 3.383 -10.432 1.00 0.00 C ATOM 245 O SER A 18 4.717 3.334 -11.251 1.00 0.00 O ATOM 246 CB SER A 18 1.565 4.029 -11.378 1.00 0.00 C ATOM 247 OG SER A 18 1.734 4.384 -12.747 1.00 0.00 O ATOM 0 H SER A 18 3.657 5.636 -12.011 1.00 0.00 H new ATOM 0 HA SER A 18 2.368 4.698 -9.516 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.454 2.948 -11.295 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.645 4.474 -10.999 1.00 0.00 H new ATOM 0 HG SER A 18 0.962 4.073 -13.263 1.00 0.00 H new ATOM 253 N VAL A 19 3.635 2.525 -9.437 1.00 0.00 N ATOM 254 CA VAL A 19 4.564 1.425 -9.236 1.00 0.00 C ATOM 255 C VAL A 19 3.809 0.225 -8.660 1.00 0.00 C ATOM 256 O VAL A 19 2.770 0.389 -8.023 1.00 0.00 O ATOM 257 CB VAL A 19 5.728 1.878 -8.354 1.00 0.00 C ATOM 258 CG1 VAL A 19 6.792 0.783 -8.245 1.00 0.00 C ATOM 259 CG2 VAL A 19 6.336 3.182 -8.875 1.00 0.00 C ATOM 0 H VAL A 19 2.872 2.568 -8.761 1.00 0.00 H new ATOM 0 HA VAL A 19 4.997 1.112 -10.186 1.00 0.00 H new ATOM 0 HB VAL A 19 5.337 2.066 -7.354 1.00 0.00 H new ATOM 0 HG11 VAL A 19 7.609 1.131 -7.612 1.00 0.00 H new ATOM 0 HG12 VAL A 19 6.350 -0.112 -7.807 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.176 0.549 -9.238 1.00 0.00 H new ATOM 0 HG21 VAL A 19 7.162 3.482 -8.230 1.00 0.00 H new ATOM 0 HG22 VAL A 19 6.705 3.032 -9.890 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.575 3.963 -8.877 1.00 0.00 H new ATOM 269 N ASP A 20 4.361 -0.954 -8.906 1.00 0.00 N ATOM 270 CA ASP A 20 3.754 -2.181 -8.419 1.00 0.00 C ATOM 271 C ASP A 20 4.835 -3.074 -7.809 1.00 0.00 C ATOM 272 O ASP A 20 5.979 -3.065 -8.260 1.00 0.00 O ATOM 273 CB ASP A 20 3.088 -2.955 -9.559 1.00 0.00 C ATOM 274 CG ASP A 20 2.747 -2.121 -10.795 1.00 0.00 C ATOM 275 OD1 ASP A 20 3.691 -1.519 -11.352 1.00 0.00 O ATOM 276 OD2 ASP A 20 1.550 -2.103 -11.155 1.00 0.00 O ATOM 0 H ASP A 20 5.222 -1.086 -9.436 1.00 0.00 H new ATOM 0 HA ASP A 20 3.002 -1.914 -7.676 1.00 0.00 H new ATOM 0 HB2 ASP A 20 3.748 -3.769 -9.859 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.172 -3.410 -9.182 1.00 0.00 H new ATOM 281 N TYR A 21 4.435 -3.825 -6.793 1.00 0.00 N ATOM 282 CA TYR A 21 5.356 -4.722 -6.117 1.00 0.00 C ATOM 283 C TYR A 21 4.687 -6.061 -5.804 1.00 0.00 C ATOM 284 O TYR A 21 3.624 -6.099 -5.186 1.00 0.00 O ATOM 285 CB TYR A 21 5.728 -4.032 -4.802 1.00 0.00 C ATOM 286 CG TYR A 21 6.219 -2.593 -4.972 1.00 0.00 C ATOM 287 CD1 TYR A 21 5.354 -1.617 -5.424 1.00 0.00 C ATOM 288 CD2 TYR A 21 7.527 -2.271 -4.673 1.00 0.00 C ATOM 289 CE1 TYR A 21 5.816 -0.262 -5.584 1.00 0.00 C ATOM 290 CE2 TYR A 21 7.990 -0.916 -4.833 1.00 0.00 C ATOM 291 CZ TYR A 21 7.112 0.020 -5.280 1.00 0.00 C ATOM 292 OH TYR A 21 7.548 1.300 -5.431 1.00 0.00 O ATOM 0 H TYR A 21 3.485 -3.830 -6.422 1.00 0.00 H new ATOM 0 HA TYR A 21 6.224 -4.924 -6.744 1.00 0.00 H new ATOM 0 HB2 TYR A 21 4.859 -4.033 -4.144 1.00 0.00 H new ATOM 0 HB3 TYR A 21 6.504 -4.614 -4.305 1.00 0.00 H new ATOM 0 HD1 TYR A 21 4.330 -1.869 -5.658 1.00 0.00 H new ATOM 0 HD2 TYR A 21 8.204 -3.035 -4.319 1.00 0.00 H new ATOM 0 HE1 TYR A 21 5.150 0.511 -5.937 1.00 0.00 H new ATOM 0 HE2 TYR A 21 9.011 -0.650 -4.603 1.00 0.00 H new ATOM 0 HH TYR A 21 6.979 1.903 -4.908 1.00 0.00 H new ATOM 302 N GLU A 22 5.336 -7.129 -6.245 1.00 0.00 N ATOM 303 CA GLU A 22 4.816 -8.466 -6.021 1.00 0.00 C ATOM 304 C GLU A 22 5.622 -9.172 -4.928 1.00 0.00 C ATOM 305 O GLU A 22 6.794 -9.491 -5.124 1.00 0.00 O ATOM 306 CB GLU A 22 4.820 -9.280 -7.316 1.00 0.00 C ATOM 307 CG GLU A 22 4.391 -10.726 -7.056 1.00 0.00 C ATOM 308 CD GLU A 22 4.798 -11.636 -8.217 1.00 0.00 C ATOM 309 OE1 GLU A 22 5.877 -11.374 -8.792 1.00 0.00 O ATOM 310 OE2 GLU A 22 4.021 -12.572 -8.504 1.00 0.00 O ATOM 0 H GLU A 22 6.218 -7.095 -6.757 1.00 0.00 H new ATOM 0 HA GLU A 22 3.782 -8.381 -5.687 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.146 -8.822 -8.040 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.817 -9.266 -7.755 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.846 -11.084 -6.132 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.311 -10.769 -6.917 1.00 0.00 H new ATOM 317 N THR A 23 4.963 -9.395 -3.801 1.00 0.00 N ATOM 318 CA THR A 23 5.603 -10.057 -2.677 1.00 0.00 C ATOM 319 C THR A 23 4.646 -11.063 -2.035 1.00 0.00 C ATOM 320 O THR A 23 3.454 -10.789 -1.895 1.00 0.00 O ATOM 321 CB THR A 23 6.091 -8.978 -1.709 1.00 0.00 C ATOM 322 OG1 THR A 23 6.877 -9.694 -0.758 1.00 0.00 O ATOM 323 CG2 THR A 23 4.954 -8.379 -0.878 1.00 0.00 C ATOM 0 H THR A 23 3.991 -9.129 -3.642 1.00 0.00 H new ATOM 0 HA THR A 23 6.466 -10.639 -2.999 1.00 0.00 H new ATOM 0 HB THR A 23 6.587 -8.186 -2.269 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.235 -9.070 -0.093 1.00 0.00 H new ATOM 0 HG21 THR A 23 5.355 -7.619 -0.208 1.00 0.00 H new ATOM 0 HG22 THR A 23 4.218 -7.926 -1.542 1.00 0.00 H new ATOM 0 HG23 THR A 23 4.479 -9.165 -0.292 1.00 0.00 H new ATOM 331 N GLU A 24 5.202 -12.205 -1.660 1.00 0.00 N ATOM 332 CA GLU A 24 4.413 -13.252 -1.036 1.00 0.00 C ATOM 333 C GLU A 24 4.418 -13.086 0.486 1.00 0.00 C ATOM 334 O GLU A 24 5.324 -13.566 1.164 1.00 0.00 O ATOM 335 CB GLU A 24 4.925 -14.638 -1.436 1.00 0.00 C ATOM 336 CG GLU A 24 4.362 -15.058 -2.795 1.00 0.00 C ATOM 337 CD GLU A 24 4.888 -16.435 -3.204 1.00 0.00 C ATOM 338 OE1 GLU A 24 4.450 -17.421 -2.572 1.00 0.00 O ATOM 339 OE2 GLU A 24 5.716 -16.472 -4.139 1.00 0.00 O ATOM 0 H GLU A 24 6.190 -12.428 -1.777 1.00 0.00 H new ATOM 0 HA GLU A 24 3.386 -13.163 -1.389 1.00 0.00 H new ATOM 0 HB2 GLU A 24 6.014 -14.630 -1.476 1.00 0.00 H new ATOM 0 HB3 GLU A 24 4.639 -15.368 -0.679 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.273 -15.079 -2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.636 -14.321 -3.550 1.00 0.00 H new ATOM 346 N THR A 25 3.394 -12.403 0.978 1.00 0.00 N ATOM 347 CA THR A 25 3.269 -12.166 2.405 1.00 0.00 C ATOM 348 C THR A 25 1.842 -12.463 2.871 1.00 0.00 C ATOM 349 O THR A 25 0.910 -11.736 2.533 1.00 0.00 O ATOM 350 CB THR A 25 3.713 -10.730 2.687 1.00 0.00 C ATOM 351 OG1 THR A 25 3.033 -9.956 1.703 1.00 0.00 O ATOM 352 CG2 THR A 25 5.195 -10.505 2.380 1.00 0.00 C ATOM 0 H THR A 25 2.643 -12.006 0.413 1.00 0.00 H new ATOM 0 HA THR A 25 3.911 -12.837 2.975 1.00 0.00 H new ATOM 0 HB THR A 25 3.518 -10.488 3.732 1.00 0.00 H new ATOM 0 HG1 THR A 25 2.126 -10.306 1.581 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.459 -9.470 2.597 1.00 0.00 H new ATOM 0 HG22 THR A 25 5.799 -11.170 2.996 1.00 0.00 H new ATOM 0 HG23 THR A 25 5.384 -10.714 1.327 1.00 0.00 H new ATOM 360 N PRO A 26 1.713 -13.562 3.662 1.00 0.00 N ATOM 361 CA PRO A 26 0.416 -13.964 4.179 1.00 0.00 C ATOM 362 C PRO A 26 -0.028 -13.047 5.321 1.00 0.00 C ATOM 363 O PRO A 26 -0.737 -12.068 5.096 1.00 0.00 O ATOM 364 CB PRO A 26 0.597 -15.409 4.614 1.00 0.00 C ATOM 365 CG PRO A 26 2.095 -15.617 4.757 1.00 0.00 C ATOM 366 CD PRO A 26 2.795 -14.447 4.085 1.00 0.00 C ATOM 0 HA PRO A 26 -0.377 -13.882 3.436 1.00 0.00 H new ATOM 0 HB2 PRO A 26 0.085 -15.600 5.557 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.176 -16.094 3.878 1.00 0.00 H new ATOM 0 HG2 PRO A 26 2.373 -15.675 5.809 1.00 0.00 H new ATOM 0 HG3 PRO A 26 2.395 -16.558 4.295 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.473 -13.943 4.773 1.00 0.00 H new ATOM 0 HD3 PRO A 26 3.392 -14.778 3.235 1.00 0.00 H new ATOM 374 N MET A 27 0.409 -13.397 6.522 1.00 0.00 N ATOM 375 CA MET A 27 0.066 -12.618 7.699 1.00 0.00 C ATOM 376 C MET A 27 0.851 -11.306 7.737 1.00 0.00 C ATOM 377 O MET A 27 0.389 -10.317 8.304 1.00 0.00 O ATOM 378 CB MET A 27 0.371 -13.432 8.958 1.00 0.00 C ATOM 379 CG MET A 27 -0.459 -14.717 8.995 1.00 0.00 C ATOM 380 SD MET A 27 -1.487 -14.737 10.453 1.00 0.00 S ATOM 381 CE MET A 27 -3.102 -14.741 9.693 1.00 0.00 C ATOM 0 H MET A 27 0.998 -14.210 6.705 1.00 0.00 H new ATOM 0 HA MET A 27 -0.997 -12.382 7.657 1.00 0.00 H new ATOM 0 HB2 MET A 27 1.432 -13.679 8.987 1.00 0.00 H new ATOM 0 HB3 MET A 27 0.159 -12.832 9.843 1.00 0.00 H new ATOM 0 HG2 MET A 27 -1.080 -14.785 8.101 1.00 0.00 H new ATOM 0 HG3 MET A 27 0.200 -15.585 8.992 1.00 0.00 H new ATOM 0 HE1 MET A 27 -3.869 -14.753 10.468 1.00 0.00 H new ATOM 0 HE2 MET A 27 -3.218 -13.846 9.081 1.00 0.00 H new ATOM 0 HE3 MET A 27 -3.207 -15.626 9.065 1.00 0.00 H new ATOM 391 N THR A 28 2.026 -11.338 7.125 1.00 0.00 N ATOM 392 CA THR A 28 2.880 -10.164 7.081 1.00 0.00 C ATOM 393 C THR A 28 2.095 -8.952 6.575 1.00 0.00 C ATOM 394 O THR A 28 2.452 -7.812 6.866 1.00 0.00 O ATOM 395 CB THR A 28 4.100 -10.499 6.220 1.00 0.00 C ATOM 396 OG1 THR A 28 3.857 -11.831 5.776 1.00 0.00 O ATOM 397 CG2 THR A 28 5.385 -10.610 7.044 1.00 0.00 C ATOM 0 H THR A 28 2.406 -12.160 6.655 1.00 0.00 H new ATOM 0 HA THR A 28 3.231 -9.893 8.077 1.00 0.00 H new ATOM 0 HB THR A 28 4.224 -9.734 5.454 1.00 0.00 H new ATOM 0 HG1 THR A 28 4.599 -12.127 5.209 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.220 -10.849 6.385 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.578 -9.662 7.546 1.00 0.00 H new ATOM 0 HG23 THR A 28 5.273 -11.398 7.788 1.00 0.00 H new ATOM 405 N LEU A 29 1.040 -9.241 5.827 1.00 0.00 N ATOM 406 CA LEU A 29 0.201 -8.189 5.278 1.00 0.00 C ATOM 407 C LEU A 29 -0.426 -7.392 6.424 1.00 0.00 C ATOM 408 O LEU A 29 -0.575 -6.175 6.331 1.00 0.00 O ATOM 409 CB LEU A 29 -0.823 -8.774 4.303 1.00 0.00 C ATOM 410 CG LEU A 29 -0.303 -9.102 2.902 1.00 0.00 C ATOM 411 CD1 LEU A 29 -1.262 -10.041 2.168 1.00 0.00 C ATOM 412 CD2 LEU A 29 -0.031 -7.823 2.105 1.00 0.00 C ATOM 0 H LEU A 29 0.747 -10.188 5.588 1.00 0.00 H new ATOM 0 HA LEU A 29 0.800 -7.490 4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.232 -9.685 4.740 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.648 -8.068 4.207 1.00 0.00 H new ATOM 0 HG LEU A 29 0.647 -9.627 3.004 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.869 -10.258 1.175 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -1.363 -10.970 2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.238 -9.565 2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.338 -8.084 1.113 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.954 -7.250 2.010 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.717 -7.223 2.624 1.00 0.00 H new ATOM 424 N LEU A 30 -0.778 -8.113 7.480 1.00 0.00 N ATOM 425 CA LEU A 30 -1.385 -7.489 8.643 1.00 0.00 C ATOM 426 C LEU A 30 -0.290 -6.880 9.520 1.00 0.00 C ATOM 427 O LEU A 30 -0.551 -5.962 10.296 1.00 0.00 O ATOM 428 CB LEU A 30 -2.281 -8.487 9.380 1.00 0.00 C ATOM 429 CG LEU A 30 -3.146 -9.390 8.499 1.00 0.00 C ATOM 430 CD1 LEU A 30 -4.119 -10.213 9.345 1.00 0.00 C ATOM 431 CD2 LEU A 30 -3.869 -8.576 7.423 1.00 0.00 C ATOM 0 H LEU A 30 -0.654 -9.123 7.554 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.040 -6.673 8.339 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.650 -9.119 10.005 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -2.937 -7.930 10.050 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.491 -10.094 7.985 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -4.722 -10.846 8.694 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.558 -10.837 10.040 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -4.771 -9.543 9.905 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.477 -9.242 6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -4.510 -7.833 7.898 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -3.135 -8.073 6.793 1.00 0.00 H new ATOM 443 N VAL A 31 0.912 -7.416 9.368 1.00 0.00 N ATOM 444 CA VAL A 31 2.048 -6.936 10.137 1.00 0.00 C ATOM 445 C VAL A 31 2.308 -5.469 9.793 1.00 0.00 C ATOM 446 O VAL A 31 2.325 -5.096 8.621 1.00 0.00 O ATOM 447 CB VAL A 31 3.263 -7.834 9.890 1.00 0.00 C ATOM 448 CG1 VAL A 31 4.510 -7.266 10.571 1.00 0.00 C ATOM 449 CG2 VAL A 31 2.990 -9.266 10.352 1.00 0.00 C ATOM 0 H VAL A 31 1.124 -8.178 8.724 1.00 0.00 H new ATOM 0 HA VAL A 31 1.836 -6.986 11.205 1.00 0.00 H new ATOM 0 HB VAL A 31 3.449 -7.859 8.816 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.359 -7.922 10.381 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.722 -6.274 10.173 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.338 -7.197 11.645 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.869 -9.883 10.165 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.766 -9.268 11.419 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.140 -9.670 9.802 1.00 0.00 H new ATOM 459 N PRO A 32 2.510 -4.655 10.864 1.00 0.00 N ATOM 460 CA PRO A 32 2.769 -3.236 10.686 1.00 0.00 C ATOM 461 C PRO A 32 4.197 -2.997 10.192 1.00 0.00 C ATOM 462 O PRO A 32 4.418 -2.194 9.286 1.00 0.00 O ATOM 463 CB PRO A 32 2.500 -2.614 12.048 1.00 0.00 C ATOM 464 CG PRO A 32 2.553 -3.759 13.046 1.00 0.00 C ATOM 465 CD PRO A 32 2.497 -5.062 12.265 1.00 0.00 C ATOM 0 HA PRO A 32 2.134 -2.785 9.923 1.00 0.00 H new ATOM 0 HB2 PRO A 32 3.245 -1.855 12.285 1.00 0.00 H new ATOM 0 HB3 PRO A 32 1.527 -2.123 12.068 1.00 0.00 H new ATOM 0 HG2 PRO A 32 3.467 -3.708 13.637 1.00 0.00 H new ATOM 0 HG3 PRO A 32 1.718 -3.696 13.744 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.348 -5.701 12.500 1.00 0.00 H new ATOM 0 HD3 PRO A 32 1.597 -5.629 12.504 1.00 0.00 H new ATOM 473 N GLU A 33 5.130 -3.708 10.808 1.00 0.00 N ATOM 474 CA GLU A 33 6.530 -3.583 10.442 1.00 0.00 C ATOM 475 C GLU A 33 6.727 -3.937 8.966 1.00 0.00 C ATOM 476 O GLU A 33 7.561 -3.341 8.286 1.00 0.00 O ATOM 477 CB GLU A 33 7.411 -4.458 11.336 1.00 0.00 C ATOM 478 CG GLU A 33 6.929 -4.417 12.788 1.00 0.00 C ATOM 479 CD GLU A 33 8.063 -4.773 13.752 1.00 0.00 C ATOM 480 OE1 GLU A 33 8.889 -3.872 14.012 1.00 0.00 O ATOM 481 OE2 GLU A 33 8.077 -5.936 14.207 1.00 0.00 O ATOM 0 H GLU A 33 4.943 -4.373 11.559 1.00 0.00 H new ATOM 0 HA GLU A 33 6.832 -2.546 10.591 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.397 -5.486 10.973 1.00 0.00 H new ATOM 0 HB3 GLU A 33 8.444 -4.115 11.282 1.00 0.00 H new ATOM 0 HG2 GLU A 33 6.548 -3.423 13.021 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.102 -5.114 12.920 1.00 0.00 H new ATOM 488 N VAL A 34 5.942 -4.904 8.512 1.00 0.00 N ATOM 489 CA VAL A 34 6.020 -5.344 7.130 1.00 0.00 C ATOM 490 C VAL A 34 5.246 -4.366 6.245 1.00 0.00 C ATOM 491 O VAL A 34 5.726 -3.975 5.181 1.00 0.00 O ATOM 492 CB VAL A 34 5.516 -6.784 7.010 1.00 0.00 C ATOM 493 CG1 VAL A 34 5.416 -7.210 5.545 1.00 0.00 C ATOM 494 CG2 VAL A 34 6.407 -7.745 7.800 1.00 0.00 C ATOM 0 H VAL A 34 5.249 -5.395 9.077 1.00 0.00 H new ATOM 0 HA VAL A 34 7.055 -5.346 6.787 1.00 0.00 H new ATOM 0 HB VAL A 34 4.515 -6.825 7.440 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.056 -8.237 5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.722 -6.553 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.399 -7.144 5.079 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.026 -8.761 7.698 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.425 -7.698 7.413 1.00 0.00 H new ATOM 0 HG23 VAL A 34 6.405 -7.461 8.852 1.00 0.00 H new ATOM 504 N ALA A 35 4.064 -3.998 6.715 1.00 0.00 N ATOM 505 CA ALA A 35 3.221 -3.071 5.979 1.00 0.00 C ATOM 506 C ALA A 35 3.912 -1.709 5.904 1.00 0.00 C ATOM 507 O ALA A 35 3.897 -1.059 4.859 1.00 0.00 O ATOM 508 CB ALA A 35 1.846 -2.992 6.646 1.00 0.00 C ATOM 0 H ALA A 35 3.669 -4.325 7.597 1.00 0.00 H new ATOM 0 HA ALA A 35 3.068 -3.419 4.957 1.00 0.00 H new ATOM 0 HB1 ALA A 35 1.213 -2.297 6.094 1.00 0.00 H new ATOM 0 HB2 ALA A 35 1.385 -3.980 6.647 1.00 0.00 H new ATOM 0 HB3 ALA A 35 1.959 -2.643 7.673 1.00 0.00 H new ATOM 514 N ALA A 36 4.500 -1.316 7.023 1.00 0.00 N ATOM 515 CA ALA A 36 5.196 -0.043 7.097 1.00 0.00 C ATOM 516 C ALA A 36 6.359 -0.044 6.104 1.00 0.00 C ATOM 517 O ALA A 36 6.515 0.894 5.324 1.00 0.00 O ATOM 518 CB ALA A 36 5.656 0.205 8.534 1.00 0.00 C ATOM 0 H ALA A 36 4.509 -1.857 7.887 1.00 0.00 H new ATOM 0 HA ALA A 36 4.530 0.775 6.823 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.178 1.160 8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.789 0.226 9.195 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.329 -0.595 8.844 1.00 0.00 H new ATOM 524 N GLU A 37 7.147 -1.108 6.165 1.00 0.00 N ATOM 525 CA GLU A 37 8.292 -1.243 5.281 1.00 0.00 C ATOM 526 C GLU A 37 7.830 -1.345 3.826 1.00 0.00 C ATOM 527 O GLU A 37 8.504 -0.854 2.922 1.00 0.00 O ATOM 528 CB GLU A 37 9.146 -2.452 5.670 1.00 0.00 C ATOM 529 CG GLU A 37 10.197 -2.067 6.713 1.00 0.00 C ATOM 530 CD GLU A 37 11.359 -3.063 6.713 1.00 0.00 C ATOM 531 OE1 GLU A 37 11.065 -4.278 6.685 1.00 0.00 O ATOM 532 OE2 GLU A 37 12.514 -2.587 6.741 1.00 0.00 O ATOM 0 H GLU A 37 7.015 -1.884 6.813 1.00 0.00 H new ATOM 0 HA GLU A 37 8.912 -0.353 5.384 1.00 0.00 H new ATOM 0 HB2 GLU A 37 8.507 -3.241 6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.638 -2.855 4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 37 10.572 -1.065 6.504 1.00 0.00 H new ATOM 0 HG3 GLU A 37 9.739 -2.036 7.702 1.00 0.00 H new ATOM 539 N VAL A 38 6.684 -1.984 3.645 1.00 0.00 N ATOM 540 CA VAL A 38 6.124 -2.156 2.315 1.00 0.00 C ATOM 541 C VAL A 38 5.643 -0.801 1.791 1.00 0.00 C ATOM 542 O VAL A 38 6.027 -0.382 0.700 1.00 0.00 O ATOM 543 CB VAL A 38 5.017 -3.212 2.346 1.00 0.00 C ATOM 544 CG1 VAL A 38 3.985 -2.955 1.246 1.00 0.00 C ATOM 545 CG2 VAL A 38 5.601 -4.621 2.232 1.00 0.00 C ATOM 0 H VAL A 38 6.127 -2.389 4.398 1.00 0.00 H new ATOM 0 HA VAL A 38 6.884 -2.521 1.624 1.00 0.00 H new ATOM 0 HB VAL A 38 4.508 -3.137 3.307 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.209 -3.719 1.289 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.535 -1.973 1.391 1.00 0.00 H new ATOM 0 HG13 VAL A 38 4.474 -2.990 0.273 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.793 -5.353 2.257 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.146 -4.714 1.293 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.280 -4.802 3.065 1.00 0.00 H new ATOM 555 N ILE A 39 4.810 -0.153 2.592 1.00 0.00 N ATOM 556 CA ILE A 39 4.274 1.145 2.222 1.00 0.00 C ATOM 557 C ILE A 39 5.428 2.115 1.965 1.00 0.00 C ATOM 558 O ILE A 39 5.440 2.818 0.956 1.00 0.00 O ATOM 559 CB ILE A 39 3.282 1.636 3.278 1.00 0.00 C ATOM 560 CG1 ILE A 39 2.027 0.760 3.301 1.00 0.00 C ATOM 561 CG2 ILE A 39 2.946 3.114 3.072 1.00 0.00 C ATOM 562 CD1 ILE A 39 1.121 1.069 2.107 1.00 0.00 C ATOM 0 H ILE A 39 4.493 -0.503 3.496 1.00 0.00 H new ATOM 0 HA ILE A 39 3.707 1.072 1.294 1.00 0.00 H new ATOM 0 HB ILE A 39 3.754 1.548 4.256 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.313 -0.292 3.283 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.480 0.926 4.229 1.00 0.00 H new ATOM 0 HG21 ILE A 39 2.239 3.436 3.836 1.00 0.00 H new ATOM 0 HG22 ILE A 39 3.857 3.708 3.147 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.502 3.252 2.086 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.237 0.433 2.147 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.817 2.115 2.142 1.00 0.00 H new ATOM 0 HD13 ILE A 39 1.663 0.879 1.180 1.00 0.00 H new ATOM 574 N LYS A 40 6.371 2.123 2.896 1.00 0.00 N ATOM 575 CA LYS A 40 7.527 2.995 2.784 1.00 0.00 C ATOM 576 C LYS A 40 8.384 2.548 1.598 1.00 0.00 C ATOM 577 O LYS A 40 8.833 3.375 0.805 1.00 0.00 O ATOM 578 CB LYS A 40 8.290 3.048 4.109 1.00 0.00 C ATOM 579 CG LYS A 40 9.798 3.156 3.871 1.00 0.00 C ATOM 580 CD LYS A 40 10.465 1.782 3.957 1.00 0.00 C ATOM 581 CE LYS A 40 11.887 1.827 3.393 1.00 0.00 C ATOM 582 NZ LYS A 40 12.764 2.641 4.264 1.00 0.00 N ATOM 0 H LYS A 40 6.357 1.539 3.732 1.00 0.00 H new ATOM 0 HA LYS A 40 7.213 4.019 2.583 1.00 0.00 H new ATOM 0 HB2 LYS A 40 7.949 3.901 4.695 1.00 0.00 H new ATOM 0 HB3 LYS A 40 8.074 2.153 4.693 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.985 3.594 2.891 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.239 3.826 4.609 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.492 1.451 4.995 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.874 1.051 3.405 1.00 0.00 H new ATOM 0 HE2 LYS A 40 12.284 0.815 3.311 1.00 0.00 H new ATOM 0 HE3 LYS A 40 11.873 2.247 2.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 13.729 2.647 3.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 12.402 3.615 4.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.778 2.233 5.221 1.00 0.00 H new ATOM 596 N ASP A 41 8.586 1.242 1.514 1.00 0.00 N ATOM 597 CA ASP A 41 9.382 0.675 0.439 1.00 0.00 C ATOM 598 C ASP A 41 8.774 1.077 -0.906 1.00 0.00 C ATOM 599 O ASP A 41 9.491 1.476 -1.821 1.00 0.00 O ATOM 600 CB ASP A 41 9.398 -0.853 0.513 1.00 0.00 C ATOM 601 CG ASP A 41 9.931 -1.556 -0.738 1.00 0.00 C ATOM 602 OD1 ASP A 41 10.982 -1.102 -1.239 1.00 0.00 O ATOM 603 OD2 ASP A 41 9.275 -2.530 -1.165 1.00 0.00 O ATOM 0 H ASP A 41 8.212 0.559 2.173 1.00 0.00 H new ATOM 0 HA ASP A 41 10.400 1.052 0.538 1.00 0.00 H new ATOM 0 HB2 ASP A 41 10.005 -1.154 1.367 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.384 -1.203 0.704 1.00 0.00 H new ATOM 608 N LEU A 42 7.456 0.957 -0.983 1.00 0.00 N ATOM 609 CA LEU A 42 6.744 1.303 -2.201 1.00 0.00 C ATOM 610 C LEU A 42 7.003 2.772 -2.538 1.00 0.00 C ATOM 611 O LEU A 42 7.387 3.097 -3.661 1.00 0.00 O ATOM 612 CB LEU A 42 5.259 0.955 -2.071 1.00 0.00 C ATOM 613 CG LEU A 42 4.872 -0.478 -2.440 1.00 0.00 C ATOM 614 CD1 LEU A 42 4.530 -1.294 -1.191 1.00 0.00 C ATOM 615 CD2 LEU A 42 3.734 -0.493 -3.463 1.00 0.00 C ATOM 0 H LEU A 42 6.864 0.625 -0.222 1.00 0.00 H new ATOM 0 HA LEU A 42 7.114 0.713 -3.039 1.00 0.00 H new ATOM 0 HB2 LEU A 42 4.952 1.140 -1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.689 1.638 -2.701 1.00 0.00 H new ATOM 0 HG LEU A 42 5.733 -0.953 -2.909 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.258 -2.309 -1.482 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.395 -1.326 -0.529 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.692 -0.829 -0.671 1.00 0.00 H new ATOM 0 HD21 LEU A 42 3.478 -1.524 -3.708 1.00 0.00 H new ATOM 0 HD22 LEU A 42 2.861 0.007 -3.044 1.00 0.00 H new ATOM 0 HD23 LEU A 42 4.051 0.027 -4.367 1.00 0.00 H new ATOM 627 N VAL A 43 6.784 3.622 -1.546 1.00 0.00 N ATOM 628 CA VAL A 43 6.989 5.049 -1.724 1.00 0.00 C ATOM 629 C VAL A 43 8.473 5.318 -1.984 1.00 0.00 C ATOM 630 O VAL A 43 8.823 6.034 -2.921 1.00 0.00 O ATOM 631 CB VAL A 43 6.448 5.811 -0.512 1.00 0.00 C ATOM 632 CG1 VAL A 43 7.251 7.089 -0.264 1.00 0.00 C ATOM 633 CG2 VAL A 43 4.959 6.124 -0.682 1.00 0.00 C ATOM 0 H VAL A 43 6.466 3.350 -0.616 1.00 0.00 H new ATOM 0 HA VAL A 43 6.436 5.409 -2.591 1.00 0.00 H new ATOM 0 HB VAL A 43 6.559 5.171 0.363 1.00 0.00 H new ATOM 0 HG11 VAL A 43 6.846 7.611 0.603 1.00 0.00 H new ATOM 0 HG12 VAL A 43 8.294 6.833 -0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.186 7.735 -1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.599 6.666 0.193 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.815 6.736 -1.572 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.401 5.193 -0.787 1.00 0.00 H new ATOM 643 N ASN A 44 9.305 4.729 -1.139 1.00 0.00 N ATOM 644 CA ASN A 44 10.743 4.896 -1.266 1.00 0.00 C ATOM 645 C ASN A 44 11.185 4.440 -2.657 1.00 0.00 C ATOM 646 O ASN A 44 12.082 5.033 -3.254 1.00 0.00 O ATOM 647 CB ASN A 44 11.489 4.051 -0.232 1.00 0.00 C ATOM 648 CG ASN A 44 11.956 4.910 0.946 1.00 0.00 C ATOM 649 OD1 ASN A 44 10.973 5.313 1.745 1.00 0.00 O flip ATOM 650 ND2 ASN A 44 13.131 5.188 1.117 1.00 0.00 N flip ATOM 0 H ASN A 44 9.011 4.135 -0.363 1.00 0.00 H new ATOM 0 HA ASN A 44 10.975 5.949 -1.106 1.00 0.00 H new ATOM 0 HB2 ASN A 44 10.838 3.255 0.130 1.00 0.00 H new ATOM 0 HB3 ASN A 44 12.349 3.572 -0.701 1.00 0.00 H new ATOM 0 HD21 ASN A 44 13.836 4.845 0.465 1.00 0.00 H new ATOM 0 HD22 ASN A 44 13.408 5.763 1.912 1.00 0.00 H new ATOM 657 N THR A 45 10.534 3.389 -3.134 1.00 0.00 N ATOM 658 CA THR A 45 10.848 2.846 -4.444 1.00 0.00 C ATOM 659 C THR A 45 10.313 3.764 -5.545 1.00 0.00 C ATOM 660 O THR A 45 11.011 4.044 -6.519 1.00 0.00 O ATOM 661 CB THR A 45 10.287 1.424 -4.514 1.00 0.00 C ATOM 662 OG1 THR A 45 11.208 0.649 -3.751 1.00 0.00 O ATOM 663 CG2 THR A 45 10.373 0.827 -5.921 1.00 0.00 C ATOM 0 H THR A 45 9.790 2.899 -2.636 1.00 0.00 H new ATOM 0 HA THR A 45 11.925 2.795 -4.602 1.00 0.00 H new ATOM 0 HB THR A 45 9.248 1.428 -4.185 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.899 0.594 -2.823 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.962 -0.182 -5.914 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.804 1.446 -6.614 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.415 0.792 -6.238 1.00 0.00 H new ATOM 925 N LYS B 203 -2.423 18.197 -7.264 1.00 0.00 N ATOM 926 CA LYS B 203 -2.849 17.801 -5.932 1.00 0.00 C ATOM 927 C LYS B 203 -1.942 16.677 -5.425 1.00 0.00 C ATOM 928 O LYS B 203 -1.331 15.963 -6.218 1.00 0.00 O ATOM 929 CB LYS B 203 -4.335 17.440 -5.930 1.00 0.00 C ATOM 930 CG LYS B 203 -4.997 17.848 -4.611 1.00 0.00 C ATOM 931 CD LYS B 203 -6.511 17.984 -4.777 1.00 0.00 C ATOM 932 CE LYS B 203 -6.947 19.445 -4.649 1.00 0.00 C ATOM 933 NZ LYS B 203 -8.399 19.577 -4.903 1.00 0.00 N ATOM 0 HA LYS B 203 -2.746 18.633 -5.236 1.00 0.00 H new ATOM 0 HB2 LYS B 203 -4.835 17.938 -6.761 1.00 0.00 H new ATOM 0 HB3 LYS B 203 -4.453 16.367 -6.083 1.00 0.00 H new ATOM 0 HG2 LYS B 203 -4.777 17.105 -3.844 1.00 0.00 H new ATOM 0 HG3 LYS B 203 -4.579 18.794 -4.267 1.00 0.00 H new ATOM 0 HD2 LYS B 203 -6.810 17.595 -5.750 1.00 0.00 H new ATOM 0 HD3 LYS B 203 -7.019 17.382 -4.024 1.00 0.00 H new ATOM 0 HE2 LYS B 203 -6.711 19.815 -3.651 1.00 0.00 H new ATOM 0 HE3 LYS B 203 -6.391 20.060 -5.356 1.00 0.00 H new ATOM 0 HZ1 LYS B 203 -8.678 20.575 -4.812 1.00 0.00 H new ATOM 0 HZ2 LYS B 203 -8.615 19.243 -5.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 203 -8.926 19.006 -4.212 1.00 0.00 H new ATOM 947 N ALA B 204 -1.885 16.557 -4.107 1.00 0.00 N ATOM 948 CA ALA B 204 -1.063 15.532 -3.484 1.00 0.00 C ATOM 949 C ALA B 204 -1.959 14.391 -3.001 1.00 0.00 C ATOM 950 O ALA B 204 -2.687 14.540 -2.020 1.00 0.00 O ATOM 951 CB ALA B 204 -0.246 16.153 -2.349 1.00 0.00 C ATOM 0 H ALA B 204 -2.394 17.152 -3.453 1.00 0.00 H new ATOM 0 HA ALA B 204 -0.358 15.115 -4.203 1.00 0.00 H new ATOM 0 HB1 ALA B 204 0.370 15.385 -1.882 1.00 0.00 H new ATOM 0 HB2 ALA B 204 0.395 16.938 -2.750 1.00 0.00 H new ATOM 0 HB3 ALA B 204 -0.920 16.579 -1.606 1.00 0.00 H new ATOM 957 N THR B 205 -1.878 13.275 -3.712 1.00 0.00 N ATOM 958 CA THR B 205 -2.672 12.109 -3.368 1.00 0.00 C ATOM 959 C THR B 205 -1.917 10.826 -3.722 1.00 0.00 C ATOM 960 O THR B 205 -0.977 10.854 -4.515 1.00 0.00 O ATOM 961 CB THR B 205 -4.024 12.232 -4.072 1.00 0.00 C ATOM 962 OG1 THR B 205 -3.687 12.596 -5.407 1.00 0.00 O ATOM 963 CG2 THR B 205 -4.846 13.417 -3.559 1.00 0.00 C ATOM 0 H THR B 205 -1.274 13.155 -4.525 1.00 0.00 H new ATOM 0 HA THR B 205 -2.853 12.057 -2.294 1.00 0.00 H new ATOM 0 HB THR B 205 -4.590 11.311 -3.934 1.00 0.00 H new ATOM 0 HG1 THR B 205 -4.506 12.695 -5.936 1.00 0.00 H new ATOM 0 HG21 THR B 205 -5.796 13.459 -4.092 1.00 0.00 H new ATOM 0 HG22 THR B 205 -5.033 13.295 -2.492 1.00 0.00 H new ATOM 0 HG23 THR B 205 -4.295 14.342 -3.727 1.00 0.00 H new ATOM 971 N TYR B 206 -2.357 9.732 -3.117 1.00 0.00 N ATOM 972 CA TYR B 206 -1.735 8.442 -3.360 1.00 0.00 C ATOM 973 C TYR B 206 -2.791 7.350 -3.544 1.00 0.00 C ATOM 974 O TYR B 206 -3.866 7.415 -2.952 1.00 0.00 O ATOM 975 CB TYR B 206 -0.909 8.130 -2.109 1.00 0.00 C ATOM 976 CG TYR B 206 0.602 8.260 -2.313 1.00 0.00 C ATOM 977 CD1 TYR B 206 1.302 7.250 -2.942 1.00 0.00 C ATOM 978 CD2 TYR B 206 1.264 9.385 -1.868 1.00 0.00 C ATOM 979 CE1 TYR B 206 2.724 7.372 -3.133 1.00 0.00 C ATOM 980 CE2 TYR B 206 2.685 9.507 -2.059 1.00 0.00 C ATOM 981 CZ TYR B 206 3.346 8.495 -2.682 1.00 0.00 C ATOM 982 OH TYR B 206 4.689 8.610 -2.864 1.00 0.00 O ATOM 0 H TYR B 206 -3.136 9.713 -2.459 1.00 0.00 H new ATOM 0 HA TYR B 206 -1.129 8.473 -4.265 1.00 0.00 H new ATOM 0 HB2 TYR B 206 -1.216 8.801 -1.307 1.00 0.00 H new ATOM 0 HB3 TYR B 206 -1.135 7.116 -1.780 1.00 0.00 H new ATOM 0 HD1 TYR B 206 0.784 6.369 -3.291 1.00 0.00 H new ATOM 0 HD2 TYR B 206 0.716 10.175 -1.376 1.00 0.00 H new ATOM 0 HE1 TYR B 206 3.284 6.590 -3.623 1.00 0.00 H new ATOM 0 HE2 TYR B 206 3.215 10.383 -1.715 1.00 0.00 H new ATOM 0 HH TYR B 206 4.997 9.463 -2.493 1.00 0.00 H new ATOM 992 N THR B 207 -2.446 6.370 -4.367 1.00 0.00 N ATOM 993 CA THR B 207 -3.350 5.267 -4.638 1.00 0.00 C ATOM 994 C THR B 207 -2.646 3.929 -4.398 1.00 0.00 C ATOM 995 O THR B 207 -1.767 3.541 -5.165 1.00 0.00 O ATOM 996 CB THR B 207 -3.880 5.427 -6.063 1.00 0.00 C ATOM 997 OG1 THR B 207 -4.212 6.809 -6.157 1.00 0.00 O ATOM 998 CG2 THR B 207 -5.214 4.708 -6.277 1.00 0.00 C ATOM 0 H THR B 207 -1.552 6.318 -4.855 1.00 0.00 H new ATOM 0 HA THR B 207 -4.201 5.278 -3.957 1.00 0.00 H new ATOM 0 HB THR B 207 -3.144 5.043 -6.769 1.00 0.00 H new ATOM 0 HG1 THR B 207 -4.563 7.001 -7.052 1.00 0.00 H new ATOM 0 HG21 THR B 207 -5.545 4.854 -7.305 1.00 0.00 H new ATOM 0 HG22 THR B 207 -5.088 3.643 -6.084 1.00 0.00 H new ATOM 0 HG23 THR B 207 -5.960 5.115 -5.594 1.00 0.00 H new ATOM 1006 N VAL B 208 -3.059 3.263 -3.330 1.00 0.00 N ATOM 1007 CA VAL B 208 -2.478 1.978 -2.979 1.00 0.00 C ATOM 1008 C VAL B 208 -3.441 0.859 -3.385 1.00 0.00 C ATOM 1009 O VAL B 208 -4.610 0.873 -3.002 1.00 0.00 O ATOM 1010 CB VAL B 208 -2.125 1.951 -1.491 1.00 0.00 C ATOM 1011 CG1 VAL B 208 -1.763 0.534 -1.038 1.00 0.00 C ATOM 1012 CG2 VAL B 208 -0.993 2.932 -1.179 1.00 0.00 C ATOM 0 H VAL B 208 -3.789 3.589 -2.696 1.00 0.00 H new ATOM 0 HA VAL B 208 -1.547 1.820 -3.523 1.00 0.00 H new ATOM 0 HB VAL B 208 -3.006 2.266 -0.932 1.00 0.00 H new ATOM 0 HG11 VAL B 208 -1.516 0.543 0.024 1.00 0.00 H new ATOM 0 HG12 VAL B 208 -2.611 -0.130 -1.208 1.00 0.00 H new ATOM 0 HG13 VAL B 208 -0.904 0.178 -1.607 1.00 0.00 H new ATOM 0 HG21 VAL B 208 -0.761 2.893 -0.115 1.00 0.00 H new ATOM 0 HG22 VAL B 208 -0.107 2.660 -1.753 1.00 0.00 H new ATOM 0 HG23 VAL B 208 -1.303 3.942 -1.446 1.00 0.00 H new ATOM 1022 N THR B 209 -2.915 -0.081 -4.155 1.00 0.00 N ATOM 1023 CA THR B 209 -3.714 -1.203 -4.618 1.00 0.00 C ATOM 1024 C THR B 209 -3.225 -2.504 -3.978 1.00 0.00 C ATOM 1025 O THR B 209 -2.035 -2.659 -3.707 1.00 0.00 O ATOM 1026 CB THR B 209 -3.664 -1.222 -6.147 1.00 0.00 C ATOM 1027 OG1 THR B 209 -3.683 0.156 -6.511 1.00 0.00 O ATOM 1028 CG2 THR B 209 -4.942 -1.789 -6.767 1.00 0.00 C ATOM 0 H THR B 209 -1.945 -0.089 -4.470 1.00 0.00 H new ATOM 0 HA THR B 209 -4.756 -1.098 -4.315 1.00 0.00 H new ATOM 0 HB THR B 209 -2.809 -1.812 -6.476 1.00 0.00 H new ATOM 0 HG1 THR B 209 -3.651 0.237 -7.487 1.00 0.00 H new ATOM 0 HG21 THR B 209 -4.854 -1.780 -7.853 1.00 0.00 H new ATOM 0 HG22 THR B 209 -5.090 -2.813 -6.423 1.00 0.00 H new ATOM 0 HG23 THR B 209 -5.794 -1.179 -6.467 1.00 0.00 H new ATOM 1036 N VAL B 210 -4.169 -3.408 -3.755 1.00 0.00 N ATOM 1037 CA VAL B 210 -3.849 -4.691 -3.153 1.00 0.00 C ATOM 1038 C VAL B 210 -4.653 -5.791 -3.847 1.00 0.00 C ATOM 1039 O VAL B 210 -5.881 -5.811 -3.768 1.00 0.00 O ATOM 1040 CB VAL B 210 -4.092 -4.635 -1.644 1.00 0.00 C ATOM 1041 CG1 VAL B 210 -4.279 -6.039 -1.066 1.00 0.00 C ATOM 1042 CG2 VAL B 210 -2.956 -3.897 -0.932 1.00 0.00 C ATOM 0 H VAL B 210 -5.155 -3.277 -3.981 1.00 0.00 H new ATOM 0 HA VAL B 210 -2.793 -4.925 -3.291 1.00 0.00 H new ATOM 0 HB VAL B 210 -5.013 -4.077 -1.474 1.00 0.00 H new ATOM 0 HG11 VAL B 210 -4.450 -5.970 0.008 1.00 0.00 H new ATOM 0 HG12 VAL B 210 -5.136 -6.516 -1.540 1.00 0.00 H new ATOM 0 HG13 VAL B 210 -3.384 -6.632 -1.254 1.00 0.00 H new ATOM 0 HG21 VAL B 210 -3.154 -3.872 0.140 1.00 0.00 H new ATOM 0 HG22 VAL B 210 -2.015 -4.415 -1.115 1.00 0.00 H new ATOM 0 HG23 VAL B 210 -2.889 -2.878 -1.313 1.00 0.00 H new ATOM 1052 N THR B 211 -3.930 -6.679 -4.513 1.00 0.00 N ATOM 1053 CA THR B 211 -4.562 -7.779 -5.221 1.00 0.00 C ATOM 1054 C THR B 211 -3.982 -9.116 -4.756 1.00 0.00 C ATOM 1055 O THR B 211 -2.765 -9.281 -4.695 1.00 0.00 O ATOM 1056 CB THR B 211 -4.395 -7.534 -6.722 1.00 0.00 C ATOM 1057 OG1 THR B 211 -5.332 -6.500 -7.011 1.00 0.00 O ATOM 1058 CG2 THR B 211 -4.873 -8.717 -7.566 1.00 0.00 C ATOM 0 H THR B 211 -2.912 -6.659 -4.577 1.00 0.00 H new ATOM 0 HA THR B 211 -5.629 -7.829 -5.002 1.00 0.00 H new ATOM 0 HB THR B 211 -3.347 -7.332 -6.942 1.00 0.00 H new ATOM 0 HG1 THR B 211 -5.541 -6.009 -6.189 1.00 0.00 H new ATOM 0 HG21 THR B 211 -4.732 -8.490 -8.623 1.00 0.00 H new ATOM 0 HG22 THR B 211 -4.298 -9.606 -7.306 1.00 0.00 H new ATOM 0 HG23 THR B 211 -5.930 -8.899 -7.372 1.00 0.00 H new ATOM 1066 N ASN B 212 -4.881 -10.037 -4.441 1.00 0.00 N ATOM 1067 CA ASN B 212 -4.473 -11.354 -3.983 1.00 0.00 C ATOM 1068 C ASN B 212 -4.483 -12.326 -5.165 1.00 0.00 C ATOM 1069 O ASN B 212 -5.534 -12.840 -5.543 1.00 0.00 O ATOM 1070 CB ASN B 212 -5.436 -11.891 -2.922 1.00 0.00 C ATOM 1071 CG ASN B 212 -5.904 -10.772 -1.991 1.00 0.00 C ATOM 1072 OD1 ASN B 212 -5.325 -9.700 -1.926 1.00 0.00 O ATOM 1073 ND2 ASN B 212 -6.981 -11.080 -1.273 1.00 0.00 N ATOM 0 H ASN B 212 -5.890 -9.897 -4.494 1.00 0.00 H new ATOM 0 HA ASN B 212 -3.475 -11.267 -3.554 1.00 0.00 H new ATOM 0 HB2 ASN B 212 -6.298 -12.350 -3.407 1.00 0.00 H new ATOM 0 HB3 ASN B 212 -4.944 -12.671 -2.341 1.00 0.00 H new ATOM 0 HD21 ASN B 212 -7.370 -10.400 -0.620 1.00 0.00 H new ATOM 0 HD22 ASN B 212 -7.418 -11.996 -1.376 1.00 0.00 H new ATOM 1080 N ASN B 213 -3.299 -12.548 -5.716 1.00 0.00 N ATOM 1081 CA ASN B 213 -3.157 -13.450 -6.848 1.00 0.00 C ATOM 1082 C ASN B 213 -3.657 -14.840 -6.453 1.00 0.00 C ATOM 1083 O ASN B 213 -3.898 -15.685 -7.314 1.00 0.00 O ATOM 1084 CB ASN B 213 -1.693 -13.576 -7.272 1.00 0.00 C ATOM 1085 CG ASN B 213 -1.456 -12.914 -8.631 1.00 0.00 C ATOM 1086 OD1 ASN B 213 -1.665 -13.500 -9.681 1.00 0.00 O ATOM 1087 ND2 ASN B 213 -1.011 -11.663 -8.554 1.00 0.00 N ATOM 0 H ASN B 213 -2.429 -12.119 -5.400 1.00 0.00 H new ATOM 0 HA ASN B 213 -3.738 -13.045 -7.677 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -1.052 -13.113 -6.521 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -1.415 -14.629 -7.323 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -0.824 -11.135 -9.406 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -0.857 -11.232 -7.643 1.00 0.00 H new ATOM 1094 N SER B 214 -3.799 -15.035 -5.150 1.00 0.00 N ATOM 1095 CA SER B 214 -4.265 -16.309 -4.630 1.00 0.00 C ATOM 1096 C SER B 214 -5.784 -16.411 -4.782 1.00 0.00 C ATOM 1097 O SER B 214 -6.315 -17.493 -5.030 1.00 0.00 O ATOM 1098 CB SER B 214 -3.865 -16.485 -3.163 1.00 0.00 C ATOM 1099 OG SER B 214 -4.946 -16.207 -2.279 1.00 0.00 O ATOM 0 H SER B 214 -3.599 -14.332 -4.439 1.00 0.00 H new ATOM 0 HA SER B 214 -3.794 -17.106 -5.205 1.00 0.00 H new ATOM 0 HB2 SER B 214 -3.518 -17.506 -3.002 1.00 0.00 H new ATOM 0 HB3 SER B 214 -3.029 -15.824 -2.933 1.00 0.00 H new ATOM 0 HG SER B 214 -4.652 -16.332 -1.353 1.00 0.00 H new ATOM 1105 N ASN B 215 -6.441 -15.271 -4.627 1.00 0.00 N ATOM 1106 CA ASN B 215 -7.888 -15.219 -4.744 1.00 0.00 C ATOM 1107 C ASN B 215 -8.266 -14.474 -6.026 1.00 0.00 C ATOM 1108 O ASN B 215 -9.443 -14.365 -6.361 1.00 0.00 O ATOM 1109 CB ASN B 215 -8.510 -14.472 -3.563 1.00 0.00 C ATOM 1110 CG ASN B 215 -9.623 -15.299 -2.916 1.00 0.00 C ATOM 1111 OD1 ASN B 215 -9.508 -16.498 -2.721 1.00 0.00 O ATOM 1112 ND2 ASN B 215 -10.703 -14.593 -2.594 1.00 0.00 N ATOM 0 H ASN B 215 -5.997 -14.376 -4.421 1.00 0.00 H new ATOM 0 HA ASN B 215 -8.261 -16.243 -4.760 1.00 0.00 H new ATOM 0 HB2 ASN B 215 -7.741 -14.249 -2.823 1.00 0.00 H new ATOM 0 HB3 ASN B 215 -8.912 -13.517 -3.903 1.00 0.00 H new ATOM 0 HD21 ASN B 215 -11.501 -15.053 -2.156 1.00 0.00 H new ATOM 0 HD22 ASN B 215 -10.733 -13.592 -2.785 1.00 0.00 H new ATOM 1119 N GLY B 216 -7.242 -13.980 -6.708 1.00 0.00 N ATOM 1120 CA GLY B 216 -7.452 -13.248 -7.945 1.00 0.00 C ATOM 1121 C GLY B 216 -8.289 -11.990 -7.705 1.00 0.00 C ATOM 1122 O GLY B 216 -8.774 -11.371 -8.650 1.00 0.00 O ATOM 0 H GLY B 216 -6.266 -14.073 -6.427 1.00 0.00 H new ATOM 0 HA2 GLY B 216 -6.490 -12.972 -8.376 1.00 0.00 H new ATOM 0 HA3 GLY B 216 -7.953 -13.889 -8.670 1.00 0.00 H new ATOM 1126 N VAL B 217 -8.435 -11.650 -6.432 1.00 0.00 N ATOM 1127 CA VAL B 217 -9.206 -10.478 -6.054 1.00 0.00 C ATOM 1128 C VAL B 217 -8.282 -9.259 -6.009 1.00 0.00 C ATOM 1129 O VAL B 217 -7.118 -9.370 -5.626 1.00 0.00 O ATOM 1130 CB VAL B 217 -9.926 -10.730 -4.728 1.00 0.00 C ATOM 1131 CG1 VAL B 217 -10.580 -9.449 -4.206 1.00 0.00 C ATOM 1132 CG2 VAL B 217 -10.956 -11.854 -4.869 1.00 0.00 C ATOM 0 H VAL B 217 -8.032 -12.166 -5.650 1.00 0.00 H new ATOM 0 HA VAL B 217 -9.979 -10.274 -6.795 1.00 0.00 H new ATOM 0 HB VAL B 217 -9.182 -11.047 -3.997 1.00 0.00 H new ATOM 0 HG11 VAL B 217 -11.085 -9.657 -3.262 1.00 0.00 H new ATOM 0 HG12 VAL B 217 -9.815 -8.688 -4.049 1.00 0.00 H new ATOM 0 HG13 VAL B 217 -11.306 -9.088 -4.934 1.00 0.00 H new ATOM 0 HG21 VAL B 217 -11.454 -12.013 -3.913 1.00 0.00 H new ATOM 0 HG22 VAL B 217 -11.695 -11.578 -5.621 1.00 0.00 H new ATOM 0 HG23 VAL B 217 -10.453 -12.772 -5.174 1.00 0.00 H new ATOM 1142 N SER B 218 -8.836 -8.122 -6.405 1.00 0.00 N ATOM 1143 CA SER B 218 -8.076 -6.883 -6.415 1.00 0.00 C ATOM 1144 C SER B 218 -8.837 -5.796 -5.653 1.00 0.00 C ATOM 1145 O SER B 218 -10.061 -5.853 -5.543 1.00 0.00 O ATOM 1146 CB SER B 218 -7.787 -6.426 -7.846 1.00 0.00 C ATOM 1147 OG SER B 218 -7.096 -5.180 -7.879 1.00 0.00 O ATOM 0 H SER B 218 -9.802 -8.033 -6.721 1.00 0.00 H new ATOM 0 HA SER B 218 -7.121 -7.063 -5.921 1.00 0.00 H new ATOM 0 HB2 SER B 218 -7.192 -7.184 -8.356 1.00 0.00 H new ATOM 0 HB3 SER B 218 -8.725 -6.335 -8.394 1.00 0.00 H new ATOM 0 HG SER B 218 -6.139 -5.333 -7.732 1.00 0.00 H new ATOM 1153 N VAL B 219 -8.081 -4.833 -5.147 1.00 0.00 N ATOM 1154 CA VAL B 219 -8.670 -3.735 -4.399 1.00 0.00 C ATOM 1155 C VAL B 219 -7.744 -2.520 -4.472 1.00 0.00 C ATOM 1156 O VAL B 219 -6.554 -2.622 -4.178 1.00 0.00 O ATOM 1157 CB VAL B 219 -8.963 -4.177 -2.964 1.00 0.00 C ATOM 1158 CG1 VAL B 219 -9.321 -2.979 -2.083 1.00 0.00 C ATOM 1159 CG2 VAL B 219 -10.071 -5.232 -2.930 1.00 0.00 C ATOM 0 H VAL B 219 -7.066 -4.790 -5.240 1.00 0.00 H new ATOM 0 HA VAL B 219 -9.625 -3.444 -4.837 1.00 0.00 H new ATOM 0 HB VAL B 219 -8.056 -4.630 -2.562 1.00 0.00 H new ATOM 0 HG11 VAL B 219 -9.525 -3.321 -1.068 1.00 0.00 H new ATOM 0 HG12 VAL B 219 -8.488 -2.276 -2.069 1.00 0.00 H new ATOM 0 HG13 VAL B 219 -10.206 -2.484 -2.483 1.00 0.00 H new ATOM 0 HG21 VAL B 219 -10.259 -5.529 -1.898 1.00 0.00 H new ATOM 0 HG22 VAL B 219 -10.982 -4.817 -3.360 1.00 0.00 H new ATOM 0 HG23 VAL B 219 -9.762 -6.103 -3.507 1.00 0.00 H new ATOM 1169 N ASP B 220 -8.324 -1.396 -4.866 1.00 0.00 N ATOM 1170 CA ASP B 220 -7.566 -0.162 -4.982 1.00 0.00 C ATOM 1171 C ASP B 220 -8.143 0.878 -4.020 1.00 0.00 C ATOM 1172 O ASP B 220 -9.354 0.937 -3.816 1.00 0.00 O ATOM 1173 CB ASP B 220 -7.653 0.407 -6.400 1.00 0.00 C ATOM 1174 CG ASP B 220 -8.155 -0.575 -7.461 1.00 0.00 C ATOM 1175 OD1 ASP B 220 -7.699 -1.738 -7.418 1.00 0.00 O ATOM 1176 OD2 ASP B 220 -8.982 -0.140 -8.290 1.00 0.00 O ATOM 0 H ASP B 220 -9.311 -1.314 -5.109 1.00 0.00 H new ATOM 0 HA ASP B 220 -6.525 -0.382 -4.745 1.00 0.00 H new ATOM 0 HB2 ASP B 220 -8.313 1.274 -6.388 1.00 0.00 H new ATOM 0 HB3 ASP B 220 -6.665 0.763 -6.694 1.00 0.00 H new ATOM 1181 N TYR B 221 -7.248 1.673 -3.452 1.00 0.00 N ATOM 1182 CA TYR B 221 -7.652 2.708 -2.516 1.00 0.00 C ATOM 1183 C TYR B 221 -6.843 3.988 -2.730 1.00 0.00 C ATOM 1184 O TYR B 221 -5.614 3.953 -2.756 1.00 0.00 O ATOM 1185 CB TYR B 221 -7.351 2.155 -1.121 1.00 0.00 C ATOM 1186 CG TYR B 221 -8.584 1.641 -0.376 1.00 0.00 C ATOM 1187 CD1 TYR B 221 -9.281 0.553 -0.863 1.00 0.00 C ATOM 1188 CD2 TYR B 221 -9.000 2.264 0.783 1.00 0.00 C ATOM 1189 CE1 TYR B 221 -10.441 0.068 -0.161 1.00 0.00 C ATOM 1190 CE2 TYR B 221 -10.161 1.779 1.484 1.00 0.00 C ATOM 1191 CZ TYR B 221 -10.824 0.705 0.978 1.00 0.00 C ATOM 1192 OH TYR B 221 -11.920 0.247 1.640 1.00 0.00 O ATOM 0 H TYR B 221 -6.244 1.621 -3.622 1.00 0.00 H new ATOM 0 HA TYR B 221 -8.705 2.956 -2.649 1.00 0.00 H new ATOM 0 HB2 TYR B 221 -6.629 1.343 -1.211 1.00 0.00 H new ATOM 0 HB3 TYR B 221 -6.879 2.937 -0.526 1.00 0.00 H new ATOM 0 HD1 TYR B 221 -8.956 0.066 -1.770 1.00 0.00 H new ATOM 0 HD2 TYR B 221 -8.455 3.115 1.164 1.00 0.00 H new ATOM 0 HE1 TYR B 221 -10.994 -0.783 -0.531 1.00 0.00 H new ATOM 0 HE2 TYR B 221 -10.498 2.258 2.392 1.00 0.00 H new ATOM 0 HH TYR B 221 -11.728 -0.636 2.019 1.00 0.00 H new ATOM 1202 N GLU B 222 -7.566 5.090 -2.878 1.00 0.00 N ATOM 1203 CA GLU B 222 -6.929 6.379 -3.090 1.00 0.00 C ATOM 1204 C GLU B 222 -6.922 7.185 -1.791 1.00 0.00 C ATOM 1205 O GLU B 222 -7.976 7.572 -1.289 1.00 0.00 O ATOM 1206 CB GLU B 222 -7.622 7.153 -4.213 1.00 0.00 C ATOM 1207 CG GLU B 222 -7.063 8.574 -4.324 1.00 0.00 C ATOM 1208 CD GLU B 222 -7.893 9.414 -5.297 1.00 0.00 C ATOM 1209 OE1 GLU B 222 -7.609 9.321 -6.511 1.00 0.00 O ATOM 1210 OE2 GLU B 222 -8.791 10.131 -4.805 1.00 0.00 O ATOM 0 H GLU B 222 -8.585 5.116 -2.855 1.00 0.00 H new ATOM 0 HA GLU B 222 -5.896 6.209 -3.395 1.00 0.00 H new ATOM 0 HB2 GLU B 222 -7.485 6.629 -5.159 1.00 0.00 H new ATOM 0 HB3 GLU B 222 -8.695 7.194 -4.024 1.00 0.00 H new ATOM 0 HG2 GLU B 222 -7.060 9.046 -3.341 1.00 0.00 H new ATOM 0 HG3 GLU B 222 -6.027 8.536 -4.662 1.00 0.00 H new ATOM 1217 N THR B 223 -5.720 7.417 -1.282 1.00 0.00 N ATOM 1218 CA THR B 223 -5.562 8.171 -0.051 1.00 0.00 C ATOM 1219 C THR B 223 -4.384 9.141 -0.168 1.00 0.00 C ATOM 1220 O THR B 223 -3.418 8.868 -0.879 1.00 0.00 O ATOM 1221 CB THR B 223 -5.415 7.174 1.100 1.00 0.00 C ATOM 1222 OG1 THR B 223 -5.511 7.979 2.272 1.00 0.00 O ATOM 1223 CG2 THR B 223 -4.010 6.570 1.176 1.00 0.00 C ATOM 0 H THR B 223 -4.847 7.096 -1.700 1.00 0.00 H new ATOM 0 HA THR B 223 -6.436 8.791 0.147 1.00 0.00 H new ATOM 0 HB THR B 223 -6.148 6.375 0.984 1.00 0.00 H new ATOM 0 HG1 THR B 223 -5.428 7.411 3.066 1.00 0.00 H new ATOM 0 HG21 THR B 223 -3.960 5.870 2.010 1.00 0.00 H new ATOM 0 HG22 THR B 223 -3.789 6.045 0.247 1.00 0.00 H new ATOM 0 HG23 THR B 223 -3.280 7.365 1.326 1.00 0.00 H new ATOM 1231 N GLU B 224 -4.502 10.254 0.542 1.00 0.00 N ATOM 1232 CA GLU B 224 -3.460 11.266 0.526 1.00 0.00 C ATOM 1233 C GLU B 224 -2.667 11.231 1.835 1.00 0.00 C ATOM 1234 O GLU B 224 -3.063 11.848 2.822 1.00 0.00 O ATOM 1235 CB GLU B 224 -4.049 12.657 0.280 1.00 0.00 C ATOM 1236 CG GLU B 224 -5.528 12.703 0.669 1.00 0.00 C ATOM 1237 CD GLU B 224 -5.703 12.523 2.179 1.00 0.00 C ATOM 1238 OE1 GLU B 224 -5.171 13.379 2.918 1.00 0.00 O ATOM 1239 OE2 GLU B 224 -6.366 11.534 2.560 1.00 0.00 O ATOM 0 H GLU B 224 -5.304 10.477 1.132 1.00 0.00 H new ATOM 0 HA GLU B 224 -2.779 11.045 -0.296 1.00 0.00 H new ATOM 0 HB2 GLU B 224 -3.495 13.398 0.856 1.00 0.00 H new ATOM 0 HB3 GLU B 224 -3.937 12.922 -0.771 1.00 0.00 H new ATOM 0 HG2 GLU B 224 -5.960 13.655 0.360 1.00 0.00 H new ATOM 0 HG3 GLU B 224 -6.071 11.920 0.140 1.00 0.00 H new ATOM 1246 N THR B 225 -1.561 10.502 1.799 1.00 0.00 N ATOM 1247 CA THR B 225 -0.709 10.379 2.969 1.00 0.00 C ATOM 1248 C THR B 225 0.758 10.585 2.585 1.00 0.00 C ATOM 1249 O THR B 225 1.369 9.715 1.966 1.00 0.00 O ATOM 1250 CB THR B 225 -0.983 9.017 3.612 1.00 0.00 C ATOM 1251 OG1 THR B 225 -1.003 8.112 2.512 1.00 0.00 O ATOM 1252 CG2 THR B 225 -2.392 8.921 4.201 1.00 0.00 C ATOM 0 H THR B 225 -1.236 9.991 0.978 1.00 0.00 H new ATOM 0 HA THR B 225 -0.932 11.153 3.704 1.00 0.00 H new ATOM 0 HB THR B 225 -0.249 8.831 4.396 1.00 0.00 H new ATOM 0 HG1 THR B 225 -1.173 7.204 2.839 1.00 0.00 H new ATOM 0 HG21 THR B 225 -2.535 7.936 4.644 1.00 0.00 H new ATOM 0 HG22 THR B 225 -2.519 9.686 4.967 1.00 0.00 H new ATOM 0 HG23 THR B 225 -3.128 9.073 3.411 1.00 0.00 H new ATOM 1260 N PRO B 226 1.293 11.771 2.978 1.00 0.00 N ATOM 1261 CA PRO B 226 2.677 12.102 2.683 1.00 0.00 C ATOM 1262 C PRO B 226 3.633 11.330 3.593 1.00 0.00 C ATOM 1263 O PRO B 226 4.167 10.293 3.200 1.00 0.00 O ATOM 1264 CB PRO B 226 2.768 13.609 2.866 1.00 0.00 C ATOM 1265 CG PRO B 226 1.563 14.000 3.705 1.00 0.00 C ATOM 1266 CD PRO B 226 0.599 12.824 3.713 1.00 0.00 C ATOM 0 HA PRO B 226 2.971 11.818 1.673 1.00 0.00 H new ATOM 0 HB2 PRO B 226 3.697 13.887 3.364 1.00 0.00 H new ATOM 0 HB3 PRO B 226 2.757 14.121 1.904 1.00 0.00 H new ATOM 0 HG2 PRO B 226 1.870 14.249 4.721 1.00 0.00 H new ATOM 0 HG3 PRO B 226 1.081 14.886 3.291 1.00 0.00 H new ATOM 0 HD2 PRO B 226 0.366 12.510 4.730 1.00 0.00 H new ATOM 0 HD3 PRO B 226 -0.346 13.083 3.236 1.00 0.00 H new ATOM 1274 N MET B 227 3.820 11.864 4.791 1.00 0.00 N ATOM 1275 CA MET B 227 4.703 11.237 5.760 1.00 0.00 C ATOM 1276 C MET B 227 4.057 9.987 6.362 1.00 0.00 C ATOM 1277 O MET B 227 4.752 9.045 6.739 1.00 0.00 O ATOM 1278 CB MET B 227 5.025 12.233 6.875 1.00 0.00 C ATOM 1279 CG MET B 227 5.427 13.592 6.299 1.00 0.00 C ATOM 1280 SD MET B 227 4.821 14.903 7.347 1.00 0.00 S ATOM 1281 CE MET B 227 3.092 14.469 7.420 1.00 0.00 C ATOM 0 H MET B 227 3.375 12.724 5.113 1.00 0.00 H new ATOM 0 HA MET B 227 5.619 10.939 5.250 1.00 0.00 H new ATOM 0 HB2 MET B 227 4.157 12.352 7.523 1.00 0.00 H new ATOM 0 HB3 MET B 227 5.833 11.843 7.493 1.00 0.00 H new ATOM 0 HG2 MET B 227 6.512 13.654 6.216 1.00 0.00 H new ATOM 0 HG3 MET B 227 5.023 13.704 5.293 1.00 0.00 H new ATOM 0 HE1 MET B 227 2.486 15.361 7.259 1.00 0.00 H new ATOM 0 HE2 MET B 227 2.868 13.734 6.647 1.00 0.00 H new ATOM 0 HE3 MET B 227 2.864 14.047 8.399 1.00 0.00 H new ATOM 1291 N THR B 228 2.734 10.019 6.432 1.00 0.00 N ATOM 1292 CA THR B 228 1.987 8.900 6.982 1.00 0.00 C ATOM 1293 C THR B 228 2.371 7.602 6.271 1.00 0.00 C ATOM 1294 O THR B 228 2.485 6.553 6.904 1.00 0.00 O ATOM 1295 CB THR B 228 0.497 9.231 6.879 1.00 0.00 C ATOM 1296 OG1 THR B 228 0.467 10.502 6.236 1.00 0.00 O ATOM 1297 CG2 THR B 228 -0.141 9.491 8.245 1.00 0.00 C ATOM 0 H THR B 228 2.160 10.802 6.117 1.00 0.00 H new ATOM 0 HA THR B 228 2.228 8.742 8.033 1.00 0.00 H new ATOM 0 HB THR B 228 -0.023 8.410 6.385 1.00 0.00 H new ATOM 0 HG1 THR B 228 -0.463 10.792 6.128 1.00 0.00 H new ATOM 0 HG21 THR B 228 -1.198 9.721 8.115 1.00 0.00 H new ATOM 0 HG22 THR B 228 -0.037 8.604 8.870 1.00 0.00 H new ATOM 0 HG23 THR B 228 0.357 10.333 8.725 1.00 0.00 H new ATOM 1305 N LEU B 229 2.561 7.714 4.964 1.00 0.00 N ATOM 1306 CA LEU B 229 2.930 6.561 4.160 1.00 0.00 C ATOM 1307 C LEU B 229 4.139 5.870 4.793 1.00 0.00 C ATOM 1308 O LEU B 229 4.255 4.646 4.745 1.00 0.00 O ATOM 1309 CB LEU B 229 3.149 6.972 2.704 1.00 0.00 C ATOM 1310 CG LEU B 229 1.900 7.011 1.821 1.00 0.00 C ATOM 1311 CD1 LEU B 229 2.180 7.737 0.504 1.00 0.00 C ATOM 1312 CD2 LEU B 229 1.345 5.604 1.593 1.00 0.00 C ATOM 0 H LEU B 229 2.466 8.585 4.442 1.00 0.00 H new ATOM 0 HA LEU B 229 2.119 5.833 4.143 1.00 0.00 H new ATOM 0 HB2 LEU B 229 3.609 7.960 2.692 1.00 0.00 H new ATOM 0 HB3 LEU B 229 3.864 6.282 2.256 1.00 0.00 H new ATOM 0 HG LEU B 229 1.131 7.580 2.344 1.00 0.00 H new ATOM 0 HD11 LEU B 229 1.275 7.750 -0.104 1.00 0.00 H new ATOM 0 HD12 LEU B 229 2.492 8.760 0.712 1.00 0.00 H new ATOM 0 HD13 LEU B 229 2.972 7.219 -0.036 1.00 0.00 H new ATOM 0 HD21 LEU B 229 0.458 5.661 0.962 1.00 0.00 H new ATOM 0 HD22 LEU B 229 2.100 4.990 1.102 1.00 0.00 H new ATOM 0 HD23 LEU B 229 1.081 5.157 2.552 1.00 0.00 H new ATOM 1324 N LEU B 230 5.010 6.683 5.372 1.00 0.00 N ATOM 1325 CA LEU B 230 6.206 6.165 6.014 1.00 0.00 C ATOM 1326 C LEU B 230 5.843 5.622 7.398 1.00 0.00 C ATOM 1327 O LEU B 230 6.524 4.740 7.920 1.00 0.00 O ATOM 1328 CB LEU B 230 7.303 7.230 6.040 1.00 0.00 C ATOM 1329 CG LEU B 230 7.619 7.902 4.703 1.00 0.00 C ATOM 1330 CD1 LEU B 230 8.793 8.874 4.840 1.00 0.00 C ATOM 1331 CD2 LEU B 230 7.864 6.859 3.610 1.00 0.00 C ATOM 0 H LEU B 230 4.911 7.697 5.410 1.00 0.00 H new ATOM 0 HA LEU B 230 6.615 5.332 5.442 1.00 0.00 H new ATOM 0 HB2 LEU B 230 7.015 8.003 6.753 1.00 0.00 H new ATOM 0 HB3 LEU B 230 8.217 6.772 6.419 1.00 0.00 H new ATOM 0 HG LEU B 230 6.750 8.488 4.402 1.00 0.00 H new ATOM 0 HD11 LEU B 230 8.996 9.338 3.875 1.00 0.00 H new ATOM 0 HD12 LEU B 230 8.543 9.646 5.568 1.00 0.00 H new ATOM 0 HD13 LEU B 230 9.677 8.332 5.175 1.00 0.00 H new ATOM 0 HD21 LEU B 230 8.087 7.363 2.669 1.00 0.00 H new ATOM 0 HD22 LEU B 230 8.707 6.228 3.892 1.00 0.00 H new ATOM 0 HD23 LEU B 230 6.973 6.242 3.489 1.00 0.00 H new ATOM 1343 N VAL B 231 4.771 6.169 7.950 1.00 0.00 N ATOM 1344 CA VAL B 231 4.309 5.750 9.263 1.00 0.00 C ATOM 1345 C VAL B 231 3.853 4.292 9.197 1.00 0.00 C ATOM 1346 O VAL B 231 3.162 3.896 8.260 1.00 0.00 O ATOM 1347 CB VAL B 231 3.214 6.697 9.759 1.00 0.00 C ATOM 1348 CG1 VAL B 231 2.691 6.260 11.129 1.00 0.00 C ATOM 1349 CG2 VAL B 231 3.715 8.142 9.799 1.00 0.00 C ATOM 0 H VAL B 231 4.208 6.899 7.513 1.00 0.00 H new ATOM 0 HA VAL B 231 5.121 5.804 9.989 1.00 0.00 H new ATOM 0 HB VAL B 231 2.385 6.650 9.053 1.00 0.00 H new ATOM 0 HG11 VAL B 231 1.914 6.950 11.459 1.00 0.00 H new ATOM 0 HG12 VAL B 231 2.277 5.254 11.056 1.00 0.00 H new ATOM 0 HG13 VAL B 231 3.509 6.264 11.849 1.00 0.00 H new ATOM 0 HG21 VAL B 231 2.917 8.794 10.155 1.00 0.00 H new ATOM 0 HG22 VAL B 231 4.569 8.212 10.473 1.00 0.00 H new ATOM 0 HG23 VAL B 231 4.016 8.451 8.798 1.00 0.00 H new ATOM 1359 N PRO B 232 4.269 3.512 10.231 1.00 0.00 N ATOM 1360 CA PRO B 232 3.910 2.105 10.299 1.00 0.00 C ATOM 1361 C PRO B 232 2.446 1.932 10.711 1.00 0.00 C ATOM 1362 O PRO B 232 1.736 1.098 10.153 1.00 0.00 O ATOM 1363 CB PRO B 232 4.884 1.499 11.296 1.00 0.00 C ATOM 1364 CG PRO B 232 5.444 2.665 12.094 1.00 0.00 C ATOM 1365 CD PRO B 232 5.087 3.947 11.358 1.00 0.00 C ATOM 0 HA PRO B 232 3.985 1.604 9.334 1.00 0.00 H new ATOM 0 HB2 PRO B 232 4.381 0.785 11.948 1.00 0.00 H new ATOM 0 HB3 PRO B 232 5.680 0.958 10.785 1.00 0.00 H new ATOM 0 HG2 PRO B 232 5.027 2.674 13.101 1.00 0.00 H new ATOM 0 HG3 PRO B 232 6.525 2.573 12.198 1.00 0.00 H new ATOM 0 HD2 PRO B 232 4.539 4.634 12.003 1.00 0.00 H new ATOM 0 HD3 PRO B 232 5.981 4.471 11.020 1.00 0.00 H new ATOM 1373 N GLU B 233 2.040 2.733 11.684 1.00 0.00 N ATOM 1374 CA GLU B 233 0.674 2.679 12.177 1.00 0.00 C ATOM 1375 C GLU B 233 -0.310 2.999 11.050 1.00 0.00 C ATOM 1376 O GLU B 233 -1.403 2.438 10.998 1.00 0.00 O ATOM 1377 CB GLU B 233 0.481 3.629 13.361 1.00 0.00 C ATOM 1378 CG GLU B 233 1.709 3.625 14.273 1.00 0.00 C ATOM 1379 CD GLU B 233 1.340 4.063 15.692 1.00 0.00 C ATOM 1380 OE1 GLU B 233 0.401 3.451 16.248 1.00 0.00 O ATOM 1381 OE2 GLU B 233 2.004 4.998 16.188 1.00 0.00 O ATOM 0 H GLU B 233 2.633 3.423 12.145 1.00 0.00 H new ATOM 0 HA GLU B 233 0.475 1.667 12.530 1.00 0.00 H new ATOM 0 HB2 GLU B 233 0.299 4.639 12.995 1.00 0.00 H new ATOM 0 HB3 GLU B 233 -0.400 3.332 13.930 1.00 0.00 H new ATOM 0 HG2 GLU B 233 2.144 2.626 14.299 1.00 0.00 H new ATOM 0 HG3 GLU B 233 2.469 4.293 13.868 1.00 0.00 H new ATOM 1388 N VAL B 234 0.113 3.901 10.176 1.00 0.00 N ATOM 1389 CA VAL B 234 -0.717 4.302 9.054 1.00 0.00 C ATOM 1390 C VAL B 234 -0.575 3.277 7.927 1.00 0.00 C ATOM 1391 O VAL B 234 -1.570 2.842 7.350 1.00 0.00 O ATOM 1392 CB VAL B 234 -0.355 5.723 8.617 1.00 0.00 C ATOM 1393 CG1 VAL B 234 -1.068 6.095 7.316 1.00 0.00 C ATOM 1394 CG2 VAL B 234 -0.671 6.733 9.723 1.00 0.00 C ATOM 0 H VAL B 234 1.020 4.365 10.223 1.00 0.00 H new ATOM 0 HA VAL B 234 -1.767 4.322 9.345 1.00 0.00 H new ATOM 0 HB VAL B 234 0.719 5.753 8.431 1.00 0.00 H new ATOM 0 HG11 VAL B 234 -0.793 7.110 7.028 1.00 0.00 H new ATOM 0 HG12 VAL B 234 -0.773 5.402 6.528 1.00 0.00 H new ATOM 0 HG13 VAL B 234 -2.147 6.039 7.463 1.00 0.00 H new ATOM 0 HG21 VAL B 234 -0.405 7.735 9.387 1.00 0.00 H new ATOM 0 HG22 VAL B 234 -1.736 6.699 9.954 1.00 0.00 H new ATOM 0 HG23 VAL B 234 -0.098 6.485 10.617 1.00 0.00 H new ATOM 1404 N ALA B 235 0.671 2.921 7.647 1.00 0.00 N ATOM 1405 CA ALA B 235 0.955 1.955 6.600 1.00 0.00 C ATOM 1406 C ALA B 235 0.359 0.600 6.985 1.00 0.00 C ATOM 1407 O ALA B 235 -0.247 -0.074 6.155 1.00 0.00 O ATOM 1408 CB ALA B 235 2.467 1.882 6.369 1.00 0.00 C ATOM 0 H ALA B 235 1.494 3.284 8.127 1.00 0.00 H new ATOM 0 HA ALA B 235 0.495 2.262 5.661 1.00 0.00 H new ATOM 0 HB1 ALA B 235 2.680 1.157 5.583 1.00 0.00 H new ATOM 0 HB2 ALA B 235 2.837 2.862 6.069 1.00 0.00 H new ATOM 0 HB3 ALA B 235 2.961 1.574 7.290 1.00 0.00 H new ATOM 1414 N ALA B 236 0.552 0.242 8.247 1.00 0.00 N ATOM 1415 CA ALA B 236 0.039 -1.021 8.753 1.00 0.00 C ATOM 1416 C ALA B 236 -1.474 -1.078 8.531 1.00 0.00 C ATOM 1417 O ALA B 236 -1.993 -2.073 8.029 1.00 0.00 O ATOM 1418 CB ALA B 236 0.418 -1.171 10.227 1.00 0.00 C ATOM 0 H ALA B 236 1.056 0.804 8.933 1.00 0.00 H new ATOM 0 HA ALA B 236 0.482 -1.859 8.215 1.00 0.00 H new ATOM 0 HB1 ALA B 236 0.034 -2.118 10.607 1.00 0.00 H new ATOM 0 HB2 ALA B 236 1.503 -1.153 10.327 1.00 0.00 H new ATOM 0 HB3 ALA B 236 -0.012 -0.349 10.799 1.00 0.00 H new ATOM 1424 N GLU B 237 -2.137 0.002 8.916 1.00 0.00 N ATOM 1425 CA GLU B 237 -3.580 0.087 8.765 1.00 0.00 C ATOM 1426 C GLU B 237 -3.952 0.218 7.287 1.00 0.00 C ATOM 1427 O GLU B 237 -4.977 -0.308 6.852 1.00 0.00 O ATOM 1428 CB GLU B 237 -4.149 1.251 9.579 1.00 0.00 C ATOM 1429 CG GLU B 237 -4.407 0.832 11.028 1.00 0.00 C ATOM 1430 CD GLU B 237 -5.886 0.990 11.389 1.00 0.00 C ATOM 1431 OE1 GLU B 237 -6.720 0.547 10.569 1.00 0.00 O ATOM 1432 OE2 GLU B 237 -6.148 1.549 12.476 1.00 0.00 O ATOM 0 H GLU B 237 -1.702 0.826 9.332 1.00 0.00 H new ATOM 0 HA GLU B 237 -4.021 -0.832 9.150 1.00 0.00 H new ATOM 0 HB2 GLU B 237 -3.453 2.089 9.558 1.00 0.00 H new ATOM 0 HB3 GLU B 237 -5.078 1.597 9.126 1.00 0.00 H new ATOM 0 HG2 GLU B 237 -4.103 -0.205 11.170 1.00 0.00 H new ATOM 0 HG3 GLU B 237 -3.798 1.438 11.699 1.00 0.00 H new ATOM 1439 N VAL B 238 -3.101 0.921 6.555 1.00 0.00 N ATOM 1440 CA VAL B 238 -3.329 1.128 5.135 1.00 0.00 C ATOM 1441 C VAL B 238 -3.156 -0.201 4.397 1.00 0.00 C ATOM 1442 O VAL B 238 -3.879 -0.484 3.443 1.00 0.00 O ATOM 1443 CB VAL B 238 -2.403 2.228 4.611 1.00 0.00 C ATOM 1444 CG1 VAL B 238 -1.977 1.945 3.169 1.00 0.00 C ATOM 1445 CG2 VAL B 238 -3.063 3.602 4.729 1.00 0.00 C ATOM 0 H VAL B 238 -2.252 1.355 6.918 1.00 0.00 H new ATOM 0 HA VAL B 238 -4.349 1.469 4.957 1.00 0.00 H new ATOM 0 HB VAL B 238 -1.506 2.234 5.230 1.00 0.00 H new ATOM 0 HG11 VAL B 238 -1.320 2.742 2.821 1.00 0.00 H new ATOM 0 HG12 VAL B 238 -1.448 0.993 3.126 1.00 0.00 H new ATOM 0 HG13 VAL B 238 -2.860 1.898 2.531 1.00 0.00 H new ATOM 0 HG21 VAL B 238 -2.384 4.366 4.350 1.00 0.00 H new ATOM 0 HG22 VAL B 238 -3.984 3.614 4.147 1.00 0.00 H new ATOM 0 HG23 VAL B 238 -3.292 3.807 5.775 1.00 0.00 H new ATOM 1455 N ILE B 239 -2.193 -0.981 4.866 1.00 0.00 N ATOM 1456 CA ILE B 239 -1.917 -2.273 4.263 1.00 0.00 C ATOM 1457 C ILE B 239 -2.969 -3.283 4.725 1.00 0.00 C ATOM 1458 O ILE B 239 -3.506 -4.039 3.916 1.00 0.00 O ATOM 1459 CB ILE B 239 -0.479 -2.705 4.557 1.00 0.00 C ATOM 1460 CG1 ILE B 239 0.525 -1.780 3.866 1.00 0.00 C ATOM 1461 CG2 ILE B 239 -0.259 -4.172 4.181 1.00 0.00 C ATOM 1462 CD1 ILE B 239 0.878 -2.300 2.471 1.00 0.00 C ATOM 0 H ILE B 239 -1.594 -0.743 5.657 1.00 0.00 H new ATOM 0 HA ILE B 239 -1.991 -2.210 3.177 1.00 0.00 H new ATOM 0 HB ILE B 239 -0.310 -2.618 5.630 1.00 0.00 H new ATOM 0 HG12 ILE B 239 0.107 -0.776 3.789 1.00 0.00 H new ATOM 0 HG13 ILE B 239 1.430 -1.703 4.469 1.00 0.00 H new ATOM 0 HG21 ILE B 239 0.771 -4.453 4.400 1.00 0.00 H new ATOM 0 HG22 ILE B 239 -0.937 -4.801 4.757 1.00 0.00 H new ATOM 0 HG23 ILE B 239 -0.454 -4.308 3.117 1.00 0.00 H new ATOM 0 HD11 ILE B 239 1.593 -1.625 2.001 1.00 0.00 H new ATOM 0 HD12 ILE B 239 1.318 -3.294 2.554 1.00 0.00 H new ATOM 0 HD13 ILE B 239 -0.025 -2.352 1.863 1.00 0.00 H new ATOM 1474 N LYS B 240 -3.232 -3.264 6.022 1.00 0.00 N ATOM 1475 CA LYS B 240 -4.211 -4.168 6.601 1.00 0.00 C ATOM 1476 C LYS B 240 -5.606 -3.798 6.091 1.00 0.00 C ATOM 1477 O LYS B 240 -6.389 -4.674 5.727 1.00 0.00 O ATOM 1478 CB LYS B 240 -4.097 -4.176 8.127 1.00 0.00 C ATOM 1479 CG LYS B 240 -5.465 -4.386 8.779 1.00 0.00 C ATOM 1480 CD LYS B 240 -6.085 -3.052 9.196 1.00 0.00 C ATOM 1481 CE LYS B 240 -7.558 -3.225 9.570 1.00 0.00 C ATOM 1482 NZ LYS B 240 -8.381 -2.170 8.937 1.00 0.00 N ATOM 0 H LYS B 240 -2.784 -2.636 6.690 1.00 0.00 H new ATOM 0 HA LYS B 240 -4.016 -5.193 6.284 1.00 0.00 H new ATOM 0 HB2 LYS B 240 -3.416 -4.967 8.440 1.00 0.00 H new ATOM 0 HB3 LYS B 240 -3.669 -3.233 8.468 1.00 0.00 H new ATOM 0 HG2 LYS B 240 -6.129 -4.897 8.082 1.00 0.00 H new ATOM 0 HG3 LYS B 240 -5.361 -5.031 9.652 1.00 0.00 H new ATOM 0 HD2 LYS B 240 -5.537 -2.641 10.044 1.00 0.00 H new ATOM 0 HD3 LYS B 240 -5.995 -2.334 8.380 1.00 0.00 H new ATOM 0 HE2 LYS B 240 -7.907 -4.207 9.251 1.00 0.00 H new ATOM 0 HE3 LYS B 240 -7.672 -3.182 10.653 1.00 0.00 H new ATOM 0 HZ1 LYS B 240 -9.014 -1.750 9.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 240 -7.760 -1.432 8.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 240 -8.948 -2.585 8.170 1.00 0.00 H new ATOM 1496 N ASP B 241 -5.872 -2.500 6.082 1.00 0.00 N ATOM 1497 CA ASP B 241 -7.158 -2.004 5.622 1.00 0.00 C ATOM 1498 C ASP B 241 -7.397 -2.473 4.185 1.00 0.00 C ATOM 1499 O ASP B 241 -8.488 -2.933 3.852 1.00 0.00 O ATOM 1500 CB ASP B 241 -7.194 -0.475 5.633 1.00 0.00 C ATOM 1501 CG ASP B 241 -8.423 0.148 4.967 1.00 0.00 C ATOM 1502 OD1 ASP B 241 -9.316 -0.636 4.579 1.00 0.00 O ATOM 1503 OD2 ASP B 241 -8.441 1.393 4.862 1.00 0.00 O ATOM 0 H ASP B 241 -5.219 -1.777 6.386 1.00 0.00 H new ATOM 0 HA ASP B 241 -7.927 -2.388 6.293 1.00 0.00 H new ATOM 0 HB2 ASP B 241 -7.147 -0.133 6.667 1.00 0.00 H new ATOM 0 HB3 ASP B 241 -6.300 -0.102 5.133 1.00 0.00 H new ATOM 1508 N LEU B 242 -6.359 -2.340 3.373 1.00 0.00 N ATOM 1509 CA LEU B 242 -6.442 -2.744 1.979 1.00 0.00 C ATOM 1510 C LEU B 242 -6.683 -4.253 1.905 1.00 0.00 C ATOM 1511 O LEU B 242 -7.571 -4.709 1.185 1.00 0.00 O ATOM 1512 CB LEU B 242 -5.203 -2.281 1.212 1.00 0.00 C ATOM 1513 CG LEU B 242 -5.320 -0.930 0.503 1.00 0.00 C ATOM 1514 CD1 LEU B 242 -4.184 0.008 0.919 1.00 0.00 C ATOM 1515 CD2 LEU B 242 -5.388 -1.110 -1.015 1.00 0.00 C ATOM 0 H LEU B 242 -5.456 -1.958 3.653 1.00 0.00 H new ATOM 0 HA LEU B 242 -7.288 -2.260 1.491 1.00 0.00 H new ATOM 0 HB2 LEU B 242 -4.366 -2.232 1.908 1.00 0.00 H new ATOM 0 HB3 LEU B 242 -4.956 -3.039 0.469 1.00 0.00 H new ATOM 0 HG LEU B 242 -6.254 -0.462 0.813 1.00 0.00 H new ATOM 0 HD11 LEU B 242 -4.291 0.961 0.401 1.00 0.00 H new ATOM 0 HD12 LEU B 242 -4.225 0.174 1.996 1.00 0.00 H new ATOM 0 HD13 LEU B 242 -3.226 -0.442 0.657 1.00 0.00 H new ATOM 0 HD21 LEU B 242 -5.471 -0.134 -1.494 1.00 0.00 H new ATOM 0 HD22 LEU B 242 -4.484 -1.609 -1.363 1.00 0.00 H new ATOM 0 HD23 LEU B 242 -6.258 -1.715 -1.271 1.00 0.00 H new ATOM 1527 N VAL B 243 -5.877 -4.988 2.658 1.00 0.00 N ATOM 1528 CA VAL B 243 -5.990 -6.435 2.686 1.00 0.00 C ATOM 1529 C VAL B 243 -7.363 -6.824 3.241 1.00 0.00 C ATOM 1530 O VAL B 243 -8.055 -7.661 2.665 1.00 0.00 O ATOM 1531 CB VAL B 243 -4.831 -7.036 3.482 1.00 0.00 C ATOM 1532 CG1 VAL B 243 -5.275 -8.295 4.231 1.00 0.00 C ATOM 1533 CG2 VAL B 243 -3.637 -7.332 2.573 1.00 0.00 C ATOM 0 H VAL B 243 -5.142 -4.607 3.254 1.00 0.00 H new ATOM 0 HA VAL B 243 -5.919 -6.843 1.678 1.00 0.00 H new ATOM 0 HB VAL B 243 -4.515 -6.300 4.221 1.00 0.00 H new ATOM 0 HG11 VAL B 243 -4.432 -8.703 4.789 1.00 0.00 H new ATOM 0 HG12 VAL B 243 -6.080 -8.043 4.922 1.00 0.00 H new ATOM 0 HG13 VAL B 243 -5.630 -9.037 3.516 1.00 0.00 H new ATOM 0 HG21 VAL B 243 -2.827 -7.759 3.164 1.00 0.00 H new ATOM 0 HG22 VAL B 243 -3.935 -8.041 1.800 1.00 0.00 H new ATOM 0 HG23 VAL B 243 -3.297 -6.408 2.106 1.00 0.00 H new ATOM 1543 N ASN B 244 -7.713 -6.197 4.354 1.00 0.00 N ATOM 1544 CA ASN B 244 -8.990 -6.467 4.994 1.00 0.00 C ATOM 1545 C ASN B 244 -10.120 -6.221 3.992 1.00 0.00 C ATOM 1546 O ASN B 244 -11.150 -6.892 4.035 1.00 0.00 O ATOM 1547 CB ASN B 244 -9.212 -5.543 6.193 1.00 0.00 C ATOM 1548 CG ASN B 244 -9.120 -6.320 7.508 1.00 0.00 C ATOM 1549 OD1 ASN B 244 -7.879 -6.644 7.860 1.00 0.00 O flip ATOM 1550 ND2 ASN B 244 -10.110 -6.605 8.160 1.00 0.00 N flip ATOM 0 H ASN B 244 -7.136 -5.503 4.829 1.00 0.00 H new ATOM 0 HA ASN B 244 -8.984 -7.503 5.333 1.00 0.00 H new ATOM 0 HB2 ASN B 244 -8.469 -4.746 6.185 1.00 0.00 H new ATOM 0 HB3 ASN B 244 -10.190 -5.068 6.115 1.00 0.00 H new ATOM 0 HD21 ASN B 244 -11.034 -6.325 7.832 1.00 0.00 H new ATOM 0 HD22 ASN B 244 -10.014 -7.123 9.033 1.00 0.00 H new ATOM 1557 N THR B 245 -9.889 -5.256 3.114 1.00 0.00 N ATOM 1558 CA THR B 245 -10.875 -4.912 2.103 1.00 0.00 C ATOM 1559 C THR B 245 -10.920 -5.987 1.015 1.00 0.00 C ATOM 1560 O THR B 245 -11.997 -6.388 0.577 1.00 0.00 O ATOM 1561 CB THR B 245 -10.537 -3.520 1.567 1.00 0.00 C ATOM 1562 OG1 THR B 245 -10.750 -2.658 2.682 1.00 0.00 O ATOM 1563 CG2 THR B 245 -11.545 -3.034 0.524 1.00 0.00 C ATOM 0 H THR B 245 -9.034 -4.701 3.082 1.00 0.00 H new ATOM 0 HA THR B 245 -11.879 -4.878 2.525 1.00 0.00 H new ATOM 0 HB THR B 245 -9.539 -3.532 1.130 1.00 0.00 H new ATOM 0 HG1 THR B 245 -9.957 -2.665 3.257 1.00 0.00 H new ATOM 0 HG21 THR B 245 -11.259 -2.041 0.176 1.00 0.00 H new ATOM 0 HG22 THR B 245 -11.557 -3.724 -0.319 1.00 0.00 H new ATOM 0 HG23 THR B 245 -12.538 -2.989 0.971 1.00 0.00 H new