USER MOD reduce.3.24.130724 H: found=0, std=0, add=520, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 520 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 Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 1.46 K(o=1.5,f=-3.2!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.0315 USER MOD Single : A 25 SER OG : rot 180:sc= 0.0219 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 MET CE :methyl -131:sc= -0.87 (180deg=-1.19) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 74:sc= 1.23 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 CYS SG : rot 60:sc= -0.0147 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A 54 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.054) USER MOD Single : A 60 ASN : amide:sc= 0.697 K(o=0.7,f=-1.2!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 154:sc= 1.82 (180deg=1.23) USER MOD ----------------------------------------------------------------- ATOM 59 N TYR A 5 13.319 1.908 0.172 1.00 25.00 N ATOM 60 CA TYR A 5 13.868 0.607 0.552 1.00 25.00 C ATOM 61 C TYR A 5 13.343 -0.606 -0.235 1.00 25.00 C ATOM 62 O TYR A 5 12.388 -0.521 -0.999 1.00 25.00 O ATOM 63 CB TYR A 5 13.697 0.410 2.056 1.00 25.00 C ATOM 64 CG TYR A 5 14.567 1.343 2.879 1.00 25.00 C ATOM 65 CD1 TYR A 5 14.009 2.147 3.895 1.00 25.00 C ATOM 66 CD2 TYR A 5 15.962 1.415 2.661 1.00 25.00 C ATOM 67 CE1 TYR A 5 14.835 3.005 4.680 1.00 25.00 C ATOM 68 CE2 TYR A 5 16.781 2.267 3.440 1.00 25.00 C ATOM 69 CZ TYR A 5 16.214 3.050 4.442 1.00 25.00 C ATOM 70 OH TYR A 5 17.020 3.861 5.198 1.00 25.00 O ATOM 0 HA TYR A 5 14.923 0.643 0.280 1.00 25.00 H new ATOM 0 HB2 TYR A 5 12.652 0.569 2.321 1.00 25.00 H new ATOM 0 HB3 TYR A 5 13.938 -0.622 2.311 1.00 25.00 H new ATOM 0 HD1 TYR A 5 12.946 2.113 4.080 1.00 25.00 H new ATOM 0 HD2 TYR A 5 16.410 0.810 1.887 1.00 25.00 H new ATOM 0 HE1 TYR A 5 14.398 3.618 5.455 1.00 25.00 H new ATOM 0 HE2 TYR A 5 17.845 2.310 3.257 1.00 25.00 H new ATOM 0 HH TYR A 5 17.949 3.769 4.900 1.00 25.00 H new ATOM 80 N LEU A 6 14.054 -1.717 -0.091 1.00 25.00 N ATOM 81 CA LEU A 6 13.768 -2.953 -0.819 1.00 25.00 C ATOM 82 C LEU A 6 12.542 -3.667 -0.243 1.00 25.00 C ATOM 83 O LEU A 6 11.717 -4.186 -0.986 1.00 25.00 O ATOM 84 CB LEU A 6 14.978 -3.899 -0.733 1.00 25.00 C ATOM 85 CG LEU A 6 16.351 -3.415 -1.230 1.00 25.00 C ATOM 86 CD1 LEU A 6 17.416 -4.481 -0.905 1.00 25.00 C ATOM 87 CD2 LEU A 6 16.346 -3.131 -2.730 1.00 25.00 C ATOM 0 H LEU A 6 14.853 -1.789 0.539 1.00 25.00 H new ATOM 0 HA LEU A 6 13.565 -2.689 -1.857 1.00 25.00 H new ATOM 0 HB2 LEU A 6 15.092 -4.190 0.311 1.00 25.00 H new ATOM 0 HB3 LEU A 6 14.728 -4.802 -1.290 1.00 25.00 H new ATOM 0 HG LEU A 6 16.584 -2.481 -0.719 1.00 25.00 H new ATOM 0 HD11 LEU A 6 18.390 -4.141 -1.256 1.00 25.00 H new ATOM 0 HD12 LEU A 6 17.454 -4.641 0.173 1.00 25.00 H new ATOM 0 HD13 LEU A 6 17.158 -5.416 -1.401 1.00 25.00 H new ATOM 0 HD21 LEU A 6 17.335 -2.792 -3.039 1.00 25.00 H new ATOM 0 HD22 LEU A 6 16.089 -4.041 -3.272 1.00 25.00 H new ATOM 0 HD23 LEU A 6 15.611 -2.357 -2.951 1.00 25.00 H new ATOM 99 N ASN A 7 12.452 -3.682 1.084 1.00 25.00 N ATOM 100 CA ASN A 7 11.343 -4.303 1.832 1.00 25.00 C ATOM 101 C ASN A 7 11.099 -5.774 1.467 1.00 25.00 C ATOM 102 O ASN A 7 9.972 -6.182 1.195 1.00 25.00 O ATOM 103 CB ASN A 7 10.059 -3.486 1.648 1.00 25.00 C ATOM 104 CG ASN A 7 10.232 -2.059 2.067 1.00 25.00 C ATOM 105 OD1 ASN A 7 10.456 -1.764 3.229 1.00 25.00 O ATOM 106 ND2 ASN A 7 10.167 -1.170 1.124 1.00 25.00 N ATOM 0 H ASN A 7 13.156 -3.258 1.688 1.00 25.00 H new ATOM 0 HA ASN A 7 11.640 -4.298 2.881 1.00 25.00 H new ATOM 0 HB2 ASN A 7 9.755 -3.521 0.602 1.00 25.00 H new ATOM 0 HB3 ASN A 7 9.256 -3.939 2.229 1.00 25.00 H new ATOM 0 HD21 ASN A 7 10.306 -0.183 1.343 1.00 25.00 H new ATOM 0 HD22 ASN A 7 9.977 -1.458 0.164 1.00 25.00 H new ATOM 113 N VAL A 8 12.160 -6.570 1.479 1.00 25.00 N ATOM 114 CA VAL A 8 12.071 -7.996 1.148 1.00 25.00 C ATOM 115 C VAL A 8 12.204 -8.774 2.449 1.00 25.00 C ATOM 116 O VAL A 8 12.690 -8.241 3.432 1.00 25.00 O ATOM 117 CB VAL A 8 13.179 -8.421 0.105 1.00 25.00 C ATOM 118 CG1 VAL A 8 13.700 -7.208 -0.650 1.00 25.00 C ATOM 119 CG2 VAL A 8 14.365 -9.129 0.762 1.00 25.00 C ATOM 0 H VAL A 8 13.101 -6.255 1.715 1.00 25.00 H new ATOM 0 HA VAL A 8 11.114 -8.212 0.674 1.00 25.00 H new ATOM 0 HB VAL A 8 12.698 -9.119 -0.580 1.00 25.00 H new ATOM 0 HG11 VAL A 8 14.462 -7.523 -1.363 1.00 25.00 H new ATOM 0 HG12 VAL A 8 12.878 -6.731 -1.184 1.00 25.00 H new ATOM 0 HG13 VAL A 8 14.134 -6.499 0.055 1.00 25.00 H new ATOM 0 HG21 VAL A 8 15.096 -9.399 -0.001 1.00 25.00 H new ATOM 0 HG22 VAL A 8 14.829 -8.463 1.490 1.00 25.00 H new ATOM 0 HG23 VAL A 8 14.017 -10.031 1.266 1.00 25.00 H new ATOM 129 N LEU A 9 11.794 -10.028 2.467 1.00 25.00 N ATOM 130 CA LEU A 9 11.936 -10.846 3.673 1.00 25.00 C ATOM 131 C LEU A 9 13.200 -11.694 3.577 1.00 25.00 C ATOM 132 O LEU A 9 13.530 -12.210 2.511 1.00 25.00 O ATOM 133 CB LEU A 9 10.715 -11.754 3.849 1.00 25.00 C ATOM 134 CG LEU A 9 9.364 -11.033 4.021 1.00 25.00 C ATOM 135 CD1 LEU A 9 8.253 -12.075 4.137 1.00 25.00 C ATOM 136 CD2 LEU A 9 9.349 -10.123 5.251 1.00 25.00 C ATOM 0 H LEU A 9 11.364 -10.505 1.674 1.00 25.00 H new ATOM 0 HA LEU A 9 12.009 -10.185 4.537 1.00 25.00 H new ATOM 0 HB2 LEU A 9 10.647 -12.412 2.983 1.00 25.00 H new ATOM 0 HB3 LEU A 9 10.880 -12.389 4.719 1.00 25.00 H new ATOM 0 HG LEU A 9 9.205 -10.401 3.147 1.00 25.00 H new ATOM 0 HD11 LEU A 9 7.294 -11.572 4.259 1.00 25.00 H new ATOM 0 HD12 LEU A 9 8.231 -12.685 3.234 1.00 25.00 H new ATOM 0 HD13 LEU A 9 8.441 -12.713 5.001 1.00 25.00 H new ATOM 0 HD21 LEU A 9 8.377 -9.636 5.332 1.00 25.00 H new ATOM 0 HD22 LEU A 9 9.532 -10.718 6.146 1.00 25.00 H new ATOM 0 HD23 LEU A 9 10.127 -9.366 5.153 1.00 25.00 H new ATOM 148 N ALA A 10 13.900 -11.853 4.690 1.00 25.00 N ATOM 149 CA ALA A 10 15.097 -12.690 4.735 1.00 25.00 C ATOM 150 C ALA A 10 15.083 -13.548 5.999 1.00 25.00 C ATOM 151 O ALA A 10 14.619 -13.097 7.040 1.00 25.00 O ATOM 152 CB ALA A 10 16.340 -11.820 4.697 1.00 25.00 C ATOM 0 H ALA A 10 13.661 -11.413 5.579 1.00 25.00 H new ATOM 0 HA ALA A 10 15.107 -13.348 3.866 1.00 25.00 H new ATOM 0 HB1 ALA A 10 17.228 -12.452 4.731 1.00 25.00 H new ATOM 0 HB2 ALA A 10 16.346 -11.234 3.778 1.00 25.00 H new ATOM 0 HB3 ALA A 10 16.340 -11.148 5.555 1.00 25.00 H new ATOM 158 N LYS A 11 15.596 -14.771 5.899 1.00 25.00 N ATOM 159 CA LYS A 11 15.668 -15.695 7.039 1.00 25.00 C ATOM 160 C LYS A 11 17.080 -15.800 7.588 1.00 25.00 C ATOM 161 O LYS A 11 18.035 -15.960 6.831 1.00 25.00 O ATOM 162 CB LYS A 11 15.220 -17.102 6.627 1.00 25.00 C ATOM 163 CG LYS A 11 15.399 -18.149 7.737 1.00 25.00 C ATOM 164 CD LYS A 11 14.772 -19.490 7.418 1.00 25.00 C ATOM 165 CE LYS A 11 13.264 -19.448 7.591 1.00 25.00 C ATOM 166 NZ LYS A 11 12.677 -20.822 7.493 1.00 25.00 N ATOM 0 H LYS A 11 15.973 -15.153 5.032 1.00 25.00 H new ATOM 0 HA LYS A 11 15.007 -15.293 7.807 1.00 25.00 H new ATOM 0 HB2 LYS A 11 14.171 -17.070 6.334 1.00 25.00 H new ATOM 0 HB3 LYS A 11 15.787 -17.413 5.749 1.00 25.00 H new ATOM 0 HG2 LYS A 11 16.464 -18.291 7.922 1.00 25.00 H new ATOM 0 HG3 LYS A 11 14.964 -17.765 8.660 1.00 25.00 H new ATOM 0 HD2 LYS A 11 15.015 -19.773 6.394 1.00 25.00 H new ATOM 0 HD3 LYS A 11 15.194 -20.255 8.069 1.00 25.00 H new ATOM 0 HE2 LYS A 11 13.017 -19.011 8.558 1.00 25.00 H new ATOM 0 HE3 LYS A 11 12.824 -18.805 6.829 1.00 25.00 H new ATOM 0 HZ1 LYS A 11 11.645 -20.768 7.614 1.00 25.00 H new ATOM 0 HZ2 LYS A 11 12.895 -21.227 6.560 1.00 25.00 H new ATOM 0 HZ3 LYS A 11 13.082 -21.426 8.236 1.00 25.00 H new ATOM 180 N ALA A 12 17.187 -15.789 8.904 1.00 25.00 N ATOM 181 CA ALA A 12 18.451 -16.014 9.591 1.00 25.00 C ATOM 182 C ALA A 12 18.831 -17.498 9.522 1.00 25.00 C ATOM 183 O ALA A 12 18.032 -18.357 9.886 1.00 25.00 O ATOM 184 CB ALA A 12 18.305 -15.575 11.034 1.00 25.00 C ATOM 0 H ALA A 12 16.399 -15.624 9.530 1.00 25.00 H new ATOM 0 HA ALA A 12 19.241 -15.437 9.111 1.00 25.00 H new ATOM 0 HB1 ALA A 12 19.245 -15.738 11.561 1.00 25.00 H new ATOM 0 HB2 ALA A 12 18.049 -14.516 11.068 1.00 25.00 H new ATOM 0 HB3 ALA A 12 17.516 -16.155 11.513 1.00 25.00 H new ATOM 190 N LEU A 13 20.043 -17.801 9.083 1.00 25.00 N ATOM 191 CA LEU A 13 20.519 -19.190 9.052 1.00 25.00 C ATOM 192 C LEU A 13 21.196 -19.535 10.358 1.00 25.00 C ATOM 193 O LEU A 13 21.420 -20.697 10.664 1.00 25.00 O ATOM 194 CB LEU A 13 21.552 -19.393 7.947 1.00 25.00 C ATOM 195 CG LEU A 13 21.167 -19.266 6.474 1.00 25.00 C ATOM 196 CD1 LEU A 13 19.715 -19.667 6.185 1.00 25.00 C ATOM 197 CD2 LEU A 13 21.437 -17.875 5.969 1.00 25.00 C ATOM 0 H LEU A 13 20.717 -17.114 8.744 1.00 25.00 H new ATOM 0 HA LEU A 13 19.650 -19.824 8.877 1.00 25.00 H new ATOM 0 HB2 LEU A 13 22.357 -18.681 8.129 1.00 25.00 H new ATOM 0 HB3 LEU A 13 21.972 -20.390 8.082 1.00 25.00 H new ATOM 0 HG LEU A 13 21.797 -19.975 5.936 1.00 25.00 H new ATOM 0 HD11 LEU A 13 19.511 -19.552 5.120 1.00 25.00 H new ATOM 0 HD12 LEU A 13 19.560 -20.706 6.474 1.00 25.00 H new ATOM 0 HD13 LEU A 13 19.041 -19.028 6.755 1.00 25.00 H new ATOM 0 HD21 LEU A 13 21.155 -17.808 4.918 1.00 25.00 H new ATOM 0 HD22 LEU A 13 20.854 -17.158 6.547 1.00 25.00 H new ATOM 0 HD23 LEU A 13 22.498 -17.649 6.075 1.00 25.00 H new ATOM 209 N TYR A 14 21.537 -18.502 11.106 1.00 25.00 N ATOM 210 CA TYR A 14 22.253 -18.641 12.366 1.00 25.00 C ATOM 211 C TYR A 14 21.716 -17.593 13.317 1.00 25.00 C ATOM 212 O TYR A 14 21.044 -16.661 12.888 1.00 25.00 O ATOM 213 CB TYR A 14 23.746 -18.413 12.146 1.00 25.00 C ATOM 214 CG TYR A 14 24.316 -19.290 11.054 1.00 25.00 C ATOM 215 CD1 TYR A 14 24.476 -18.795 9.746 1.00 25.00 C ATOM 216 CD2 TYR A 14 24.675 -20.628 11.312 1.00 25.00 C ATOM 217 CE1 TYR A 14 24.973 -19.620 8.710 1.00 25.00 C ATOM 218 CE2 TYR A 14 25.187 -21.454 10.280 1.00 25.00 C ATOM 219 CZ TYR A 14 25.325 -20.945 8.988 1.00 25.00 C ATOM 220 OH TYR A 14 25.817 -21.737 7.983 1.00 25.00 O ATOM 0 H TYR A 14 21.325 -17.536 10.857 1.00 25.00 H new ATOM 0 HA TYR A 14 22.112 -19.642 12.773 1.00 25.00 H new ATOM 0 HB2 TYR A 14 23.916 -17.367 11.892 1.00 25.00 H new ATOM 0 HB3 TYR A 14 24.280 -18.606 13.077 1.00 25.00 H new ATOM 0 HD1 TYR A 14 24.215 -17.769 9.530 1.00 25.00 H new ATOM 0 HD2 TYR A 14 24.559 -21.029 12.308 1.00 25.00 H new ATOM 0 HE1 TYR A 14 25.080 -19.229 7.709 1.00 25.00 H new ATOM 0 HE2 TYR A 14 25.469 -22.474 10.493 1.00 25.00 H new ATOM 0 HH TYR A 14 26.015 -22.629 8.337 1.00 25.00 H new ATOM 230 N ASP A 15 22.020 -17.728 14.595 1.00 25.00 N ATOM 231 CA ASP A 15 21.675 -16.708 15.575 1.00 25.00 C ATOM 232 C ASP A 15 22.689 -15.571 15.445 1.00 25.00 C ATOM 233 O ASP A 15 23.757 -15.736 14.843 1.00 25.00 O ATOM 234 CB ASP A 15 21.712 -17.292 16.990 1.00 25.00 C ATOM 235 CG ASP A 15 23.068 -17.866 17.349 1.00 25.00 C ATOM 236 OD1 ASP A 15 23.713 -17.340 18.272 1.00 25.00 O ATOM 237 OD2 ASP A 15 23.449 -18.896 16.745 1.00 25.00 O ATOM 0 H ASP A 15 22.507 -18.536 14.982 1.00 25.00 H new ATOM 0 HA ASP A 15 20.666 -16.339 15.394 1.00 25.00 H new ATOM 0 HB2 ASP A 15 21.450 -16.514 17.707 1.00 25.00 H new ATOM 0 HB3 ASP A 15 20.957 -18.073 17.076 1.00 25.00 H new ATOM 242 N ASN A 16 22.353 -14.416 15.995 1.00 25.00 N ATOM 243 CA ASN A 16 23.243 -13.268 15.980 1.00 25.00 C ATOM 244 C ASN A 16 23.076 -12.499 17.273 1.00 25.00 C ATOM 245 O ASN A 16 21.953 -12.212 17.688 1.00 25.00 O ATOM 246 CB ASN A 16 22.929 -12.345 14.805 1.00 25.00 C ATOM 247 CG ASN A 16 24.056 -11.394 14.522 1.00 25.00 C ATOM 248 OD1 ASN A 16 25.144 -11.820 14.157 1.00 25.00 O ATOM 249 ND2 ASN A 16 23.827 -10.127 14.715 1.00 25.00 N ATOM 0 H ASN A 16 21.462 -14.248 16.461 1.00 25.00 H new ATOM 0 HA ASN A 16 24.268 -13.624 15.875 1.00 25.00 H new ATOM 0 HB2 ASN A 16 22.728 -12.944 13.917 1.00 25.00 H new ATOM 0 HB3 ASN A 16 22.022 -11.779 15.020 1.00 25.00 H new ATOM 0 HD21 ASN A 16 24.570 -9.445 14.562 1.00 25.00 H new ATOM 0 HD22 ASN A 16 22.904 -9.816 15.019 1.00 25.00 H new ATOM 256 N VAL A 17 24.187 -12.132 17.885 1.00 25.00 N ATOM 257 CA VAL A 17 24.179 -11.325 19.090 1.00 25.00 C ATOM 258 C VAL A 17 24.673 -9.969 18.642 1.00 25.00 C ATOM 259 O VAL A 17 25.722 -9.858 18.018 1.00 25.00 O ATOM 260 CB VAL A 17 25.104 -11.918 20.189 1.00 25.00 C ATOM 261 CG1 VAL A 17 25.111 -11.022 21.441 1.00 25.00 C ATOM 262 CG2 VAL A 17 24.634 -13.338 20.567 1.00 25.00 C ATOM 0 H VAL A 17 25.120 -12.385 17.560 1.00 25.00 H new ATOM 0 HA VAL A 17 23.187 -11.281 19.539 1.00 25.00 H new ATOM 0 HB VAL A 17 26.118 -11.967 19.792 1.00 25.00 H new ATOM 0 HG11 VAL A 17 25.765 -11.457 22.196 1.00 25.00 H new ATOM 0 HG12 VAL A 17 25.474 -10.029 21.176 1.00 25.00 H new ATOM 0 HG13 VAL A 17 24.099 -10.944 21.839 1.00 25.00 H new ATOM 0 HG21 VAL A 17 25.289 -13.745 21.338 1.00 25.00 H new ATOM 0 HG22 VAL A 17 23.612 -13.295 20.944 1.00 25.00 H new ATOM 0 HG23 VAL A 17 24.668 -13.979 19.686 1.00 25.00 H new ATOM 272 N ALA A 18 23.865 -8.955 18.893 1.00 25.00 N ATOM 273 CA ALA A 18 24.189 -7.602 18.492 1.00 25.00 C ATOM 274 C ALA A 18 25.282 -7.057 19.403 1.00 25.00 C ATOM 275 O ALA A 18 25.146 -7.083 20.626 1.00 25.00 O ATOM 276 CB ALA A 18 22.943 -6.734 18.571 1.00 25.00 C ATOM 0 H ALA A 18 22.972 -9.047 19.377 1.00 25.00 H new ATOM 0 HA ALA A 18 24.551 -7.595 17.464 1.00 25.00 H new ATOM 0 HB1 ALA A 18 23.189 -5.716 18.269 1.00 25.00 H new ATOM 0 HB2 ALA A 18 22.178 -7.135 17.907 1.00 25.00 H new ATOM 0 HB3 ALA A 18 22.568 -6.728 19.594 1.00 25.00 H new ATOM 282 N GLU A 19 26.359 -6.583 18.799 1.00 25.00 N ATOM 283 CA GLU A 19 27.492 -6.030 19.543 1.00 25.00 C ATOM 284 C GLU A 19 27.569 -4.528 19.305 1.00 25.00 C ATOM 285 O GLU A 19 27.914 -3.755 20.195 1.00 25.00 O ATOM 286 CB GLU A 19 28.786 -6.713 19.087 1.00 25.00 C ATOM 287 CG GLU A 19 28.812 -8.211 19.391 1.00 25.00 C ATOM 288 CD GLU A 19 30.035 -8.904 18.808 1.00 25.00 C ATOM 289 OE1 GLU A 19 30.859 -9.426 19.585 1.00 25.00 O ATOM 290 OE2 GLU A 19 30.149 -8.963 17.558 1.00 25.00 O ATOM 0 H GLU A 19 26.478 -6.568 17.786 1.00 25.00 H new ATOM 0 HA GLU A 19 27.358 -6.211 20.610 1.00 25.00 H new ATOM 0 HB2 GLU A 19 28.910 -6.564 18.014 1.00 25.00 H new ATOM 0 HB3 GLU A 19 29.634 -6.234 19.576 1.00 25.00 H new ATOM 0 HG2 GLU A 19 28.795 -8.359 20.471 1.00 25.00 H new ATOM 0 HG3 GLU A 19 27.911 -8.675 18.991 1.00 25.00 H new ATOM 297 N SER A 20 27.192 -4.115 18.106 1.00 25.00 N ATOM 298 CA SER A 20 27.120 -2.698 17.767 1.00 25.00 C ATOM 299 C SER A 20 25.747 -2.206 18.193 1.00 25.00 C ATOM 300 O SER A 20 24.766 -2.948 18.106 1.00 25.00 O ATOM 301 CB SER A 20 27.304 -2.514 16.257 1.00 25.00 C ATOM 302 OG SER A 20 26.991 -1.193 15.846 1.00 25.00 O ATOM 0 H SER A 20 26.929 -4.742 17.346 1.00 25.00 H new ATOM 0 HA SER A 20 27.904 -2.134 18.272 1.00 25.00 H new ATOM 0 HB2 SER A 20 28.334 -2.745 15.985 1.00 25.00 H new ATOM 0 HB3 SER A 20 26.668 -3.221 15.724 1.00 25.00 H new ATOM 0 HG SER A 20 27.121 -1.112 14.878 1.00 25.00 H new ATOM 308 N PRO A 21 25.639 -0.935 18.613 1.00 25.00 N ATOM 309 CA PRO A 21 24.317 -0.409 18.968 1.00 25.00 C ATOM 310 C PRO A 21 23.381 -0.294 17.765 1.00 25.00 C ATOM 311 O PRO A 21 22.175 -0.126 17.928 1.00 25.00 O ATOM 312 CB PRO A 21 24.647 0.967 19.551 1.00 25.00 C ATOM 313 CG PRO A 21 25.910 1.353 18.860 1.00 25.00 C ATOM 314 CD PRO A 21 26.687 0.093 18.777 1.00 25.00 C ATOM 0 HA PRO A 21 23.781 -1.063 19.656 1.00 25.00 H new ATOM 0 HB2 PRO A 21 23.850 1.685 19.358 1.00 25.00 H new ATOM 0 HB3 PRO A 21 24.780 0.922 20.632 1.00 25.00 H new ATOM 0 HG2 PRO A 21 25.711 1.763 17.870 1.00 25.00 H new ATOM 0 HG3 PRO A 21 26.451 2.117 19.419 1.00 25.00 H new ATOM 0 HD2 PRO A 21 27.380 0.101 17.935 1.00 25.00 H new ATOM 0 HD3 PRO A 21 27.280 -0.075 19.676 1.00 25.00 H new ATOM 322 N ASP A 22 23.928 -0.420 16.563 1.00 25.00 N ATOM 323 CA ASP A 22 23.135 -0.356 15.344 1.00 25.00 C ATOM 324 C ASP A 22 22.832 -1.752 14.823 1.00 25.00 C ATOM 325 O ASP A 22 22.178 -1.890 13.818 1.00 25.00 O ATOM 326 CB ASP A 22 23.893 0.428 14.264 1.00 25.00 C ATOM 327 CG ASP A 22 23.504 1.895 14.226 1.00 25.00 C ATOM 328 OD1 ASP A 22 22.986 2.413 15.240 1.00 25.00 O ATOM 329 OD2 ASP A 22 23.683 2.519 13.158 1.00 25.00 O ATOM 0 H ASP A 22 24.925 -0.568 16.407 1.00 25.00 H new ATOM 0 HA ASP A 22 22.197 0.148 15.577 1.00 25.00 H new ATOM 0 HB2 ASP A 22 24.965 0.345 14.445 1.00 25.00 H new ATOM 0 HB3 ASP A 22 23.698 -0.021 13.290 1.00 25.00 H new ATOM 334 N GLU A 23 23.322 -2.788 15.482 1.00 25.00 N ATOM 335 CA GLU A 23 23.138 -4.159 15.013 1.00 25.00 C ATOM 336 C GLU A 23 21.873 -4.789 15.608 1.00 25.00 C ATOM 337 O GLU A 23 21.440 -4.430 16.703 1.00 25.00 O ATOM 338 CB GLU A 23 24.383 -4.973 15.388 1.00 25.00 C ATOM 339 CG GLU A 23 24.454 -6.371 14.800 1.00 25.00 C ATOM 340 CD GLU A 23 25.766 -7.064 15.126 1.00 25.00 C ATOM 341 OE1 GLU A 23 26.009 -8.166 14.580 1.00 25.00 O ATOM 342 OE2 GLU A 23 26.571 -6.514 15.919 1.00 25.00 O ATOM 0 H GLU A 23 23.854 -2.709 16.349 1.00 25.00 H new ATOM 0 HA GLU A 23 23.010 -4.156 13.931 1.00 25.00 H new ATOM 0 HB2 GLU A 23 25.266 -4.419 15.070 1.00 25.00 H new ATOM 0 HB3 GLU A 23 24.430 -5.052 16.474 1.00 25.00 H new ATOM 0 HG2 GLU A 23 23.625 -6.967 15.183 1.00 25.00 H new ATOM 0 HG3 GLU A 23 24.334 -6.315 13.718 1.00 25.00 H new ATOM 349 N LEU A 24 21.292 -5.739 14.889 1.00 25.00 N ATOM 350 CA LEU A 24 20.130 -6.483 15.385 1.00 25.00 C ATOM 351 C LEU A 24 20.517 -7.849 15.921 1.00 25.00 C ATOM 352 O LEU A 24 21.366 -8.547 15.364 1.00 25.00 O ATOM 353 CB LEU A 24 19.092 -6.692 14.284 1.00 25.00 C ATOM 354 CG LEU A 24 18.314 -5.445 13.841 1.00 25.00 C ATOM 355 CD1 LEU A 24 17.381 -5.807 12.693 1.00 25.00 C ATOM 356 CD2 LEU A 24 17.515 -4.843 15.000 1.00 25.00 C ATOM 0 H LEU A 24 21.603 -6.017 13.958 1.00 25.00 H new ATOM 0 HA LEU A 24 19.710 -5.879 16.190 1.00 25.00 H new ATOM 0 HB2 LEU A 24 19.596 -7.109 13.412 1.00 25.00 H new ATOM 0 HB3 LEU A 24 18.376 -7.439 14.626 1.00 25.00 H new ATOM 0 HG LEU A 24 19.031 -4.695 13.508 1.00 25.00 H new ATOM 0 HD11 LEU A 24 16.829 -4.921 12.379 1.00 25.00 H new ATOM 0 HD12 LEU A 24 17.966 -6.186 11.855 1.00 25.00 H new ATOM 0 HD13 LEU A 24 16.680 -6.574 13.022 1.00 25.00 H new ATOM 0 HD21 LEU A 24 16.976 -3.962 14.652 1.00 25.00 H new ATOM 0 HD22 LEU A 24 16.803 -5.580 15.373 1.00 25.00 H new ATOM 0 HD23 LEU A 24 18.196 -4.558 15.802 1.00 25.00 H new ATOM 368 N SER A 25 19.831 -8.250 16.977 1.00 25.00 N ATOM 369 CA SER A 25 20.012 -9.550 17.587 1.00 25.00 C ATOM 370 C SER A 25 18.782 -10.382 17.277 1.00 25.00 C ATOM 371 O SER A 25 17.651 -9.919 17.414 1.00 25.00 O ATOM 372 CB SER A 25 20.179 -9.392 19.095 1.00 25.00 C ATOM 373 OG SER A 25 19.615 -8.163 19.524 1.00 25.00 O ATOM 0 H SER A 25 19.126 -7.674 17.438 1.00 25.00 H new ATOM 0 HA SER A 25 20.904 -10.039 17.195 1.00 25.00 H new ATOM 0 HB2 SER A 25 19.696 -10.222 19.611 1.00 25.00 H new ATOM 0 HB3 SER A 25 21.237 -9.426 19.357 1.00 25.00 H new ATOM 0 HG SER A 25 19.726 -8.073 20.493 1.00 25.00 H new ATOM 379 N PHE A 26 19.020 -11.596 16.824 1.00 25.00 N ATOM 380 CA PHE A 26 17.957 -12.528 16.436 1.00 25.00 C ATOM 381 C PHE A 26 18.467 -13.961 16.506 1.00 25.00 C ATOM 382 O PHE A 26 19.644 -14.195 16.766 1.00 25.00 O ATOM 383 CB PHE A 26 17.485 -12.222 15.014 1.00 25.00 C ATOM 384 CG PHE A 26 18.593 -12.154 14.016 1.00 25.00 C ATOM 385 CD1 PHE A 26 19.034 -10.908 13.546 1.00 25.00 C ATOM 386 CD2 PHE A 26 19.199 -13.326 13.522 1.00 25.00 C ATOM 387 CE1 PHE A 26 20.049 -10.828 12.588 1.00 25.00 C ATOM 388 CE2 PHE A 26 20.228 -13.255 12.562 1.00 25.00 C ATOM 389 CZ PHE A 26 20.646 -12.013 12.086 1.00 25.00 C ATOM 0 H PHE A 26 19.960 -11.975 16.710 1.00 25.00 H new ATOM 0 HA PHE A 26 17.121 -12.411 17.125 1.00 25.00 H new ATOM 0 HB2 PHE A 26 16.775 -12.988 14.704 1.00 25.00 H new ATOM 0 HB3 PHE A 26 16.950 -11.273 15.015 1.00 25.00 H new ATOM 0 HD1 PHE A 26 18.585 -10.003 13.928 1.00 25.00 H new ATOM 0 HD2 PHE A 26 18.871 -14.290 13.883 1.00 25.00 H new ATOM 0 HE1 PHE A 26 20.379 -9.864 12.230 1.00 25.00 H new ATOM 0 HE2 PHE A 26 20.691 -14.159 12.196 1.00 25.00 H new ATOM 0 HZ PHE A 26 21.422 -11.953 11.337 1.00 25.00 H new ATOM 399 N ARG A 27 17.586 -14.920 16.262 1.00 25.00 N ATOM 400 CA ARG A 27 17.929 -16.334 16.306 1.00 25.00 C ATOM 401 C ARG A 27 17.805 -16.970 14.922 1.00 25.00 C ATOM 402 O ARG A 27 17.090 -16.474 14.057 1.00 25.00 O ATOM 403 CB ARG A 27 16.978 -17.022 17.288 1.00 25.00 C ATOM 404 CG ARG A 27 17.396 -18.418 17.690 1.00 25.00 C ATOM 405 CD ARG A 27 17.428 -18.545 19.184 1.00 25.00 C ATOM 406 NE ARG A 27 17.736 -19.925 19.599 1.00 25.00 N ATOM 407 CZ ARG A 27 17.645 -20.390 20.839 1.00 25.00 C ATOM 408 NH1 ARG A 27 17.244 -19.642 21.838 1.00 25.00 N ATOM 409 NH2 ARG A 27 17.959 -21.633 21.078 1.00 25.00 N ATOM 0 H ARG A 27 16.610 -14.739 16.027 1.00 25.00 H new ATOM 0 HA ARG A 27 18.963 -16.450 16.630 1.00 25.00 H new ATOM 0 HB2 ARG A 27 16.896 -16.408 18.185 1.00 25.00 H new ATOM 0 HB3 ARG A 27 15.985 -17.068 16.841 1.00 25.00 H new ATOM 0 HG2 ARG A 27 16.702 -19.147 17.272 1.00 25.00 H new ATOM 0 HG3 ARG A 27 18.380 -18.642 17.279 1.00 25.00 H new ATOM 0 HD2 ARG A 27 18.175 -17.865 19.593 1.00 25.00 H new ATOM 0 HD3 ARG A 27 16.465 -18.245 19.597 1.00 25.00 H new ATOM 0 HE ARG A 27 18.044 -20.575 18.876 1.00 25.00 H new ATOM 0 HH11 ARG A 27 16.989 -18.668 21.676 1.00 25.00 H new ATOM 0 HH12 ARG A 27 17.187 -20.034 22.778 1.00 25.00 H new ATOM 0 HH21 ARG A 27 18.270 -22.236 20.316 1.00 25.00 H new ATOM 0 HH22 ARG A 27 17.893 -22.002 22.027 1.00 25.00 H new ATOM 423 N LYS A 28 18.463 -18.107 14.741 1.00 25.00 N ATOM 424 CA LYS A 28 18.320 -18.915 13.535 1.00 25.00 C ATOM 425 C LYS A 28 16.842 -19.193 13.292 1.00 25.00 C ATOM 426 O LYS A 28 16.138 -19.649 14.186 1.00 25.00 O ATOM 427 CB LYS A 28 19.067 -20.236 13.736 1.00 25.00 C ATOM 428 CG LYS A 28 18.919 -21.237 12.603 1.00 25.00 C ATOM 429 CD LYS A 28 19.786 -22.460 12.893 1.00 25.00 C ATOM 430 CE LYS A 28 19.716 -23.500 11.781 1.00 25.00 C ATOM 431 NZ LYS A 28 20.460 -24.750 12.169 1.00 25.00 N ATOM 0 H LYS A 28 19.111 -18.496 15.425 1.00 25.00 H new ATOM 0 HA LYS A 28 18.733 -18.386 12.676 1.00 25.00 H new ATOM 0 HB2 LYS A 28 20.126 -20.020 13.873 1.00 25.00 H new ATOM 0 HB3 LYS A 28 18.714 -20.699 14.658 1.00 25.00 H new ATOM 0 HG2 LYS A 28 17.875 -21.533 12.498 1.00 25.00 H new ATOM 0 HG3 LYS A 28 19.217 -20.781 11.659 1.00 25.00 H new ATOM 0 HD2 LYS A 28 20.821 -22.145 13.027 1.00 25.00 H new ATOM 0 HD3 LYS A 28 19.467 -22.914 13.831 1.00 25.00 H new ATOM 0 HE2 LYS A 28 18.675 -23.742 11.569 1.00 25.00 H new ATOM 0 HE3 LYS A 28 20.140 -23.089 10.865 1.00 25.00 H new ATOM 0 HZ1 LYS A 28 20.399 -25.444 11.397 1.00 25.00 H new ATOM 0 HZ2 LYS A 28 21.458 -24.518 12.348 1.00 25.00 H new ATOM 0 HZ3 LYS A 28 20.038 -25.152 13.030 1.00 25.00 H new ATOM 445 N GLY A 29 16.393 -18.918 12.077 1.00 25.00 N ATOM 446 CA GLY A 29 15.011 -19.149 11.700 1.00 25.00 C ATOM 447 C GLY A 29 14.157 -17.898 11.688 1.00 25.00 C ATOM 448 O GLY A 29 13.067 -17.922 11.110 1.00 25.00 O ATOM 0 H GLY A 29 16.972 -18.532 11.332 1.00 25.00 H new ATOM 0 HA2 GLY A 29 14.987 -19.602 10.709 1.00 25.00 H new ATOM 0 HA3 GLY A 29 14.572 -19.869 12.391 1.00 25.00 H new ATOM 452 N ASP A 30 14.635 -16.810 12.284 1.00 25.00 N ATOM 453 CA ASP A 30 13.855 -15.571 12.346 1.00 25.00 C ATOM 454 C ASP A 30 13.771 -14.933 10.980 1.00 25.00 C ATOM 455 O ASP A 30 14.632 -15.149 10.122 1.00 25.00 O ATOM 456 CB ASP A 30 14.478 -14.559 13.316 1.00 25.00 C ATOM 457 CG ASP A 30 14.055 -14.792 14.752 1.00 25.00 C ATOM 458 OD1 ASP A 30 14.881 -14.581 15.667 1.00 25.00 O ATOM 459 OD2 ASP A 30 12.878 -15.143 14.970 1.00 25.00 O ATOM 0 H ASP A 30 15.551 -16.757 12.729 1.00 25.00 H new ATOM 0 HA ASP A 30 12.860 -15.838 12.701 1.00 25.00 H new ATOM 0 HB2 ASP A 30 15.564 -14.617 13.247 1.00 25.00 H new ATOM 0 HB3 ASP A 30 14.193 -13.551 13.016 1.00 25.00 H new ATOM 464 N ILE A 31 12.730 -14.135 10.788 1.00 25.00 N ATOM 465 CA ILE A 31 12.502 -13.428 9.534 1.00 25.00 C ATOM 466 C ILE A 31 12.565 -11.936 9.820 1.00 25.00 C ATOM 467 O ILE A 31 11.873 -11.445 10.710 1.00 25.00 O ATOM 468 CB ILE A 31 11.106 -13.760 8.926 1.00 25.00 C ATOM 469 CG1 ILE A 31 10.953 -15.278 8.681 1.00 25.00 C ATOM 470 CG2 ILE A 31 10.884 -12.975 7.608 1.00 25.00 C ATOM 471 CD1 ILE A 31 11.997 -15.907 7.765 1.00 25.00 C ATOM 0 H ILE A 31 12.019 -13.959 11.497 1.00 25.00 H new ATOM 0 HA ILE A 31 13.262 -13.737 8.817 1.00 25.00 H new ATOM 0 HB ILE A 31 10.346 -13.454 9.645 1.00 25.00 H new ATOM 0 HG12 ILE A 31 10.986 -15.788 9.644 1.00 25.00 H new ATOM 0 HG13 ILE A 31 9.966 -15.462 8.257 1.00 25.00 H new ATOM 0 HG21 ILE A 31 9.904 -13.220 7.199 1.00 25.00 H new ATOM 0 HG22 ILE A 31 10.936 -11.905 7.809 1.00 25.00 H new ATOM 0 HG23 ILE A 31 11.656 -13.247 6.888 1.00 25.00 H new ATOM 0 HD11 ILE A 31 11.796 -16.973 7.662 1.00 25.00 H new ATOM 0 HD12 ILE A 31 11.953 -15.433 6.784 1.00 25.00 H new ATOM 0 HD13 ILE A 31 12.989 -15.765 8.193 1.00 25.00 H new ATOM 483 N MET A 32 13.366 -11.216 9.051 1.00 25.00 N ATOM 484 CA MET A 32 13.462 -9.767 9.174 1.00 25.00 C ATOM 485 C MET A 32 13.238 -9.136 7.818 1.00 25.00 C ATOM 486 O MET A 32 13.415 -9.781 6.777 1.00 25.00 O ATOM 487 CB MET A 32 14.822 -9.357 9.741 1.00 25.00 C ATOM 488 CG MET A 32 16.019 -9.887 8.977 1.00 25.00 C ATOM 489 SD MET A 32 17.328 -10.310 10.132 1.00 25.00 S ATOM 490 CE MET A 32 16.667 -11.865 10.867 1.00 25.00 C ATOM 0 H MET A 32 13.965 -11.614 8.328 1.00 25.00 H new ATOM 0 HA MET A 32 12.696 -9.417 9.866 1.00 25.00 H new ATOM 0 HB2 MET A 32 14.877 -8.269 9.763 1.00 25.00 H new ATOM 0 HB3 MET A 32 14.887 -9.701 10.773 1.00 25.00 H new ATOM 0 HG2 MET A 32 15.734 -10.765 8.397 1.00 25.00 H new ATOM 0 HG3 MET A 32 16.373 -9.138 8.269 1.00 25.00 H new ATOM 0 HE1 MET A 32 16.730 -11.809 11.954 1.00 25.00 H new ATOM 0 HE2 MET A 32 15.626 -11.994 10.570 1.00 25.00 H new ATOM 0 HE3 MET A 32 17.253 -12.713 10.512 1.00 25.00 H new ATOM 500 N THR A 33 12.821 -7.884 7.840 1.00 25.00 N ATOM 501 CA THR A 33 12.541 -7.141 6.614 1.00 25.00 C ATOM 502 C THR A 33 13.801 -6.423 6.164 1.00 25.00 C ATOM 503 O THR A 33 14.247 -5.516 6.837 1.00 25.00 O ATOM 504 CB THR A 33 11.446 -6.084 6.850 1.00 25.00 C ATOM 505 OG1 THR A 33 10.252 -6.733 7.295 1.00 25.00 O ATOM 506 CG2 THR A 33 11.136 -5.320 5.581 1.00 25.00 C ATOM 0 H THR A 33 12.666 -7.353 8.697 1.00 25.00 H new ATOM 0 HA THR A 33 12.203 -7.849 5.857 1.00 25.00 H new ATOM 0 HB THR A 33 11.809 -5.383 7.601 1.00 25.00 H new ATOM 0 HG1 THR A 33 9.553 -6.063 7.448 1.00 25.00 H new ATOM 0 HG21 THR A 33 10.359 -4.582 5.781 1.00 25.00 H new ATOM 0 HG22 THR A 33 12.036 -4.814 5.232 1.00 25.00 H new ATOM 0 HG23 THR A 33 10.789 -6.013 4.815 1.00 25.00 H new ATOM 514 N VAL A 34 14.378 -6.829 5.045 1.00 25.00 N ATOM 515 CA VAL A 34 15.586 -6.192 4.523 1.00 25.00 C ATOM 516 C VAL A 34 15.199 -4.903 3.846 1.00 25.00 C ATOM 517 O VAL A 34 14.406 -4.890 2.903 1.00 25.00 O ATOM 518 CB VAL A 34 16.324 -7.075 3.505 1.00 25.00 C ATOM 519 CG1 VAL A 34 17.644 -6.424 3.057 1.00 25.00 C ATOM 520 CG2 VAL A 34 16.594 -8.436 4.105 1.00 25.00 C ATOM 0 H VAL A 34 14.031 -7.600 4.475 1.00 25.00 H new ATOM 0 HA VAL A 34 16.258 -6.020 5.364 1.00 25.00 H new ATOM 0 HB VAL A 34 15.688 -7.186 2.627 1.00 25.00 H new ATOM 0 HG11 VAL A 34 18.143 -7.072 2.337 1.00 25.00 H new ATOM 0 HG12 VAL A 34 17.435 -5.460 2.593 1.00 25.00 H new ATOM 0 HG13 VAL A 34 18.290 -6.278 3.923 1.00 25.00 H new ATOM 0 HG21 VAL A 34 17.117 -9.057 3.378 1.00 25.00 H new ATOM 0 HG22 VAL A 34 17.210 -8.325 4.997 1.00 25.00 H new ATOM 0 HG23 VAL A 34 15.649 -8.909 4.373 1.00 25.00 H new ATOM 530 N LEU A 35 15.753 -3.818 4.343 1.00 25.00 N ATOM 531 CA LEU A 35 15.473 -2.499 3.829 1.00 25.00 C ATOM 532 C LEU A 35 16.509 -2.147 2.784 1.00 25.00 C ATOM 533 O LEU A 35 16.165 -1.726 1.695 1.00 25.00 O ATOM 534 CB LEU A 35 15.500 -1.504 4.979 1.00 25.00 C ATOM 535 CG LEU A 35 14.450 -1.787 6.061 1.00 25.00 C ATOM 536 CD1 LEU A 35 14.704 -0.878 7.213 1.00 25.00 C ATOM 537 CD2 LEU A 35 13.028 -1.596 5.546 1.00 25.00 C ATOM 0 H LEU A 35 16.414 -3.829 5.120 1.00 25.00 H new ATOM 0 HA LEU A 35 14.487 -2.469 3.365 1.00 25.00 H new ATOM 0 HB2 LEU A 35 16.490 -1.514 5.434 1.00 25.00 H new ATOM 0 HB3 LEU A 35 15.341 -0.501 4.584 1.00 25.00 H new ATOM 0 HG LEU A 35 14.538 -2.830 6.367 1.00 25.00 H new ATOM 0 HD11 LEU A 35 13.966 -1.065 7.993 1.00 25.00 H new ATOM 0 HD12 LEU A 35 15.704 -1.061 7.607 1.00 25.00 H new ATOM 0 HD13 LEU A 35 14.628 0.158 6.883 1.00 25.00 H new ATOM 0 HD21 LEU A 35 12.319 -1.808 6.347 1.00 25.00 H new ATOM 0 HD22 LEU A 35 12.898 -0.568 5.209 1.00 25.00 H new ATOM 0 HD23 LEU A 35 12.848 -2.276 4.713 1.00 25.00 H new ATOM 549 N GLU A 36 17.771 -2.406 3.070 1.00 25.00 N ATOM 550 CA GLU A 36 18.812 -2.241 2.055 1.00 25.00 C ATOM 551 C GLU A 36 19.981 -3.153 2.371 1.00 25.00 C ATOM 552 O GLU A 36 20.022 -3.762 3.432 1.00 25.00 O ATOM 553 CB GLU A 36 19.252 -0.775 1.930 1.00 25.00 C ATOM 554 CG GLU A 36 20.193 -0.263 2.939 1.00 25.00 C ATOM 555 CD GLU A 36 20.258 1.257 2.935 1.00 25.00 C ATOM 556 OE1 GLU A 36 20.520 1.837 4.010 1.00 25.00 O ATOM 557 OE2 GLU A 36 19.994 1.874 1.884 1.00 25.00 O ATOM 0 H GLU A 36 18.104 -2.727 3.979 1.00 25.00 H new ATOM 0 HA GLU A 36 18.403 -2.525 1.085 1.00 25.00 H new ATOM 0 HB2 GLU A 36 19.706 -0.642 0.948 1.00 25.00 H new ATOM 0 HB3 GLU A 36 18.358 -0.152 1.956 1.00 25.00 H new ATOM 0 HG2 GLU A 36 19.891 -0.611 3.927 1.00 25.00 H new ATOM 0 HG3 GLU A 36 21.186 -0.669 2.748 1.00 25.00 H new ATOM 564 N ARG A 37 20.923 -3.260 1.451 1.00 25.00 N ATOM 565 CA ARG A 37 22.107 -4.082 1.654 1.00 25.00 C ATOM 566 C ARG A 37 23.290 -3.174 1.480 1.00 25.00 C ATOM 567 O ARG A 37 23.186 -2.201 0.746 1.00 25.00 O ATOM 568 CB ARG A 37 22.194 -5.179 0.608 1.00 25.00 C ATOM 569 CG ARG A 37 21.003 -6.127 0.549 1.00 25.00 C ATOM 570 CD ARG A 37 21.278 -7.291 -0.423 1.00 25.00 C ATOM 571 NE ARG A 37 21.636 -6.820 -1.779 1.00 25.00 N ATOM 572 CZ ARG A 37 22.879 -6.640 -2.233 1.00 25.00 C ATOM 573 NH1 ARG A 37 23.938 -6.907 -1.513 1.00 25.00 N ATOM 574 NH2 ARG A 37 23.056 -6.159 -3.431 1.00 25.00 N ATOM 0 H ARG A 37 20.892 -2.785 0.549 1.00 25.00 H new ATOM 0 HA ARG A 37 22.074 -4.548 2.639 1.00 25.00 H new ATOM 0 HB2 ARG A 37 22.315 -4.715 -0.371 1.00 25.00 H new ATOM 0 HB3 ARG A 37 23.093 -5.765 0.796 1.00 25.00 H new ATOM 0 HG2 ARG A 37 20.795 -6.520 1.544 1.00 25.00 H new ATOM 0 HG3 ARG A 37 20.114 -5.583 0.229 1.00 25.00 H new ATOM 0 HD2 ARG A 37 22.087 -7.906 -0.029 1.00 25.00 H new ATOM 0 HD3 ARG A 37 20.395 -7.927 -0.483 1.00 25.00 H new ATOM 0 HE ARG A 37 20.870 -6.616 -2.421 1.00 25.00 H new ATOM 0 HH11 ARG A 37 23.832 -7.268 -0.565 1.00 25.00 H new ATOM 0 HH12 ARG A 37 24.869 -6.754 -1.900 1.00 25.00 H new ATOM 0 HH21 ARG A 37 22.250 -5.925 -4.011 1.00 25.00 H new ATOM 0 HH22 ARG A 37 24.000 -6.017 -3.789 1.00 25.00 H new ATOM 588 N ASP A 38 24.388 -3.509 2.142 1.00 25.00 N ATOM 589 CA ASP A 38 25.656 -2.780 2.043 1.00 25.00 C ATOM 590 C ASP A 38 25.404 -1.326 2.469 1.00 25.00 C ATOM 591 O ASP A 38 25.923 -0.354 1.916 1.00 25.00 O ATOM 592 CB ASP A 38 26.246 -2.961 0.639 1.00 25.00 C ATOM 593 CG ASP A 38 26.248 -4.439 0.207 1.00 25.00 C ATOM 594 OD1 ASP A 38 25.761 -4.742 -0.913 1.00 25.00 O ATOM 595 OD2 ASP A 38 26.589 -5.319 1.047 1.00 25.00 O ATOM 0 H ASP A 38 24.429 -4.308 2.775 1.00 25.00 H new ATOM 0 HA ASP A 38 26.418 -3.172 2.717 1.00 25.00 H new ATOM 0 HB2 ASP A 38 25.670 -2.374 -0.076 1.00 25.00 H new ATOM 0 HB3 ASP A 38 27.265 -2.575 0.620 1.00 25.00 H new ATOM 600 N THR A 39 24.532 -1.225 3.463 1.00 25.00 N ATOM 601 CA THR A 39 24.050 0.043 4.003 1.00 25.00 C ATOM 602 C THR A 39 25.170 0.829 4.657 1.00 25.00 C ATOM 603 O THR A 39 26.074 0.257 5.227 1.00 25.00 O ATOM 604 CB THR A 39 22.936 -0.217 5.047 1.00 25.00 C ATOM 605 OG1 THR A 39 22.497 1.013 5.629 1.00 25.00 O ATOM 606 CG2 THR A 39 23.381 -1.141 6.135 1.00 25.00 C ATOM 0 H THR A 39 24.130 -2.039 3.928 1.00 25.00 H new ATOM 0 HA THR A 39 23.655 0.628 3.172 1.00 25.00 H new ATOM 0 HB THR A 39 22.113 -0.692 4.513 1.00 25.00 H new ATOM 0 HG1 THR A 39 21.948 1.504 4.982 1.00 25.00 H new ATOM 0 HG21 THR A 39 22.565 -1.291 6.841 1.00 25.00 H new ATOM 0 HG22 THR A 39 23.668 -2.100 5.703 1.00 25.00 H new ATOM 0 HG23 THR A 39 24.235 -0.707 6.655 1.00 25.00 H new ATOM 614 N GLN A 40 25.102 2.150 4.550 1.00 25.00 N ATOM 615 CA GLN A 40 26.105 3.075 5.102 1.00 25.00 C ATOM 616 C GLN A 40 27.524 2.827 4.565 1.00 25.00 C ATOM 617 O GLN A 40 28.497 3.318 5.124 1.00 25.00 O ATOM 618 CB GLN A 40 26.110 3.045 6.644 1.00 25.00 C ATOM 619 CG GLN A 40 24.723 3.002 7.274 1.00 25.00 C ATOM 620 CD GLN A 40 24.713 3.502 8.704 1.00 25.00 C ATOM 621 OE1 GLN A 40 24.919 4.677 8.955 1.00 25.00 O ATOM 622 NE2 GLN A 40 24.451 2.622 9.637 1.00 25.00 N ATOM 0 H GLN A 40 24.338 2.625 4.070 1.00 25.00 H new ATOM 0 HA GLN A 40 25.805 4.067 4.764 1.00 25.00 H new ATOM 0 HB2 GLN A 40 26.675 2.174 6.977 1.00 25.00 H new ATOM 0 HB3 GLN A 40 26.636 3.926 7.011 1.00 25.00 H new ATOM 0 HG2 GLN A 40 24.039 3.606 6.678 1.00 25.00 H new ATOM 0 HG3 GLN A 40 24.349 1.978 7.249 1.00 25.00 H new ATOM 0 HE21 GLN A 40 24.284 1.647 9.386 1.00 25.00 H new ATOM 0 HE22 GLN A 40 24.414 2.911 10.615 1.00 25.00 H new ATOM 631 N GLY A 41 27.636 2.056 3.487 1.00 25.00 N ATOM 632 CA GLY A 41 28.939 1.711 2.941 1.00 25.00 C ATOM 633 C GLY A 41 29.563 0.555 3.699 1.00 25.00 C ATOM 634 O GLY A 41 30.752 0.281 3.568 1.00 25.00 O ATOM 0 H GLY A 41 26.844 1.662 2.979 1.00 25.00 H new ATOM 0 HA2 GLY A 41 28.837 1.446 1.889 1.00 25.00 H new ATOM 0 HA3 GLY A 41 29.597 2.578 2.989 1.00 25.00 H new ATOM 638 N LEU A 42 28.763 -0.118 4.514 1.00 25.00 N ATOM 639 CA LEU A 42 29.226 -1.242 5.300 1.00 25.00 C ATOM 640 C LEU A 42 28.996 -2.494 4.474 1.00 25.00 C ATOM 641 O LEU A 42 27.929 -3.101 4.521 1.00 25.00 O ATOM 642 CB LEU A 42 28.450 -1.308 6.616 1.00 25.00 C ATOM 643 CG LEU A 42 28.517 -0.054 7.494 1.00 25.00 C ATOM 644 CD1 LEU A 42 27.465 -0.141 8.565 1.00 25.00 C ATOM 645 CD2 LEU A 42 29.876 0.085 8.142 1.00 25.00 C ATOM 0 H LEU A 42 27.776 0.103 4.646 1.00 25.00 H new ATOM 0 HA LEU A 42 30.283 -1.143 5.545 1.00 25.00 H new ATOM 0 HB2 LEU A 42 27.404 -1.514 6.389 1.00 25.00 H new ATOM 0 HB3 LEU A 42 28.823 -2.153 7.194 1.00 25.00 H new ATOM 0 HG LEU A 42 28.344 0.818 6.863 1.00 25.00 H new ATOM 0 HD11 LEU A 42 27.509 0.750 9.192 1.00 25.00 H new ATOM 0 HD12 LEU A 42 26.480 -0.211 8.103 1.00 25.00 H new ATOM 0 HD13 LEU A 42 27.642 -1.025 9.178 1.00 25.00 H new ATOM 0 HD21 LEU A 42 29.895 0.983 8.759 1.00 25.00 H new ATOM 0 HD22 LEU A 42 30.073 -0.787 8.765 1.00 25.00 H new ATOM 0 HD23 LEU A 42 30.641 0.159 7.370 1.00 25.00 H new ATOM 657 N ASP A 43 29.981 -2.849 3.673 1.00 25.00 N ATOM 658 CA ASP A 43 29.867 -4.011 2.790 1.00 25.00 C ATOM 659 C ASP A 43 29.547 -5.260 3.597 1.00 25.00 C ATOM 660 O ASP A 43 30.174 -5.548 4.620 1.00 25.00 O ATOM 661 CB ASP A 43 31.164 -4.237 2.019 1.00 25.00 C ATOM 662 CG ASP A 43 31.161 -3.552 0.668 1.00 25.00 C ATOM 663 OD1 ASP A 43 31.869 -2.538 0.504 1.00 25.00 O ATOM 664 OD2 ASP A 43 30.467 -4.053 -0.242 1.00 25.00 O ATOM 0 H ASP A 43 30.871 -2.355 3.610 1.00 25.00 H new ATOM 0 HA ASP A 43 29.061 -3.814 2.084 1.00 25.00 H new ATOM 0 HB2 ASP A 43 32.003 -3.867 2.609 1.00 25.00 H new ATOM 0 HB3 ASP A 43 31.319 -5.307 1.880 1.00 25.00 H new ATOM 669 N GLY A 44 28.540 -5.993 3.149 1.00 25.00 N ATOM 670 CA GLY A 44 28.137 -7.206 3.833 1.00 25.00 C ATOM 671 C GLY A 44 27.135 -6.984 4.948 1.00 25.00 C ATOM 672 O GLY A 44 26.507 -7.947 5.388 1.00 25.00 O ATOM 0 H GLY A 44 27.991 -5.769 2.319 1.00 25.00 H new ATOM 0 HA2 GLY A 44 27.708 -7.895 3.106 1.00 25.00 H new ATOM 0 HA3 GLY A 44 29.023 -7.689 4.246 1.00 25.00 H new ATOM 676 N TRP A 45 26.944 -5.756 5.405 1.00 25.00 N ATOM 677 CA TRP A 45 25.960 -5.464 6.427 1.00 25.00 C ATOM 678 C TRP A 45 24.657 -5.076 5.741 1.00 25.00 C ATOM 679 O TRP A 45 24.644 -4.254 4.837 1.00 25.00 O ATOM 680 CB TRP A 45 26.488 -4.320 7.280 1.00 25.00 C ATOM 681 CG TRP A 45 27.537 -4.776 8.249 1.00 25.00 C ATOM 682 CD1 TRP A 45 28.883 -4.630 8.153 1.00 25.00 C ATOM 683 CD2 TRP A 45 27.318 -5.461 9.490 1.00 25.00 C ATOM 684 NE1 TRP A 45 29.526 -5.153 9.238 1.00 25.00 N ATOM 685 CE2 TRP A 45 28.593 -5.689 10.084 1.00 25.00 C ATOM 686 CE3 TRP A 45 26.170 -5.897 10.166 1.00 25.00 C ATOM 687 CZ2 TRP A 45 28.733 -6.352 11.327 1.00 25.00 C ATOM 688 CZ3 TRP A 45 26.301 -6.530 11.411 1.00 25.00 C ATOM 689 CH2 TRP A 45 27.578 -6.756 11.977 1.00 25.00 C ATOM 0 H TRP A 45 27.464 -4.942 5.079 1.00 25.00 H new ATOM 0 HA TRP A 45 25.777 -6.328 7.066 1.00 25.00 H new ATOM 0 HB2 TRP A 45 26.904 -3.548 6.633 1.00 25.00 H new ATOM 0 HB3 TRP A 45 25.662 -3.866 7.828 1.00 25.00 H new ATOM 0 HD1 TRP A 45 29.384 -4.158 7.321 1.00 25.00 H new ATOM 0 HE1 TRP A 45 30.534 -5.146 9.392 1.00 25.00 H new ATOM 0 HE3 TRP A 45 25.193 -5.747 9.732 1.00 25.00 H new ATOM 0 HZ2 TRP A 45 29.708 -6.537 11.754 1.00 25.00 H new ATOM 0 HZ3 TRP A 45 25.417 -6.848 11.944 1.00 25.00 H new ATOM 0 HH2 TRP A 45 27.654 -7.252 12.933 1.00 25.00 H new ATOM 700 N TRP A 46 23.557 -5.688 6.143 1.00 25.00 N ATOM 701 CA TRP A 46 22.260 -5.429 5.518 1.00 25.00 C ATOM 702 C TRP A 46 21.350 -4.753 6.525 1.00 25.00 C ATOM 703 O TRP A 46 21.186 -5.240 7.636 1.00 25.00 O ATOM 704 CB TRP A 46 21.624 -6.741 5.025 1.00 25.00 C ATOM 705 CG TRP A 46 22.428 -7.453 3.941 1.00 25.00 C ATOM 706 CD1 TRP A 46 23.584 -7.033 3.353 1.00 25.00 C ATOM 707 CD2 TRP A 46 22.141 -8.731 3.328 1.00 25.00 C ATOM 708 NE1 TRP A 46 24.040 -7.923 2.434 1.00 25.00 N ATOM 709 CE2 TRP A 46 23.189 -8.992 2.391 1.00 25.00 C ATOM 710 CE3 TRP A 46 21.109 -9.685 3.474 1.00 25.00 C ATOM 711 CZ2 TRP A 46 23.232 -10.169 1.617 1.00 25.00 C ATOM 712 CZ3 TRP A 46 21.166 -10.878 2.711 1.00 25.00 C ATOM 713 CH2 TRP A 46 22.224 -11.102 1.786 1.00 25.00 C ATOM 0 H TRP A 46 23.530 -6.370 6.901 1.00 25.00 H new ATOM 0 HA TRP A 46 22.402 -4.777 4.656 1.00 25.00 H new ATOM 0 HB2 TRP A 46 21.502 -7.414 5.873 1.00 25.00 H new ATOM 0 HB3 TRP A 46 20.626 -6.527 4.641 1.00 25.00 H new ATOM 0 HD1 TRP A 46 24.079 -6.103 3.590 1.00 25.00 H new ATOM 0 HE1 TRP A 46 24.881 -7.812 1.868 1.00 25.00 H new ATOM 0 HE3 TRP A 46 20.290 -9.508 4.156 1.00 25.00 H new ATOM 0 HZ2 TRP A 46 24.031 -10.338 0.910 1.00 25.00 H new ATOM 0 HZ3 TRP A 46 20.397 -11.626 2.833 1.00 25.00 H new ATOM 0 HH2 TRP A 46 22.241 -12.014 1.207 1.00 25.00 H new ATOM 724 N LEU A 47 20.768 -3.627 6.146 1.00 25.00 N ATOM 725 CA LEU A 47 19.846 -2.910 7.016 1.00 25.00 C ATOM 726 C LEU A 47 18.553 -3.677 7.015 1.00 25.00 C ATOM 727 O LEU A 47 17.960 -3.880 5.962 1.00 25.00 O ATOM 728 CB LEU A 47 19.588 -1.501 6.483 1.00 25.00 C ATOM 729 CG LEU A 47 18.607 -0.639 7.285 1.00 25.00 C ATOM 730 CD1 LEU A 47 19.057 -0.448 8.722 1.00 25.00 C ATOM 731 CD2 LEU A 47 18.436 0.712 6.605 1.00 25.00 C ATOM 0 H LEU A 47 20.918 -3.187 5.238 1.00 25.00 H new ATOM 0 HA LEU A 47 20.265 -2.825 8.019 1.00 25.00 H new ATOM 0 HB2 LEU A 47 20.541 -0.975 6.431 1.00 25.00 H new ATOM 0 HB3 LEU A 47 19.214 -1.585 5.463 1.00 25.00 H new ATOM 0 HG LEU A 47 17.651 -1.162 7.312 1.00 25.00 H new ATOM 0 HD11 LEU A 47 18.331 0.169 9.252 1.00 25.00 H new ATOM 0 HD12 LEU A 47 19.134 -1.419 9.211 1.00 25.00 H new ATOM 0 HD13 LEU A 47 20.030 0.043 8.736 1.00 25.00 H new ATOM 0 HD21 LEU A 47 17.738 1.322 7.178 1.00 25.00 H new ATOM 0 HD22 LEU A 47 19.400 1.217 6.552 1.00 25.00 H new ATOM 0 HD23 LEU A 47 18.047 0.566 5.597 1.00 25.00 H new ATOM 743 N CYS A 48 18.108 -4.107 8.179 1.00 25.00 N ATOM 744 CA CYS A 48 16.865 -4.837 8.294 1.00 25.00 C ATOM 745 C CYS A 48 16.045 -4.318 9.448 1.00 25.00 C ATOM 746 O CYS A 48 16.522 -3.535 10.267 1.00 25.00 O ATOM 747 CB CYS A 48 17.140 -6.336 8.476 1.00 25.00 C ATOM 748 SG CYS A 48 18.315 -7.020 7.278 1.00 25.00 S ATOM 0 H CYS A 48 18.594 -3.961 9.064 1.00 25.00 H new ATOM 0 HA CYS A 48 16.299 -4.691 7.374 1.00 25.00 H new ATOM 0 HB2 CYS A 48 17.523 -6.505 9.482 1.00 25.00 H new ATOM 0 HB3 CYS A 48 16.199 -6.880 8.398 1.00 25.00 H new ATOM 0 HG CYS A 48 19.456 -6.407 7.390 1.00 25.00 H new ATOM 754 N SER A 49 14.804 -4.766 9.504 1.00 25.00 N ATOM 755 CA SER A 49 13.897 -4.403 10.568 1.00 25.00 C ATOM 756 C SER A 49 13.330 -5.679 11.184 1.00 25.00 C ATOM 757 O SER A 49 12.919 -6.608 10.473 1.00 25.00 O ATOM 758 CB SER A 49 12.813 -3.476 10.021 1.00 25.00 C ATOM 759 OG SER A 49 11.562 -4.127 9.882 1.00 25.00 O ATOM 0 H SER A 49 14.399 -5.393 8.809 1.00 25.00 H new ATOM 0 HA SER A 49 14.414 -3.855 11.356 1.00 25.00 H new ATOM 0 HB2 SER A 49 12.702 -2.620 10.687 1.00 25.00 H new ATOM 0 HB3 SER A 49 13.127 -3.088 9.052 1.00 25.00 H new ATOM 0 HG SER A 49 10.901 -3.494 9.531 1.00 25.00 H new ATOM 765 N LEU A 50 13.406 -5.751 12.504 1.00 25.00 N ATOM 766 CA LEU A 50 13.008 -6.925 13.274 1.00 25.00 C ATOM 767 C LEU A 50 12.554 -6.429 14.642 1.00 25.00 C ATOM 768 O LEU A 50 13.164 -5.514 15.175 1.00 25.00 O ATOM 769 CB LEU A 50 14.214 -7.849 13.445 1.00 25.00 C ATOM 770 CG LEU A 50 13.960 -9.155 14.205 1.00 25.00 C ATOM 771 CD1 LEU A 50 14.072 -10.326 13.278 1.00 25.00 C ATOM 772 CD2 LEU A 50 14.950 -9.276 15.352 1.00 25.00 C ATOM 0 H LEU A 50 13.751 -4.985 13.082 1.00 25.00 H new ATOM 0 HA LEU A 50 12.211 -7.473 12.771 1.00 25.00 H new ATOM 0 HB2 LEU A 50 14.599 -8.097 12.456 1.00 25.00 H new ATOM 0 HB3 LEU A 50 14.998 -7.297 13.963 1.00 25.00 H new ATOM 0 HG LEU A 50 12.949 -9.145 14.613 1.00 25.00 H new ATOM 0 HD11 LEU A 50 13.889 -11.247 13.832 1.00 25.00 H new ATOM 0 HD12 LEU A 50 13.336 -10.230 12.480 1.00 25.00 H new ATOM 0 HD13 LEU A 50 15.073 -10.354 12.847 1.00 25.00 H new ATOM 0 HD21 LEU A 50 14.769 -10.205 15.892 1.00 25.00 H new ATOM 0 HD22 LEU A 50 15.966 -9.278 14.957 1.00 25.00 H new ATOM 0 HD23 LEU A 50 14.826 -8.432 16.030 1.00 25.00 H new ATOM 784 N HIS A 51 11.475 -6.994 15.181 1.00 25.00 N ATOM 785 CA HIS A 51 10.926 -6.589 16.493 1.00 25.00 C ATOM 786 C HIS A 51 10.594 -5.082 16.556 1.00 25.00 C ATOM 787 O HIS A 51 10.578 -4.480 17.621 1.00 25.00 O ATOM 788 CB HIS A 51 11.904 -6.977 17.626 1.00 25.00 C ATOM 789 CG HIS A 51 11.705 -8.368 18.139 1.00 25.00 C ATOM 790 ND1 HIS A 51 10.870 -8.693 19.178 1.00 25.00 N ATOM 791 CD2 HIS A 51 12.267 -9.547 17.759 1.00 25.00 C ATOM 792 CE1 HIS A 51 10.946 -10.003 19.380 1.00 25.00 C ATOM 793 NE2 HIS A 51 11.779 -10.577 18.539 1.00 25.00 N ATOM 0 H HIS A 51 10.951 -7.744 14.730 1.00 25.00 H new ATOM 0 HA HIS A 51 9.987 -7.126 16.628 1.00 25.00 H new ATOM 0 HB2 HIS A 51 12.927 -6.876 17.262 1.00 25.00 H new ATOM 0 HB3 HIS A 51 11.788 -6.274 18.451 1.00 25.00 H new ATOM 0 HD2 HIS A 51 12.989 -9.661 16.964 1.00 25.00 H new ATOM 0 HE1 HIS A 51 10.392 -10.532 20.141 1.00 25.00 H new ATOM 0 HE2 HIS A 51 12.014 -11.568 18.477 1.00 25.00 H new ATOM 801 N GLY A 52 10.295 -4.487 15.407 1.00 25.00 N ATOM 802 CA GLY A 52 9.971 -3.066 15.363 1.00 25.00 C ATOM 803 C GLY A 52 11.187 -2.175 15.556 1.00 25.00 C ATOM 804 O GLY A 52 11.055 -0.982 15.813 1.00 25.00 O ATOM 0 H GLY A 52 10.270 -4.960 14.503 1.00 25.00 H new ATOM 0 HA2 GLY A 52 9.506 -2.834 14.405 1.00 25.00 H new ATOM 0 HA3 GLY A 52 9.236 -2.842 16.137 1.00 25.00 H new ATOM 808 N ARG A 53 12.375 -2.752 15.431 1.00 25.00 N ATOM 809 CA ARG A 53 13.631 -2.039 15.599 1.00 25.00 C ATOM 810 C ARG A 53 14.344 -2.191 14.274 1.00 25.00 C ATOM 811 O ARG A 53 14.146 -3.177 13.579 1.00 25.00 O ATOM 812 CB ARG A 53 14.438 -2.687 16.737 1.00 25.00 C ATOM 813 CG ARG A 53 15.278 -1.716 17.574 1.00 25.00 C ATOM 814 CD ARG A 53 16.694 -1.567 17.030 1.00 25.00 C ATOM 815 NE ARG A 53 17.543 -0.771 17.930 1.00 25.00 N ATOM 816 CZ ARG A 53 18.833 -0.510 17.734 1.00 25.00 C ATOM 817 NH1 ARG A 53 19.492 -0.922 16.684 1.00 25.00 N ATOM 818 NH2 ARG A 53 19.472 0.182 18.629 1.00 25.00 N ATOM 0 H ARG A 53 12.493 -3.740 15.207 1.00 25.00 H new ATOM 0 HA ARG A 53 13.494 -0.990 15.860 1.00 25.00 H new ATOM 0 HB2 ARG A 53 13.748 -3.209 17.399 1.00 25.00 H new ATOM 0 HB3 ARG A 53 15.100 -3.440 16.309 1.00 25.00 H new ATOM 0 HG2 ARG A 53 14.793 -0.740 17.592 1.00 25.00 H new ATOM 0 HG3 ARG A 53 15.321 -2.070 18.604 1.00 25.00 H new ATOM 0 HD2 ARG A 53 17.136 -2.554 16.891 1.00 25.00 H new ATOM 0 HD3 ARG A 53 16.659 -1.093 16.049 1.00 25.00 H new ATOM 0 HE ARG A 53 17.109 -0.389 18.770 1.00 25.00 H new ATOM 0 HH11 ARG A 53 19.018 -1.471 15.967 1.00 25.00 H new ATOM 0 HH12 ARG A 53 20.481 -0.695 16.581 1.00 25.00 H new ATOM 0 HH21 ARG A 53 18.984 0.513 19.461 1.00 25.00 H new ATOM 0 HH22 ARG A 53 20.461 0.394 18.499 1.00 25.00 H new ATOM 832 N GLN A 54 15.157 -1.217 13.923 1.00 25.00 N ATOM 833 CA GLN A 54 15.913 -1.249 12.678 1.00 25.00 C ATOM 834 C GLN A 54 17.386 -1.355 13.010 1.00 25.00 C ATOM 835 O GLN A 54 17.826 -0.824 14.025 1.00 25.00 O ATOM 836 CB GLN A 54 15.657 0.030 11.888 1.00 25.00 C ATOM 837 CG GLN A 54 14.868 -0.189 10.632 1.00 25.00 C ATOM 838 CD GLN A 54 14.579 1.104 9.893 1.00 25.00 C ATOM 839 OE1 GLN A 54 13.441 1.404 9.581 1.00 25.00 O ATOM 840 NE2 GLN A 54 15.605 1.865 9.605 1.00 25.00 N ATOM 0 H GLN A 54 15.316 -0.382 14.487 1.00 25.00 H new ATOM 0 HA GLN A 54 15.603 -2.104 12.077 1.00 25.00 H new ATOM 0 HB2 GLN A 54 15.125 0.739 12.523 1.00 25.00 H new ATOM 0 HB3 GLN A 54 16.613 0.487 11.632 1.00 25.00 H new ATOM 0 HG2 GLN A 54 15.417 -0.864 9.975 1.00 25.00 H new ATOM 0 HG3 GLN A 54 13.927 -0.680 10.879 1.00 25.00 H new ATOM 0 HE21 GLN A 54 16.544 1.581 9.883 1.00 25.00 H new ATOM 0 HE22 GLN A 54 15.465 2.742 9.103 1.00 25.00 H new ATOM 849 N GLY A 55 18.145 -2.030 12.168 1.00 25.00 N ATOM 850 CA GLY A 55 19.570 -2.149 12.400 1.00 25.00 C ATOM 851 C GLY A 55 20.269 -2.983 11.352 1.00 25.00 C ATOM 852 O GLY A 55 19.618 -3.584 10.501 1.00 25.00 O ATOM 0 H GLY A 55 17.804 -2.498 11.328 1.00 25.00 H new ATOM 0 HA2 GLY A 55 20.014 -1.154 12.420 1.00 25.00 H new ATOM 0 HA3 GLY A 55 19.737 -2.593 13.381 1.00 25.00 H new ATOM 856 N ILE A 56 21.589 -3.000 11.397 1.00 25.00 N ATOM 857 CA ILE A 56 22.388 -3.751 10.438 1.00 25.00 C ATOM 858 C ILE A 56 22.500 -5.203 10.884 1.00 25.00 C ATOM 859 O ILE A 56 22.368 -5.532 12.066 1.00 25.00 O ATOM 860 CB ILE A 56 23.801 -3.112 10.247 1.00 25.00 C ATOM 861 CG1 ILE A 56 24.606 -3.181 11.564 1.00 25.00 C ATOM 862 CG2 ILE A 56 23.635 -1.648 9.816 1.00 25.00 C ATOM 863 CD1 ILE A 56 26.019 -2.625 11.474 1.00 25.00 C ATOM 0 H ILE A 56 22.138 -2.497 12.095 1.00 25.00 H new ATOM 0 HA ILE A 56 21.887 -3.717 9.471 1.00 25.00 H new ATOM 0 HB ILE A 56 24.344 -3.665 9.480 1.00 25.00 H new ATOM 0 HG12 ILE A 56 24.063 -2.634 12.335 1.00 25.00 H new ATOM 0 HG13 ILE A 56 24.659 -4.220 11.888 1.00 25.00 H new ATOM 0 HG21 ILE A 56 24.617 -1.195 9.681 1.00 25.00 H new ATOM 0 HG22 ILE A 56 23.083 -1.606 8.877 1.00 25.00 H new ATOM 0 HG23 ILE A 56 23.087 -1.103 10.584 1.00 25.00 H new ATOM 0 HD11 ILE A 56 26.508 -2.715 12.444 1.00 25.00 H new ATOM 0 HD12 ILE A 56 26.584 -3.186 10.730 1.00 25.00 H new ATOM 0 HD13 ILE A 56 25.979 -1.575 11.184 1.00 25.00 H new ATOM 875 N VAL A 57 22.688 -6.074 9.910 1.00 25.00 N ATOM 876 CA VAL A 57 22.775 -7.512 10.137 1.00 25.00 C ATOM 877 C VAL A 57 23.869 -8.067 9.237 1.00 25.00 C ATOM 878 O VAL A 57 23.956 -7.677 8.074 1.00 25.00 O ATOM 879 CB VAL A 57 21.445 -8.200 9.739 1.00 25.00 C ATOM 880 CG1 VAL A 57 21.527 -9.687 9.876 1.00 25.00 C ATOM 881 CG2 VAL A 57 20.282 -7.634 10.551 1.00 25.00 C ATOM 0 H VAL A 57 22.786 -5.806 8.931 1.00 25.00 H new ATOM 0 HA VAL A 57 22.984 -7.698 11.191 1.00 25.00 H new ATOM 0 HB VAL A 57 21.264 -7.985 8.686 1.00 25.00 H new ATOM 0 HG11 VAL A 57 20.575 -10.132 9.588 1.00 25.00 H new ATOM 0 HG12 VAL A 57 22.317 -10.069 9.229 1.00 25.00 H new ATOM 0 HG13 VAL A 57 21.749 -9.945 10.911 1.00 25.00 H new ATOM 0 HG21 VAL A 57 19.357 -8.130 10.257 1.00 25.00 H new ATOM 0 HG22 VAL A 57 20.463 -7.804 11.612 1.00 25.00 H new ATOM 0 HG23 VAL A 57 20.195 -6.564 10.364 1.00 25.00 H new ATOM 891 N PRO A 58 24.697 -8.998 9.735 1.00 25.00 N ATOM 892 CA PRO A 58 25.686 -9.582 8.829 1.00 25.00 C ATOM 893 C PRO A 58 25.013 -10.468 7.774 1.00 25.00 C ATOM 894 O PRO A 58 24.398 -11.491 8.088 1.00 25.00 O ATOM 895 CB PRO A 58 26.585 -10.379 9.775 1.00 25.00 C ATOM 896 CG PRO A 58 25.716 -10.743 10.915 1.00 25.00 C ATOM 897 CD PRO A 58 24.759 -9.598 11.079 1.00 25.00 C ATOM 0 HA PRO A 58 26.241 -8.845 8.250 1.00 25.00 H new ATOM 0 HB2 PRO A 58 26.985 -11.267 9.285 1.00 25.00 H new ATOM 0 HB3 PRO A 58 27.438 -9.785 10.103 1.00 25.00 H new ATOM 0 HG2 PRO A 58 25.183 -11.674 10.719 1.00 25.00 H new ATOM 0 HG3 PRO A 58 26.302 -10.896 11.821 1.00 25.00 H new ATOM 0 HD2 PRO A 58 23.779 -9.940 11.410 1.00 25.00 H new ATOM 0 HD3 PRO A 58 25.114 -8.883 11.821 1.00 25.00 H new ATOM 905 N GLY A 59 25.134 -10.071 6.515 1.00 25.00 N ATOM 906 CA GLY A 59 24.502 -10.785 5.416 1.00 25.00 C ATOM 907 C GLY A 59 24.998 -12.206 5.273 1.00 25.00 C ATOM 908 O GLY A 59 24.289 -13.068 4.778 1.00 25.00 O ATOM 0 H GLY A 59 25.669 -9.251 6.229 1.00 25.00 H new ATOM 0 HA2 GLY A 59 23.423 -10.796 5.570 1.00 25.00 H new ATOM 0 HA3 GLY A 59 24.686 -10.246 4.486 1.00 25.00 H new ATOM 912 N ASN A 60 26.198 -12.468 5.772 1.00 25.00 N ATOM 913 CA ASN A 60 26.781 -13.815 5.738 1.00 25.00 C ATOM 914 C ASN A 60 26.003 -14.818 6.608 1.00 25.00 C ATOM 915 O ASN A 60 26.229 -16.020 6.537 1.00 25.00 O ATOM 916 CB ASN A 60 28.243 -13.750 6.199 1.00 25.00 C ATOM 917 CG ASN A 60 29.047 -14.946 5.742 1.00 25.00 C ATOM 918 OD1 ASN A 60 28.795 -15.512 4.695 1.00 25.00 O ATOM 919 ND2 ASN A 60 30.038 -15.306 6.504 1.00 25.00 N ATOM 0 H ASN A 60 26.795 -11.766 6.209 1.00 25.00 H new ATOM 0 HA ASN A 60 26.723 -14.171 4.710 1.00 25.00 H new ATOM 0 HB2 ASN A 60 28.702 -12.839 5.814 1.00 25.00 H new ATOM 0 HB3 ASN A 60 28.275 -13.688 7.287 1.00 25.00 H new ATOM 0 HD21 ASN A 60 30.634 -16.087 6.230 1.00 25.00 H new ATOM 0 HD22 ASN A 60 30.219 -14.807 7.375 1.00 25.00 H new ATOM 926 N ARG A 61 25.076 -14.321 7.423 1.00 25.00 N ATOM 927 CA ARG A 61 24.230 -15.180 8.261 1.00 25.00 C ATOM 928 C ARG A 61 22.758 -15.057 7.857 1.00 25.00 C ATOM 929 O ARG A 61 21.872 -15.563 8.554 1.00 25.00 O ATOM 930 CB ARG A 61 24.419 -14.813 9.742 1.00 25.00 C ATOM 931 CG ARG A 61 25.851 -15.042 10.238 1.00 25.00 C ATOM 932 CD ARG A 61 26.019 -14.638 11.694 1.00 25.00 C ATOM 933 NE ARG A 61 27.377 -14.951 12.175 1.00 25.00 N ATOM 934 CZ ARG A 61 27.863 -14.633 13.369 1.00 25.00 C ATOM 935 NH1 ARG A 61 27.185 -13.951 14.255 1.00 25.00 N ATOM 936 NH2 ARG A 61 29.071 -15.016 13.670 1.00 25.00 N ATOM 0 H ARG A 61 24.888 -13.324 7.524 1.00 25.00 H new ATOM 0 HA ARG A 61 24.531 -16.217 8.113 1.00 25.00 H new ATOM 0 HB2 ARG A 61 24.153 -13.766 9.888 1.00 25.00 H new ATOM 0 HB3 ARG A 61 23.732 -15.404 10.348 1.00 25.00 H new ATOM 0 HG2 ARG A 61 26.112 -16.094 10.121 1.00 25.00 H new ATOM 0 HG3 ARG A 61 26.545 -14.471 9.621 1.00 25.00 H new ATOM 0 HD2 ARG A 61 25.827 -13.571 11.804 1.00 25.00 H new ATOM 0 HD3 ARG A 61 25.283 -15.158 12.307 1.00 25.00 H new ATOM 0 HE ARG A 61 27.995 -15.454 11.538 1.00 25.00 H new ATOM 0 HH11 ARG A 61 26.238 -13.638 14.042 1.00 25.00 H new ATOM 0 HH12 ARG A 61 27.603 -13.732 15.159 1.00 25.00 H new ATOM 0 HH21 ARG A 61 29.621 -15.548 12.995 1.00 25.00 H new ATOM 0 HH22 ARG A 61 29.467 -14.784 14.581 1.00 25.00 H new ATOM 950 N LEU A 62 22.499 -14.407 6.728 1.00 25.00 N ATOM 951 CA LEU A 62 21.134 -14.208 6.238 1.00 25.00 C ATOM 952 C LEU A 62 20.904 -14.789 4.858 1.00 25.00 C ATOM 953 O LEU A 62 21.803 -14.868 4.031 1.00 25.00 O ATOM 954 CB LEU A 62 20.808 -12.718 6.146 1.00 25.00 C ATOM 955 CG LEU A 62 20.045 -12.102 7.321 1.00 25.00 C ATOM 956 CD1 LEU A 62 19.807 -10.636 7.007 1.00 25.00 C ATOM 957 CD2 LEU A 62 18.714 -12.783 7.600 1.00 25.00 C ATOM 0 H LEU A 62 23.220 -14.005 6.129 1.00 25.00 H new ATOM 0 HA LEU A 62 20.494 -14.722 6.956 1.00 25.00 H new ATOM 0 HB2 LEU A 62 21.744 -12.173 6.026 1.00 25.00 H new ATOM 0 HB3 LEU A 62 20.225 -12.554 5.240 1.00 25.00 H new ATOM 0 HG LEU A 62 20.650 -12.233 8.218 1.00 25.00 H new ATOM 0 HD11 LEU A 62 19.264 -10.171 7.830 1.00 25.00 H new ATOM 0 HD12 LEU A 62 20.764 -10.132 6.874 1.00 25.00 H new ATOM 0 HD13 LEU A 62 19.222 -10.550 6.091 1.00 25.00 H new ATOM 0 HD21 LEU A 62 18.226 -12.296 8.445 1.00 25.00 H new ATOM 0 HD22 LEU A 62 18.075 -12.708 6.720 1.00 25.00 H new ATOM 0 HD23 LEU A 62 18.885 -13.833 7.836 1.00 25.00 H new ATOM 969 N LYS A 63 19.655 -15.136 4.601 1.00 25.00 N ATOM 970 CA LYS A 63 19.236 -15.601 3.279 1.00 25.00 C ATOM 971 C LYS A 63 18.030 -14.835 2.817 1.00 25.00 C ATOM 972 O LYS A 63 16.979 -14.896 3.439 1.00 25.00 O ATOM 973 CB LYS A 63 18.895 -17.091 3.302 1.00 25.00 C ATOM 974 CG LYS A 63 18.379 -17.616 1.953 1.00 25.00 C ATOM 975 CD LYS A 63 18.186 -19.129 1.942 1.00 25.00 C ATOM 976 CE LYS A 63 19.528 -19.845 1.954 1.00 25.00 C ATOM 977 NZ LYS A 63 19.400 -21.328 1.731 1.00 25.00 N ATOM 0 H LYS A 63 18.905 -15.106 5.292 1.00 25.00 H new ATOM 0 HA LYS A 63 20.067 -15.436 2.593 1.00 25.00 H new ATOM 0 HB2 LYS A 63 19.782 -17.656 3.589 1.00 25.00 H new ATOM 0 HB3 LYS A 63 18.141 -17.272 4.068 1.00 25.00 H new ATOM 0 HG2 LYS A 63 17.431 -17.132 1.718 1.00 25.00 H new ATOM 0 HG3 LYS A 63 19.082 -17.338 1.167 1.00 25.00 H new ATOM 0 HD2 LYS A 63 17.600 -19.432 2.810 1.00 25.00 H new ATOM 0 HD3 LYS A 63 17.621 -19.422 1.057 1.00 25.00 H new ATOM 0 HE2 LYS A 63 20.168 -19.420 1.181 1.00 25.00 H new ATOM 0 HE3 LYS A 63 20.021 -19.667 2.910 1.00 25.00 H new ATOM 0 HZ1 LYS A 63 20.344 -21.765 1.749 1.00 25.00 H new ATOM 0 HZ2 LYS A 63 18.812 -21.743 2.482 1.00 25.00 H new ATOM 0 HZ3 LYS A 63 18.955 -21.503 0.807 1.00 25.00 H new ATOM 991 N ILE A 64 18.172 -14.154 1.695 1.00 25.00 N ATOM 992 CA ILE A 64 17.061 -13.433 1.095 1.00 25.00 C ATOM 993 C ILE A 64 16.053 -14.460 0.601 1.00 25.00 C ATOM 994 O ILE A 64 16.404 -15.379 -0.145 1.00 25.00 O ATOM 995 CB ILE A 64 17.529 -12.581 -0.107 1.00 25.00 C ATOM 996 CG1 ILE A 64 18.634 -11.590 0.310 1.00 25.00 C ATOM 997 CG2 ILE A 64 16.357 -11.819 -0.710 1.00 25.00 C ATOM 998 CD1 ILE A 64 18.209 -10.503 1.318 1.00 25.00 C ATOM 0 H ILE A 64 19.048 -14.084 1.178 1.00 25.00 H new ATOM 0 HA ILE A 64 16.625 -12.765 1.838 1.00 25.00 H new ATOM 0 HB ILE A 64 17.937 -13.260 -0.855 1.00 25.00 H new ATOM 0 HG12 ILE A 64 19.461 -12.155 0.740 1.00 25.00 H new ATOM 0 HG13 ILE A 64 19.015 -11.100 -0.586 1.00 25.00 H new ATOM 0 HG21 ILE A 64 16.705 -11.225 -1.555 1.00 25.00 H new ATOM 0 HG22 ILE A 64 15.600 -12.526 -1.051 1.00 25.00 H new ATOM 0 HG23 ILE A 64 15.925 -11.160 0.043 1.00 25.00 H new ATOM 0 HD11 ILE A 64 19.061 -9.861 1.542 1.00 25.00 H new ATOM 0 HD12 ILE A 64 17.406 -9.903 0.889 1.00 25.00 H new ATOM 0 HD13 ILE A 64 17.859 -10.975 2.236 1.00 25.00 H new ATOM 1010 N LEU A 65 14.808 -14.316 1.018 1.00 25.00 N ATOM 1011 CA LEU A 65 13.756 -15.229 0.598 1.00 25.00 C ATOM 1012 C LEU A 65 13.063 -14.611 -0.603 1.00 25.00 C ATOM 1013 O LEU A 65 12.134 -13.825 -0.471 1.00 25.00 O ATOM 1014 CB LEU A 65 12.774 -15.484 1.741 1.00 25.00 C ATOM 1015 CG LEU A 65 13.409 -16.026 3.034 1.00 25.00 C ATOM 1016 CD1 LEU A 65 12.298 -16.224 4.057 1.00 25.00 C ATOM 1017 CD2 LEU A 65 14.190 -17.348 2.811 1.00 25.00 C ATOM 0 H LEU A 65 14.499 -13.575 1.648 1.00 25.00 H new ATOM 0 HA LEU A 65 14.175 -16.197 0.324 1.00 25.00 H new ATOM 0 HB2 LEU A 65 12.257 -14.552 1.971 1.00 25.00 H new ATOM 0 HB3 LEU A 65 12.019 -16.192 1.400 1.00 25.00 H new ATOM 0 HG LEU A 65 14.142 -15.303 3.392 1.00 25.00 H new ATOM 0 HD11 LEU A 65 12.722 -16.608 4.985 1.00 25.00 H new ATOM 0 HD12 LEU A 65 11.807 -15.270 4.250 1.00 25.00 H new ATOM 0 HD13 LEU A 65 11.569 -16.935 3.669 1.00 25.00 H new ATOM 0 HD21 LEU A 65 14.616 -17.683 3.757 1.00 25.00 H new ATOM 0 HD22 LEU A 65 13.512 -18.111 2.428 1.00 25.00 H new ATOM 0 HD23 LEU A 65 14.991 -17.180 2.091 1.00 25.00 H new ATOM 1327 N PRO A 89 29.201 -18.885 10.580 1.00 25.00 N ATOM 1328 CA PRO A 89 30.424 -18.346 9.980 1.00 25.00 C ATOM 1329 C PRO A 89 30.737 -16.937 10.508 1.00 25.00 C ATOM 1330 O PRO A 89 29.881 -16.302 11.150 1.00 25.00 O ATOM 1331 CB PRO A 89 30.070 -18.317 8.491 1.00 25.00 C ATOM 1332 CG PRO A 89 28.630 -18.011 8.482 1.00 25.00 C ATOM 1333 CD PRO A 89 28.071 -18.801 9.634 1.00 25.00 C ATOM 0 HA PRO A 89 31.314 -18.932 10.207 1.00 25.00 H new ATOM 0 HB2 PRO A 89 30.644 -17.559 7.957 1.00 25.00 H new ATOM 0 HB3 PRO A 89 30.280 -19.273 8.011 1.00 25.00 H new ATOM 0 HG2 PRO A 89 28.450 -16.943 8.608 1.00 25.00 H new ATOM 0 HG3 PRO A 89 28.168 -18.303 7.539 1.00 25.00 H new ATOM 0 HD2 PRO A 89 27.210 -18.303 10.081 1.00 25.00 H new ATOM 0 HD3 PRO A 89 27.739 -19.790 9.318 1.00 25.00 H new ATOM 1341 N PRO A 90 31.953 -16.418 10.244 1.00 25.00 N ATOM 1342 CA PRO A 90 32.272 -15.061 10.712 1.00 25.00 C ATOM 1343 C PRO A 90 31.366 -13.964 10.150 1.00 25.00 C ATOM 1344 O PRO A 90 30.737 -14.122 9.099 1.00 25.00 O ATOM 1345 CB PRO A 90 33.706 -14.848 10.208 1.00 25.00 C ATOM 1346 CG PRO A 90 34.251 -16.213 10.036 1.00 25.00 C ATOM 1347 CD PRO A 90 33.097 -17.009 9.524 1.00 25.00 C ATOM 0 HA PRO A 90 32.139 -14.990 11.791 1.00 25.00 H new ATOM 0 HB2 PRO A 90 33.717 -14.296 9.268 1.00 25.00 H new ATOM 0 HB3 PRO A 90 34.296 -14.273 10.922 1.00 25.00 H new ATOM 0 HG2 PRO A 90 35.084 -16.223 9.333 1.00 25.00 H new ATOM 0 HG3 PRO A 90 34.624 -16.614 10.978 1.00 25.00 H new ATOM 0 HD2 PRO A 90 32.988 -16.916 8.444 1.00 25.00 H new ATOM 0 HD3 PRO A 90 33.208 -18.071 9.742 1.00 25.00 H new ATOM 1355 N LYS A 91 31.339 -12.837 10.846 1.00 25.00 N ATOM 1356 CA LYS A 91 30.598 -11.653 10.414 1.00 25.00 C ATOM 1357 C LYS A 91 31.623 -10.675 9.828 1.00 25.00 C ATOM 1358 O LYS A 91 32.791 -10.717 10.214 1.00 25.00 O ATOM 1359 CB LYS A 91 29.857 -11.024 11.613 1.00 25.00 C ATOM 1360 CG LYS A 91 30.751 -10.723 12.837 1.00 25.00 C ATOM 1361 CD LYS A 91 29.937 -10.238 14.046 1.00 25.00 C ATOM 1362 CE LYS A 91 29.542 -8.799 13.930 1.00 25.00 C ATOM 1363 NZ LYS A 91 28.839 -8.332 15.182 1.00 25.00 N ATOM 0 H LYS A 91 31.831 -12.714 11.731 1.00 25.00 H new ATOM 0 HA LYS A 91 29.846 -11.908 9.667 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.387 -10.096 11.286 1.00 25.00 H new ATOM 0 HB3 LYS A 91 29.056 -11.696 11.921 1.00 25.00 H new ATOM 0 HG2 LYS A 91 31.304 -11.622 13.111 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.487 -9.965 12.569 1.00 25.00 H new ATOM 0 HD2 LYS A 91 29.041 -10.851 14.146 1.00 25.00 H new ATOM 0 HD3 LYS A 91 30.523 -10.379 14.954 1.00 25.00 H new ATOM 0 HE2 LYS A 91 30.427 -8.187 13.755 1.00 25.00 H new ATOM 0 HE3 LYS A 91 28.887 -8.665 13.069 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 28.962 -7.305 15.287 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 27.825 -8.554 15.114 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 29.245 -8.815 16.009 1.00 25.00 H new ATOM 1377 N PRO A 92 31.208 -9.809 8.883 1.00 25.00 N ATOM 1378 CA PRO A 92 32.172 -8.832 8.360 1.00 25.00 C ATOM 1379 C PRO A 92 32.549 -7.797 9.432 1.00 25.00 C ATOM 1380 O PRO A 92 31.829 -7.643 10.429 1.00 25.00 O ATOM 1381 CB PRO A 92 31.411 -8.196 7.188 1.00 25.00 C ATOM 1382 CG PRO A 92 29.996 -8.318 7.560 1.00 25.00 C ATOM 1383 CD PRO A 92 29.884 -9.641 8.256 1.00 25.00 C ATOM 0 HA PRO A 92 33.121 -9.274 8.056 1.00 25.00 H new ATOM 0 HB2 PRO A 92 31.696 -7.153 7.048 1.00 25.00 H new ATOM 0 HB3 PRO A 92 31.621 -8.712 6.251 1.00 25.00 H new ATOM 0 HG2 PRO A 92 29.689 -7.502 8.214 1.00 25.00 H new ATOM 0 HG3 PRO A 92 29.353 -8.280 6.681 1.00 25.00 H new ATOM 0 HD2 PRO A 92 29.085 -9.639 8.998 1.00 25.00 H new ATOM 0 HD3 PRO A 92 29.666 -10.447 7.555 1.00 25.00 H new