USER MOD reduce.3.24.130724 H: found=0, std=0, add=570, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 571 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: A 55 THR OG1 : rot 114:sc= 0.338 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0.323 USER MOD Set 2.1: A 7 THR OG1 : rot 124:sc= 1.01 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.807 USER MOD Single : A 1 MET CE :methyl -157:sc= 0 (180deg=-0.507) USER MOD Single : A 1 MET N :NH3+ 136:sc= 1.17 (180deg=0.373) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 158:sc= -0.0416 (180deg=-0.502) USER MOD Single : A 11 LYS NZ :NH3+ -159:sc= -0.0155 (180deg=-0.201) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -71:sc= 1.92 USER MOD Single : A 20 SER OG : rot -17:sc= 1.14 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.269 USER MOD Single : A 25 ASN : amide:sc= -0.95 K(o=-0.95,f=-2.1!) USER MOD Single : A 27 LYS NZ :NH3+ -170:sc= 0.0823 (180deg=0.0642) USER MOD Single : A 29 LYS NZ :NH3+ -157:sc= -0.0819 (180deg=-0.656) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 33 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.176) USER MOD Single : A 40 GLN : amide:sc= -0.0542 X(o=-0.054,f=-0.034) USER MOD Single : A 41 GLN : amide:sc= -2.75 X(o=-2.7,f=-2.7) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -4.68! K(o=-4.7!,f=-1.1) USER MOD Single : A 59 TYR OH : rot 180:sc= -0.28 USER MOD Single : A 60 ASN : amide:sc= -0.0606 X(o=-0.061,f=-0.046) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -165:sc= -0.0184 (180deg=-0.397) USER MOD Single : A 66 THR OG1 : rot 27:sc= 0.119 USER MOD Single : A 68 HIS : no HD1:sc= -0.0191 X(o=-0.019,f=-0.38) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 31.123 32.912 3.017 1.00 0.00 N ATOM 2 CA MET A 1 30.727 34.104 3.818 1.00 0.00 C ATOM 3 C MET A 1 31.593 34.182 5.068 1.00 0.00 C ATOM 4 O MET A 1 32.231 33.203 5.456 1.00 0.00 O ATOM 5 CB MET A 1 29.252 33.990 4.212 1.00 0.00 C ATOM 6 CG MET A 1 29.060 32.810 5.170 1.00 0.00 C ATOM 7 SD MET A 1 27.296 32.415 5.287 1.00 0.00 S ATOM 8 CE MET A 1 27.291 31.839 7.004 1.00 0.00 C ATOM 0 H1 MET A 1 30.270 32.416 2.688 1.00 0.00 H new ATOM 0 H2 MET A 1 31.685 33.216 2.196 1.00 0.00 H new ATOM 0 H3 MET A 1 31.691 32.271 3.607 1.00 0.00 H new ATOM 0 HA MET A 1 30.868 35.007 3.225 1.00 0.00 H new ATOM 0 HB2 MET A 1 28.921 34.913 4.687 1.00 0.00 H new ATOM 0 HB3 MET A 1 28.638 33.851 3.322 1.00 0.00 H new ATOM 0 HG2 MET A 1 29.616 31.943 4.813 1.00 0.00 H new ATOM 0 HG3 MET A 1 29.455 33.058 6.155 1.00 0.00 H new ATOM 0 HE1 MET A 1 26.437 31.182 7.165 1.00 0.00 H new ATOM 0 HE2 MET A 1 28.212 31.293 7.207 1.00 0.00 H new ATOM 0 HE3 MET A 1 27.221 32.695 7.675 1.00 0.00 H new ATOM 20 N GLN A 2 31.612 35.355 5.700 1.00 0.00 N ATOM 21 CA GLN A 2 32.406 35.561 6.913 1.00 0.00 C ATOM 22 C GLN A 2 31.493 35.851 8.102 1.00 0.00 C ATOM 23 O GLN A 2 30.379 36.345 7.938 1.00 0.00 O ATOM 24 CB GLN A 2 33.363 36.742 6.708 1.00 0.00 C ATOM 25 CG GLN A 2 32.586 37.945 6.165 1.00 0.00 C ATOM 26 CD GLN A 2 33.502 39.162 6.075 1.00 0.00 C ATOM 27 OE1 GLN A 2 34.172 39.362 5.061 1.00 0.00 O ATOM 28 NE2 GLN A 2 33.571 39.990 7.080 1.00 0.00 N ATOM 0 H GLN A 2 31.089 36.175 5.394 1.00 0.00 H new ATOM 0 HA GLN A 2 32.977 34.655 7.116 1.00 0.00 H new ATOM 0 HB2 GLN A 2 33.843 37.002 7.651 1.00 0.00 H new ATOM 0 HB3 GLN A 2 34.156 36.464 6.013 1.00 0.00 H new ATOM 0 HG2 GLN A 2 32.180 37.712 5.181 1.00 0.00 H new ATOM 0 HG3 GLN A 2 31.739 38.165 6.815 1.00 0.00 H new ATOM 0 HE21 GLN A 2 33.015 39.822 7.918 1.00 0.00 H new ATOM 0 HE22 GLN A 2 34.181 40.806 7.028 1.00 0.00 H new ATOM 37 N ILE A 3 31.994 35.565 9.299 1.00 0.00 N ATOM 38 CA ILE A 3 31.239 35.824 10.525 1.00 0.00 C ATOM 39 C ILE A 3 32.186 35.985 11.700 1.00 0.00 C ATOM 40 O ILE A 3 33.395 35.797 11.569 1.00 0.00 O ATOM 41 CB ILE A 3 30.233 34.703 10.820 1.00 0.00 C ATOM 42 CG1 ILE A 3 30.948 33.338 10.796 1.00 0.00 C ATOM 43 CG2 ILE A 3 29.100 34.741 9.782 1.00 0.00 C ATOM 44 CD1 ILE A 3 29.924 32.209 10.635 1.00 0.00 C ATOM 0 H ILE A 3 32.916 35.155 9.449 1.00 0.00 H new ATOM 0 HA ILE A 3 30.680 36.748 10.377 1.00 0.00 H new ATOM 0 HB ILE A 3 29.804 34.850 11.811 1.00 0.00 H new ATOM 0 HG12 ILE A 3 31.665 33.309 9.975 1.00 0.00 H new ATOM 0 HG13 ILE A 3 31.513 33.198 11.718 1.00 0.00 H new ATOM 0 HG21 ILE A 3 28.387 33.944 9.993 1.00 0.00 H new ATOM 0 HG22 ILE A 3 28.593 35.705 9.832 1.00 0.00 H new ATOM 0 HG23 ILE A 3 29.516 34.601 8.784 1.00 0.00 H new ATOM 0 HD11 ILE A 3 30.440 31.249 10.619 1.00 0.00 H new ATOM 0 HD12 ILE A 3 29.224 32.231 11.470 1.00 0.00 H new ATOM 0 HD13 ILE A 3 29.379 32.343 9.701 1.00 0.00 H new ATOM 56 N PHE A 4 31.627 36.338 12.851 1.00 0.00 N ATOM 57 CA PHE A 4 32.420 36.533 14.065 1.00 0.00 C ATOM 58 C PHE A 4 32.060 35.489 15.112 1.00 0.00 C ATOM 59 O PHE A 4 30.885 35.170 15.302 1.00 0.00 O ATOM 60 CB PHE A 4 32.149 37.925 14.636 1.00 0.00 C ATOM 61 CG PHE A 4 32.584 38.978 13.646 1.00 0.00 C ATOM 62 CD1 PHE A 4 31.669 39.484 12.716 1.00 0.00 C ATOM 63 CD2 PHE A 4 33.900 39.454 13.664 1.00 0.00 C ATOM 64 CE1 PHE A 4 32.070 40.468 11.803 1.00 0.00 C ATOM 65 CE2 PHE A 4 34.302 40.436 12.751 1.00 0.00 C ATOM 66 CZ PHE A 4 33.387 40.944 11.821 1.00 0.00 C ATOM 0 H PHE A 4 30.627 36.496 12.972 1.00 0.00 H new ATOM 0 HA PHE A 4 33.475 36.432 13.809 1.00 0.00 H new ATOM 0 HB2 PHE A 4 31.088 38.037 14.857 1.00 0.00 H new ATOM 0 HB3 PHE A 4 32.685 38.053 15.576 1.00 0.00 H new ATOM 0 HD1 PHE A 4 30.654 39.116 12.702 1.00 0.00 H new ATOM 0 HD2 PHE A 4 34.606 39.064 14.382 1.00 0.00 H new ATOM 0 HE1 PHE A 4 31.364 40.859 11.086 1.00 0.00 H new ATOM 0 HE2 PHE A 4 35.318 40.802 12.764 1.00 0.00 H new ATOM 0 HZ PHE A 4 33.697 41.703 11.118 1.00 0.00 H new ATOM 76 N VAL A 5 33.077 34.970 15.806 1.00 0.00 N ATOM 77 CA VAL A 5 32.866 33.972 16.851 1.00 0.00 C ATOM 78 C VAL A 5 33.215 34.581 18.198 1.00 0.00 C ATOM 79 O VAL A 5 34.344 35.013 18.430 1.00 0.00 O ATOM 80 CB VAL A 5 33.727 32.730 16.581 1.00 0.00 C ATOM 81 CG1 VAL A 5 33.796 31.855 17.842 1.00 0.00 C ATOM 82 CG2 VAL A 5 33.084 31.921 15.452 1.00 0.00 C ATOM 0 H VAL A 5 34.054 35.226 15.661 1.00 0.00 H new ATOM 0 HA VAL A 5 31.820 33.664 16.856 1.00 0.00 H new ATOM 0 HB VAL A 5 34.734 33.041 16.302 1.00 0.00 H new ATOM 0 HG11 VAL A 5 34.409 30.976 17.642 1.00 0.00 H new ATOM 0 HG12 VAL A 5 34.238 32.427 18.658 1.00 0.00 H new ATOM 0 HG13 VAL A 5 32.791 31.540 18.122 1.00 0.00 H new ATOM 0 HG21 VAL A 5 33.686 31.035 15.250 1.00 0.00 H new ATOM 0 HG22 VAL A 5 32.080 31.617 15.748 1.00 0.00 H new ATOM 0 HG23 VAL A 5 33.027 32.534 14.552 1.00 0.00 H new ATOM 92 N LYS A 6 32.221 34.625 19.066 1.00 0.00 N ATOM 93 CA LYS A 6 32.382 35.199 20.399 1.00 0.00 C ATOM 94 C LYS A 6 32.561 34.101 21.446 1.00 0.00 C ATOM 95 O LYS A 6 31.770 33.160 21.509 1.00 0.00 O ATOM 96 CB LYS A 6 31.137 36.021 20.730 1.00 0.00 C ATOM 97 CG LYS A 6 31.417 36.936 21.917 1.00 0.00 C ATOM 98 CD LYS A 6 30.116 37.632 22.327 1.00 0.00 C ATOM 99 CE LYS A 6 30.399 38.672 23.412 1.00 0.00 C ATOM 100 NZ LYS A 6 31.211 39.779 22.838 1.00 0.00 N ATOM 0 H LYS A 6 31.285 34.268 18.874 1.00 0.00 H new ATOM 0 HA LYS A 6 33.271 35.830 20.411 1.00 0.00 H new ATOM 0 HB2 LYS A 6 30.842 36.614 19.864 1.00 0.00 H new ATOM 0 HB3 LYS A 6 30.304 35.357 20.960 1.00 0.00 H new ATOM 0 HG2 LYS A 6 31.815 36.359 22.752 1.00 0.00 H new ATOM 0 HG3 LYS A 6 32.173 37.676 21.652 1.00 0.00 H new ATOM 0 HD2 LYS A 6 29.662 38.113 21.460 1.00 0.00 H new ATOM 0 HD3 LYS A 6 29.400 36.896 22.694 1.00 0.00 H new ATOM 0 HE2 LYS A 6 29.462 39.062 23.810 1.00 0.00 H new ATOM 0 HE3 LYS A 6 30.931 38.210 24.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 31.096 40.632 23.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 32.213 39.503 22.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 30.892 39.977 21.868 1.00 0.00 H new ATOM 114 N THR A 7 33.603 34.225 22.270 1.00 0.00 N ATOM 115 CA THR A 7 33.872 33.237 23.318 1.00 0.00 C ATOM 116 C THR A 7 33.344 33.734 24.655 1.00 0.00 C ATOM 117 O THR A 7 32.886 34.871 24.763 1.00 0.00 O ATOM 118 CB THR A 7 35.375 32.978 23.437 1.00 0.00 C ATOM 119 OG1 THR A 7 36.012 34.133 23.963 1.00 0.00 O ATOM 120 CG2 THR A 7 35.954 32.654 22.058 1.00 0.00 C ATOM 0 H THR A 7 34.271 34.995 22.233 1.00 0.00 H new ATOM 0 HA THR A 7 33.368 32.309 23.048 1.00 0.00 H new ATOM 0 HB THR A 7 35.546 32.133 24.104 1.00 0.00 H new ATOM 0 HG1 THR A 7 36.516 33.891 24.768 1.00 0.00 H new ATOM 0 HG21 THR A 7 37.025 32.470 22.147 1.00 0.00 H new ATOM 0 HG22 THR A 7 35.465 31.766 21.658 1.00 0.00 H new ATOM 0 HG23 THR A 7 35.785 33.495 21.386 1.00 0.00 H new ATOM 128 N LEU A 8 33.414 32.883 25.676 1.00 0.00 N ATOM 129 CA LEU A 8 32.935 33.260 26.998 1.00 0.00 C ATOM 130 C LEU A 8 33.863 34.294 27.629 1.00 0.00 C ATOM 131 O LEU A 8 33.422 35.131 28.417 1.00 0.00 O ATOM 132 CB LEU A 8 32.851 32.022 27.899 1.00 0.00 C ATOM 133 CG LEU A 8 32.087 32.361 29.197 1.00 0.00 C ATOM 134 CD1 LEU A 8 30.569 32.344 28.951 1.00 0.00 C ATOM 135 CD2 LEU A 8 32.431 31.334 30.282 1.00 0.00 C ATOM 0 H LEU A 8 33.794 31.938 25.613 1.00 0.00 H new ATOM 0 HA LEU A 8 31.942 33.697 26.893 1.00 0.00 H new ATOM 0 HB2 LEU A 8 32.346 31.213 27.372 1.00 0.00 H new ATOM 0 HB3 LEU A 8 33.854 31.669 28.140 1.00 0.00 H new ATOM 0 HG LEU A 8 32.384 33.358 29.522 1.00 0.00 H new ATOM 0 HD11 LEU A 8 30.048 32.585 29.877 1.00 0.00 H new ATOM 0 HD12 LEU A 8 30.316 33.081 28.189 1.00 0.00 H new ATOM 0 HD13 LEU A 8 30.266 31.353 28.612 1.00 0.00 H new ATOM 0 HD21 LEU A 8 31.890 31.576 31.197 1.00 0.00 H new ATOM 0 HD22 LEU A 8 32.145 30.338 29.944 1.00 0.00 H new ATOM 0 HD23 LEU A 8 33.503 31.357 30.478 1.00 0.00 H new ATOM 147 N THR A 9 35.152 34.235 27.287 1.00 0.00 N ATOM 148 CA THR A 9 36.115 35.179 27.848 1.00 0.00 C ATOM 149 C THR A 9 35.842 36.593 27.346 1.00 0.00 C ATOM 150 O THR A 9 36.112 37.566 28.049 1.00 0.00 O ATOM 151 CB THR A 9 37.540 34.768 27.483 1.00 0.00 C ATOM 152 OG1 THR A 9 37.642 34.609 26.074 1.00 0.00 O ATOM 153 CG2 THR A 9 37.878 33.448 28.177 1.00 0.00 C ATOM 0 H THR A 9 35.546 33.556 26.636 1.00 0.00 H new ATOM 0 HA THR A 9 36.007 35.166 28.933 1.00 0.00 H new ATOM 0 HB THR A 9 38.239 35.539 27.809 1.00 0.00 H new ATOM 0 HG1 THR A 9 38.557 34.347 25.840 1.00 0.00 H new ATOM 0 HG21 THR A 9 38.895 33.151 27.919 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.800 33.574 29.257 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.181 32.676 27.851 1.00 0.00 H new ATOM 161 N GLY A 10 35.300 36.711 26.133 1.00 0.00 N ATOM 162 CA GLY A 10 34.994 38.026 25.549 1.00 0.00 C ATOM 163 C GLY A 10 35.892 38.330 24.352 1.00 0.00 C ATOM 164 O GLY A 10 36.023 39.480 23.938 1.00 0.00 O ATOM 0 H GLY A 10 35.063 35.919 25.535 1.00 0.00 H new ATOM 0 HA2 GLY A 10 33.950 38.053 25.238 1.00 0.00 H new ATOM 0 HA3 GLY A 10 35.121 38.800 26.306 1.00 0.00 H new ATOM 168 N LYS A 11 36.481 37.285 23.783 1.00 0.00 N ATOM 169 CA LYS A 11 37.338 37.444 22.608 1.00 0.00 C ATOM 170 C LYS A 11 36.504 37.312 21.343 1.00 0.00 C ATOM 171 O LYS A 11 35.614 36.464 21.267 1.00 0.00 O ATOM 172 CB LYS A 11 38.441 36.384 22.601 1.00 0.00 C ATOM 173 CG LYS A 11 39.380 36.594 23.807 1.00 0.00 C ATOM 174 CD LYS A 11 40.502 37.592 23.449 1.00 0.00 C ATOM 175 CE LYS A 11 41.664 36.850 22.780 1.00 0.00 C ATOM 176 NZ LYS A 11 42.430 36.106 23.816 1.00 0.00 N ATOM 0 H LYS A 11 36.384 36.324 24.111 1.00 0.00 H new ATOM 0 HA LYS A 11 37.797 38.432 22.645 1.00 0.00 H new ATOM 0 HB2 LYS A 11 38.000 35.388 22.642 1.00 0.00 H new ATOM 0 HB3 LYS A 11 39.009 36.444 21.672 1.00 0.00 H new ATOM 0 HG2 LYS A 11 38.811 36.967 24.658 1.00 0.00 H new ATOM 0 HG3 LYS A 11 39.815 35.641 24.108 1.00 0.00 H new ATOM 0 HD2 LYS A 11 40.117 38.361 22.780 1.00 0.00 H new ATOM 0 HD3 LYS A 11 40.852 38.098 24.349 1.00 0.00 H new ATOM 0 HE2 LYS A 11 41.285 36.161 22.026 1.00 0.00 H new ATOM 0 HE3 LYS A 11 42.315 37.557 22.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 43.386 35.902 23.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 42.496 36.682 24.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 41.944 35.213 24.033 1.00 0.00 H new ATOM 190 N THR A 12 36.802 38.138 20.342 1.00 0.00 N ATOM 191 CA THR A 12 36.080 38.093 19.070 1.00 0.00 C ATOM 192 C THR A 12 37.045 37.773 17.941 1.00 0.00 C ATOM 193 O THR A 12 38.069 38.436 17.768 1.00 0.00 O ATOM 194 CB THR A 12 35.408 39.439 18.791 1.00 0.00 C ATOM 195 OG1 THR A 12 34.532 39.760 19.863 1.00 0.00 O ATOM 196 CG2 THR A 12 34.606 39.342 17.488 1.00 0.00 C ATOM 0 H THR A 12 37.536 38.845 20.386 1.00 0.00 H new ATOM 0 HA THR A 12 35.316 37.318 19.132 1.00 0.00 H new ATOM 0 HB THR A 12 36.167 40.216 18.697 1.00 0.00 H new ATOM 0 HG1 THR A 12 34.102 40.623 19.687 1.00 0.00 H new ATOM 0 HG21 THR A 12 34.125 40.299 17.285 1.00 0.00 H new ATOM 0 HG22 THR A 12 35.276 39.091 16.666 1.00 0.00 H new ATOM 0 HG23 THR A 12 33.846 38.567 17.586 1.00 0.00 H new ATOM 204 N ILE A 13 36.704 36.749 17.174 1.00 0.00 N ATOM 205 CA ILE A 13 37.533 36.324 16.048 1.00 0.00 C ATOM 206 C ILE A 13 36.672 36.102 14.819 1.00 0.00 C ATOM 207 O ILE A 13 35.537 35.636 14.916 1.00 0.00 O ATOM 208 CB ILE A 13 38.288 35.044 16.398 1.00 0.00 C ATOM 209 CG1 ILE A 13 39.267 34.712 15.271 1.00 0.00 C ATOM 210 CG2 ILE A 13 37.298 33.897 16.572 1.00 0.00 C ATOM 211 CD1 ILE A 13 40.131 33.520 15.680 1.00 0.00 C ATOM 0 H ILE A 13 35.859 36.194 17.308 1.00 0.00 H new ATOM 0 HA ILE A 13 38.258 37.109 15.833 1.00 0.00 H new ATOM 0 HB ILE A 13 38.838 35.187 17.328 1.00 0.00 H new ATOM 0 HG12 ILE A 13 38.720 34.482 14.356 1.00 0.00 H new ATOM 0 HG13 ILE A 13 39.897 35.575 15.057 1.00 0.00 H new ATOM 0 HG21 ILE A 13 37.839 32.984 16.822 1.00 0.00 H new ATOM 0 HG22 ILE A 13 36.601 34.137 17.375 1.00 0.00 H new ATOM 0 HG23 ILE A 13 36.746 33.749 15.644 1.00 0.00 H new ATOM 0 HD11 ILE A 13 40.829 33.284 14.877 1.00 0.00 H new ATOM 0 HD12 ILE A 13 40.688 33.768 16.583 1.00 0.00 H new ATOM 0 HD13 ILE A 13 39.493 32.657 15.872 1.00 0.00 H new ATOM 223 N THR A 14 37.217 36.445 13.658 1.00 0.00 N ATOM 224 CA THR A 14 36.486 36.286 12.405 1.00 0.00 C ATOM 225 C THR A 14 36.917 35.008 11.698 1.00 0.00 C ATOM 226 O THR A 14 38.108 34.710 11.593 1.00 0.00 O ATOM 227 CB THR A 14 36.721 37.494 11.499 1.00 0.00 C ATOM 228 OG1 THR A 14 36.596 38.685 12.265 1.00 0.00 O ATOM 229 CG2 THR A 14 35.674 37.498 10.377 1.00 0.00 C ATOM 0 H THR A 14 38.155 36.832 13.557 1.00 0.00 H new ATOM 0 HA THR A 14 35.422 36.218 12.630 1.00 0.00 H new ATOM 0 HB THR A 14 37.720 37.440 11.066 1.00 0.00 H new ATOM 0 HG1 THR A 14 35.655 38.824 12.503 1.00 0.00 H new ATOM 0 HG21 THR A 14 35.839 38.359 9.729 1.00 0.00 H new ATOM 0 HG22 THR A 14 35.763 36.582 9.793 1.00 0.00 H new ATOM 0 HG23 THR A 14 34.676 37.556 10.811 1.00 0.00 H new ATOM 237 N LEU A 15 35.927 34.256 11.225 1.00 0.00 N ATOM 238 CA LEU A 15 36.169 32.990 10.532 1.00 0.00 C ATOM 239 C LEU A 15 35.559 33.038 9.129 1.00 0.00 C ATOM 240 O LEU A 15 34.496 33.625 8.920 1.00 0.00 O ATOM 241 CB LEU A 15 35.521 31.843 11.355 1.00 0.00 C ATOM 242 CG LEU A 15 36.585 30.964 12.031 1.00 0.00 C ATOM 243 CD1 LEU A 15 37.398 31.792 13.031 1.00 0.00 C ATOM 244 CD2 LEU A 15 35.878 29.821 12.767 1.00 0.00 C ATOM 0 H LEU A 15 34.941 34.503 11.309 1.00 0.00 H new ATOM 0 HA LEU A 15 37.241 32.817 10.437 1.00 0.00 H new ATOM 0 HB2 LEU A 15 34.861 32.265 12.113 1.00 0.00 H new ATOM 0 HB3 LEU A 15 34.902 31.229 10.701 1.00 0.00 H new ATOM 0 HG LEU A 15 37.263 30.565 11.277 1.00 0.00 H new ATOM 0 HD11 LEU A 15 38.148 31.158 13.503 1.00 0.00 H new ATOM 0 HD12 LEU A 15 37.892 32.611 12.508 1.00 0.00 H new ATOM 0 HD13 LEU A 15 36.733 32.197 13.794 1.00 0.00 H new ATOM 0 HD21 LEU A 15 36.620 29.187 13.253 1.00 0.00 H new ATOM 0 HD22 LEU A 15 35.205 30.234 13.519 1.00 0.00 H new ATOM 0 HD23 LEU A 15 35.305 29.228 12.054 1.00 0.00 H new ATOM 256 N GLU A 16 36.224 32.380 8.182 1.00 0.00 N ATOM 257 CA GLU A 16 35.727 32.311 6.804 1.00 0.00 C ATOM 258 C GLU A 16 35.143 30.924 6.568 1.00 0.00 C ATOM 259 O GLU A 16 35.835 29.921 6.730 1.00 0.00 O ATOM 260 CB GLU A 16 36.854 32.572 5.802 1.00 0.00 C ATOM 261 CG GLU A 16 37.358 34.009 5.953 1.00 0.00 C ATOM 262 CD GLU A 16 38.620 34.208 5.118 1.00 0.00 C ATOM 263 OE1 GLU A 16 39.316 33.232 4.892 1.00 0.00 O ATOM 264 OE2 GLU A 16 38.869 35.332 4.717 1.00 0.00 O ATOM 0 H GLU A 16 37.104 31.889 8.339 1.00 0.00 H new ATOM 0 HA GLU A 16 34.964 33.076 6.661 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.671 31.871 5.969 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.495 32.407 4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.586 34.710 5.634 1.00 0.00 H new ATOM 0 HG3 GLU A 16 37.568 34.222 7.001 1.00 0.00 H new ATOM 271 N VAL A 17 33.865 30.870 6.197 1.00 0.00 N ATOM 272 CA VAL A 17 33.206 29.583 5.965 1.00 0.00 C ATOM 273 C VAL A 17 32.167 29.679 4.852 1.00 0.00 C ATOM 274 O VAL A 17 31.779 30.771 4.433 1.00 0.00 O ATOM 275 CB VAL A 17 32.549 29.084 7.272 1.00 0.00 C ATOM 276 CG1 VAL A 17 33.405 29.493 8.474 1.00 0.00 C ATOM 277 CG2 VAL A 17 31.151 29.690 7.440 1.00 0.00 C ATOM 0 H VAL A 17 33.272 31.687 6.052 1.00 0.00 H new ATOM 0 HA VAL A 17 33.965 28.867 5.648 1.00 0.00 H new ATOM 0 HB VAL A 17 32.470 27.998 7.218 1.00 0.00 H new ATOM 0 HG11 VAL A 17 32.936 29.138 9.392 1.00 0.00 H new ATOM 0 HG12 VAL A 17 34.398 29.053 8.380 1.00 0.00 H new ATOM 0 HG13 VAL A 17 33.491 30.579 8.507 1.00 0.00 H new ATOM 0 HG21 VAL A 17 30.706 29.326 8.366 1.00 0.00 H new ATOM 0 HG22 VAL A 17 31.227 30.777 7.477 1.00 0.00 H new ATOM 0 HG23 VAL A 17 30.524 29.399 6.597 1.00 0.00 H new ATOM 287 N GLU A 18 31.700 28.515 4.403 1.00 0.00 N ATOM 288 CA GLU A 18 30.681 28.440 3.363 1.00 0.00 C ATOM 289 C GLU A 18 29.321 28.212 4.022 1.00 0.00 C ATOM 290 O GLU A 18 29.249 27.626 5.102 1.00 0.00 O ATOM 291 CB GLU A 18 31.001 27.278 2.414 1.00 0.00 C ATOM 292 CG GLU A 18 32.119 27.687 1.453 1.00 0.00 C ATOM 293 CD GLU A 18 32.413 26.547 0.483 1.00 0.00 C ATOM 294 OE1 GLU A 18 31.712 26.445 -0.511 1.00 0.00 O ATOM 295 OE2 GLU A 18 33.337 25.794 0.747 1.00 0.00 O ATOM 0 H GLU A 18 32.015 27.608 4.747 1.00 0.00 H new ATOM 0 HA GLU A 18 30.662 29.368 2.792 1.00 0.00 H new ATOM 0 HB2 GLU A 18 31.304 26.401 2.987 1.00 0.00 H new ATOM 0 HB3 GLU A 18 30.110 26.999 1.852 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.827 28.580 0.900 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.019 27.940 2.014 1.00 0.00 H new ATOM 302 N PRO A 19 28.250 28.655 3.417 1.00 0.00 N ATOM 303 CA PRO A 19 26.888 28.479 3.997 1.00 0.00 C ATOM 304 C PRO A 19 26.480 27.009 4.030 1.00 0.00 C ATOM 305 O PRO A 19 25.505 26.642 4.685 1.00 0.00 O ATOM 306 CB PRO A 19 25.986 29.298 3.060 1.00 0.00 C ATOM 307 CG PRO A 19 26.722 29.336 1.760 1.00 0.00 C ATOM 308 CD PRO A 19 28.206 29.361 2.125 1.00 0.00 C ATOM 0 HA PRO A 19 26.825 28.810 5.033 1.00 0.00 H new ATOM 0 HB2 PRO A 19 25.007 28.833 2.947 1.00 0.00 H new ATOM 0 HB3 PRO A 19 25.819 30.302 3.450 1.00 0.00 H new ATOM 0 HG2 PRO A 19 26.484 28.465 1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 19 26.447 30.217 1.180 1.00 0.00 H new ATOM 0 HD2 PRO A 19 28.814 28.860 1.372 1.00 0.00 H new ATOM 0 HD3 PRO A 19 28.582 30.381 2.211 1.00 0.00 H new ATOM 316 N SER A 20 27.224 26.171 3.303 1.00 0.00 N ATOM 317 CA SER A 20 26.930 24.740 3.235 1.00 0.00 C ATOM 318 C SER A 20 27.909 23.929 4.081 1.00 0.00 C ATOM 319 O SER A 20 27.877 22.698 4.063 1.00 0.00 O ATOM 320 CB SER A 20 27.013 24.279 1.781 1.00 0.00 C ATOM 321 OG SER A 20 26.778 22.879 1.718 1.00 0.00 O ATOM 0 H SER A 20 28.034 26.460 2.754 1.00 0.00 H new ATOM 0 HA SER A 20 25.927 24.577 3.628 1.00 0.00 H new ATOM 0 HB2 SER A 20 26.278 24.810 1.177 1.00 0.00 H new ATOM 0 HB3 SER A 20 27.994 24.514 1.369 1.00 0.00 H new ATOM 0 HG SER A 20 26.883 22.489 2.611 1.00 0.00 H new ATOM 327 N ASP A 21 28.773 24.612 4.827 1.00 0.00 N ATOM 328 CA ASP A 21 29.734 23.926 5.675 1.00 0.00 C ATOM 329 C ASP A 21 29.010 23.126 6.751 1.00 0.00 C ATOM 330 O ASP A 21 27.958 23.535 7.243 1.00 0.00 O ATOM 331 CB ASP A 21 30.678 24.957 6.320 1.00 0.00 C ATOM 332 CG ASP A 21 31.799 25.348 5.356 1.00 0.00 C ATOM 333 OD1 ASP A 21 31.966 24.670 4.358 1.00 0.00 O ATOM 334 OD2 ASP A 21 32.483 26.314 5.640 1.00 0.00 O ATOM 0 H ASP A 21 28.825 25.630 4.860 1.00 0.00 H new ATOM 0 HA ASP A 21 30.320 23.235 5.068 1.00 0.00 H new ATOM 0 HB2 ASP A 21 30.113 25.844 6.606 1.00 0.00 H new ATOM 0 HB3 ASP A 21 31.106 24.543 7.233 1.00 0.00 H new ATOM 339 N THR A 22 29.582 21.980 7.112 1.00 0.00 N ATOM 340 CA THR A 22 28.989 21.127 8.138 1.00 0.00 C ATOM 341 C THR A 22 29.527 21.513 9.507 1.00 0.00 C ATOM 342 O THR A 22 30.649 22.003 9.623 1.00 0.00 O ATOM 343 CB THR A 22 29.312 19.656 7.861 1.00 0.00 C ATOM 344 OG1 THR A 22 30.720 19.471 7.873 1.00 0.00 O ATOM 345 CG2 THR A 22 28.752 19.253 6.498 1.00 0.00 C ATOM 0 H THR A 22 30.450 21.622 6.712 1.00 0.00 H new ATOM 0 HA THR A 22 27.908 21.264 8.119 1.00 0.00 H new ATOM 0 HB THR A 22 28.858 19.034 8.632 1.00 0.00 H new ATOM 0 HG1 THR A 22 30.928 18.529 7.698 1.00 0.00 H new ATOM 0 HG21 THR A 22 28.984 18.206 6.305 1.00 0.00 H new ATOM 0 HG22 THR A 22 27.671 19.392 6.493 1.00 0.00 H new ATOM 0 HG23 THR A 22 29.201 19.873 5.722 1.00 0.00 H new ATOM 353 N ILE A 23 28.726 21.290 10.537 1.00 0.00 N ATOM 354 CA ILE A 23 29.154 21.624 11.888 1.00 0.00 C ATOM 355 C ILE A 23 30.531 21.024 12.156 1.00 0.00 C ATOM 356 O ILE A 23 31.271 21.493 13.018 1.00 0.00 O ATOM 357 CB ILE A 23 28.146 21.093 12.911 1.00 0.00 C ATOM 358 CG1 ILE A 23 26.717 21.420 12.453 1.00 0.00 C ATOM 359 CG2 ILE A 23 28.403 21.747 14.271 1.00 0.00 C ATOM 360 CD1 ILE A 23 26.610 22.901 12.073 1.00 0.00 C ATOM 0 H ILE A 23 27.792 20.886 10.468 1.00 0.00 H new ATOM 0 HA ILE A 23 29.210 22.709 11.982 1.00 0.00 H new ATOM 0 HB ILE A 23 28.260 20.012 12.996 1.00 0.00 H new ATOM 0 HG12 ILE A 23 26.449 20.798 11.599 1.00 0.00 H new ATOM 0 HG13 ILE A 23 26.010 21.189 13.250 1.00 0.00 H new ATOM 0 HG21 ILE A 23 27.685 21.368 14.998 1.00 0.00 H new ATOM 0 HG22 ILE A 23 29.414 21.511 14.603 1.00 0.00 H new ATOM 0 HG23 ILE A 23 28.293 22.828 14.182 1.00 0.00 H new ATOM 0 HD11 ILE A 23 25.593 23.121 11.750 1.00 0.00 H new ATOM 0 HD12 ILE A 23 26.858 23.517 12.937 1.00 0.00 H new ATOM 0 HD13 ILE A 23 27.304 23.119 11.261 1.00 0.00 H new ATOM 372 N GLU A 24 30.873 19.993 11.391 1.00 0.00 N ATOM 373 CA GLU A 24 32.166 19.342 11.538 1.00 0.00 C ATOM 374 C GLU A 24 33.259 20.202 10.909 1.00 0.00 C ATOM 375 O GLU A 24 34.229 20.579 11.565 1.00 0.00 O ATOM 376 CB GLU A 24 32.130 17.964 10.871 1.00 0.00 C ATOM 377 CG GLU A 24 33.380 17.174 11.259 1.00 0.00 C ATOM 378 CD GLU A 24 33.363 15.807 10.583 1.00 0.00 C ATOM 379 OE1 GLU A 24 32.287 15.360 10.222 1.00 0.00 O ATOM 380 OE2 GLU A 24 34.426 15.227 10.438 1.00 0.00 O ATOM 0 H GLU A 24 30.276 19.593 10.667 1.00 0.00 H new ATOM 0 HA GLU A 24 32.385 19.218 12.599 1.00 0.00 H new ATOM 0 HB2 GLU A 24 31.235 17.423 11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 24 32.079 18.074 9.788 1.00 0.00 H new ATOM 0 HG2 GLU A 24 34.274 17.724 10.964 1.00 0.00 H new ATOM 0 HG3 GLU A 24 33.423 17.053 12.341 1.00 0.00 H new ATOM 387 N ASN A 25 33.088 20.510 9.629 1.00 0.00 N ATOM 388 CA ASN A 25 34.058 21.329 8.910 1.00 0.00 C ATOM 389 C ASN A 25 34.288 22.653 9.638 1.00 0.00 C ATOM 390 O ASN A 25 35.412 23.147 9.710 1.00 0.00 O ATOM 391 CB ASN A 25 33.548 21.608 7.495 1.00 0.00 C ATOM 392 CG ASN A 25 34.548 22.470 6.731 1.00 0.00 C ATOM 393 OD1 ASN A 25 35.645 22.739 7.222 1.00 0.00 O ATOM 394 ND2 ASN A 25 34.231 22.921 5.548 1.00 0.00 N ATOM 0 H ASN A 25 32.291 20.207 9.069 1.00 0.00 H new ATOM 0 HA ASN A 25 35.002 20.786 8.861 1.00 0.00 H new ATOM 0 HB2 ASN A 25 33.390 20.668 6.966 1.00 0.00 H new ATOM 0 HB3 ASN A 25 32.583 22.114 7.542 1.00 0.00 H new ATOM 0 HD21 ASN A 25 34.892 23.498 5.028 1.00 0.00 H new ATOM 0 HD22 ASN A 25 33.322 22.697 5.144 1.00 0.00 H new ATOM 401 N VAL A 26 33.214 23.227 10.169 1.00 0.00 N ATOM 402 CA VAL A 26 33.323 24.497 10.879 1.00 0.00 C ATOM 403 C VAL A 26 34.118 24.325 12.172 1.00 0.00 C ATOM 404 O VAL A 26 34.932 25.178 12.529 1.00 0.00 O ATOM 405 CB VAL A 26 31.932 25.061 11.181 1.00 0.00 C ATOM 406 CG1 VAL A 26 32.077 26.405 11.888 1.00 0.00 C ATOM 407 CG2 VAL A 26 31.168 25.265 9.870 1.00 0.00 C ATOM 0 H VAL A 26 32.271 22.841 10.123 1.00 0.00 H new ATOM 0 HA VAL A 26 33.854 25.202 10.240 1.00 0.00 H new ATOM 0 HB VAL A 26 31.387 24.364 11.818 1.00 0.00 H new ATOM 0 HG11 VAL A 26 31.089 26.810 12.105 1.00 0.00 H new ATOM 0 HG12 VAL A 26 32.626 26.269 12.820 1.00 0.00 H new ATOM 0 HG13 VAL A 26 32.620 27.098 11.245 1.00 0.00 H new ATOM 0 HG21 VAL A 26 30.178 25.667 10.085 1.00 0.00 H new ATOM 0 HG22 VAL A 26 31.713 25.964 9.236 1.00 0.00 H new ATOM 0 HG23 VAL A 26 31.068 24.310 9.355 1.00 0.00 H new ATOM 417 N LYS A 27 33.891 23.217 12.869 1.00 0.00 N ATOM 418 CA LYS A 27 34.612 22.954 14.109 1.00 0.00 C ATOM 419 C LYS A 27 36.088 22.794 13.798 1.00 0.00 C ATOM 420 O LYS A 27 36.950 23.263 14.537 1.00 0.00 O ATOM 421 CB LYS A 27 34.072 21.685 14.782 1.00 0.00 C ATOM 422 CG LYS A 27 32.791 22.014 15.556 1.00 0.00 C ATOM 423 CD LYS A 27 32.109 20.716 15.998 1.00 0.00 C ATOM 424 CE LYS A 27 31.099 21.021 17.108 1.00 0.00 C ATOM 425 NZ LYS A 27 30.441 19.756 17.541 1.00 0.00 N ATOM 0 H LYS A 27 33.222 22.495 12.601 1.00 0.00 H new ATOM 0 HA LYS A 27 34.471 23.790 14.794 1.00 0.00 H new ATOM 0 HB2 LYS A 27 33.868 20.922 14.031 1.00 0.00 H new ATOM 0 HB3 LYS A 27 34.821 21.274 15.458 1.00 0.00 H new ATOM 0 HG2 LYS A 27 33.027 22.627 16.426 1.00 0.00 H new ATOM 0 HG3 LYS A 27 32.115 22.596 14.930 1.00 0.00 H new ATOM 0 HD2 LYS A 27 31.605 20.251 15.151 1.00 0.00 H new ATOM 0 HD3 LYS A 27 32.854 20.005 16.355 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.602 21.490 17.954 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.351 21.729 16.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 29.641 19.978 18.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.094 19.242 16.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.128 19.165 18.051 1.00 0.00 H new ATOM 439 N ALA A 28 36.362 22.135 12.682 1.00 0.00 N ATOM 440 CA ALA A 28 37.725 21.912 12.243 1.00 0.00 C ATOM 441 C ALA A 28 38.430 23.252 12.018 1.00 0.00 C ATOM 442 O ALA A 28 39.608 23.405 12.341 1.00 0.00 O ATOM 443 CB ALA A 28 37.698 21.099 10.948 1.00 0.00 C ATOM 0 H ALA A 28 35.651 21.745 12.063 1.00 0.00 H new ATOM 0 HA ALA A 28 38.275 21.362 13.007 1.00 0.00 H new ATOM 0 HB1 ALA A 28 38.718 20.924 10.607 1.00 0.00 H new ATOM 0 HB2 ALA A 28 37.207 20.143 11.129 1.00 0.00 H new ATOM 0 HB3 ALA A 28 37.149 21.650 10.184 1.00 0.00 H new ATOM 449 N LYS A 29 37.688 24.223 11.487 1.00 0.00 N ATOM 450 CA LYS A 29 38.246 25.551 11.251 1.00 0.00 C ATOM 451 C LYS A 29 38.581 26.213 12.585 1.00 0.00 C ATOM 452 O LYS A 29 39.622 26.857 12.735 1.00 0.00 O ATOM 453 CB LYS A 29 37.242 26.432 10.495 1.00 0.00 C ATOM 454 CG LYS A 29 37.124 25.971 9.038 1.00 0.00 C ATOM 455 CD LYS A 29 36.147 26.887 8.290 1.00 0.00 C ATOM 456 CE LYS A 29 36.098 26.486 6.814 1.00 0.00 C ATOM 457 NZ LYS A 29 37.436 26.704 6.196 1.00 0.00 N ATOM 0 H LYS A 29 36.711 24.116 11.215 1.00 0.00 H new ATOM 0 HA LYS A 29 39.149 25.443 10.651 1.00 0.00 H new ATOM 0 HB2 LYS A 29 36.267 26.383 10.980 1.00 0.00 H new ATOM 0 HB3 LYS A 29 37.563 27.473 10.530 1.00 0.00 H new ATOM 0 HG2 LYS A 29 38.102 25.995 8.557 1.00 0.00 H new ATOM 0 HG3 LYS A 29 36.775 24.939 8.999 1.00 0.00 H new ATOM 0 HD2 LYS A 29 35.153 26.813 8.731 1.00 0.00 H new ATOM 0 HD3 LYS A 29 36.461 27.926 8.385 1.00 0.00 H new ATOM 0 HE2 LYS A 29 35.808 25.439 6.720 1.00 0.00 H new ATOM 0 HE3 LYS A 29 35.344 27.074 6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 37.329 26.815 5.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 37.866 27.563 6.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.047 25.887 6.395 1.00 0.00 H new ATOM 471 N ILE A 30 37.693 26.031 13.553 1.00 0.00 N ATOM 472 CA ILE A 30 37.888 26.594 14.874 1.00 0.00 C ATOM 473 C ILE A 30 39.067 25.918 15.571 1.00 0.00 C ATOM 474 O ILE A 30 39.926 26.590 16.132 1.00 0.00 O ATOM 475 CB ILE A 30 36.604 26.419 15.689 1.00 0.00 C ATOM 476 CG1 ILE A 30 35.526 27.353 15.129 1.00 0.00 C ATOM 477 CG2 ILE A 30 36.867 26.774 17.151 1.00 0.00 C ATOM 478 CD1 ILE A 30 34.162 26.979 15.713 1.00 0.00 C ATOM 0 H ILE A 30 36.831 25.497 13.444 1.00 0.00 H new ATOM 0 HA ILE A 30 38.114 27.657 14.787 1.00 0.00 H new ATOM 0 HB ILE A 30 36.271 25.383 15.625 1.00 0.00 H new ATOM 0 HG12 ILE A 30 35.765 28.388 15.374 1.00 0.00 H new ATOM 0 HG13 ILE A 30 35.498 27.281 14.042 1.00 0.00 H new ATOM 0 HG21 ILE A 30 35.950 26.648 17.727 1.00 0.00 H new ATOM 0 HG22 ILE A 30 37.640 26.118 17.551 1.00 0.00 H new ATOM 0 HG23 ILE A 30 37.199 27.810 17.220 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.399 27.646 15.312 1.00 0.00 H new ATOM 0 HD12 ILE A 30 33.921 25.950 15.446 1.00 0.00 H new ATOM 0 HD13 ILE A 30 34.192 27.074 16.798 1.00 0.00 H new ATOM 490 N GLN A 31 39.097 24.591 15.534 1.00 0.00 N ATOM 491 CA GLN A 31 40.179 23.849 16.170 1.00 0.00 C ATOM 492 C GLN A 31 41.522 24.238 15.565 1.00 0.00 C ATOM 493 O GLN A 31 42.492 24.475 16.279 1.00 0.00 O ATOM 494 CB GLN A 31 39.963 22.344 15.987 1.00 0.00 C ATOM 495 CG GLN A 31 41.071 21.577 16.718 1.00 0.00 C ATOM 496 CD GLN A 31 40.800 20.078 16.663 1.00 0.00 C ATOM 497 OE1 GLN A 31 39.799 19.648 16.091 1.00 0.00 O ATOM 498 NE2 GLN A 31 41.641 19.255 17.226 1.00 0.00 N ATOM 0 H GLN A 31 38.393 24.012 15.076 1.00 0.00 H new ATOM 0 HA GLN A 31 40.181 24.093 17.232 1.00 0.00 H new ATOM 0 HB2 GLN A 31 38.987 22.055 16.378 1.00 0.00 H new ATOM 0 HB3 GLN A 31 39.969 22.091 14.927 1.00 0.00 H new ATOM 0 HG2 GLN A 31 42.036 21.796 16.262 1.00 0.00 H new ATOM 0 HG3 GLN A 31 41.127 21.906 17.756 1.00 0.00 H new ATOM 0 HE21 GLN A 31 42.469 19.617 17.699 1.00 0.00 H new ATOM 0 HE22 GLN A 31 41.470 18.250 17.193 1.00 0.00 H new ATOM 507 N ASP A 32 41.573 24.282 14.244 1.00 0.00 N ATOM 508 CA ASP A 32 42.808 24.621 13.548 1.00 0.00 C ATOM 509 C ASP A 32 43.337 25.993 13.971 1.00 0.00 C ATOM 510 O ASP A 32 44.549 26.188 14.068 1.00 0.00 O ATOM 511 CB ASP A 32 42.572 24.609 12.037 1.00 0.00 C ATOM 512 CG ASP A 32 43.906 24.668 11.299 1.00 0.00 C ATOM 513 OD1 ASP A 32 44.915 24.364 11.915 1.00 0.00 O ATOM 514 OD2 ASP A 32 43.900 25.015 10.131 1.00 0.00 O ATOM 0 H ASP A 32 40.780 24.089 13.633 1.00 0.00 H new ATOM 0 HA ASP A 32 43.555 23.873 13.815 1.00 0.00 H new ATOM 0 HB2 ASP A 32 42.030 23.707 11.753 1.00 0.00 H new ATOM 0 HB3 ASP A 32 41.951 25.458 11.751 1.00 0.00 H new ATOM 519 N LYS A 33 42.436 26.952 14.199 1.00 0.00 N ATOM 520 CA LYS A 33 42.854 28.304 14.581 1.00 0.00 C ATOM 521 C LYS A 33 43.039 28.469 16.097 1.00 0.00 C ATOM 522 O LYS A 33 43.948 29.177 16.533 1.00 0.00 O ATOM 523 CB LYS A 33 41.824 29.321 14.083 1.00 0.00 C ATOM 524 CG LYS A 33 41.767 29.279 12.555 1.00 0.00 C ATOM 525 CD LYS A 33 40.826 30.375 12.047 1.00 0.00 C ATOM 526 CE LYS A 33 40.824 30.387 10.517 1.00 0.00 C ATOM 527 NZ LYS A 33 39.896 31.445 10.027 1.00 0.00 N ATOM 0 H LYS A 33 41.427 26.821 14.127 1.00 0.00 H new ATOM 0 HA LYS A 33 43.824 28.478 14.116 1.00 0.00 H new ATOM 0 HB2 LYS A 33 40.843 29.096 14.501 1.00 0.00 H new ATOM 0 HB3 LYS A 33 42.092 30.322 14.421 1.00 0.00 H new ATOM 0 HG2 LYS A 33 42.765 29.421 12.140 1.00 0.00 H new ATOM 0 HG3 LYS A 33 41.418 28.302 12.221 1.00 0.00 H new ATOM 0 HD2 LYS A 33 39.816 30.202 12.420 1.00 0.00 H new ATOM 0 HD3 LYS A 33 41.144 31.346 12.427 1.00 0.00 H new ATOM 0 HE2 LYS A 33 41.831 30.571 10.143 1.00 0.00 H new ATOM 0 HE3 LYS A 33 40.516 29.413 10.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 39.525 31.176 9.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 39.107 31.552 10.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 40.408 32.347 9.949 1.00 0.00 H new ATOM 541 N GLU A 34 42.169 27.853 16.900 1.00 0.00 N ATOM 542 CA GLU A 34 42.253 27.993 18.365 1.00 0.00 C ATOM 543 C GLU A 34 42.893 26.772 19.031 1.00 0.00 C ATOM 544 O GLU A 34 43.221 26.812 20.216 1.00 0.00 O ATOM 545 CB GLU A 34 40.854 28.203 18.949 1.00 0.00 C ATOM 546 CG GLU A 34 40.163 29.362 18.227 1.00 0.00 C ATOM 547 CD GLU A 34 38.896 29.763 18.976 1.00 0.00 C ATOM 548 OE1 GLU A 34 38.658 29.212 20.038 1.00 0.00 O ATOM 549 OE2 GLU A 34 38.183 30.618 18.477 1.00 0.00 O ATOM 0 H GLU A 34 41.407 27.260 16.572 1.00 0.00 H new ATOM 0 HA GLU A 34 42.886 28.857 18.568 1.00 0.00 H new ATOM 0 HB2 GLU A 34 40.264 27.292 18.843 1.00 0.00 H new ATOM 0 HB3 GLU A 34 40.923 28.416 20.016 1.00 0.00 H new ATOM 0 HG2 GLU A 34 40.840 30.214 18.159 1.00 0.00 H new ATOM 0 HG3 GLU A 34 39.915 29.069 17.207 1.00 0.00 H new ATOM 556 N GLY A 35 43.106 25.705 18.269 1.00 0.00 N ATOM 557 CA GLY A 35 43.743 24.503 18.810 1.00 0.00 C ATOM 558 C GLY A 35 42.898 23.834 19.897 1.00 0.00 C ATOM 559 O GLY A 35 43.385 22.959 20.612 1.00 0.00 O ATOM 0 H GLY A 35 42.851 25.644 17.283 1.00 0.00 H new ATOM 0 HA2 GLY A 35 43.919 23.793 18.002 1.00 0.00 H new ATOM 0 HA3 GLY A 35 44.718 24.765 19.221 1.00 0.00 H new ATOM 563 N ILE A 36 41.633 24.240 20.021 1.00 0.00 N ATOM 564 CA ILE A 36 40.746 23.661 21.028 1.00 0.00 C ATOM 565 C ILE A 36 39.953 22.490 20.425 1.00 0.00 C ATOM 566 O ILE A 36 39.404 22.625 19.331 1.00 0.00 O ATOM 567 CB ILE A 36 39.776 24.735 21.525 1.00 0.00 C ATOM 568 CG1 ILE A 36 40.564 25.996 21.894 1.00 0.00 C ATOM 569 CG2 ILE A 36 39.038 24.217 22.755 1.00 0.00 C ATOM 570 CD1 ILE A 36 39.607 27.084 22.380 1.00 0.00 C ATOM 0 H ILE A 36 41.204 24.961 19.441 1.00 0.00 H new ATOM 0 HA ILE A 36 41.344 23.291 21.861 1.00 0.00 H new ATOM 0 HB ILE A 36 39.056 24.972 20.742 1.00 0.00 H new ATOM 0 HG12 ILE A 36 41.292 25.766 22.672 1.00 0.00 H new ATOM 0 HG13 ILE A 36 41.124 26.352 21.029 1.00 0.00 H new ATOM 0 HG21 ILE A 36 38.346 24.980 23.112 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.482 23.316 22.493 1.00 0.00 H new ATOM 0 HG23 ILE A 36 39.758 23.984 23.540 1.00 0.00 H new ATOM 0 HD11 ILE A 36 40.174 27.978 22.641 1.00 0.00 H new ATOM 0 HD12 ILE A 36 38.896 27.323 21.589 1.00 0.00 H new ATOM 0 HD13 ILE A 36 39.067 26.728 23.258 1.00 0.00 H new ATOM 582 N PRO A 37 39.873 21.346 21.086 1.00 0.00 N ATOM 583 CA PRO A 37 39.122 20.172 20.541 1.00 0.00 C ATOM 584 C PRO A 37 37.600 20.383 20.601 1.00 0.00 C ATOM 585 O PRO A 37 37.097 21.057 21.501 1.00 0.00 O ATOM 586 CB PRO A 37 39.561 19.015 21.451 1.00 0.00 C ATOM 587 CG PRO A 37 39.895 19.666 22.753 1.00 0.00 C ATOM 588 CD PRO A 37 40.476 21.036 22.400 1.00 0.00 C ATOM 0 HA PRO A 37 39.336 19.994 19.487 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.766 18.279 21.568 1.00 0.00 H new ATOM 0 HB3 PRO A 37 40.422 18.490 21.038 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.008 19.767 23.378 1.00 0.00 H new ATOM 0 HG3 PRO A 37 40.614 19.070 23.315 1.00 0.00 H new ATOM 0 HD2 PRO A 37 40.215 21.786 23.147 1.00 0.00 H new ATOM 0 HD3 PRO A 37 41.564 21.007 22.344 1.00 0.00 H new ATOM 596 N PRO A 38 36.861 19.821 19.671 1.00 0.00 N ATOM 597 CA PRO A 38 35.373 19.964 19.628 1.00 0.00 C ATOM 598 C PRO A 38 34.687 19.223 20.772 1.00 0.00 C ATOM 599 O PRO A 38 33.502 19.432 21.036 1.00 0.00 O ATOM 600 CB PRO A 38 34.996 19.362 18.269 1.00 0.00 C ATOM 601 CG PRO A 38 36.063 18.359 18.014 1.00 0.00 C ATOM 602 CD PRO A 38 37.344 18.979 18.561 1.00 0.00 C ATOM 0 HA PRO A 38 35.054 21.000 19.743 1.00 0.00 H new ATOM 0 HB2 PRO A 38 34.010 18.898 18.297 1.00 0.00 H new ATOM 0 HB3 PRO A 38 34.968 20.123 17.489 1.00 0.00 H new ATOM 0 HG2 PRO A 38 35.841 17.415 18.511 1.00 0.00 H new ATOM 0 HG3 PRO A 38 36.154 18.145 16.949 1.00 0.00 H new ATOM 0 HD2 PRO A 38 38.044 18.219 18.907 1.00 0.00 H new ATOM 0 HD3 PRO A 38 37.862 19.568 17.804 1.00 0.00 H new ATOM 610 N ASP A 39 35.433 18.355 21.445 1.00 0.00 N ATOM 611 CA ASP A 39 34.876 17.591 22.553 1.00 0.00 C ATOM 612 C ASP A 39 34.717 18.464 23.790 1.00 0.00 C ATOM 613 O ASP A 39 33.930 18.147 24.682 1.00 0.00 O ATOM 614 CB ASP A 39 35.786 16.407 22.882 1.00 0.00 C ATOM 615 CG ASP A 39 35.109 15.498 23.902 1.00 0.00 C ATOM 616 OD1 ASP A 39 33.998 15.808 24.297 1.00 0.00 O ATOM 617 OD2 ASP A 39 35.714 14.505 24.274 1.00 0.00 O ATOM 0 H ASP A 39 36.415 18.164 21.245 1.00 0.00 H new ATOM 0 HA ASP A 39 33.894 17.227 22.253 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.010 15.846 21.974 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.736 16.767 23.277 1.00 0.00 H new ATOM 622 N GLN A 40 35.475 19.562 23.852 1.00 0.00 N ATOM 623 CA GLN A 40 35.415 20.470 25.000 1.00 0.00 C ATOM 624 C GLN A 40 34.605 21.717 24.669 1.00 0.00 C ATOM 625 O GLN A 40 34.350 22.544 25.546 1.00 0.00 O ATOM 626 CB GLN A 40 36.831 20.895 25.394 1.00 0.00 C ATOM 627 CG GLN A 40 37.652 19.658 25.767 1.00 0.00 C ATOM 628 CD GLN A 40 37.169 19.091 27.098 1.00 0.00 C ATOM 629 OE1 GLN A 40 36.732 17.942 27.163 1.00 0.00 O ATOM 630 NE2 GLN A 40 37.222 19.833 28.171 1.00 0.00 N ATOM 0 H GLN A 40 36.134 19.842 23.125 1.00 0.00 H new ATOM 0 HA GLN A 40 34.934 19.942 25.823 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.306 21.424 24.568 1.00 0.00 H new ATOM 0 HB3 GLN A 40 36.793 21.587 26.236 1.00 0.00 H new ATOM 0 HG2 GLN A 40 37.561 18.903 24.986 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.708 19.920 25.836 1.00 0.00 H new ATOM 0 HE21 GLN A 40 37.584 20.785 28.115 1.00 0.00 H new ATOM 0 HE22 GLN A 40 36.901 19.461 29.065 1.00 0.00 H new ATOM 639 N GLN A 41 34.225 21.867 23.399 1.00 0.00 N ATOM 640 CA GLN A 41 33.468 23.045 22.961 1.00 0.00 C ATOM 641 C GLN A 41 32.095 22.675 22.411 1.00 0.00 C ATOM 642 O GLN A 41 31.910 21.620 21.804 1.00 0.00 O ATOM 643 CB GLN A 41 34.251 23.772 21.866 1.00 0.00 C ATOM 644 CG GLN A 41 35.576 24.285 22.428 1.00 0.00 C ATOM 645 CD GLN A 41 36.395 24.925 21.314 1.00 0.00 C ATOM 646 OE1 GLN A 41 36.843 24.237 20.398 1.00 0.00 O ATOM 647 NE2 GLN A 41 36.618 26.211 21.336 1.00 0.00 N ATOM 0 H GLN A 41 34.426 21.194 22.659 1.00 0.00 H new ATOM 0 HA GLN A 41 33.325 23.684 23.832 1.00 0.00 H new ATOM 0 HB2 GLN A 41 34.437 23.097 21.031 1.00 0.00 H new ATOM 0 HB3 GLN A 41 33.664 24.604 21.478 1.00 0.00 H new ATOM 0 HG2 GLN A 41 35.389 25.012 23.218 1.00 0.00 H new ATOM 0 HG3 GLN A 41 36.134 23.463 22.876 1.00 0.00 H new ATOM 0 HE21 GLN A 41 36.246 26.780 22.096 1.00 0.00 H new ATOM 0 HE22 GLN A 41 37.164 26.647 20.593 1.00 0.00 H new ATOM 656 N ARG A 42 31.146 23.585 22.614 1.00 0.00 N ATOM 657 CA ARG A 42 29.776 23.418 22.131 1.00 0.00 C ATOM 658 C ARG A 42 29.366 24.692 21.397 1.00 0.00 C ATOM 659 O ARG A 42 29.656 25.795 21.864 1.00 0.00 O ATOM 660 CB ARG A 42 28.824 23.165 23.304 1.00 0.00 C ATOM 661 CG ARG A 42 29.212 21.854 24.032 1.00 0.00 C ATOM 662 CD ARG A 42 27.956 21.145 24.547 1.00 0.00 C ATOM 663 NE ARG A 42 27.255 21.985 25.514 1.00 0.00 N ATOM 664 CZ ARG A 42 26.024 21.686 25.923 1.00 0.00 C ATOM 665 NH1 ARG A 42 25.416 22.456 26.784 1.00 0.00 N ATOM 666 NH2 ARG A 42 25.424 20.621 25.466 1.00 0.00 N ATOM 0 H ARG A 42 31.304 24.458 23.117 1.00 0.00 H new ATOM 0 HA ARG A 42 29.725 22.562 21.459 1.00 0.00 H new ATOM 0 HB2 ARG A 42 28.863 24.002 24.001 1.00 0.00 H new ATOM 0 HB3 ARG A 42 27.798 23.099 22.942 1.00 0.00 H new ATOM 0 HG2 ARG A 42 29.756 21.199 23.352 1.00 0.00 H new ATOM 0 HG3 ARG A 42 29.881 22.075 24.864 1.00 0.00 H new ATOM 0 HD2 ARG A 42 27.295 20.912 23.712 1.00 0.00 H new ATOM 0 HD3 ARG A 42 28.230 20.198 25.011 1.00 0.00 H new ATOM 0 HE ARG A 42 27.717 22.816 25.883 1.00 0.00 H new ATOM 0 HH11 ARG A 42 25.884 23.288 27.144 1.00 0.00 H new ATOM 0 HH12 ARG A 42 24.473 22.226 27.097 1.00 0.00 H new ATOM 0 HH21 ARG A 42 25.898 20.017 24.795 1.00 0.00 H new ATOM 0 HH22 ARG A 42 24.481 20.393 25.780 1.00 0.00 H new ATOM 680 N LEU A 43 28.707 24.554 20.244 1.00 0.00 N ATOM 681 CA LEU A 43 28.286 25.723 19.461 1.00 0.00 C ATOM 682 C LEU A 43 26.770 25.884 19.502 1.00 0.00 C ATOM 683 O LEU A 43 26.029 24.934 19.240 1.00 0.00 O ATOM 684 CB LEU A 43 28.733 25.549 18.006 1.00 0.00 C ATOM 685 CG LEU A 43 30.234 25.237 17.948 1.00 0.00 C ATOM 686 CD1 LEU A 43 30.647 24.985 16.494 1.00 0.00 C ATOM 687 CD2 LEU A 43 31.037 26.419 18.512 1.00 0.00 C ATOM 0 H LEU A 43 28.454 23.655 19.833 1.00 0.00 H new ATOM 0 HA LEU A 43 28.746 26.612 19.892 1.00 0.00 H new ATOM 0 HB2 LEU A 43 28.168 24.743 17.538 1.00 0.00 H new ATOM 0 HB3 LEU A 43 28.520 26.457 17.441 1.00 0.00 H new ATOM 0 HG LEU A 43 30.439 24.349 18.546 1.00 0.00 H new ATOM 0 HD11 LEU A 43 31.713 24.763 16.452 1.00 0.00 H new ATOM 0 HD12 LEU A 43 30.085 24.140 16.097 1.00 0.00 H new ATOM 0 HD13 LEU A 43 30.437 25.873 15.897 1.00 0.00 H new ATOM 0 HD21 LEU A 43 32.102 26.190 18.467 1.00 0.00 H new ATOM 0 HD22 LEU A 43 30.833 27.312 17.922 1.00 0.00 H new ATOM 0 HD23 LEU A 43 30.747 26.595 19.548 1.00 0.00 H new ATOM 699 N ILE A 44 26.307 27.092 19.844 1.00 0.00 N ATOM 700 CA ILE A 44 24.868 27.370 19.930 1.00 0.00 C ATOM 701 C ILE A 44 24.499 28.636 19.155 1.00 0.00 C ATOM 702 O ILE A 44 25.243 29.619 19.136 1.00 0.00 O ATOM 703 CB ILE A 44 24.462 27.528 21.401 1.00 0.00 C ATOM 704 CG1 ILE A 44 25.087 26.387 22.221 1.00 0.00 C ATOM 705 CG2 ILE A 44 22.932 27.480 21.516 1.00 0.00 C ATOM 706 CD1 ILE A 44 24.403 26.275 23.589 1.00 0.00 C ATOM 0 H ILE A 44 26.904 27.889 20.065 1.00 0.00 H new ATOM 0 HA ILE A 44 24.332 26.532 19.485 1.00 0.00 H new ATOM 0 HB ILE A 44 24.818 28.485 21.784 1.00 0.00 H new ATOM 0 HG12 ILE A 44 24.989 25.446 21.680 1.00 0.00 H new ATOM 0 HG13 ILE A 44 26.154 26.568 22.354 1.00 0.00 H new ATOM 0 HG21 ILE A 44 22.642 27.592 22.561 1.00 0.00 H new ATOM 0 HG22 ILE A 44 22.497 28.290 20.930 1.00 0.00 H new ATOM 0 HG23 ILE A 44 22.569 26.524 21.139 1.00 0.00 H new ATOM 0 HD11 ILE A 44 24.857 25.463 24.157 1.00 0.00 H new ATOM 0 HD12 ILE A 44 24.524 27.211 24.134 1.00 0.00 H new ATOM 0 HD13 ILE A 44 23.341 26.071 23.449 1.00 0.00 H new ATOM 718 N PHE A 45 23.324 28.592 18.529 1.00 0.00 N ATOM 719 CA PHE A 45 22.799 29.716 17.749 1.00 0.00 C ATOM 720 C PHE A 45 21.282 29.753 17.894 1.00 0.00 C ATOM 721 O PHE A 45 20.632 28.709 17.869 1.00 0.00 O ATOM 722 CB PHE A 45 23.163 29.551 16.272 1.00 0.00 C ATOM 723 CG PHE A 45 22.591 30.696 15.465 1.00 0.00 C ATOM 724 CD1 PHE A 45 23.324 31.880 15.309 1.00 0.00 C ATOM 725 CD2 PHE A 45 21.331 30.571 14.865 1.00 0.00 C ATOM 726 CE1 PHE A 45 22.798 32.936 14.555 1.00 0.00 C ATOM 727 CE2 PHE A 45 20.805 31.628 14.111 1.00 0.00 C ATOM 728 CZ PHE A 45 21.538 32.811 13.957 1.00 0.00 C ATOM 0 H PHE A 45 22.709 27.779 18.547 1.00 0.00 H new ATOM 0 HA PHE A 45 23.235 30.645 18.118 1.00 0.00 H new ATOM 0 HB2 PHE A 45 24.247 29.521 16.158 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.776 28.603 15.898 1.00 0.00 H new ATOM 0 HD1 PHE A 45 24.295 31.978 15.771 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.765 29.659 14.984 1.00 0.00 H new ATOM 0 HE1 PHE A 45 23.364 33.848 14.435 1.00 0.00 H new ATOM 0 HE2 PHE A 45 19.834 31.530 13.648 1.00 0.00 H new ATOM 0 HZ PHE A 45 21.132 33.627 13.377 1.00 0.00 H new ATOM 738 N ALA A 46 20.714 30.939 18.061 1.00 0.00 N ATOM 739 CA ALA A 46 19.272 31.038 18.224 1.00 0.00 C ATOM 740 C ALA A 46 18.825 30.099 19.342 1.00 0.00 C ATOM 741 O ALA A 46 17.785 29.443 19.252 1.00 0.00 O ATOM 742 CB ALA A 46 18.570 30.675 16.915 1.00 0.00 C ATOM 0 H ALA A 46 21.216 31.827 18.087 1.00 0.00 H new ATOM 0 HA ALA A 46 19.006 32.062 18.486 1.00 0.00 H new ATOM 0 HB1 ALA A 46 17.491 30.752 17.047 1.00 0.00 H new ATOM 0 HB2 ALA A 46 18.889 31.360 16.129 1.00 0.00 H new ATOM 0 HB3 ALA A 46 18.829 29.654 16.634 1.00 0.00 H new ATOM 748 N GLY A 47 19.629 30.061 20.401 1.00 0.00 N ATOM 749 CA GLY A 47 19.346 29.234 21.570 1.00 0.00 C ATOM 750 C GLY A 47 19.331 27.734 21.262 1.00 0.00 C ATOM 751 O GLY A 47 18.952 26.941 22.122 1.00 0.00 O ATOM 0 H GLY A 47 20.492 30.600 20.473 1.00 0.00 H new ATOM 0 HA2 GLY A 47 20.095 29.433 22.337 1.00 0.00 H new ATOM 0 HA3 GLY A 47 18.380 29.522 21.985 1.00 0.00 H new ATOM 755 N LYS A 48 19.739 27.332 20.051 1.00 0.00 N ATOM 756 CA LYS A 48 19.751 25.901 19.692 1.00 0.00 C ATOM 757 C LYS A 48 21.165 25.399 19.421 1.00 0.00 C ATOM 758 O LYS A 48 21.976 26.085 18.799 1.00 0.00 O ATOM 759 CB LYS A 48 18.912 25.665 18.441 1.00 0.00 C ATOM 760 CG LYS A 48 17.455 26.036 18.711 1.00 0.00 C ATOM 761 CD LYS A 48 16.600 25.632 17.504 1.00 0.00 C ATOM 762 CE LYS A 48 16.943 26.514 16.297 1.00 0.00 C ATOM 763 NZ LYS A 48 15.833 26.455 15.311 1.00 0.00 N ATOM 0 H LYS A 48 20.060 27.960 19.314 1.00 0.00 H new ATOM 0 HA LYS A 48 19.337 25.355 20.540 1.00 0.00 H new ATOM 0 HB2 LYS A 48 19.300 26.261 17.615 1.00 0.00 H new ATOM 0 HB3 LYS A 48 18.980 24.620 18.140 1.00 0.00 H new ATOM 0 HG2 LYS A 48 17.099 25.531 19.609 1.00 0.00 H new ATOM 0 HG3 LYS A 48 17.367 27.107 18.892 1.00 0.00 H new ATOM 0 HD2 LYS A 48 16.774 24.584 17.260 1.00 0.00 H new ATOM 0 HD3 LYS A 48 15.542 25.731 17.748 1.00 0.00 H new ATOM 0 HE2 LYS A 48 17.104 27.543 16.619 1.00 0.00 H new ATOM 0 HE3 LYS A 48 17.871 26.175 15.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 16.064 27.053 14.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.700 25.473 14.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.957 26.798 15.754 1.00 0.00 H new ATOM 777 N GLN A 49 21.439 24.176 19.875 1.00 0.00 N ATOM 778 CA GLN A 49 22.736 23.551 19.672 1.00 0.00 C ATOM 779 C GLN A 49 22.796 22.907 18.288 1.00 0.00 C ATOM 780 O GLN A 49 21.879 22.188 17.890 1.00 0.00 O ATOM 781 CB GLN A 49 22.957 22.480 20.740 1.00 0.00 C ATOM 782 CG GLN A 49 24.414 22.018 20.717 1.00 0.00 C ATOM 783 CD GLN A 49 24.595 20.820 21.646 1.00 0.00 C ATOM 784 OE1 GLN A 49 24.368 19.679 21.241 1.00 0.00 O ATOM 785 NE2 GLN A 49 24.990 21.011 22.875 1.00 0.00 N ATOM 0 H GLN A 49 20.772 23.599 20.388 1.00 0.00 H new ATOM 0 HA GLN A 49 23.514 24.311 19.746 1.00 0.00 H new ATOM 0 HB2 GLN A 49 22.708 22.878 21.724 1.00 0.00 H new ATOM 0 HB3 GLN A 49 22.295 21.633 20.561 1.00 0.00 H new ATOM 0 HG2 GLN A 49 24.703 21.748 19.701 1.00 0.00 H new ATOM 0 HG3 GLN A 49 25.068 22.833 21.029 1.00 0.00 H new ATOM 0 HE21 GLN A 49 25.178 21.956 23.209 1.00 0.00 H new ATOM 0 HE22 GLN A 49 25.111 20.215 23.501 1.00 0.00 H new ATOM 794 N LEU A 50 23.867 23.178 17.555 1.00 0.00 N ATOM 795 CA LEU A 50 24.015 22.623 16.210 1.00 0.00 C ATOM 796 C LEU A 50 24.391 21.143 16.265 1.00 0.00 C ATOM 797 O LEU A 50 25.323 20.753 16.969 1.00 0.00 O ATOM 798 CB LEU A 50 25.081 23.402 15.437 1.00 0.00 C ATOM 799 CG LEU A 50 24.889 24.903 15.671 1.00 0.00 C ATOM 800 CD1 LEU A 50 25.869 25.688 14.794 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.452 25.301 15.313 1.00 0.00 C ATOM 0 H LEU A 50 24.639 23.771 17.861 1.00 0.00 H new ATOM 0 HA LEU A 50 23.057 22.714 15.697 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.076 23.097 15.762 1.00 0.00 H new ATOM 0 HB3 LEU A 50 25.010 23.177 14.373 1.00 0.00 H new ATOM 0 HG LEU A 50 25.077 25.131 16.720 1.00 0.00 H new ATOM 0 HD11 LEU A 50 25.732 26.756 14.961 1.00 0.00 H new ATOM 0 HD12 LEU A 50 26.891 25.409 15.051 1.00 0.00 H new ATOM 0 HD13 LEU A 50 25.683 25.458 13.745 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.318 26.370 15.480 1.00 0.00 H new ATOM 0 HD22 LEU A 50 23.261 25.071 14.265 1.00 0.00 H new ATOM 0 HD23 LEU A 50 22.754 24.745 15.939 1.00 0.00 H new ATOM 813 N GLU A 51 23.640 20.324 15.527 1.00 0.00 N ATOM 814 CA GLU A 51 23.877 18.879 15.498 1.00 0.00 C ATOM 815 C GLU A 51 24.915 18.497 14.448 1.00 0.00 C ATOM 816 O GLU A 51 24.960 19.055 13.347 1.00 0.00 O ATOM 817 CB GLU A 51 22.563 18.142 15.198 1.00 0.00 C ATOM 818 CG GLU A 51 21.726 18.044 16.473 1.00 0.00 C ATOM 819 CD GLU A 51 20.405 17.338 16.177 1.00 0.00 C ATOM 820 OE1 GLU A 51 20.381 16.521 15.271 1.00 0.00 O ATOM 821 OE2 GLU A 51 19.436 17.626 16.861 1.00 0.00 O ATOM 0 H GLU A 51 22.864 20.635 14.943 1.00 0.00 H new ATOM 0 HA GLU A 51 24.258 18.589 16.477 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.006 18.672 14.425 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.774 17.145 14.812 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.277 17.497 17.238 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.534 19.041 16.870 1.00 0.00 H new ATOM 828 N ASP A 52 25.736 17.519 14.797 1.00 0.00 N ATOM 829 CA ASP A 52 26.764 17.040 13.895 1.00 0.00 C ATOM 830 C ASP A 52 26.133 16.405 12.661 1.00 0.00 C ATOM 831 O ASP A 52 25.178 15.634 12.770 1.00 0.00 O ATOM 832 CB ASP A 52 27.644 16.012 14.608 1.00 0.00 C ATOM 833 CG ASP A 52 28.411 16.682 15.744 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.121 17.637 15.470 1.00 0.00 O ATOM 835 OD2 ASP A 52 28.281 16.230 16.869 1.00 0.00 O ATOM 0 H ASP A 52 25.708 17.043 15.699 1.00 0.00 H new ATOM 0 HA ASP A 52 27.376 17.886 13.583 1.00 0.00 H new ATOM 0 HB2 ASP A 52 27.028 15.204 15.001 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.342 15.565 13.900 1.00 0.00 H new ATOM 840 N GLY A 53 26.675 16.722 11.487 1.00 0.00 N ATOM 841 CA GLY A 53 26.164 16.167 10.234 1.00 0.00 C ATOM 842 C GLY A 53 25.213 17.134 9.531 1.00 0.00 C ATOM 843 O GLY A 53 24.812 16.891 8.393 1.00 0.00 O ATOM 0 H GLY A 53 27.465 17.358 11.376 1.00 0.00 H new ATOM 0 HA2 GLY A 53 26.999 15.933 9.573 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.645 15.230 10.436 1.00 0.00 H new ATOM 847 N ARG A 54 24.853 18.237 10.198 1.00 0.00 N ATOM 848 CA ARG A 54 23.953 19.222 9.588 1.00 0.00 C ATOM 849 C ARG A 54 24.754 20.355 8.944 1.00 0.00 C ATOM 850 O ARG A 54 25.892 20.621 9.328 1.00 0.00 O ATOM 851 CB ARG A 54 23.013 19.803 10.647 1.00 0.00 C ATOM 852 CG ARG A 54 22.109 18.697 11.195 1.00 0.00 C ATOM 853 CD ARG A 54 20.951 19.323 11.972 1.00 0.00 C ATOM 854 NE ARG A 54 19.991 19.924 11.053 1.00 0.00 N ATOM 855 CZ ARG A 54 18.801 20.338 11.476 1.00 0.00 C ATOM 856 NH1 ARG A 54 17.946 20.845 10.631 1.00 0.00 N ATOM 857 NH2 ARG A 54 18.492 20.246 12.741 1.00 0.00 N ATOM 0 H ARG A 54 25.164 18.467 11.142 1.00 0.00 H new ATOM 0 HA ARG A 54 23.367 18.719 8.819 1.00 0.00 H new ATOM 0 HB2 ARG A 54 23.592 20.248 11.457 1.00 0.00 H new ATOM 0 HB3 ARG A 54 22.408 20.599 10.213 1.00 0.00 H new ATOM 0 HG2 ARG A 54 21.725 18.088 10.377 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.681 18.034 11.845 1.00 0.00 H new ATOM 0 HD2 ARG A 54 20.458 18.563 12.578 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.331 20.080 12.658 1.00 0.00 H new ATOM 0 HE ARG A 54 20.237 20.028 10.069 1.00 0.00 H new ATOM 0 HH11 ARG A 54 18.190 20.924 9.644 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.033 21.162 10.957 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.163 19.857 13.403 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.579 20.563 13.067 1.00 0.00 H new ATOM 871 N THR A 55 24.144 21.025 7.964 1.00 0.00 N ATOM 872 CA THR A 55 24.794 22.141 7.267 1.00 0.00 C ATOM 873 C THR A 55 24.318 23.465 7.854 1.00 0.00 C ATOM 874 O THR A 55 23.276 23.517 8.500 1.00 0.00 O ATOM 875 CB THR A 55 24.450 22.091 5.775 1.00 0.00 C ATOM 876 OG1 THR A 55 23.057 21.850 5.622 1.00 0.00 O ATOM 877 CG2 THR A 55 25.241 20.968 5.100 1.00 0.00 C ATOM 0 H THR A 55 23.202 20.816 7.634 1.00 0.00 H new ATOM 0 HA THR A 55 25.874 22.058 7.393 1.00 0.00 H new ATOM 0 HB THR A 55 24.710 23.042 5.310 1.00 0.00 H new ATOM 0 HG1 THR A 55 22.631 22.637 5.224 1.00 0.00 H new ATOM 0 HG21 THR A 55 24.994 20.936 4.039 1.00 0.00 H new ATOM 0 HG22 THR A 55 26.309 21.153 5.218 1.00 0.00 H new ATOM 0 HG23 THR A 55 24.985 20.014 5.562 1.00 0.00 H new ATOM 885 N LEU A 56 25.069 24.542 7.630 1.00 0.00 N ATOM 886 CA LEU A 56 24.665 25.839 8.161 1.00 0.00 C ATOM 887 C LEU A 56 23.296 26.230 7.594 1.00 0.00 C ATOM 888 O LEU A 56 22.453 26.757 8.321 1.00 0.00 O ATOM 889 CB LEU A 56 25.730 26.921 7.840 1.00 0.00 C ATOM 890 CG LEU A 56 26.656 27.151 9.054 1.00 0.00 C ATOM 891 CD1 LEU A 56 27.504 25.898 9.308 1.00 0.00 C ATOM 892 CD2 LEU A 56 27.571 28.351 8.775 1.00 0.00 C ATOM 0 H LEU A 56 25.939 24.544 7.098 1.00 0.00 H new ATOM 0 HA LEU A 56 24.584 25.766 9.246 1.00 0.00 H new ATOM 0 HB2 LEU A 56 26.322 26.612 6.978 1.00 0.00 H new ATOM 0 HB3 LEU A 56 25.237 27.855 7.570 1.00 0.00 H new ATOM 0 HG LEU A 56 26.051 27.353 9.938 1.00 0.00 H new ATOM 0 HD11 LEU A 56 28.155 26.067 10.166 1.00 0.00 H new ATOM 0 HD12 LEU A 56 26.849 25.050 9.511 1.00 0.00 H new ATOM 0 HD13 LEU A 56 28.111 25.685 8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 56 28.226 28.516 9.631 1.00 0.00 H new ATOM 0 HD22 LEU A 56 28.174 28.151 7.890 1.00 0.00 H new ATOM 0 HD23 LEU A 56 26.964 29.240 8.606 1.00 0.00 H new ATOM 904 N SER A 57 23.081 25.983 6.301 1.00 0.00 N ATOM 905 CA SER A 57 21.806 26.329 5.677 1.00 0.00 C ATOM 906 C SER A 57 20.646 25.817 6.519 1.00 0.00 C ATOM 907 O SER A 57 19.596 26.455 6.595 1.00 0.00 O ATOM 908 CB SER A 57 21.711 25.725 4.276 1.00 0.00 C ATOM 909 OG SER A 57 21.727 24.307 4.375 1.00 0.00 O ATOM 0 H SER A 57 23.761 25.552 5.675 1.00 0.00 H new ATOM 0 HA SER A 57 21.752 27.415 5.605 1.00 0.00 H new ATOM 0 HB2 SER A 57 20.796 26.057 3.786 1.00 0.00 H new ATOM 0 HB3 SER A 57 22.544 26.068 3.662 1.00 0.00 H new ATOM 0 HG SER A 57 21.665 23.916 3.479 1.00 0.00 H new ATOM 915 N ASP A 58 20.842 24.670 7.161 1.00 0.00 N ATOM 916 CA ASP A 58 19.803 24.101 8.005 1.00 0.00 C ATOM 917 C ASP A 58 19.404 25.119 9.065 1.00 0.00 C ATOM 918 O ASP A 58 18.221 25.311 9.354 1.00 0.00 O ATOM 919 CB ASP A 58 20.315 22.826 8.681 1.00 0.00 C ATOM 920 CG ASP A 58 20.746 21.811 7.628 1.00 0.00 C ATOM 921 OD1 ASP A 58 20.235 21.878 6.523 1.00 0.00 O ATOM 922 OD2 ASP A 58 21.583 20.979 7.942 1.00 0.00 O ATOM 0 H ASP A 58 21.701 24.123 7.113 1.00 0.00 H new ATOM 0 HA ASP A 58 18.937 23.851 7.392 1.00 0.00 H new ATOM 0 HB2 ASP A 58 21.155 23.063 9.334 1.00 0.00 H new ATOM 0 HB3 ASP A 58 19.533 22.400 9.310 1.00 0.00 H new ATOM 927 N TYR A 59 20.413 25.778 9.628 1.00 0.00 N ATOM 928 CA TYR A 59 20.211 26.799 10.651 1.00 0.00 C ATOM 929 C TYR A 59 20.371 28.181 10.026 1.00 0.00 C ATOM 930 O TYR A 59 21.484 28.561 9.699 1.00 0.00 O ATOM 931 CB TYR A 59 21.270 26.627 11.744 1.00 0.00 C ATOM 932 CG TYR A 59 21.095 25.294 12.429 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.937 24.220 12.109 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.092 25.133 13.390 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.776 22.987 12.752 1.00 0.00 C ATOM 936 CE2 TYR A 59 19.927 23.901 14.032 1.00 0.00 C ATOM 937 CZ TYR A 59 20.769 22.827 13.714 1.00 0.00 C ATOM 938 OH TYR A 59 20.606 21.613 14.348 1.00 0.00 O ATOM 0 H TYR A 59 21.392 25.620 9.388 1.00 0.00 H new ATOM 0 HA TYR A 59 19.212 26.698 11.075 1.00 0.00 H new ATOM 0 HB2 TYR A 59 22.267 26.693 11.309 1.00 0.00 H new ATOM 0 HB3 TYR A 59 21.186 27.433 12.473 1.00 0.00 H new ATOM 0 HD1 TYR A 59 22.711 24.344 11.366 1.00 0.00 H new ATOM 0 HD2 TYR A 59 19.444 25.961 13.637 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.427 22.160 12.507 1.00 0.00 H new ATOM 0 HE2 TYR A 59 19.151 23.778 14.773 1.00 0.00 H new ATOM 0 HH TYR A 59 19.864 21.674 14.986 1.00 0.00 H new ATOM 948 N ASN A 60 19.249 28.880 9.800 1.00 0.00 N ATOM 949 CA ASN A 60 19.258 30.204 9.140 1.00 0.00 C ATOM 950 C ASN A 60 20.329 31.172 9.685 1.00 0.00 C ATOM 951 O ASN A 60 20.011 32.227 10.234 1.00 0.00 O ATOM 952 CB ASN A 60 17.879 30.862 9.268 1.00 0.00 C ATOM 953 CG ASN A 60 16.816 30.007 8.583 1.00 0.00 C ATOM 954 OD1 ASN A 60 15.815 29.647 9.202 1.00 0.00 O ATOM 955 ND2 ASN A 60 16.970 29.664 7.332 1.00 0.00 N ATOM 0 H ASN A 60 18.319 28.554 10.063 1.00 0.00 H new ATOM 0 HA ASN A 60 19.508 30.013 8.096 1.00 0.00 H new ATOM 0 HB2 ASN A 60 17.627 30.992 10.321 1.00 0.00 H new ATOM 0 HB3 ASN A 60 17.900 31.855 8.820 1.00 0.00 H new ATOM 0 HD21 ASN A 60 16.260 29.097 6.867 1.00 0.00 H new ATOM 0 HD22 ASN A 60 17.800 29.963 6.820 1.00 0.00 H new ATOM 962 N ILE A 61 21.592 30.799 9.495 1.00 0.00 N ATOM 963 CA ILE A 61 22.737 31.605 9.915 1.00 0.00 C ATOM 964 C ILE A 61 23.308 32.324 8.693 1.00 0.00 C ATOM 965 O ILE A 61 24.037 31.725 7.906 1.00 0.00 O ATOM 966 CB ILE A 61 23.823 30.695 10.506 1.00 0.00 C ATOM 967 CG1 ILE A 61 23.316 30.040 11.793 1.00 0.00 C ATOM 968 CG2 ILE A 61 25.078 31.521 10.809 1.00 0.00 C ATOM 969 CD1 ILE A 61 24.306 28.953 12.224 1.00 0.00 C ATOM 0 H ILE A 61 21.852 29.923 9.042 1.00 0.00 H new ATOM 0 HA ILE A 61 22.418 32.327 10.667 1.00 0.00 H new ATOM 0 HB ILE A 61 24.066 29.916 9.783 1.00 0.00 H new ATOM 0 HG12 ILE A 61 23.212 30.787 12.580 1.00 0.00 H new ATOM 0 HG13 ILE A 61 22.329 29.607 11.631 1.00 0.00 H new ATOM 0 HG21 ILE A 61 25.848 30.873 11.228 1.00 0.00 H new ATOM 0 HG22 ILE A 61 25.447 31.973 9.888 1.00 0.00 H new ATOM 0 HG23 ILE A 61 24.833 32.305 11.526 1.00 0.00 H new ATOM 0 HD11 ILE A 61 23.952 28.481 13.141 1.00 0.00 H new ATOM 0 HD12 ILE A 61 24.387 28.203 11.438 1.00 0.00 H new ATOM 0 HD13 ILE A 61 25.284 29.401 12.401 1.00 0.00 H new ATOM 981 N GLN A 62 22.954 33.595 8.516 1.00 0.00 N ATOM 982 CA GLN A 62 23.432 34.351 7.350 1.00 0.00 C ATOM 983 C GLN A 62 24.782 35.011 7.601 1.00 0.00 C ATOM 984 O GLN A 62 25.353 34.908 8.686 1.00 0.00 O ATOM 985 CB GLN A 62 22.417 35.416 6.944 1.00 0.00 C ATOM 986 CG GLN A 62 21.116 34.739 6.511 1.00 0.00 C ATOM 987 CD GLN A 62 20.112 35.790 6.054 1.00 0.00 C ATOM 988 OE1 GLN A 62 19.277 36.235 6.841 1.00 0.00 O ATOM 989 NE2 GLN A 62 20.145 36.220 4.822 1.00 0.00 N ATOM 0 H GLN A 62 22.350 34.119 9.149 1.00 0.00 H new ATOM 0 HA GLN A 62 23.554 33.631 6.541 1.00 0.00 H new ATOM 0 HB2 GLN A 62 22.228 36.091 7.779 1.00 0.00 H new ATOM 0 HB3 GLN A 62 22.814 36.021 6.129 1.00 0.00 H new ATOM 0 HG2 GLN A 62 21.313 34.036 5.702 1.00 0.00 H new ATOM 0 HG3 GLN A 62 20.702 34.164 7.339 1.00 0.00 H new ATOM 0 HE21 GLN A 62 20.838 35.850 4.171 1.00 0.00 H new ATOM 0 HE22 GLN A 62 19.478 36.926 4.510 1.00 0.00 H new ATOM 998 N LYS A 63 25.295 35.664 6.559 1.00 0.00 N ATOM 999 CA LYS A 63 26.596 36.314 6.636 1.00 0.00 C ATOM 1000 C LYS A 63 26.638 37.387 7.717 1.00 0.00 C ATOM 1001 O LYS A 63 25.660 38.094 7.960 1.00 0.00 O ATOM 1002 CB LYS A 63 26.975 36.916 5.272 1.00 0.00 C ATOM 1003 CG LYS A 63 26.136 38.162 4.959 1.00 0.00 C ATOM 1004 CD LYS A 63 26.434 38.605 3.521 1.00 0.00 C ATOM 1005 CE LYS A 63 25.675 39.893 3.192 1.00 0.00 C ATOM 1006 NZ LYS A 63 24.210 39.651 3.305 1.00 0.00 N ATOM 0 H LYS A 63 24.829 35.755 5.656 1.00 0.00 H new ATOM 0 HA LYS A 63 27.325 35.550 6.907 1.00 0.00 H new ATOM 0 HB2 LYS A 63 28.033 37.178 5.269 1.00 0.00 H new ATOM 0 HB3 LYS A 63 26.829 36.171 4.490 1.00 0.00 H new ATOM 0 HG2 LYS A 63 25.075 37.942 5.075 1.00 0.00 H new ATOM 0 HG3 LYS A 63 26.374 38.963 5.659 1.00 0.00 H new ATOM 0 HD2 LYS A 63 27.505 38.765 3.397 1.00 0.00 H new ATOM 0 HD3 LYS A 63 26.147 37.818 2.824 1.00 0.00 H new ATOM 0 HE2 LYS A 63 25.976 40.689 3.873 1.00 0.00 H new ATOM 0 HE3 LYS A 63 25.922 40.226 2.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 23.693 40.428 2.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 23.970 38.752 2.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 23.942 39.604 4.309 1.00 0.00 H new ATOM 1020 N GLU A 64 27.805 37.496 8.347 1.00 0.00 N ATOM 1021 CA GLU A 64 28.032 38.480 9.397 1.00 0.00 C ATOM 1022 C GLU A 64 27.054 38.317 10.560 1.00 0.00 C ATOM 1023 O GLU A 64 26.206 39.177 10.796 1.00 0.00 O ATOM 1024 CB GLU A 64 27.941 39.892 8.818 1.00 0.00 C ATOM 1025 CG GLU A 64 28.972 40.032 7.695 1.00 0.00 C ATOM 1026 CD GLU A 64 28.968 41.452 7.144 1.00 0.00 C ATOM 1027 OE1 GLU A 64 28.515 42.340 7.848 1.00 0.00 O ATOM 1028 OE2 GLU A 64 29.419 41.633 6.025 1.00 0.00 O ATOM 0 H GLU A 64 28.614 36.908 8.145 1.00 0.00 H new ATOM 0 HA GLU A 64 29.034 38.314 9.793 1.00 0.00 H new ATOM 0 HB2 GLU A 64 26.938 40.079 8.435 1.00 0.00 H new ATOM 0 HB3 GLU A 64 28.128 40.632 9.596 1.00 0.00 H new ATOM 0 HG2 GLU A 64 29.965 39.784 8.071 1.00 0.00 H new ATOM 0 HG3 GLU A 64 28.748 39.325 6.897 1.00 0.00 H new ATOM 1049 N THR A 66 26.802 36.614 14.871 1.00 0.00 N ATOM 1050 CA THR A 66 27.627 36.239 16.025 1.00 0.00 C ATOM 1051 C THR A 66 27.249 34.851 16.531 1.00 0.00 C ATOM 1052 O THR A 66 26.099 34.600 16.890 1.00 0.00 O ATOM 1053 CB THR A 66 27.451 37.260 17.152 1.00 0.00 C ATOM 1054 OG1 THR A 66 27.807 38.552 16.673 1.00 0.00 O ATOM 1055 CG2 THR A 66 28.358 36.885 18.326 1.00 0.00 C ATOM 0 HA THR A 66 28.670 36.225 15.708 1.00 0.00 H new ATOM 0 HB THR A 66 26.413 37.265 17.483 1.00 0.00 H new ATOM 0 HG1 THR A 66 27.660 38.594 15.705 1.00 0.00 H new ATOM 0 HG21 THR A 66 28.233 37.612 19.129 1.00 0.00 H new ATOM 0 HG22 THR A 66 28.091 35.893 18.690 1.00 0.00 H new ATOM 0 HG23 THR A 66 29.397 36.883 17.997 1.00 0.00 H new ATOM 1063 N LEU A 67 28.234 33.951 16.566 1.00 0.00 N ATOM 1064 CA LEU A 67 28.012 32.582 17.038 1.00 0.00 C ATOM 1065 C LEU A 67 28.415 32.468 18.507 1.00 0.00 C ATOM 1066 O LEU A 67 29.385 33.096 18.938 1.00 0.00 O ATOM 1067 CB LEU A 67 28.852 31.613 16.200 1.00 0.00 C ATOM 1068 CG LEU A 67 28.521 30.157 16.567 1.00 0.00 C ATOM 1069 CD1 LEU A 67 27.065 29.828 16.189 1.00 0.00 C ATOM 1070 CD2 LEU A 67 29.478 29.222 15.815 1.00 0.00 C ATOM 0 H LEU A 67 29.192 34.145 16.274 1.00 0.00 H new ATOM 0 HA LEU A 67 26.956 32.333 16.937 1.00 0.00 H new ATOM 0 HB2 LEU A 67 28.660 31.780 15.140 1.00 0.00 H new ATOM 0 HB3 LEU A 67 29.912 31.804 16.366 1.00 0.00 H new ATOM 0 HG LEU A 67 28.639 30.020 17.642 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.845 28.794 16.455 1.00 0.00 H new ATOM 0 HD12 LEU A 67 26.390 30.493 16.728 1.00 0.00 H new ATOM 0 HD13 LEU A 67 26.928 29.964 15.116 1.00 0.00 H new ATOM 0 HD21 LEU A 67 29.250 28.187 16.070 1.00 0.00 H new ATOM 0 HD22 LEU A 67 29.359 29.366 14.741 1.00 0.00 H new ATOM 0 HD23 LEU A 67 30.506 29.448 16.099 1.00 0.00 H new ATOM 1082 N HIS A 68 27.683 31.667 19.289 1.00 0.00 N ATOM 1083 CA HIS A 68 28.003 31.503 20.705 1.00 0.00 C ATOM 1084 C HIS A 68 28.897 30.275 20.909 1.00 0.00 C ATOM 1085 O HIS A 68 28.498 29.153 20.593 1.00 0.00 O ATOM 1086 CB HIS A 68 26.711 31.331 21.508 1.00 0.00 C ATOM 1087 CG HIS A 68 25.861 32.563 21.359 1.00 0.00 C ATOM 1088 ND1 HIS A 68 25.022 32.755 20.271 1.00 0.00 N ATOM 1089 CD2 HIS A 68 25.707 33.675 22.151 1.00 0.00 C ATOM 1090 CE1 HIS A 68 24.408 33.942 20.437 1.00 0.00 C ATOM 1091 NE2 HIS A 68 24.789 34.543 21.567 1.00 0.00 N ATOM 0 H HIS A 68 26.877 31.131 18.968 1.00 0.00 H new ATOM 0 HA HIS A 68 28.534 32.390 21.050 1.00 0.00 H new ATOM 0 HB2 HIS A 68 26.166 30.455 21.157 1.00 0.00 H new ATOM 0 HB3 HIS A 68 26.943 31.161 22.559 1.00 0.00 H new ATOM 0 HD2 HIS A 68 26.220 33.849 23.085 1.00 0.00 H new ATOM 0 HE1 HIS A 68 23.694 34.357 19.741 1.00 0.00 H new ATOM 0 HE2 HIS A 68 24.475 35.445 21.925 1.00 0.00 H new ATOM 1100 N LEU A 69 30.106 30.484 21.448 1.00 0.00 N ATOM 1101 CA LEU A 69 31.039 29.402 21.697 1.00 0.00 C ATOM 1102 C LEU A 69 31.163 29.207 23.195 1.00 0.00 C ATOM 1103 O LEU A 69 31.783 30.004 23.899 1.00 0.00 O ATOM 1104 CB LEU A 69 32.408 29.739 21.090 1.00 0.00 C ATOM 1105 CG LEU A 69 33.268 28.476 20.987 1.00 0.00 C ATOM 1106 CD1 LEU A 69 34.566 28.805 20.242 1.00 0.00 C ATOM 1107 CD2 LEU A 69 33.603 27.943 22.393 1.00 0.00 C ATOM 0 H LEU A 69 30.453 31.404 21.718 1.00 0.00 H new ATOM 0 HA LEU A 69 30.677 28.484 21.235 1.00 0.00 H new ATOM 0 HB2 LEU A 69 32.277 30.180 20.102 1.00 0.00 H new ATOM 0 HB3 LEU A 69 32.914 30.483 21.706 1.00 0.00 H new ATOM 0 HG LEU A 69 32.714 27.712 20.443 1.00 0.00 H new ATOM 0 HD11 LEU A 69 35.180 27.908 20.167 1.00 0.00 H new ATOM 0 HD12 LEU A 69 34.329 29.167 19.242 1.00 0.00 H new ATOM 0 HD13 LEU A 69 35.113 29.575 20.787 1.00 0.00 H new ATOM 0 HD21 LEU A 69 34.215 27.045 22.306 1.00 0.00 H new ATOM 0 HD22 LEU A 69 34.152 28.703 22.949 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.680 27.703 22.921 1.00 0.00 H new ATOM 1119 N VAL A 70 30.559 28.133 23.664 1.00 0.00 N ATOM 1120 CA VAL A 70 30.576 27.788 25.084 1.00 0.00 C ATOM 1121 C VAL A 70 31.420 26.540 25.307 1.00 0.00 C ATOM 1122 O VAL A 70 31.467 25.650 24.457 1.00 0.00 O ATOM 1123 CB VAL A 70 29.148 27.547 25.572 1.00 0.00 C ATOM 1124 CG1 VAL A 70 29.154 27.288 27.078 1.00 0.00 C ATOM 1125 CG2 VAL A 70 28.297 28.785 25.272 1.00 0.00 C ATOM 0 H VAL A 70 30.044 27.474 23.081 1.00 0.00 H new ATOM 0 HA VAL A 70 31.012 28.613 25.647 1.00 0.00 H new ATOM 0 HB VAL A 70 28.731 26.680 25.060 1.00 0.00 H new ATOM 0 HG11 VAL A 70 28.134 27.117 27.422 1.00 0.00 H new ATOM 0 HG12 VAL A 70 29.762 26.409 27.294 1.00 0.00 H new ATOM 0 HG13 VAL A 70 29.570 28.153 27.594 1.00 0.00 H new ATOM 0 HG21 VAL A 70 27.277 28.618 25.618 1.00 0.00 H new ATOM 0 HG22 VAL A 70 28.718 29.649 25.786 1.00 0.00 H new ATOM 0 HG23 VAL A 70 28.290 28.970 24.198 1.00 0.00 H new