USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 586 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 62 GLN : amide:sc= -0.426 K(o=-0.39,f=-3.6!) USER MOD Set 1.2: A 65 SER OG : rot 159:sc= 0.0322 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0.949 USER MOD Set 2.2: A 25 ASN : amide:sc= 1.11 K(o=2.1,f=0.63) USER MOD Set 3.1: A 7 THR OG1 : rot 124:sc= 1.46 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.768 USER MOD Single : A 1 MET CE :methyl 141:sc= -0.0626 (180deg=-0.736) USER MOD Single : A 1 MET N :NH3+ 171:sc= 2.3 (180deg=1.9) USER MOD Single : A 2 GLN : amide:sc= -0.0209 K(o=-0.021,f=-1.8!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -130:sc= 0.379 (180deg=0.0355) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -166:sc= 1.09 (180deg=0.617) USER MOD Single : A 29 LYS NZ :NH3+ -120:sc= 1.13 (180deg=0.269) USER MOD Single : A 31 GLN : amide:sc= -2.03! K(o=-2!,f=-0.04) USER MOD Single : A 33 LYS NZ :NH3+ -147:sc= 1.02 (180deg=0.402) USER MOD Single : A 40 GLN : amide:sc= -0.623 X(o=-0.62,f=-0.64) USER MOD Single : A 41 GLN : amide:sc= -0.838 K(o=-0.84,f=-1.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -2.25 X(o=-2.3,f=-1.9!) USER MOD Single : A 55 THR OG1 : rot -53:sc= 1.19 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.761 USER MOD Single : A 60 ASN : amide:sc= -0.0585 K(o=-0.059,f=-1.5!) USER MOD Single : A 63 LYS NZ :NH3+ -152:sc= -0.313 (180deg=-1.45!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0939 X(o=-0.094,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.155 31.546 15.257 1.00 0.00 N ATOM 2 CA MET A 1 13.997 31.285 16.699 1.00 0.00 C ATOM 3 C MET A 1 15.296 31.866 17.273 1.00 0.00 C ATOM 4 O MET A 1 16.266 31.890 16.527 1.00 0.00 O ATOM 5 CB MET A 1 13.810 29.793 16.981 1.00 0.00 C ATOM 6 CG MET A 1 13.815 29.334 18.447 1.00 0.00 C ATOM 7 SD MET A 1 13.514 27.553 18.590 1.00 0.00 S ATOM 8 CE MET A 1 15.197 26.892 18.463 1.00 0.00 C ATOM 0 H1 MET A 1 13.401 31.060 14.732 1.00 0.00 H new ATOM 0 H2 MET A 1 14.096 32.569 15.081 1.00 0.00 H new ATOM 0 H3 MET A 1 15.080 31.193 14.940 1.00 0.00 H new ATOM 0 HA MET A 1 13.110 31.733 17.147 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.864 29.484 16.537 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.599 29.252 16.458 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.775 29.579 18.902 1.00 0.00 H new ATOM 0 HG3 MET A 1 13.051 29.878 19.002 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.314 26.058 19.155 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.376 26.546 17.445 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.915 27.674 18.712 1.00 0.00 H new ATOM 20 N GLN A 2 15.469 32.323 18.510 1.00 0.00 N ATOM 21 CA GLN A 2 16.739 32.678 19.099 1.00 0.00 C ATOM 22 C GLN A 2 17.203 31.506 19.974 1.00 0.00 C ATOM 23 O GLN A 2 16.308 31.118 20.720 1.00 0.00 O ATOM 24 CB GLN A 2 16.466 33.914 19.949 1.00 0.00 C ATOM 25 CG GLN A 2 16.182 35.169 19.107 1.00 0.00 C ATOM 26 CD GLN A 2 15.870 36.333 20.035 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.457 36.098 21.165 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.927 37.541 19.474 1.00 0.00 N ATOM 0 H GLN A 2 14.687 32.459 19.151 1.00 0.00 H new ATOM 0 HA GLN A 2 17.514 32.882 18.361 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.614 33.720 20.601 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.324 34.102 20.594 1.00 0.00 H new ATOM 0 HG2 GLN A 2 17.044 35.406 18.484 1.00 0.00 H new ATOM 0 HG3 GLN A 2 15.343 34.989 18.435 1.00 0.00 H new ATOM 0 HE21 GLN A 2 16.286 37.646 18.525 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.611 38.360 19.994 1.00 0.00 H new ATOM 37 N ILE A 3 18.493 31.200 20.084 1.00 0.00 N ATOM 38 CA ILE A 3 19.025 30.591 21.288 1.00 0.00 C ATOM 39 C ILE A 3 20.106 31.468 21.911 1.00 0.00 C ATOM 40 O ILE A 3 20.680 32.233 21.140 1.00 0.00 O ATOM 41 CB ILE A 3 19.423 29.144 21.010 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.593 29.020 20.039 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.223 28.234 20.710 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.287 27.667 20.241 1.00 0.00 C ATOM 0 H ILE A 3 19.184 31.366 19.352 1.00 0.00 H new ATOM 0 HA ILE A 3 18.256 30.531 22.058 1.00 0.00 H new ATOM 0 HB ILE A 3 19.819 28.749 21.946 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.238 29.108 19.012 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.302 29.832 20.202 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.574 27.219 20.521 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.546 28.231 21.564 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.696 28.605 19.831 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.123 27.580 19.547 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.656 27.597 21.264 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.576 26.862 20.056 1.00 0.00 H new ATOM 56 N PHE A 4 20.350 31.248 23.203 1.00 0.00 N ATOM 57 CA PHE A 4 21.376 31.785 24.087 1.00 0.00 C ATOM 58 C PHE A 4 22.481 30.733 24.193 1.00 0.00 C ATOM 59 O PHE A 4 22.192 29.583 24.499 1.00 0.00 O ATOM 60 CB PHE A 4 20.847 32.216 25.450 1.00 0.00 C ATOM 61 CG PHE A 4 20.263 33.599 25.616 1.00 0.00 C ATOM 62 CD1 PHE A 4 19.350 34.120 24.693 1.00 0.00 C ATOM 63 CD2 PHE A 4 20.531 34.364 26.763 1.00 0.00 C ATOM 64 CE1 PHE A 4 18.761 35.387 24.800 1.00 0.00 C ATOM 65 CE2 PHE A 4 19.902 35.607 26.915 1.00 0.00 C ATOM 66 CZ PHE A 4 19.070 36.165 25.931 1.00 0.00 C ATOM 0 H PHE A 4 19.751 30.603 23.718 1.00 0.00 H new ATOM 0 HA PHE A 4 21.768 32.708 23.661 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.080 31.500 25.744 1.00 0.00 H new ATOM 0 HB3 PHE A 4 21.665 32.119 26.164 1.00 0.00 H new ATOM 0 HD1 PHE A 4 19.082 33.507 23.845 1.00 0.00 H new ATOM 0 HD2 PHE A 4 21.212 33.999 27.517 1.00 0.00 H new ATOM 0 HE1 PHE A 4 18.090 35.755 24.038 1.00 0.00 H new ATOM 0 HE2 PHE A 4 20.064 36.160 27.829 1.00 0.00 H new ATOM 0 HZ PHE A 4 18.677 37.165 26.039 1.00 0.00 H new ATOM 76 N VAL A 5 23.709 31.227 24.018 1.00 0.00 N ATOM 77 CA VAL A 5 24.901 30.425 24.249 1.00 0.00 C ATOM 78 C VAL A 5 25.773 31.261 25.181 1.00 0.00 C ATOM 79 O VAL A 5 25.795 32.482 25.080 1.00 0.00 O ATOM 80 CB VAL A 5 25.506 29.912 22.937 1.00 0.00 C ATOM 81 CG1 VAL A 5 24.485 29.330 21.970 1.00 0.00 C ATOM 82 CG2 VAL A 5 26.252 30.967 22.111 1.00 0.00 C ATOM 0 H VAL A 5 23.899 32.183 23.716 1.00 0.00 H new ATOM 0 HA VAL A 5 24.718 29.475 24.751 1.00 0.00 H new ATOM 0 HB VAL A 5 26.192 29.154 23.314 1.00 0.00 H new ATOM 0 HG11 VAL A 5 24.992 28.990 21.067 1.00 0.00 H new ATOM 0 HG12 VAL A 5 23.977 28.488 22.440 1.00 0.00 H new ATOM 0 HG13 VAL A 5 23.754 30.095 21.709 1.00 0.00 H new ATOM 0 HG21 VAL A 5 26.643 30.508 21.203 1.00 0.00 H new ATOM 0 HG22 VAL A 5 25.567 31.772 21.845 1.00 0.00 H new ATOM 0 HG23 VAL A 5 27.077 31.372 22.697 1.00 0.00 H new ATOM 92 N LYS A 6 26.484 30.568 26.068 1.00 0.00 N ATOM 93 CA LYS A 6 27.452 31.068 27.012 1.00 0.00 C ATOM 94 C LYS A 6 28.831 30.513 26.639 1.00 0.00 C ATOM 95 O LYS A 6 28.946 29.333 26.334 1.00 0.00 O ATOM 96 CB LYS A 6 27.003 30.730 28.435 1.00 0.00 C ATOM 97 CG LYS A 6 27.787 31.327 29.605 1.00 0.00 C ATOM 98 CD LYS A 6 27.088 31.096 30.944 1.00 0.00 C ATOM 99 CE LYS A 6 27.556 32.135 31.965 1.00 0.00 C ATOM 100 NZ LYS A 6 26.964 32.050 33.310 1.00 0.00 N ATOM 0 H LYS A 6 26.380 29.556 26.142 1.00 0.00 H new ATOM 0 HA LYS A 6 27.528 32.155 26.975 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.964 31.041 28.538 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.023 29.645 28.541 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.783 30.886 29.636 1.00 0.00 H new ATOM 0 HG3 LYS A 6 27.917 32.397 29.445 1.00 0.00 H new ATOM 0 HD2 LYS A 6 26.008 31.161 30.816 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.306 30.092 31.309 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.638 32.053 32.063 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.347 33.126 31.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.357 32.803 33.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.932 32.164 33.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 27.184 31.123 33.728 1.00 0.00 H new ATOM 114 N THR A 7 29.817 31.392 26.777 1.00 0.00 N ATOM 115 CA THR A 7 31.189 30.993 26.524 1.00 0.00 C ATOM 116 C THR A 7 31.794 30.744 27.908 1.00 0.00 C ATOM 117 O THR A 7 31.290 31.060 28.985 1.00 0.00 O ATOM 118 CB THR A 7 31.910 32.171 25.878 1.00 0.00 C ATOM 119 OG1 THR A 7 32.151 33.302 26.679 1.00 0.00 O ATOM 120 CG2 THR A 7 31.154 32.619 24.621 1.00 0.00 C ATOM 0 H THR A 7 29.693 32.365 27.057 1.00 0.00 H new ATOM 0 HA THR A 7 31.265 30.119 25.877 1.00 0.00 H new ATOM 0 HB THR A 7 32.899 31.768 25.662 1.00 0.00 H new ATOM 0 HG1 THR A 7 33.111 33.500 26.685 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.674 33.461 24.164 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.107 31.793 23.911 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.143 32.922 24.893 1.00 0.00 H new ATOM 128 N LEU A 8 32.997 30.177 27.835 1.00 0.00 N ATOM 129 CA LEU A 8 33.884 29.902 28.947 1.00 0.00 C ATOM 130 C LEU A 8 34.182 31.190 29.704 1.00 0.00 C ATOM 131 O LEU A 8 34.365 31.141 30.916 1.00 0.00 O ATOM 132 CB LEU A 8 35.214 29.311 28.474 1.00 0.00 C ATOM 133 CG LEU A 8 35.070 27.938 27.821 1.00 0.00 C ATOM 134 CD1 LEU A 8 36.224 27.746 26.832 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.953 26.812 28.849 1.00 0.00 C ATOM 0 H LEU A 8 33.395 29.883 26.943 1.00 0.00 H new ATOM 0 HA LEU A 8 33.381 29.181 29.591 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.675 29.997 27.763 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.891 29.231 29.325 1.00 0.00 H new ATOM 0 HG LEU A 8 34.132 27.893 27.268 1.00 0.00 H new ATOM 0 HD11 LEU A 8 36.137 26.769 26.356 1.00 0.00 H new ATOM 0 HD12 LEU A 8 36.184 28.525 26.071 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.173 27.807 27.364 1.00 0.00 H new ATOM 0 HD21 LEU A 8 34.853 25.857 28.333 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.846 26.795 29.473 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.076 26.980 29.475 1.00 0.00 H new ATOM 147 N THR A 9 34.246 32.388 29.117 1.00 0.00 N ATOM 148 CA THR A 9 34.559 33.655 29.746 1.00 0.00 C ATOM 149 C THR A 9 33.296 34.287 30.323 1.00 0.00 C ATOM 150 O THR A 9 33.478 35.131 31.200 1.00 0.00 O ATOM 151 CB THR A 9 35.094 34.632 28.706 1.00 0.00 C ATOM 152 OG1 THR A 9 34.257 34.718 27.570 1.00 0.00 O ATOM 153 CG2 THR A 9 36.463 34.281 28.115 1.00 0.00 C ATOM 0 H THR A 9 34.066 32.496 28.119 1.00 0.00 H new ATOM 0 HA THR A 9 35.293 33.463 30.529 1.00 0.00 H new ATOM 0 HB THR A 9 35.150 35.555 29.284 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.638 35.356 26.931 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.750 35.039 27.387 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.205 34.244 28.913 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.409 33.309 27.625 1.00 0.00 H new ATOM 161 N GLY A 10 32.110 33.759 30.040 1.00 0.00 N ATOM 162 CA GLY A 10 30.746 34.006 30.469 1.00 0.00 C ATOM 163 C GLY A 10 29.895 34.803 29.475 1.00 0.00 C ATOM 164 O GLY A 10 28.821 35.229 29.900 1.00 0.00 O ATOM 0 H GLY A 10 32.094 32.993 29.366 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.260 33.049 30.656 1.00 0.00 H new ATOM 0 HA3 GLY A 10 30.770 34.542 31.418 1.00 0.00 H new ATOM 168 N LYS A 11 30.380 34.991 28.250 1.00 0.00 N ATOM 169 CA LYS A 11 29.898 35.991 27.326 1.00 0.00 C ATOM 170 C LYS A 11 28.661 35.352 26.673 1.00 0.00 C ATOM 171 O LYS A 11 28.675 34.202 26.251 1.00 0.00 O ATOM 172 CB LYS A 11 30.892 36.243 26.198 1.00 0.00 C ATOM 173 CG LYS A 11 30.569 37.323 25.154 1.00 0.00 C ATOM 174 CD LYS A 11 31.731 37.714 24.245 1.00 0.00 C ATOM 175 CE LYS A 11 31.264 38.069 22.827 1.00 0.00 C ATOM 176 NZ LYS A 11 32.404 38.307 21.930 1.00 0.00 N ATOM 0 H LYS A 11 31.142 34.430 27.870 1.00 0.00 H new ATOM 0 HA LYS A 11 29.717 36.930 27.849 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.849 36.499 26.653 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.033 35.302 25.666 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.745 36.971 24.533 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.218 38.215 25.673 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.257 38.566 24.676 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.444 36.891 24.195 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.651 37.260 22.431 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.635 38.958 22.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.269 39.208 21.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.281 38.349 22.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.470 37.532 21.239 1.00 0.00 H new ATOM 190 N THR A 12 27.556 36.092 26.676 1.00 0.00 N ATOM 191 CA THR A 12 26.277 35.643 26.166 1.00 0.00 C ATOM 192 C THR A 12 26.068 36.125 24.723 1.00 0.00 C ATOM 193 O THR A 12 26.307 37.279 24.386 1.00 0.00 O ATOM 194 CB THR A 12 25.261 36.365 27.048 1.00 0.00 C ATOM 195 OG1 THR A 12 25.587 36.045 28.385 1.00 0.00 O ATOM 196 CG2 THR A 12 23.847 35.790 26.986 1.00 0.00 C ATOM 0 H THR A 12 27.531 37.043 27.044 1.00 0.00 H new ATOM 0 HA THR A 12 26.196 34.556 26.176 1.00 0.00 H new ATOM 0 HB THR A 12 25.290 37.407 26.730 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.958 36.491 28.991 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.192 36.363 27.642 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.476 35.847 25.963 1.00 0.00 H new ATOM 0 HG23 THR A 12 23.863 34.749 27.308 1.00 0.00 H new ATOM 204 N ILE A 13 25.775 35.221 23.800 1.00 0.00 N ATOM 205 CA ILE A 13 25.394 35.554 22.437 1.00 0.00 C ATOM 206 C ILE A 13 23.991 34.977 22.222 1.00 0.00 C ATOM 207 O ILE A 13 23.523 34.047 22.881 1.00 0.00 O ATOM 208 CB ILE A 13 26.435 35.011 21.456 1.00 0.00 C ATOM 209 CG1 ILE A 13 27.794 35.644 21.770 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.020 35.208 19.993 1.00 0.00 C ATOM 211 CD1 ILE A 13 28.683 34.595 22.431 1.00 0.00 C ATOM 0 H ILE A 13 25.796 34.217 23.981 1.00 0.00 H new ATOM 0 HA ILE A 13 25.364 36.630 22.262 1.00 0.00 H new ATOM 0 HB ILE A 13 26.512 33.931 21.586 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.260 36.012 20.856 1.00 0.00 H new ATOM 0 HG13 ILE A 13 27.667 36.502 22.430 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.793 34.806 19.338 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.080 34.687 19.808 1.00 0.00 H new ATOM 0 HG23 ILE A 13 25.891 36.271 19.791 1.00 0.00 H new ATOM 0 HD11 ILE A 13 29.654 35.033 22.660 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.215 34.250 23.353 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.816 33.752 21.753 1.00 0.00 H new ATOM 223 N THR A 14 23.284 35.661 21.332 1.00 0.00 N ATOM 224 CA THR A 14 21.926 35.409 20.884 1.00 0.00 C ATOM 225 C THR A 14 22.008 35.117 19.388 1.00 0.00 C ATOM 226 O THR A 14 21.954 35.998 18.530 1.00 0.00 O ATOM 227 CB THR A 14 21.181 36.659 21.321 1.00 0.00 C ATOM 228 OG1 THR A 14 21.529 37.082 22.618 1.00 0.00 O ATOM 229 CG2 THR A 14 19.681 36.532 21.045 1.00 0.00 C ATOM 0 H THR A 14 23.683 36.476 20.867 1.00 0.00 H new ATOM 0 HA THR A 14 21.394 34.550 21.294 1.00 0.00 H new ATOM 0 HB THR A 14 21.514 37.490 20.699 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.022 37.889 22.846 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.173 37.441 21.368 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.519 36.385 19.977 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.281 35.679 21.593 1.00 0.00 H new ATOM 237 N LEU A 15 22.150 33.804 19.233 1.00 0.00 N ATOM 238 CA LEU A 15 22.216 33.252 17.900 1.00 0.00 C ATOM 239 C LEU A 15 20.823 33.040 17.295 1.00 0.00 C ATOM 240 O LEU A 15 19.923 32.772 18.080 1.00 0.00 O ATOM 241 CB LEU A 15 22.879 31.895 18.111 1.00 0.00 C ATOM 242 CG LEU A 15 23.536 31.336 16.846 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.780 32.065 16.346 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.844 29.846 17.028 1.00 0.00 C ATOM 0 H LEU A 15 22.219 33.127 19.993 1.00 0.00 H new ATOM 0 HA LEU A 15 22.748 33.914 17.217 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.632 31.985 18.893 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.132 31.186 18.468 1.00 0.00 H new ATOM 0 HG LEU A 15 22.793 31.500 16.065 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.152 31.575 15.446 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.528 33.100 16.118 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.550 32.041 17.117 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.311 29.458 16.123 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.522 29.715 17.871 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.918 29.304 17.220 1.00 0.00 H new ATOM 256 N GLU A 16 20.633 33.118 15.977 1.00 0.00 N ATOM 257 CA GLU A 16 19.379 32.944 15.278 1.00 0.00 C ATOM 258 C GLU A 16 19.436 31.615 14.522 1.00 0.00 C ATOM 259 O GLU A 16 20.222 31.441 13.599 1.00 0.00 O ATOM 260 CB GLU A 16 19.225 34.181 14.384 1.00 0.00 C ATOM 261 CG GLU A 16 17.778 34.285 13.910 1.00 0.00 C ATOM 262 CD GLU A 16 17.737 34.611 12.423 1.00 0.00 C ATOM 263 OE1 GLU A 16 18.578 35.368 11.905 1.00 0.00 O ATOM 264 OE2 GLU A 16 16.730 34.088 11.912 1.00 0.00 O ATOM 0 H GLU A 16 21.404 33.317 15.339 1.00 0.00 H new ATOM 0 HA GLU A 16 18.504 32.881 15.924 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.504 35.079 14.935 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.896 34.111 13.528 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.257 33.347 14.099 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.257 35.058 14.474 1.00 0.00 H new ATOM 271 N VAL A 17 18.707 30.600 14.964 1.00 0.00 N ATOM 272 CA VAL A 17 18.412 29.265 14.458 1.00 0.00 C ATOM 273 C VAL A 17 16.936 28.940 14.207 1.00 0.00 C ATOM 274 O VAL A 17 16.113 29.784 14.543 1.00 0.00 O ATOM 275 CB VAL A 17 18.921 28.289 15.521 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.436 28.459 15.653 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.338 28.401 16.926 1.00 0.00 C ATOM 0 H VAL A 17 18.220 30.723 15.852 1.00 0.00 H new ATOM 0 HA VAL A 17 18.889 29.192 13.481 1.00 0.00 H new ATOM 0 HB VAL A 17 18.596 27.317 15.151 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.815 27.770 16.408 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.911 28.246 14.695 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.663 29.483 15.950 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.792 27.647 17.569 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.544 29.393 17.328 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.260 28.243 16.886 1.00 0.00 H new ATOM 287 N GLU A 18 16.576 27.718 13.813 1.00 0.00 N ATOM 288 CA GLU A 18 15.199 27.273 13.697 1.00 0.00 C ATOM 289 C GLU A 18 15.304 25.757 13.934 1.00 0.00 C ATOM 290 O GLU A 18 16.348 25.201 13.597 1.00 0.00 O ATOM 291 CB GLU A 18 14.604 27.579 12.325 1.00 0.00 C ATOM 292 CG GLU A 18 13.827 28.867 12.031 1.00 0.00 C ATOM 293 CD GLU A 18 12.648 29.162 12.944 1.00 0.00 C ATOM 294 OE1 GLU A 18 11.656 28.434 12.771 1.00 0.00 O ATOM 295 OE2 GLU A 18 12.747 30.121 13.740 1.00 0.00 O ATOM 0 H GLU A 18 17.254 26.999 13.561 1.00 0.00 H new ATOM 0 HA GLU A 18 14.537 27.779 14.399 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.429 27.543 11.613 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.938 26.751 12.083 1.00 0.00 H new ATOM 0 HG2 GLU A 18 14.521 29.706 12.085 1.00 0.00 H new ATOM 0 HG3 GLU A 18 13.463 28.821 11.005 1.00 0.00 H new ATOM 302 N PRO A 19 14.264 25.018 14.299 1.00 0.00 N ATOM 303 CA PRO A 19 14.203 23.585 14.453 1.00 0.00 C ATOM 304 C PRO A 19 14.864 22.641 13.450 1.00 0.00 C ATOM 305 O PRO A 19 15.120 21.488 13.772 1.00 0.00 O ATOM 306 CB PRO A 19 12.728 23.233 14.657 1.00 0.00 C ATOM 307 CG PRO A 19 12.140 24.436 15.387 1.00 0.00 C ATOM 308 CD PRO A 19 12.990 25.545 14.756 1.00 0.00 C ATOM 0 HA PRO A 19 14.861 23.389 15.300 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.226 23.064 13.704 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.616 22.321 15.243 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.074 24.563 15.196 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.265 24.374 16.468 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.453 25.989 13.918 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.159 26.339 15.483 1.00 0.00 H new ATOM 316 N SER A 20 15.033 23.150 12.230 1.00 0.00 N ATOM 317 CA SER A 20 15.662 22.573 11.066 1.00 0.00 C ATOM 318 C SER A 20 17.198 22.610 11.067 1.00 0.00 C ATOM 319 O SER A 20 17.843 22.064 10.175 1.00 0.00 O ATOM 320 CB SER A 20 15.132 23.308 9.839 1.00 0.00 C ATOM 321 OG SER A 20 15.594 24.626 9.632 1.00 0.00 O ATOM 0 H SER A 20 14.688 24.087 12.021 1.00 0.00 H new ATOM 0 HA SER A 20 15.409 21.513 11.063 1.00 0.00 H new ATOM 0 HB2 SER A 20 15.382 22.719 8.957 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.044 23.337 9.905 1.00 0.00 H new ATOM 0 HG SER A 20 15.188 24.991 8.818 1.00 0.00 H new ATOM 327 N ASP A 21 17.830 23.114 12.114 1.00 0.00 N ATOM 328 CA ASP A 21 19.272 23.192 12.230 1.00 0.00 C ATOM 329 C ASP A 21 19.956 22.089 13.044 1.00 0.00 C ATOM 330 O ASP A 21 19.538 21.892 14.189 1.00 0.00 O ATOM 331 CB ASP A 21 19.527 24.551 12.887 1.00 0.00 C ATOM 332 CG ASP A 21 19.458 25.806 12.032 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.221 25.817 11.034 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.828 26.788 12.477 1.00 0.00 O ATOM 0 H ASP A 21 17.340 23.489 12.926 1.00 0.00 H new ATOM 0 HA ASP A 21 19.703 23.064 11.237 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.808 24.665 13.698 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.517 24.516 13.342 1.00 0.00 H new ATOM 339 N THR A 22 20.983 21.486 12.471 1.00 0.00 N ATOM 340 CA THR A 22 21.907 20.527 13.039 1.00 0.00 C ATOM 341 C THR A 22 22.950 21.190 13.942 1.00 0.00 C ATOM 342 O THR A 22 22.927 22.422 13.911 1.00 0.00 O ATOM 343 CB THR A 22 22.469 19.626 11.947 1.00 0.00 C ATOM 344 OG1 THR A 22 23.210 20.421 11.046 1.00 0.00 O ATOM 345 CG2 THR A 22 21.294 18.963 11.219 1.00 0.00 C ATOM 0 H THR A 22 21.211 21.678 11.496 1.00 0.00 H new ATOM 0 HA THR A 22 21.368 19.867 13.719 1.00 0.00 H new ATOM 0 HB THR A 22 23.118 18.858 12.368 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.580 19.854 10.337 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.674 18.312 10.432 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.713 18.373 11.928 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.658 19.731 10.779 1.00 0.00 H new ATOM 353 N ILE A 23 23.885 20.502 14.591 1.00 0.00 N ATOM 354 CA ILE A 23 24.866 21.153 15.435 1.00 0.00 C ATOM 355 C ILE A 23 25.928 21.817 14.553 1.00 0.00 C ATOM 356 O ILE A 23 26.422 22.833 15.044 1.00 0.00 O ATOM 357 CB ILE A 23 25.639 20.231 16.377 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.864 18.962 16.715 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.104 20.978 17.623 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.466 18.928 17.341 1.00 0.00 C ATOM 0 H ILE A 23 23.979 19.487 14.544 1.00 0.00 H new ATOM 0 HA ILE A 23 24.282 21.846 16.041 1.00 0.00 H new ATOM 0 HB ILE A 23 26.532 19.902 15.846 1.00 0.00 H new ATOM 0 HG12 ILE A 23 24.789 18.400 15.784 1.00 0.00 H new ATOM 0 HG13 ILE A 23 25.506 18.388 17.384 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.651 20.295 18.274 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.756 21.802 17.331 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.238 21.371 18.156 1.00 0.00 H new ATOM 0 HD11 ILE A 23 23.152 17.893 17.474 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.489 19.428 18.309 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.761 19.439 16.685 1.00 0.00 H new ATOM 372 N GLU A 24 26.196 21.410 13.321 1.00 0.00 N ATOM 373 CA GLU A 24 27.131 21.880 12.306 1.00 0.00 C ATOM 374 C GLU A 24 26.535 23.194 11.794 1.00 0.00 C ATOM 375 O GLU A 24 27.212 24.199 11.521 1.00 0.00 O ATOM 376 CB GLU A 24 27.280 20.860 11.179 1.00 0.00 C ATOM 377 CG GLU A 24 28.394 21.043 10.140 1.00 0.00 C ATOM 378 CD GLU A 24 28.165 20.678 8.681 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.173 19.982 8.349 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.167 20.926 7.985 1.00 0.00 O ATOM 0 H GLU A 24 25.677 20.613 12.953 1.00 0.00 H new ATOM 0 HA GLU A 24 28.133 22.022 12.710 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.420 19.882 11.639 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.333 20.827 10.641 1.00 0.00 H new ATOM 0 HG2 GLU A 24 28.687 22.093 10.166 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.251 20.465 10.484 1.00 0.00 H new ATOM 387 N ASN A 25 25.221 23.237 11.597 1.00 0.00 N ATOM 388 CA ASN A 25 24.566 24.451 11.153 1.00 0.00 C ATOM 389 C ASN A 25 24.608 25.622 12.135 1.00 0.00 C ATOM 390 O ASN A 25 24.698 26.770 11.721 1.00 0.00 O ATOM 391 CB ASN A 25 23.140 24.087 10.713 1.00 0.00 C ATOM 392 CG ASN A 25 23.155 23.635 9.259 1.00 0.00 C ATOM 393 OD1 ASN A 25 23.335 24.447 8.349 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.012 22.340 9.028 1.00 0.00 N ATOM 0 H ASN A 25 24.595 22.444 11.739 1.00 0.00 H new ATOM 0 HA ASN A 25 25.137 24.843 10.311 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.744 23.294 11.347 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.481 24.948 10.830 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.049 21.985 8.072 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.865 21.696 9.806 1.00 0.00 H new ATOM 401 N VAL A 26 24.636 25.315 13.425 1.00 0.00 N ATOM 402 CA VAL A 26 24.721 26.260 14.519 1.00 0.00 C ATOM 403 C VAL A 26 26.208 26.544 14.795 1.00 0.00 C ATOM 404 O VAL A 26 26.346 27.748 14.989 1.00 0.00 O ATOM 405 CB VAL A 26 24.119 25.582 15.748 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.244 26.362 17.054 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.646 25.457 15.353 1.00 0.00 C ATOM 0 H VAL A 26 24.598 24.348 13.748 1.00 0.00 H new ATOM 0 HA VAL A 26 24.199 27.188 14.286 1.00 0.00 H new ATOM 0 HB VAL A 26 24.639 24.650 15.969 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.785 25.793 17.863 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.297 26.528 17.279 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.739 27.323 16.954 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.092 24.979 16.161 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.234 26.449 15.168 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.562 24.854 14.449 1.00 0.00 H new ATOM 417 N LYS A 27 27.208 25.680 14.710 1.00 0.00 N ATOM 418 CA LYS A 27 28.611 26.043 14.771 1.00 0.00 C ATOM 419 C LYS A 27 29.094 26.914 13.601 1.00 0.00 C ATOM 420 O LYS A 27 30.054 27.659 13.813 1.00 0.00 O ATOM 421 CB LYS A 27 29.471 24.786 14.686 1.00 0.00 C ATOM 422 CG LYS A 27 29.434 23.779 15.840 1.00 0.00 C ATOM 423 CD LYS A 27 30.198 22.524 15.432 1.00 0.00 C ATOM 424 CE LYS A 27 30.031 21.253 16.261 1.00 0.00 C ATOM 425 NZ LYS A 27 30.583 20.040 15.656 1.00 0.00 N ATOM 0 H LYS A 27 27.059 24.678 14.593 1.00 0.00 H new ATOM 0 HA LYS A 27 28.708 26.595 15.706 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.188 24.255 13.777 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.506 25.104 14.560 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.878 24.216 16.734 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.402 23.528 16.087 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.917 22.287 14.406 1.00 0.00 H new ATOM 0 HD3 LYS A 27 31.259 22.773 15.422 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.506 21.405 17.230 1.00 0.00 H new ATOM 0 HE3 LYS A 27 28.969 21.096 16.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.223 19.205 16.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.298 19.990 14.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 31.621 20.062 15.719 1.00 0.00 H new ATOM 439 N ALA A 28 28.491 26.777 12.424 1.00 0.00 N ATOM 440 CA ALA A 28 28.637 27.676 11.301 1.00 0.00 C ATOM 441 C ALA A 28 28.014 29.056 11.521 1.00 0.00 C ATOM 442 O ALA A 28 28.540 30.131 11.236 1.00 0.00 O ATOM 443 CB ALA A 28 28.072 26.959 10.079 1.00 0.00 C ATOM 0 H ALA A 28 27.861 26.000 12.226 1.00 0.00 H new ATOM 0 HA ALA A 28 29.693 27.904 11.158 1.00 0.00 H new ATOM 0 HB1 ALA A 28 28.162 27.604 9.205 1.00 0.00 H new ATOM 0 HB2 ALA A 28 28.628 26.037 9.909 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.022 26.723 10.249 1.00 0.00 H new ATOM 449 N LYS A 29 26.858 29.148 12.165 1.00 0.00 N ATOM 450 CA LYS A 29 26.214 30.424 12.417 1.00 0.00 C ATOM 451 C LYS A 29 26.990 31.166 13.507 1.00 0.00 C ATOM 452 O LYS A 29 27.079 32.385 13.394 1.00 0.00 O ATOM 453 CB LYS A 29 24.750 30.244 12.801 1.00 0.00 C ATOM 454 CG LYS A 29 23.808 29.838 11.657 1.00 0.00 C ATOM 455 CD LYS A 29 22.416 29.493 12.176 1.00 0.00 C ATOM 456 CE LYS A 29 21.333 29.141 11.154 1.00 0.00 C ATOM 457 NZ LYS A 29 21.497 27.931 10.327 1.00 0.00 N ATOM 0 H LYS A 29 26.345 28.343 12.525 1.00 0.00 H new ATOM 0 HA LYS A 29 26.225 31.017 11.502 1.00 0.00 H new ATOM 0 HB2 LYS A 29 24.689 29.488 13.584 1.00 0.00 H new ATOM 0 HB3 LYS A 29 24.388 31.178 13.231 1.00 0.00 H new ATOM 0 HG2 LYS A 29 23.737 30.652 10.936 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.224 28.980 11.129 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.515 28.651 12.861 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.059 30.340 12.762 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.390 29.046 11.693 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.230 29.990 10.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.516 28.197 9.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.389 27.458 10.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.702 27.283 10.499 1.00 0.00 H new ATOM 471 N ILE A 30 27.528 30.518 14.533 1.00 0.00 N ATOM 472 CA ILE A 30 28.583 30.971 15.424 1.00 0.00 C ATOM 473 C ILE A 30 29.830 31.500 14.712 1.00 0.00 C ATOM 474 O ILE A 30 30.165 32.672 14.869 1.00 0.00 O ATOM 475 CB ILE A 30 28.893 29.964 16.531 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.618 29.665 17.329 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.046 30.340 17.455 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.566 28.357 18.108 1.00 0.00 C ATOM 0 H ILE A 30 27.208 29.582 14.782 1.00 0.00 H new ATOM 0 HA ILE A 30 28.173 31.850 15.922 1.00 0.00 H new ATOM 0 HB ILE A 30 29.244 29.066 16.023 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.463 30.482 18.033 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.777 29.677 16.636 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.182 29.559 18.203 1.00 0.00 H new ATOM 0 HG22 ILE A 30 30.960 30.446 16.871 1.00 0.00 H new ATOM 0 HG23 ILE A 30 29.821 31.284 17.952 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.609 28.278 18.623 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.678 27.519 17.420 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.374 28.337 18.839 1.00 0.00 H new ATOM 490 N GLN A 31 30.509 30.601 14.009 1.00 0.00 N ATOM 491 CA GLN A 31 31.585 30.852 13.074 1.00 0.00 C ATOM 492 C GLN A 31 31.378 32.142 12.279 1.00 0.00 C ATOM 493 O GLN A 31 32.312 32.941 12.222 1.00 0.00 O ATOM 494 CB GLN A 31 31.826 29.626 12.197 1.00 0.00 C ATOM 495 CG GLN A 31 33.005 29.505 11.227 1.00 0.00 C ATOM 496 CD GLN A 31 33.169 28.122 10.621 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.953 27.989 9.682 1.00 0.00 O ATOM 498 NE2 GLN A 31 32.319 27.204 11.071 1.00 0.00 N ATOM 0 H GLN A 31 30.302 29.605 14.088 1.00 0.00 H new ATOM 0 HA GLN A 31 32.499 31.021 13.643 1.00 0.00 H new ATOM 0 HB2 GLN A 31 31.894 28.773 12.872 1.00 0.00 H new ATOM 0 HB3 GLN A 31 30.923 29.491 11.602 1.00 0.00 H new ATOM 0 HG2 GLN A 31 32.876 30.229 10.423 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.922 29.771 11.752 1.00 0.00 H new ATOM 0 HE21 GLN A 31 31.709 27.417 11.860 1.00 0.00 H new ATOM 0 HE22 GLN A 31 32.277 26.287 10.627 1.00 0.00 H new ATOM 507 N ASP A 32 30.201 32.466 11.764 1.00 0.00 N ATOM 508 CA ASP A 32 29.816 33.621 10.979 1.00 0.00 C ATOM 509 C ASP A 32 29.978 35.012 11.607 1.00 0.00 C ATOM 510 O ASP A 32 30.553 35.938 11.032 1.00 0.00 O ATOM 511 CB ASP A 32 28.369 33.487 10.493 1.00 0.00 C ATOM 512 CG ASP A 32 27.900 34.400 9.371 1.00 0.00 C ATOM 513 OD1 ASP A 32 28.731 34.820 8.542 1.00 0.00 O ATOM 514 OD2 ASP A 32 26.681 34.628 9.185 1.00 0.00 O ATOM 0 H ASP A 32 29.401 31.849 11.906 1.00 0.00 H new ATOM 0 HA ASP A 32 30.547 33.594 10.171 1.00 0.00 H new ATOM 0 HB2 ASP A 32 28.221 32.457 10.168 1.00 0.00 H new ATOM 0 HB3 ASP A 32 27.714 33.648 11.349 1.00 0.00 H new ATOM 519 N LYS A 33 29.595 35.032 12.874 1.00 0.00 N ATOM 520 CA LYS A 33 29.605 36.246 13.668 1.00 0.00 C ATOM 521 C LYS A 33 30.777 36.363 14.647 1.00 0.00 C ATOM 522 O LYS A 33 31.403 37.402 14.822 1.00 0.00 O ATOM 523 CB LYS A 33 28.363 36.361 14.561 1.00 0.00 C ATOM 524 CG LYS A 33 27.109 36.905 13.889 1.00 0.00 C ATOM 525 CD LYS A 33 26.760 36.106 12.631 1.00 0.00 C ATOM 526 CE LYS A 33 25.400 36.654 12.178 1.00 0.00 C ATOM 527 NZ LYS A 33 24.924 35.906 11.007 1.00 0.00 N ATOM 0 H LYS A 33 29.269 34.207 13.378 1.00 0.00 H new ATOM 0 HA LYS A 33 29.663 37.022 12.905 1.00 0.00 H new ATOM 0 HB2 LYS A 33 28.137 35.374 14.964 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.606 37.003 15.407 1.00 0.00 H new ATOM 0 HG2 LYS A 33 26.274 36.868 14.589 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.260 37.952 13.627 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.516 36.238 11.857 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.704 35.038 12.844 1.00 0.00 H new ATOM 0 HE2 LYS A 33 24.677 36.574 12.990 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.488 37.712 11.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.380 36.540 10.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.738 35.525 10.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.316 35.122 11.319 1.00 0.00 H new ATOM 541 N GLU A 34 31.260 35.209 15.107 1.00 0.00 N ATOM 542 CA GLU A 34 32.208 35.129 16.201 1.00 0.00 C ATOM 543 C GLU A 34 33.576 34.504 15.930 1.00 0.00 C ATOM 544 O GLU A 34 34.539 34.605 16.688 1.00 0.00 O ATOM 545 CB GLU A 34 31.492 34.538 17.414 1.00 0.00 C ATOM 546 CG GLU A 34 30.665 35.445 18.316 1.00 0.00 C ATOM 547 CD GLU A 34 31.353 36.567 19.077 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.479 36.333 19.575 1.00 0.00 O ATOM 549 OE2 GLU A 34 30.761 37.641 19.310 1.00 0.00 O ATOM 0 H GLU A 34 30.998 34.301 14.723 1.00 0.00 H new ATOM 0 HA GLU A 34 32.523 36.155 16.392 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.832 33.750 17.051 1.00 0.00 H new ATOM 0 HB3 GLU A 34 32.247 34.059 18.037 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.886 35.896 17.701 1.00 0.00 H new ATOM 0 HG3 GLU A 34 30.166 34.811 19.048 1.00 0.00 H new ATOM 556 N GLY A 35 33.690 33.839 14.777 1.00 0.00 N ATOM 557 CA GLY A 35 34.978 33.528 14.203 1.00 0.00 C ATOM 558 C GLY A 35 35.603 32.156 14.496 1.00 0.00 C ATOM 559 O GLY A 35 36.605 31.905 13.831 1.00 0.00 O ATOM 0 H GLY A 35 32.895 33.509 14.230 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.891 33.627 13.121 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.682 34.290 14.537 1.00 0.00 H new ATOM 563 N ILE A 36 35.019 31.464 15.470 1.00 0.00 N ATOM 564 CA ILE A 36 35.610 30.337 16.167 1.00 0.00 C ATOM 565 C ILE A 36 35.573 29.190 15.163 1.00 0.00 C ATOM 566 O ILE A 36 34.465 28.983 14.655 1.00 0.00 O ATOM 567 CB ILE A 36 34.994 29.984 17.521 1.00 0.00 C ATOM 568 CG1 ILE A 36 34.435 31.194 18.264 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.936 29.134 18.372 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.900 30.784 19.637 1.00 0.00 C ATOM 0 H ILE A 36 34.082 31.686 15.806 1.00 0.00 H new ATOM 0 HA ILE A 36 36.625 30.588 16.475 1.00 0.00 H new ATOM 0 HB ILE A 36 34.124 29.362 17.310 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.214 31.947 18.382 1.00 0.00 H new ATOM 0 HG13 ILE A 36 33.637 31.650 17.678 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.459 28.906 19.325 1.00 0.00 H new ATOM 0 HG22 ILE A 36 36.162 28.205 17.848 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.860 29.683 18.551 1.00 0.00 H new ATOM 0 HD11 ILE A 36 33.506 31.661 20.151 1.00 0.00 H new ATOM 0 HD12 ILE A 36 33.105 30.048 19.513 1.00 0.00 H new ATOM 0 HD13 ILE A 36 34.707 30.350 20.227 1.00 0.00 H new ATOM 582 N PRO A 37 36.690 28.553 14.813 1.00 0.00 N ATOM 583 CA PRO A 37 36.711 27.337 14.029 1.00 0.00 C ATOM 584 C PRO A 37 35.808 26.227 14.584 1.00 0.00 C ATOM 585 O PRO A 37 35.722 26.034 15.793 1.00 0.00 O ATOM 586 CB PRO A 37 38.152 26.837 14.003 1.00 0.00 C ATOM 587 CG PRO A 37 38.958 28.095 14.332 1.00 0.00 C ATOM 588 CD PRO A 37 38.025 29.060 15.075 1.00 0.00 C ATOM 0 HA PRO A 37 36.328 27.573 13.036 1.00 0.00 H new ATOM 0 HB2 PRO A 37 38.319 26.048 14.736 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.420 26.429 13.028 1.00 0.00 H new ATOM 0 HG2 PRO A 37 39.822 27.846 14.948 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.339 28.556 13.420 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.240 29.076 16.143 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.140 30.081 14.711 1.00 0.00 H new ATOM 596 N PRO A 38 35.240 25.462 13.667 1.00 0.00 N ATOM 597 CA PRO A 38 34.304 24.426 14.038 1.00 0.00 C ATOM 598 C PRO A 38 34.869 23.208 14.762 1.00 0.00 C ATOM 599 O PRO A 38 34.244 22.615 15.627 1.00 0.00 O ATOM 600 CB PRO A 38 33.726 23.978 12.689 1.00 0.00 C ATOM 601 CG PRO A 38 34.830 24.190 11.651 1.00 0.00 C ATOM 602 CD PRO A 38 35.553 25.394 12.251 1.00 0.00 C ATOM 0 HA PRO A 38 33.601 24.835 14.763 1.00 0.00 H new ATOM 0 HB2 PRO A 38 33.423 22.931 12.725 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.839 24.558 12.435 1.00 0.00 H new ATOM 0 HG2 PRO A 38 35.481 23.321 11.556 1.00 0.00 H new ATOM 0 HG3 PRO A 38 34.431 24.399 10.659 1.00 0.00 H new ATOM 0 HD2 PRO A 38 36.629 25.301 12.105 1.00 0.00 H new ATOM 0 HD3 PRO A 38 35.242 26.311 11.750 1.00 0.00 H new ATOM 610 N ASP A 39 36.128 22.876 14.461 1.00 0.00 N ATOM 611 CA ASP A 39 36.601 21.529 14.711 1.00 0.00 C ATOM 612 C ASP A 39 36.960 21.390 16.198 1.00 0.00 C ATOM 613 O ASP A 39 36.767 20.375 16.862 1.00 0.00 O ATOM 614 CB ASP A 39 37.858 21.417 13.852 1.00 0.00 C ATOM 615 CG ASP A 39 38.323 19.971 13.942 1.00 0.00 C ATOM 616 OD1 ASP A 39 37.725 19.098 13.284 1.00 0.00 O ATOM 617 OD2 ASP A 39 39.308 19.662 14.649 1.00 0.00 O ATOM 0 H ASP A 39 36.816 23.510 14.054 1.00 0.00 H new ATOM 0 HA ASP A 39 35.866 20.759 14.477 1.00 0.00 H new ATOM 0 HB2 ASP A 39 37.646 21.692 12.819 1.00 0.00 H new ATOM 0 HB3 ASP A 39 38.633 22.095 14.210 1.00 0.00 H new ATOM 622 N GLN A 40 37.482 22.496 16.726 1.00 0.00 N ATOM 623 CA GLN A 40 37.766 22.600 18.141 1.00 0.00 C ATOM 624 C GLN A 40 36.576 22.925 19.055 1.00 0.00 C ATOM 625 O GLN A 40 36.673 22.728 20.260 1.00 0.00 O ATOM 626 CB GLN A 40 38.804 23.679 18.404 1.00 0.00 C ATOM 627 CG GLN A 40 38.516 25.064 17.801 1.00 0.00 C ATOM 628 CD GLN A 40 39.623 26.079 18.037 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.542 27.229 17.615 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.679 25.743 18.764 1.00 0.00 N ATOM 0 H GLN A 40 37.714 23.330 16.187 1.00 0.00 H new ATOM 0 HA GLN A 40 38.107 21.595 18.389 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.914 23.792 19.483 1.00 0.00 H new ATOM 0 HB3 GLN A 40 39.763 23.332 18.020 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.357 24.957 16.728 1.00 0.00 H new ATOM 0 HG3 GLN A 40 37.588 25.448 18.224 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.768 24.793 19.125 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.403 26.434 18.962 1.00 0.00 H new ATOM 639 N GLN A 41 35.501 23.467 18.478 1.00 0.00 N ATOM 640 CA GLN A 41 34.359 23.971 19.206 1.00 0.00 C ATOM 641 C GLN A 41 33.416 22.847 19.615 1.00 0.00 C ATOM 642 O GLN A 41 33.204 21.942 18.800 1.00 0.00 O ATOM 643 CB GLN A 41 33.699 24.905 18.181 1.00 0.00 C ATOM 644 CG GLN A 41 32.544 25.791 18.645 1.00 0.00 C ATOM 645 CD GLN A 41 31.953 26.676 17.555 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.768 27.014 17.609 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.717 26.919 16.501 1.00 0.00 N ATOM 0 H GLN A 41 35.409 23.565 17.467 1.00 0.00 H new ATOM 0 HA GLN A 41 34.626 24.466 20.140 1.00 0.00 H new ATOM 0 HB2 GLN A 41 34.475 25.555 17.776 1.00 0.00 H new ATOM 0 HB3 GLN A 41 33.336 24.291 17.357 1.00 0.00 H new ATOM 0 HG2 GLN A 41 31.755 25.157 19.049 1.00 0.00 H new ATOM 0 HG3 GLN A 41 32.893 26.424 19.461 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.693 26.622 16.499 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.330 27.404 15.691 1.00 0.00 H new ATOM 656 N ARG A 42 32.743 22.861 20.753 1.00 0.00 N ATOM 657 CA ARG A 42 31.707 21.934 21.180 1.00 0.00 C ATOM 658 C ARG A 42 30.591 22.654 21.943 1.00 0.00 C ATOM 659 O ARG A 42 30.955 23.672 22.523 1.00 0.00 O ATOM 660 CB ARG A 42 32.485 20.858 21.940 1.00 0.00 C ATOM 661 CG ARG A 42 33.159 21.191 23.273 1.00 0.00 C ATOM 662 CD ARG A 42 33.585 19.846 23.859 1.00 0.00 C ATOM 663 NE ARG A 42 34.184 20.062 25.177 1.00 0.00 N ATOM 664 CZ ARG A 42 34.756 19.073 25.888 1.00 0.00 C ATOM 665 NH1 ARG A 42 35.343 18.026 25.308 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.893 19.237 27.210 1.00 0.00 N ATOM 0 H ARG A 42 32.920 23.577 21.458 1.00 0.00 H new ATOM 0 HA ARG A 42 31.141 21.469 20.373 1.00 0.00 H new ATOM 0 HB2 ARG A 42 31.798 20.031 22.123 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.260 20.486 21.270 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.018 21.845 23.126 1.00 0.00 H new ATOM 0 HG3 ARG A 42 32.473 21.711 23.941 1.00 0.00 H new ATOM 0 HD2 ARG A 42 32.724 19.183 23.942 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.300 19.358 23.197 1.00 0.00 H new ATOM 0 HE ARG A 42 34.167 21.002 25.573 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.369 17.955 24.291 1.00 0.00 H new ATOM 0 HH12 ARG A 42 35.766 17.296 25.881 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.567 20.096 27.654 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.323 18.503 27.773 1.00 0.00 H new ATOM 680 N LEU A 43 29.372 22.135 21.881 1.00 0.00 N ATOM 681 CA LEU A 43 28.294 22.755 22.613 1.00 0.00 C ATOM 682 C LEU A 43 27.813 21.766 23.680 1.00 0.00 C ATOM 683 O LEU A 43 27.513 20.622 23.350 1.00 0.00 O ATOM 684 CB LEU A 43 27.179 23.117 21.626 1.00 0.00 C ATOM 685 CG LEU A 43 27.546 24.260 20.688 1.00 0.00 C ATOM 686 CD1 LEU A 43 28.058 23.786 19.330 1.00 0.00 C ATOM 687 CD2 LEU A 43 26.578 25.448 20.724 1.00 0.00 C ATOM 0 H LEU A 43 29.116 21.307 21.344 1.00 0.00 H new ATOM 0 HA LEU A 43 28.615 23.671 23.110 1.00 0.00 H new ATOM 0 HB2 LEU A 43 26.929 22.237 21.033 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.284 23.389 22.185 1.00 0.00 H new ATOM 0 HG LEU A 43 28.436 24.733 21.103 1.00 0.00 H new ATOM 0 HD11 LEU A 43 28.301 24.650 18.711 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.951 23.177 19.470 1.00 0.00 H new ATOM 0 HD13 LEU A 43 27.288 23.192 18.838 1.00 0.00 H new ATOM 0 HD21 LEU A 43 26.916 26.214 20.026 1.00 0.00 H new ATOM 0 HD22 LEU A 43 25.580 25.113 20.440 1.00 0.00 H new ATOM 0 HD23 LEU A 43 26.548 25.863 21.732 1.00 0.00 H new ATOM 699 N ILE A 44 27.880 22.180 24.944 1.00 0.00 N ATOM 700 CA ILE A 44 27.483 21.378 26.088 1.00 0.00 C ATOM 701 C ILE A 44 26.132 22.023 26.410 1.00 0.00 C ATOM 702 O ILE A 44 25.936 23.232 26.458 1.00 0.00 O ATOM 703 CB ILE A 44 28.497 21.551 27.221 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.980 21.491 26.847 1.00 0.00 C ATOM 705 CG2 ILE A 44 28.248 20.593 28.385 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.539 20.274 26.121 1.00 0.00 C ATOM 0 H ILE A 44 28.221 23.106 25.202 1.00 0.00 H new ATOM 0 HA ILE A 44 27.430 20.301 25.926 1.00 0.00 H new ATOM 0 HB ILE A 44 28.307 22.583 27.516 1.00 0.00 H new ATOM 0 HG12 ILE A 44 30.193 22.362 26.228 1.00 0.00 H new ATOM 0 HG13 ILE A 44 30.551 21.608 27.768 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.996 20.760 29.160 1.00 0.00 H new ATOM 0 HG22 ILE A 44 27.254 20.771 28.796 1.00 0.00 H new ATOM 0 HG23 ILE A 44 28.316 19.564 28.031 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.605 20.415 25.942 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.388 19.384 26.733 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.025 20.151 25.168 1.00 0.00 H new ATOM 718 N PHE A 45 25.149 21.205 26.796 1.00 0.00 N ATOM 719 CA PHE A 45 23.858 21.609 27.310 1.00 0.00 C ATOM 720 C PHE A 45 23.665 20.595 28.440 1.00 0.00 C ATOM 721 O PHE A 45 23.771 19.411 28.134 1.00 0.00 O ATOM 722 CB PHE A 45 22.832 21.499 26.181 1.00 0.00 C ATOM 723 CG PHE A 45 21.448 21.920 26.618 1.00 0.00 C ATOM 724 CD1 PHE A 45 21.130 23.152 27.184 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.396 21.016 26.394 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.853 23.519 27.608 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.088 21.383 26.731 1.00 0.00 C ATOM 728 CZ PHE A 45 18.817 22.604 27.369 1.00 0.00 C ATOM 0 H PHE A 45 25.248 20.191 26.752 1.00 0.00 H new ATOM 0 HA PHE A 45 23.762 22.634 27.669 1.00 0.00 H new ATOM 0 HB2 PHE A 45 23.150 22.119 25.343 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.800 20.470 25.822 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.926 23.872 27.303 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.595 20.045 25.965 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.670 24.464 28.098 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.273 20.715 26.496 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.809 22.839 27.676 1.00 0.00 H new ATOM 738 N ALA A 46 23.371 21.017 29.667 1.00 0.00 N ATOM 739 CA ALA A 46 23.042 20.247 30.856 1.00 0.00 C ATOM 740 C ALA A 46 24.204 19.297 31.134 1.00 0.00 C ATOM 741 O ALA A 46 24.046 18.125 31.484 1.00 0.00 O ATOM 742 CB ALA A 46 21.795 19.434 30.499 1.00 0.00 C ATOM 0 H ALA A 46 23.357 22.016 29.871 1.00 0.00 H new ATOM 0 HA ALA A 46 22.868 20.875 31.730 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.496 18.831 31.356 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.984 20.111 30.231 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.016 18.780 29.655 1.00 0.00 H new ATOM 748 N GLY A 47 25.453 19.744 31.091 1.00 0.00 N ATOM 749 CA GLY A 47 26.647 18.949 31.281 1.00 0.00 C ATOM 750 C GLY A 47 27.078 17.922 30.224 1.00 0.00 C ATOM 751 O GLY A 47 28.187 17.399 30.344 1.00 0.00 O ATOM 0 H GLY A 47 25.665 20.726 30.912 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.477 19.643 31.412 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.529 18.411 32.222 1.00 0.00 H new ATOM 755 N LYS A 48 26.224 17.592 29.263 1.00 0.00 N ATOM 756 CA LYS A 48 26.415 16.651 28.179 1.00 0.00 C ATOM 757 C LYS A 48 26.826 17.424 26.925 1.00 0.00 C ATOM 758 O LYS A 48 26.186 18.451 26.696 1.00 0.00 O ATOM 759 CB LYS A 48 25.171 15.766 28.138 1.00 0.00 C ATOM 760 CG LYS A 48 24.946 14.851 29.331 1.00 0.00 C ATOM 761 CD LYS A 48 23.484 14.422 29.482 1.00 0.00 C ATOM 762 CE LYS A 48 23.133 13.699 30.787 1.00 0.00 C ATOM 763 NZ LYS A 48 21.675 13.524 30.804 1.00 0.00 N ATOM 0 H LYS A 48 25.298 18.018 29.224 1.00 0.00 H new ATOM 0 HA LYS A 48 27.241 15.950 28.299 1.00 0.00 H new ATOM 0 HB2 LYS A 48 24.298 16.410 28.034 1.00 0.00 H new ATOM 0 HB3 LYS A 48 25.221 15.149 27.241 1.00 0.00 H new ATOM 0 HG2 LYS A 48 25.571 13.964 29.226 1.00 0.00 H new ATOM 0 HG3 LYS A 48 25.266 15.361 30.240 1.00 0.00 H new ATOM 0 HD2 LYS A 48 22.855 15.308 29.399 1.00 0.00 H new ATOM 0 HD3 LYS A 48 23.228 13.770 28.647 1.00 0.00 H new ATOM 0 HE2 LYS A 48 23.638 12.734 30.841 1.00 0.00 H new ATOM 0 HE3 LYS A 48 23.462 14.279 31.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 21.394 13.035 31.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 21.213 14.455 30.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.384 12.958 29.981 1.00 0.00 H new ATOM 777 N GLN A 49 27.794 16.947 26.157 1.00 0.00 N ATOM 778 CA GLN A 49 28.053 17.428 24.816 1.00 0.00 C ATOM 779 C GLN A 49 26.806 17.170 23.964 1.00 0.00 C ATOM 780 O GLN A 49 26.257 16.080 23.983 1.00 0.00 O ATOM 781 CB GLN A 49 29.283 16.744 24.219 1.00 0.00 C ATOM 782 CG GLN A 49 29.968 17.563 23.122 1.00 0.00 C ATOM 783 CD GLN A 49 31.358 17.128 22.669 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.960 17.760 21.800 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.920 16.224 23.470 1.00 0.00 N ATOM 0 H GLN A 49 28.428 16.205 26.455 1.00 0.00 H new ATOM 0 HA GLN A 49 28.265 18.497 24.839 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.001 16.547 25.015 1.00 0.00 H new ATOM 0 HB3 GLN A 49 28.988 15.778 23.809 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.316 17.563 22.248 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.037 18.594 23.468 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.355 15.740 24.168 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.915 16.016 23.385 1.00 0.00 H new ATOM 794 N LEU A 50 26.418 18.096 23.084 1.00 0.00 N ATOM 795 CA LEU A 50 25.495 18.022 21.969 1.00 0.00 C ATOM 796 C LEU A 50 26.315 17.408 20.831 1.00 0.00 C ATOM 797 O LEU A 50 27.273 18.007 20.334 1.00 0.00 O ATOM 798 CB LEU A 50 25.014 19.443 21.674 1.00 0.00 C ATOM 799 CG LEU A 50 24.230 20.191 22.748 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.891 21.579 22.200 1.00 0.00 C ATOM 801 CD2 LEU A 50 22.959 19.513 23.238 1.00 0.00 C ATOM 0 H LEU A 50 26.801 19.039 23.155 1.00 0.00 H new ATOM 0 HA LEU A 50 24.603 17.420 22.142 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.890 20.043 21.426 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.392 19.402 20.780 1.00 0.00 H new ATOM 0 HG LEU A 50 24.874 20.225 23.626 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.329 22.138 22.948 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.812 22.112 21.965 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.290 21.477 21.296 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.485 20.134 23.999 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.273 19.377 22.402 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.207 18.541 23.665 1.00 0.00 H new ATOM 813 N GLU A 51 25.948 16.169 20.527 1.00 0.00 N ATOM 814 CA GLU A 51 26.741 15.407 19.577 1.00 0.00 C ATOM 815 C GLU A 51 26.124 15.572 18.190 1.00 0.00 C ATOM 816 O GLU A 51 24.929 15.338 17.996 1.00 0.00 O ATOM 817 CB GLU A 51 26.757 13.910 19.878 1.00 0.00 C ATOM 818 CG GLU A 51 27.427 13.699 21.234 1.00 0.00 C ATOM 819 CD GLU A 51 27.709 12.251 21.650 1.00 0.00 C ATOM 820 OE1 GLU A 51 27.779 11.360 20.772 1.00 0.00 O ATOM 821 OE2 GLU A 51 27.989 12.082 22.854 1.00 0.00 O ATOM 0 H GLU A 51 25.135 15.686 20.910 1.00 0.00 H new ATOM 0 HA GLU A 51 27.761 15.785 19.639 1.00 0.00 H new ATOM 0 HB2 GLU A 51 25.741 13.515 19.891 1.00 0.00 H new ATOM 0 HB3 GLU A 51 27.298 13.372 19.100 1.00 0.00 H new ATOM 0 HG2 GLU A 51 28.372 14.242 21.234 1.00 0.00 H new ATOM 0 HG3 GLU A 51 26.798 14.155 21.998 1.00 0.00 H new ATOM 828 N ASP A 52 26.968 15.780 17.186 1.00 0.00 N ATOM 829 CA ASP A 52 26.782 15.921 15.752 1.00 0.00 C ATOM 830 C ASP A 52 25.898 14.868 15.077 1.00 0.00 C ATOM 831 O ASP A 52 25.871 13.715 15.509 1.00 0.00 O ATOM 832 CB ASP A 52 28.133 16.060 15.050 1.00 0.00 C ATOM 833 CG ASP A 52 28.671 17.476 15.209 1.00 0.00 C ATOM 834 OD1 ASP A 52 28.236 18.365 14.456 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.642 17.666 15.982 1.00 0.00 O ATOM 0 H ASP A 52 27.961 15.867 17.403 1.00 0.00 H new ATOM 0 HA ASP A 52 26.207 16.840 15.637 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.842 15.346 15.468 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.026 15.821 13.992 1.00 0.00 H new ATOM 840 N GLY A 53 25.087 15.297 14.115 1.00 0.00 N ATOM 841 CA GLY A 53 24.130 14.401 13.493 1.00 0.00 C ATOM 842 C GLY A 53 22.689 14.765 13.874 1.00 0.00 C ATOM 843 O GLY A 53 21.766 14.627 13.078 1.00 0.00 O ATOM 0 H GLY A 53 25.076 16.251 13.755 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.242 14.442 12.410 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.340 13.375 13.797 1.00 0.00 H new ATOM 847 N ARG A 54 22.399 15.315 15.046 1.00 0.00 N ATOM 848 CA ARG A 54 21.121 15.614 15.657 1.00 0.00 C ATOM 849 C ARG A 54 20.857 17.104 15.465 1.00 0.00 C ATOM 850 O ARG A 54 21.742 17.855 15.031 1.00 0.00 O ATOM 851 CB ARG A 54 21.168 15.134 17.103 1.00 0.00 C ATOM 852 CG ARG A 54 21.012 13.650 17.454 1.00 0.00 C ATOM 853 CD ARG A 54 21.195 13.231 18.913 1.00 0.00 C ATOM 854 NE ARG A 54 22.430 12.532 19.273 1.00 0.00 N ATOM 855 CZ ARG A 54 22.706 11.986 20.462 1.00 0.00 C ATOM 856 NH1 ARG A 54 21.739 11.943 21.395 1.00 0.00 N ATOM 857 NH2 ARG A 54 23.924 11.529 20.781 1.00 0.00 N ATOM 0 H ARG A 54 23.158 15.596 15.666 1.00 0.00 H new ATOM 0 HA ARG A 54 20.278 15.095 15.201 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.123 15.460 17.515 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.388 15.672 17.642 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.017 13.336 17.139 1.00 0.00 H new ATOM 0 HG3 ARG A 54 21.728 13.089 16.854 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.125 14.127 19.530 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.356 12.590 19.185 1.00 0.00 H new ATOM 0 HE ARG A 54 23.146 12.454 18.550 1.00 0.00 H new ATOM 0 HH11 ARG A 54 20.815 12.323 21.190 1.00 0.00 H new ATOM 0 HH12 ARG A 54 21.929 11.531 22.308 1.00 0.00 H new ATOM 0 HH21 ARG A 54 24.685 11.590 20.105 1.00 0.00 H new ATOM 0 HH22 ARG A 54 24.090 11.120 21.700 1.00 0.00 H new ATOM 871 N THR A 55 19.583 17.442 15.627 1.00 0.00 N ATOM 872 CA THR A 55 19.057 18.771 15.424 1.00 0.00 C ATOM 873 C THR A 55 18.849 19.411 16.795 1.00 0.00 C ATOM 874 O THR A 55 19.221 18.864 17.831 1.00 0.00 O ATOM 875 CB THR A 55 17.663 18.701 14.781 1.00 0.00 C ATOM 876 OG1 THR A 55 16.648 17.985 15.447 1.00 0.00 O ATOM 877 CG2 THR A 55 17.766 18.168 13.358 1.00 0.00 C ATOM 0 H THR A 55 18.871 16.770 15.913 1.00 0.00 H new ATOM 0 HA THR A 55 19.749 19.328 14.792 1.00 0.00 H new ATOM 0 HB THR A 55 17.337 19.740 14.836 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.965 17.080 15.649 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.772 18.123 12.913 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.399 18.830 12.766 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.202 17.169 13.374 1.00 0.00 H new ATOM 885 N LEU A 56 18.297 20.615 16.865 1.00 0.00 N ATOM 886 CA LEU A 56 17.854 21.211 18.112 1.00 0.00 C ATOM 887 C LEU A 56 16.696 20.454 18.762 1.00 0.00 C ATOM 888 O LEU A 56 16.588 20.559 19.986 1.00 0.00 O ATOM 889 CB LEU A 56 17.566 22.690 17.893 1.00 0.00 C ATOM 890 CG LEU A 56 18.756 23.654 17.804 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.380 24.902 17.026 1.00 0.00 C ATOM 892 CD2 LEU A 56 19.395 23.987 19.159 1.00 0.00 C ATOM 0 H LEU A 56 18.144 21.208 16.049 1.00 0.00 H new ATOM 0 HA LEU A 56 18.662 21.129 18.839 1.00 0.00 H new ATOM 0 HB2 LEU A 56 16.991 22.785 16.972 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.923 23.028 18.706 1.00 0.00 H new ATOM 0 HG LEU A 56 19.535 23.127 17.254 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.239 25.572 16.975 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.077 24.624 16.017 1.00 0.00 H new ATOM 0 HD13 LEU A 56 17.554 25.408 17.527 1.00 0.00 H new ATOM 0 HD21 LEU A 56 20.228 24.674 19.009 1.00 0.00 H new ATOM 0 HD22 LEU A 56 18.653 24.453 19.807 1.00 0.00 H new ATOM 0 HD23 LEU A 56 19.759 23.071 19.625 1.00 0.00 H new ATOM 904 N SER A 57 15.787 19.872 17.989 1.00 0.00 N ATOM 905 CA SER A 57 14.688 19.086 18.518 1.00 0.00 C ATOM 906 C SER A 57 15.127 17.844 19.288 1.00 0.00 C ATOM 907 O SER A 57 14.507 17.517 20.295 1.00 0.00 O ATOM 908 CB SER A 57 13.614 18.810 17.462 1.00 0.00 C ATOM 909 OG SER A 57 12.991 19.993 17.015 1.00 0.00 O ATOM 0 H SER A 57 15.795 19.935 16.971 1.00 0.00 H new ATOM 0 HA SER A 57 14.214 19.710 19.276 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.065 18.296 16.613 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.862 18.140 17.878 1.00 0.00 H new ATOM 0 HG SER A 57 12.314 19.772 16.341 1.00 0.00 H new ATOM 915 N ASP A 58 16.186 17.172 18.827 1.00 0.00 N ATOM 916 CA ASP A 58 16.743 15.953 19.378 1.00 0.00 C ATOM 917 C ASP A 58 17.295 16.050 20.798 1.00 0.00 C ATOM 918 O ASP A 58 17.425 15.047 21.497 1.00 0.00 O ATOM 919 CB ASP A 58 17.945 15.535 18.534 1.00 0.00 C ATOM 920 CG ASP A 58 17.527 14.897 17.213 1.00 0.00 C ATOM 921 OD1 ASP A 58 17.238 13.692 17.345 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.714 15.561 16.165 1.00 0.00 O ATOM 0 H ASP A 58 16.703 17.492 18.008 1.00 0.00 H new ATOM 0 HA ASP A 58 15.902 15.259 19.381 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.567 16.407 18.334 1.00 0.00 H new ATOM 0 HB3 ASP A 58 18.556 14.831 19.099 1.00 0.00 H new ATOM 927 N TYR A 59 17.576 17.291 21.179 1.00 0.00 N ATOM 928 CA TYR A 59 18.152 17.713 22.452 1.00 0.00 C ATOM 929 C TYR A 59 17.176 18.561 23.266 1.00 0.00 C ATOM 930 O TYR A 59 17.417 18.818 24.442 1.00 0.00 O ATOM 931 CB TYR A 59 19.537 18.345 22.267 1.00 0.00 C ATOM 932 CG TYR A 59 20.577 17.283 22.002 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.985 16.400 23.018 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.305 17.258 20.805 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.029 15.487 22.815 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.272 16.292 20.516 1.00 0.00 C ATOM 937 CZ TYR A 59 22.647 15.429 21.562 1.00 0.00 C ATOM 938 OH TYR A 59 23.740 14.623 21.511 1.00 0.00 O ATOM 0 H TYR A 59 17.395 18.084 20.564 1.00 0.00 H new ATOM 0 HA TYR A 59 18.323 16.822 23.056 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.512 19.052 21.437 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.806 18.910 23.159 1.00 0.00 H new ATOM 0 HD1 TYR A 59 20.484 16.426 23.974 1.00 0.00 H new ATOM 0 HD2 TYR A 59 21.109 18.024 20.069 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.352 14.837 23.615 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.712 16.211 19.533 1.00 0.00 H new ATOM 0 HH TYR A 59 23.639 13.893 22.157 1.00 0.00 H new ATOM 948 N ASN A 60 16.052 18.844 22.626 1.00 0.00 N ATOM 949 CA ASN A 60 14.933 19.601 23.155 1.00 0.00 C ATOM 950 C ASN A 60 15.292 20.992 23.673 1.00 0.00 C ATOM 951 O ASN A 60 15.059 21.331 24.822 1.00 0.00 O ATOM 952 CB ASN A 60 14.225 18.814 24.265 1.00 0.00 C ATOM 953 CG ASN A 60 12.832 19.347 24.563 1.00 0.00 C ATOM 954 OD1 ASN A 60 12.218 19.895 23.649 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.343 19.258 25.797 1.00 0.00 N ATOM 0 H ASN A 60 15.889 18.533 21.668 1.00 0.00 H new ATOM 0 HA ASN A 60 14.269 19.752 22.304 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.154 17.766 23.974 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.827 18.853 25.173 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.427 19.652 26.012 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.884 18.795 26.528 1.00 0.00 H new ATOM 962 N ILE A 61 15.928 21.794 22.819 1.00 0.00 N ATOM 963 CA ILE A 61 16.395 23.120 23.179 1.00 0.00 C ATOM 964 C ILE A 61 15.284 24.131 22.915 1.00 0.00 C ATOM 965 O ILE A 61 14.722 24.205 21.826 1.00 0.00 O ATOM 966 CB ILE A 61 17.674 23.406 22.387 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.689 22.387 22.908 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.200 24.844 22.425 1.00 0.00 C ATOM 969 CD1 ILE A 61 19.711 21.926 21.853 1.00 0.00 C ATOM 0 H ILE A 61 16.132 21.534 21.854 1.00 0.00 H new ATOM 0 HA ILE A 61 16.638 23.192 24.239 1.00 0.00 H new ATOM 0 HB ILE A 61 17.467 23.302 21.322 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.224 22.822 23.752 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.153 21.516 23.285 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.108 24.915 21.826 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.445 25.518 22.021 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.422 25.123 23.455 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.395 21.205 22.300 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.187 21.460 21.018 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.275 22.786 21.493 1.00 0.00 H new ATOM 981 N GLN A 62 15.064 24.978 23.917 1.00 0.00 N ATOM 982 CA GLN A 62 14.241 26.167 23.897 1.00 0.00 C ATOM 983 C GLN A 62 15.131 27.396 23.683 1.00 0.00 C ATOM 984 O GLN A 62 16.253 27.424 24.160 1.00 0.00 O ATOM 985 CB GLN A 62 13.466 26.343 25.211 1.00 0.00 C ATOM 986 CG GLN A 62 12.691 25.129 25.723 1.00 0.00 C ATOM 987 CD GLN A 62 13.607 24.218 26.528 1.00 0.00 C ATOM 988 OE1 GLN A 62 14.670 24.633 26.992 1.00 0.00 O ATOM 989 NE2 GLN A 62 13.207 22.957 26.605 1.00 0.00 N ATOM 0 H GLN A 62 15.493 24.833 24.831 1.00 0.00 H new ATOM 0 HA GLN A 62 13.522 26.062 23.084 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.172 26.645 25.984 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.762 27.166 25.083 1.00 0.00 H new ATOM 0 HG2 GLN A 62 11.857 25.457 26.343 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.267 24.579 24.883 1.00 0.00 H new ATOM 0 HE21 GLN A 62 12.313 22.680 26.199 1.00 0.00 H new ATOM 0 HE22 GLN A 62 13.793 22.264 27.071 1.00 0.00 H new ATOM 998 N LYS A 63 14.486 28.378 23.056 1.00 0.00 N ATOM 999 CA LYS A 63 14.851 29.777 23.199 1.00 0.00 C ATOM 1000 C LYS A 63 15.068 30.107 24.675 1.00 0.00 C ATOM 1001 O LYS A 63 14.300 29.678 25.533 1.00 0.00 O ATOM 1002 CB LYS A 63 13.761 30.571 22.477 1.00 0.00 C ATOM 1003 CG LYS A 63 12.383 30.495 23.140 1.00 0.00 C ATOM 1004 CD LYS A 63 11.990 31.817 23.777 1.00 0.00 C ATOM 1005 CE LYS A 63 10.687 31.755 24.565 1.00 0.00 C ATOM 1006 NZ LYS A 63 10.745 31.238 25.941 1.00 0.00 N ATOM 0 H LYS A 63 13.694 28.220 22.434 1.00 0.00 H new ATOM 0 HA LYS A 63 15.804 30.041 22.740 1.00 0.00 H new ATOM 0 HB2 LYS A 63 14.067 31.616 22.419 1.00 0.00 H new ATOM 0 HB3 LYS A 63 13.679 30.206 21.453 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.637 30.214 22.397 1.00 0.00 H new ATOM 0 HG3 LYS A 63 12.387 29.713 23.899 1.00 0.00 H new ATOM 0 HD2 LYS A 63 12.791 32.142 24.441 1.00 0.00 H new ATOM 0 HD3 LYS A 63 11.897 32.572 22.997 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.269 32.761 24.602 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.985 31.138 24.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.831 30.809 26.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.494 30.520 26.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.951 32.018 26.597 1.00 0.00 H new ATOM 1020 N GLU A 64 16.161 30.831 24.899 1.00 0.00 N ATOM 1021 CA GLU A 64 16.455 31.519 26.144 1.00 0.00 C ATOM 1022 C GLU A 64 17.124 30.660 27.222 1.00 0.00 C ATOM 1023 O GLU A 64 17.264 31.170 28.330 1.00 0.00 O ATOM 1024 CB GLU A 64 15.350 32.474 26.604 1.00 0.00 C ATOM 1025 CG GLU A 64 14.535 32.070 27.829 1.00 0.00 C ATOM 1026 CD GLU A 64 13.049 32.300 27.625 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.557 33.060 26.765 1.00 0.00 O ATOM 1028 OE2 GLU A 64 12.299 31.628 28.361 1.00 0.00 O ATOM 0 H GLU A 64 16.887 30.956 24.194 1.00 0.00 H new ATOM 0 HA GLU A 64 17.267 32.203 25.899 1.00 0.00 H new ATOM 0 HB2 GLU A 64 15.806 33.443 26.808 1.00 0.00 H new ATOM 0 HB3 GLU A 64 14.660 32.615 25.772 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.712 31.018 28.051 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.874 32.640 28.694 1.00 0.00 H new ATOM 1035 N SER A 65 17.215 29.374 26.895 1.00 0.00 N ATOM 1036 CA SER A 65 17.793 28.369 27.761 1.00 0.00 C ATOM 1037 C SER A 65 19.303 28.314 27.486 1.00 0.00 C ATOM 1038 O SER A 65 19.703 28.418 26.324 1.00 0.00 O ATOM 1039 CB SER A 65 17.122 27.071 27.328 1.00 0.00 C ATOM 1040 OG SER A 65 17.166 26.094 28.352 1.00 0.00 O ATOM 0 H SER A 65 16.882 29.002 26.005 1.00 0.00 H new ATOM 0 HA SER A 65 17.649 28.562 28.824 1.00 0.00 H new ATOM 0 HB2 SER A 65 16.085 27.269 27.058 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.615 26.686 26.436 1.00 0.00 H new ATOM 0 HG SER A 65 16.464 25.427 28.199 1.00 0.00 H new ATOM 1046 N THR A 66 20.147 28.166 28.499 1.00 0.00 N ATOM 1047 CA THR A 66 21.562 28.431 28.336 1.00 0.00 C ATOM 1048 C THR A 66 22.222 27.092 27.971 1.00 0.00 C ATOM 1049 O THR A 66 22.039 26.080 28.636 1.00 0.00 O ATOM 1050 CB THR A 66 22.114 28.963 29.655 1.00 0.00 C ATOM 1051 OG1 THR A 66 21.575 30.235 29.937 1.00 0.00 O ATOM 1052 CG2 THR A 66 23.641 29.068 29.705 1.00 0.00 C ATOM 0 H THR A 66 19.874 27.866 29.435 1.00 0.00 H new ATOM 0 HA THR A 66 21.757 29.171 27.560 1.00 0.00 H new ATOM 0 HB THR A 66 21.815 28.228 30.402 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.937 30.563 30.787 1.00 0.00 H new ATOM 0 HG21 THR A 66 23.947 29.454 30.677 1.00 0.00 H new ATOM 0 HG22 THR A 66 24.079 28.082 29.552 1.00 0.00 H new ATOM 0 HG23 THR A 66 23.985 29.743 28.921 1.00 0.00 H new ATOM 1060 N LEU A 67 22.990 27.211 26.887 1.00 0.00 N ATOM 1061 CA LEU A 67 23.925 26.330 26.222 1.00 0.00 C ATOM 1062 C LEU A 67 25.375 26.772 26.445 1.00 0.00 C ATOM 1063 O LEU A 67 25.658 27.921 26.106 1.00 0.00 O ATOM 1064 CB LEU A 67 23.690 26.309 24.711 1.00 0.00 C ATOM 1065 CG LEU A 67 22.475 25.499 24.268 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.164 26.278 24.419 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.845 25.191 22.817 1.00 0.00 C ATOM 0 H LEU A 67 22.952 28.092 26.374 1.00 0.00 H new ATOM 0 HA LEU A 67 23.761 25.341 26.650 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.574 27.335 24.360 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.577 25.904 24.224 1.00 0.00 H new ATOM 0 HG LEU A 67 22.281 24.608 24.864 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.331 25.656 24.090 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.022 26.552 25.464 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.205 27.181 23.810 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.052 24.602 22.356 1.00 0.00 H new ATOM 0 HD22 LEU A 67 22.970 26.124 22.268 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.777 24.627 22.791 1.00 0.00 H new ATOM 1079 N HIS A 68 26.337 25.968 26.872 1.00 0.00 N ATOM 1080 CA HIS A 68 27.726 26.368 27.024 1.00 0.00 C ATOM 1081 C HIS A 68 28.462 25.991 25.735 1.00 0.00 C ATOM 1082 O HIS A 68 28.211 24.910 25.193 1.00 0.00 O ATOM 1083 CB HIS A 68 28.392 25.634 28.186 1.00 0.00 C ATOM 1084 CG HIS A 68 28.770 26.425 29.408 1.00 0.00 C ATOM 1085 ND1 HIS A 68 28.681 25.829 30.666 1.00 0.00 N ATOM 1086 CD2 HIS A 68 29.283 27.698 29.497 1.00 0.00 C ATOM 1087 CE1 HIS A 68 29.227 26.783 31.413 1.00 0.00 C ATOM 1088 NE2 HIS A 68 29.626 27.913 30.816 1.00 0.00 N ATOM 0 H HIS A 68 26.168 24.995 27.129 1.00 0.00 H new ATOM 0 HA HIS A 68 27.768 27.439 27.222 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.722 24.835 28.502 1.00 0.00 H new ATOM 0 HB3 HIS A 68 29.296 25.160 27.805 1.00 0.00 H new ATOM 0 HD2 HIS A 68 29.396 28.400 28.684 1.00 0.00 H new ATOM 0 HE1 HIS A 68 29.346 26.650 32.478 1.00 0.00 H new ATOM 0 HE2 HIS A 68 30.073 28.730 31.233 1.00 0.00 H new ATOM 1096 N LEU A 69 29.377 26.845 25.279 1.00 0.00 N ATOM 1097 CA LEU A 69 30.212 26.750 24.106 1.00 0.00 C ATOM 1098 C LEU A 69 31.632 26.680 24.692 1.00 0.00 C ATOM 1099 O LEU A 69 32.394 27.626 24.892 1.00 0.00 O ATOM 1100 CB LEU A 69 29.949 28.016 23.312 1.00 0.00 C ATOM 1101 CG LEU A 69 30.576 28.167 21.929 1.00 0.00 C ATOM 1102 CD1 LEU A 69 32.073 28.496 21.857 1.00 0.00 C ATOM 1103 CD2 LEU A 69 30.216 26.935 21.088 1.00 0.00 C ATOM 0 H LEU A 69 29.563 27.711 25.785 1.00 0.00 H new ATOM 0 HA LEU A 69 30.042 25.903 23.441 1.00 0.00 H new ATOM 0 HB2 LEU A 69 28.870 28.113 23.196 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.282 28.859 23.918 1.00 0.00 H new ATOM 0 HG LEU A 69 30.139 29.077 21.517 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.379 28.573 20.814 1.00 0.00 H new ATOM 0 HD12 LEU A 69 32.262 29.444 22.362 1.00 0.00 H new ATOM 0 HD13 LEU A 69 32.643 27.705 22.345 1.00 0.00 H new ATOM 0 HD21 LEU A 69 30.658 27.030 20.096 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.601 26.038 21.573 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.132 26.861 20.997 1.00 0.00 H new ATOM 1115 N VAL A 70 32.043 25.435 24.887 1.00 0.00 N ATOM 1116 CA VAL A 70 33.397 25.069 25.232 1.00 0.00 C ATOM 1117 C VAL A 70 34.198 24.740 23.973 1.00 0.00 C ATOM 1118 O VAL A 70 33.707 24.285 22.946 1.00 0.00 O ATOM 1119 CB VAL A 70 33.326 23.892 26.206 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.682 23.252 26.459 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.517 24.217 27.463 1.00 0.00 C ATOM 0 H VAL A 70 31.419 24.632 24.805 1.00 0.00 H new ATOM 0 HA VAL A 70 33.917 25.897 25.714 1.00 0.00 H new ATOM 0 HB VAL A 70 32.753 23.106 25.714 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.568 22.423 27.158 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.090 22.881 25.519 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.361 23.993 26.882 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.499 23.347 28.119 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.977 25.056 27.985 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.497 24.480 27.182 1.00 0.00 H new ATOM 1131 N LEU A 71 35.523 24.824 24.071 1.00 0.00 N ATOM 1132 CA LEU A 71 36.550 24.391 23.147 1.00 0.00 C ATOM 1133 C LEU A 71 37.027 23.026 23.638 1.00 0.00 C ATOM 1134 O LEU A 71 37.436 22.963 24.799 1.00 0.00 O ATOM 1135 CB LEU A 71 37.691 25.365 22.846 1.00 0.00 C ATOM 1136 CG LEU A 71 37.291 26.234 21.651 1.00 0.00 C ATOM 1137 CD1 LEU A 71 35.934 26.933 21.726 1.00 0.00 C ATOM 1138 CD2 LEU A 71 38.400 27.230 21.295 1.00 0.00 C ATOM 0 H LEU A 71 35.943 25.247 24.899 1.00 0.00 H new ATOM 0 HA LEU A 71 36.098 24.337 22.157 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.895 25.989 23.716 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.607 24.817 22.625 1.00 0.00 H new ATOM 0 HG LEU A 71 37.161 25.509 20.848 1.00 0.00 H new ATOM 0 HD11 LEU A 71 35.774 27.515 20.818 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.145 26.187 21.823 1.00 0.00 H new ATOM 0 HD13 LEU A 71 35.914 27.597 22.591 1.00 0.00 H new ATOM 0 HD21 LEU A 71 38.087 27.833 20.443 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.593 27.880 22.148 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.310 26.686 21.040 1.00 0.00 H new