USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 572 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 22 THR OG1 : rot 180:sc= -1.53 USER MOD Set 1.2: A 25 ASN : amide:sc= -3.81 K(o=-5.3,f=-0.82!) USER MOD Set 2.1: A 7 THR OG1 : rot -57:sc= -0.941 USER MOD Set 2.2: A 9 THR OG1 : rot -120:sc= -0.108 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -149:sc= 0.227 (180deg=-0.588) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 6 LYS NZ :NH3+ -165:sc= -0.0667 (180deg=-0.434) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= 0.0227 USER MOD Single : A 27 LYS NZ :NH3+ -174:sc= -4.74! (180deg=-4.91!) USER MOD Single : A 29 LYS NZ :NH3+ -161:sc= -0.0426 (180deg=-0.41) USER MOD Single : A 31 GLN : amide:sc= -3.03! C(o=-3!,f=-4.6!) USER MOD Single : A 33 LYS NZ :NH3+ -135:sc= -0.112 (180deg=-0.571) USER MOD Single : A 40 GLN : amide:sc= -1.09! K(o=-1.1!,f=0) USER MOD Single : A 41 GLN : amide:sc= -2.24! X(o=-2.2!,f=-2.7) USER MOD Single : A 48 LYS NZ :NH3+ -167:sc=-0.00649 (180deg=-0.281) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 55 THR OG1 : rot -113:sc= 0.0268 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.897 USER MOD Single : A 60 ASN : amide:sc= -0.181 X(o=-0.18,f=-0.13) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.270 27.980 3.058 1.00 0.00 N ATOM 2 CA MET A 1 28.460 29.122 2.547 1.00 0.00 C ATOM 3 C MET A 1 28.381 30.211 3.621 1.00 0.00 C ATOM 4 O MET A 1 29.179 30.252 4.535 1.00 0.00 O ATOM 5 CB MET A 1 27.050 28.635 2.208 1.00 0.00 C ATOM 6 CG MET A 1 27.117 27.654 1.036 1.00 0.00 C ATOM 7 SD MET A 1 25.454 27.045 0.662 1.00 0.00 S ATOM 8 CE MET A 1 25.903 26.012 -0.755 1.00 0.00 C ATOM 0 H1 MET A 1 29.762 27.521 2.265 1.00 0.00 H new ATOM 0 H2 MET A 1 29.970 28.330 3.743 1.00 0.00 H new ATOM 0 H3 MET A 1 28.645 27.291 3.523 1.00 0.00 H new ATOM 0 HA MET A 1 28.928 29.529 1.651 1.00 0.00 H new ATOM 0 HB2 MET A 1 26.602 28.151 3.076 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.413 29.482 1.951 1.00 0.00 H new ATOM 0 HG2 MET A 1 27.541 28.145 0.160 1.00 0.00 H new ATOM 0 HG3 MET A 1 27.774 26.820 1.283 1.00 0.00 H new ATOM 0 HE1 MET A 1 25.009 25.530 -1.152 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.355 26.632 -1.529 1.00 0.00 H new ATOM 0 HE3 MET A 1 26.616 25.250 -0.439 1.00 0.00 H new ATOM 20 N GLN A 2 27.424 31.092 3.516 1.00 0.00 N ATOM 21 CA GLN A 2 27.296 32.176 4.531 1.00 0.00 C ATOM 22 C GLN A 2 26.812 31.581 5.855 1.00 0.00 C ATOM 23 O GLN A 2 25.630 31.398 6.070 1.00 0.00 O ATOM 24 CB GLN A 2 26.287 33.217 4.040 1.00 0.00 C ATOM 25 CG GLN A 2 26.839 33.913 2.793 1.00 0.00 C ATOM 26 CD GLN A 2 25.833 34.956 2.302 1.00 0.00 C ATOM 27 OE1 GLN A 2 25.261 35.682 3.090 1.00 0.00 O ATOM 28 NE2 GLN A 2 25.592 35.060 1.025 1.00 0.00 N ATOM 0 H GLN A 2 26.726 31.108 2.772 1.00 0.00 H new ATOM 0 HA GLN A 2 28.266 32.651 4.680 1.00 0.00 H new ATOM 0 HB2 GLN A 2 25.335 32.737 3.811 1.00 0.00 H new ATOM 0 HB3 GLN A 2 26.094 33.950 4.823 1.00 0.00 H new ATOM 0 HG2 GLN A 2 27.792 34.391 3.022 1.00 0.00 H new ATOM 0 HG3 GLN A 2 27.030 33.180 2.009 1.00 0.00 H new ATOM 0 HE21 GLN A 2 26.073 34.450 0.364 1.00 0.00 H new ATOM 0 HE22 GLN A 2 24.923 35.751 0.687 1.00 0.00 H new ATOM 37 N ILE A 3 27.719 31.276 6.745 1.00 0.00 N ATOM 38 CA ILE A 3 27.314 30.690 8.059 1.00 0.00 C ATOM 39 C ILE A 3 27.046 31.813 9.064 1.00 0.00 C ATOM 40 O ILE A 3 27.797 32.765 9.168 1.00 0.00 O ATOM 41 CB ILE A 3 28.433 29.783 8.583 1.00 0.00 C ATOM 42 CG1 ILE A 3 29.779 30.507 8.491 1.00 0.00 C ATOM 43 CG2 ILE A 3 28.490 28.505 7.744 1.00 0.00 C ATOM 44 CD1 ILE A 3 30.868 29.644 9.132 1.00 0.00 C ATOM 0 H ILE A 3 28.723 31.407 6.620 1.00 0.00 H new ATOM 0 HA ILE A 3 26.405 30.103 7.928 1.00 0.00 H new ATOM 0 HB ILE A 3 28.229 29.532 9.624 1.00 0.00 H new ATOM 0 HG12 ILE A 3 30.026 30.707 7.448 1.00 0.00 H new ATOM 0 HG13 ILE A 3 29.720 31.471 8.996 1.00 0.00 H new ATOM 0 HG21 ILE A 3 29.286 27.860 8.117 1.00 0.00 H new ATOM 0 HG22 ILE A 3 27.536 27.982 7.813 1.00 0.00 H new ATOM 0 HG23 ILE A 3 28.688 28.761 6.703 1.00 0.00 H new ATOM 0 HD11 ILE A 3 31.826 30.159 9.066 1.00 0.00 H new ATOM 0 HD12 ILE A 3 30.622 29.466 10.179 1.00 0.00 H new ATOM 0 HD13 ILE A 3 30.932 28.691 8.608 1.00 0.00 H new ATOM 56 N PHE A 4 25.973 31.713 9.804 1.00 0.00 N ATOM 57 CA PHE A 4 25.643 32.771 10.804 1.00 0.00 C ATOM 58 C PHE A 4 26.295 32.428 12.145 1.00 0.00 C ATOM 59 O PHE A 4 26.479 31.275 12.482 1.00 0.00 O ATOM 60 CB PHE A 4 24.125 32.845 10.982 1.00 0.00 C ATOM 61 CG PHE A 4 23.507 33.497 9.768 1.00 0.00 C ATOM 62 CD1 PHE A 4 23.260 32.742 8.616 1.00 0.00 C ATOM 63 CD2 PHE A 4 23.181 34.859 9.794 1.00 0.00 C ATOM 64 CE1 PHE A 4 22.687 33.346 7.491 1.00 0.00 C ATOM 65 CE2 PHE A 4 22.608 35.464 8.668 1.00 0.00 C ATOM 66 CZ PHE A 4 22.362 34.706 7.517 1.00 0.00 C ATOM 0 H PHE A 4 25.308 30.941 9.758 1.00 0.00 H new ATOM 0 HA PHE A 4 26.018 33.732 10.453 1.00 0.00 H new ATOM 0 HB2 PHE A 4 23.715 31.844 11.119 1.00 0.00 H new ATOM 0 HB3 PHE A 4 23.881 33.415 11.878 1.00 0.00 H new ATOM 0 HD1 PHE A 4 23.512 31.692 8.595 1.00 0.00 H new ATOM 0 HD2 PHE A 4 23.371 35.443 10.682 1.00 0.00 H new ATOM 0 HE1 PHE A 4 22.496 32.762 6.603 1.00 0.00 H new ATOM 0 HE2 PHE A 4 22.356 36.514 8.688 1.00 0.00 H new ATOM 0 HZ PHE A 4 21.921 35.172 6.648 1.00 0.00 H new ATOM 76 N VAL A 5 26.628 33.426 12.924 1.00 0.00 N ATOM 77 CA VAL A 5 27.252 33.169 14.259 1.00 0.00 C ATOM 78 C VAL A 5 26.717 34.190 15.266 1.00 0.00 C ATOM 79 O VAL A 5 27.045 35.359 15.210 1.00 0.00 O ATOM 80 CB VAL A 5 28.771 33.296 14.146 1.00 0.00 C ATOM 81 CG1 VAL A 5 29.404 33.130 15.528 1.00 0.00 C ATOM 82 CG2 VAL A 5 29.304 32.211 13.208 1.00 0.00 C ATOM 0 H VAL A 5 26.494 34.410 12.693 1.00 0.00 H new ATOM 0 HA VAL A 5 27.004 32.162 14.596 1.00 0.00 H new ATOM 0 HB VAL A 5 29.024 34.279 13.748 1.00 0.00 H new ATOM 0 HG11 VAL A 5 30.487 33.221 15.445 1.00 0.00 H new ATOM 0 HG12 VAL A 5 29.025 33.903 16.197 1.00 0.00 H new ATOM 0 HG13 VAL A 5 29.152 32.148 15.928 1.00 0.00 H new ATOM 0 HG21 VAL A 5 30.387 32.300 13.127 1.00 0.00 H new ATOM 0 HG22 VAL A 5 29.050 31.229 13.606 1.00 0.00 H new ATOM 0 HG23 VAL A 5 28.855 32.330 12.222 1.00 0.00 H new ATOM 92 N LYS A 6 25.893 33.762 16.186 1.00 0.00 N ATOM 93 CA LYS A 6 25.330 34.709 17.197 1.00 0.00 C ATOM 94 C LYS A 6 26.185 34.675 18.466 1.00 0.00 C ATOM 95 O LYS A 6 26.408 33.633 19.050 1.00 0.00 O ATOM 96 CB LYS A 6 23.899 34.289 17.539 1.00 0.00 C ATOM 97 CG LYS A 6 23.281 35.307 18.500 1.00 0.00 C ATOM 98 CD LYS A 6 21.828 34.922 18.786 1.00 0.00 C ATOM 99 CE LYS A 6 21.193 35.967 19.706 1.00 0.00 C ATOM 100 NZ LYS A 6 21.894 35.963 21.021 1.00 0.00 N ATOM 0 H LYS A 6 25.584 32.795 16.282 1.00 0.00 H new ATOM 0 HA LYS A 6 25.330 35.719 16.788 1.00 0.00 H new ATOM 0 HB2 LYS A 6 23.302 34.223 16.630 1.00 0.00 H new ATOM 0 HB3 LYS A 6 23.899 33.298 17.993 1.00 0.00 H new ATOM 0 HG2 LYS A 6 23.850 35.338 19.429 1.00 0.00 H new ATOM 0 HG3 LYS A 6 23.325 36.306 18.066 1.00 0.00 H new ATOM 0 HD2 LYS A 6 21.268 34.856 17.853 1.00 0.00 H new ATOM 0 HD3 LYS A 6 21.787 33.938 19.253 1.00 0.00 H new ATOM 0 HE2 LYS A 6 21.257 36.955 19.251 1.00 0.00 H new ATOM 0 HE3 LYS A 6 20.134 35.749 19.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 21.320 36.474 21.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 22.034 34.982 21.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 22.818 36.430 20.923 1.00 0.00 H new ATOM 114 N THR A 7 26.667 35.810 18.897 1.00 0.00 N ATOM 115 CA THR A 7 27.509 35.847 20.128 1.00 0.00 C ATOM 116 C THR A 7 26.610 35.879 21.366 1.00 0.00 C ATOM 117 O THR A 7 25.406 36.017 21.269 1.00 0.00 O ATOM 118 CB THR A 7 28.385 37.101 20.106 1.00 0.00 C ATOM 119 OG1 THR A 7 27.554 38.253 20.100 1.00 0.00 O ATOM 120 CG2 THR A 7 29.261 37.093 18.851 1.00 0.00 C ATOM 0 H THR A 7 26.514 36.714 18.450 1.00 0.00 H new ATOM 0 HA THR A 7 28.140 34.959 20.161 1.00 0.00 H new ATOM 0 HB THR A 7 29.023 37.116 20.989 1.00 0.00 H new ATOM 0 HG1 THR A 7 26.951 38.217 19.329 1.00 0.00 H new ATOM 0 HG21 THR A 7 29.884 37.987 18.837 1.00 0.00 H new ATOM 0 HG22 THR A 7 29.897 36.207 18.857 1.00 0.00 H new ATOM 0 HG23 THR A 7 28.627 37.079 17.965 1.00 0.00 H new ATOM 128 N LEU A 8 27.186 35.750 22.530 1.00 0.00 N ATOM 129 CA LEU A 8 26.371 35.770 23.778 1.00 0.00 C ATOM 130 C LEU A 8 25.822 37.181 24.010 1.00 0.00 C ATOM 131 O LEU A 8 24.724 37.357 24.502 1.00 0.00 O ATOM 132 CB LEU A 8 27.249 35.356 24.962 1.00 0.00 C ATOM 133 CG LEU A 8 26.404 35.234 26.238 1.00 0.00 C ATOM 134 CD1 LEU A 8 25.380 34.089 26.098 1.00 0.00 C ATOM 135 CD2 LEU A 8 27.333 34.957 27.426 1.00 0.00 C ATOM 0 H LEU A 8 28.189 35.631 22.671 1.00 0.00 H new ATOM 0 HA LEU A 8 25.538 35.073 23.682 1.00 0.00 H new ATOM 0 HB2 LEU A 8 27.735 34.404 24.747 1.00 0.00 H new ATOM 0 HB3 LEU A 8 28.040 36.091 25.111 1.00 0.00 H new ATOM 0 HG LEU A 8 25.861 36.165 26.400 1.00 0.00 H new ATOM 0 HD11 LEU A 8 24.789 34.016 27.011 1.00 0.00 H new ATOM 0 HD12 LEU A 8 24.721 34.292 25.254 1.00 0.00 H new ATOM 0 HD13 LEU A 8 25.906 33.149 25.930 1.00 0.00 H new ATOM 0 HD21 LEU A 8 26.742 34.869 28.337 1.00 0.00 H new ATOM 0 HD22 LEU A 8 27.876 34.028 27.254 1.00 0.00 H new ATOM 0 HD23 LEU A 8 28.043 35.778 27.532 1.00 0.00 H new ATOM 147 N THR A 9 26.578 38.190 23.668 1.00 0.00 N ATOM 148 CA THR A 9 26.100 39.587 23.876 1.00 0.00 C ATOM 149 C THR A 9 25.116 39.961 22.767 1.00 0.00 C ATOM 150 O THR A 9 24.610 41.064 22.718 1.00 0.00 O ATOM 151 CB THR A 9 27.293 40.546 23.839 1.00 0.00 C ATOM 152 OG1 THR A 9 27.931 40.456 22.572 1.00 0.00 O ATOM 153 CG2 THR A 9 28.286 40.170 24.941 1.00 0.00 C ATOM 0 H THR A 9 27.506 38.107 23.253 1.00 0.00 H new ATOM 0 HA THR A 9 25.603 39.659 24.844 1.00 0.00 H new ATOM 0 HB THR A 9 26.945 41.567 23.999 1.00 0.00 H new ATOM 0 HG1 THR A 9 28.862 40.174 22.694 1.00 0.00 H new ATOM 0 HG21 THR A 9 29.135 40.853 24.914 1.00 0.00 H new ATOM 0 HG22 THR A 9 27.795 40.239 25.912 1.00 0.00 H new ATOM 0 HG23 THR A 9 28.636 39.150 24.783 1.00 0.00 H new ATOM 161 N GLY A 10 24.838 39.048 21.876 1.00 0.00 N ATOM 162 CA GLY A 10 23.884 39.339 20.764 1.00 0.00 C ATOM 163 C GLY A 10 24.658 39.862 19.554 1.00 0.00 C ATOM 164 O GLY A 10 24.172 39.842 18.440 1.00 0.00 O ATOM 0 H GLY A 10 25.232 38.107 21.870 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.335 38.436 20.496 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.148 40.076 21.085 1.00 0.00 H new ATOM 168 N LYS A 11 25.860 40.329 19.757 1.00 0.00 N ATOM 169 CA LYS A 11 26.654 40.845 18.608 1.00 0.00 C ATOM 170 C LYS A 11 26.700 39.768 17.523 1.00 0.00 C ATOM 171 O LYS A 11 27.289 38.721 17.699 1.00 0.00 O ATOM 172 CB LYS A 11 28.077 41.177 19.068 1.00 0.00 C ATOM 173 CG LYS A 11 28.070 42.498 19.843 1.00 0.00 C ATOM 174 CD LYS A 11 29.384 42.649 20.616 1.00 0.00 C ATOM 175 CE LYS A 11 30.548 42.775 19.632 1.00 0.00 C ATOM 176 NZ LYS A 11 31.753 43.277 20.350 1.00 0.00 N ATOM 0 H LYS A 11 26.324 40.375 20.664 1.00 0.00 H new ATOM 0 HA LYS A 11 26.192 41.750 18.214 1.00 0.00 H new ATOM 0 HB2 LYS A 11 28.463 40.376 19.698 1.00 0.00 H new ATOM 0 HB3 LYS A 11 28.740 41.252 18.206 1.00 0.00 H new ATOM 0 HG2 LYS A 11 27.943 43.334 19.155 1.00 0.00 H new ATOM 0 HG3 LYS A 11 27.226 42.522 20.533 1.00 0.00 H new ATOM 0 HD2 LYS A 11 29.341 43.529 21.258 1.00 0.00 H new ATOM 0 HD3 LYS A 11 29.536 41.787 21.266 1.00 0.00 H new ATOM 0 HE2 LYS A 11 30.760 41.808 19.177 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.283 43.457 18.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 32.545 43.363 19.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 31.547 44.208 20.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.009 42.611 21.106 1.00 0.00 H new ATOM 190 N THR A 12 26.071 40.012 16.403 1.00 0.00 N ATOM 191 CA THR A 12 26.064 38.996 15.309 1.00 0.00 C ATOM 192 C THR A 12 27.222 39.258 14.347 1.00 0.00 C ATOM 193 O THR A 12 27.666 40.377 14.177 1.00 0.00 O ATOM 194 CB THR A 12 24.742 39.083 14.541 1.00 0.00 C ATOM 195 OG1 THR A 12 23.664 38.831 15.431 1.00 0.00 O ATOM 196 CG2 THR A 12 24.734 38.045 13.418 1.00 0.00 C ATOM 0 H THR A 12 25.561 40.872 16.199 1.00 0.00 H new ATOM 0 HA THR A 12 26.174 38.003 15.744 1.00 0.00 H new ATOM 0 HB THR A 12 24.634 40.079 14.111 1.00 0.00 H new ATOM 0 HG1 THR A 12 22.816 38.888 14.942 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.793 38.107 12.872 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.563 38.239 12.737 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.841 37.047 13.844 1.00 0.00 H new ATOM 204 N ILE A 13 27.684 38.232 13.687 1.00 0.00 N ATOM 205 CA ILE A 13 28.783 38.391 12.692 1.00 0.00 C ATOM 206 C ILE A 13 28.548 37.386 11.563 1.00 0.00 C ATOM 207 O ILE A 13 27.994 36.321 11.784 1.00 0.00 O ATOM 208 CB ILE A 13 30.140 38.142 13.357 1.00 0.00 C ATOM 209 CG1 ILE A 13 31.256 38.369 12.335 1.00 0.00 C ATOM 210 CG2 ILE A 13 30.205 36.706 13.871 1.00 0.00 C ATOM 211 CD1 ILE A 13 32.605 38.415 13.054 1.00 0.00 C ATOM 0 H ILE A 13 27.342 37.277 13.796 1.00 0.00 H new ATOM 0 HA ILE A 13 28.788 39.406 12.294 1.00 0.00 H new ATOM 0 HB ILE A 13 30.265 38.830 14.193 1.00 0.00 H new ATOM 0 HG12 ILE A 13 31.254 37.569 11.595 1.00 0.00 H new ATOM 0 HG13 ILE A 13 31.087 39.302 11.797 1.00 0.00 H new ATOM 0 HG21 ILE A 13 31.172 36.532 14.344 1.00 0.00 H new ATOM 0 HG22 ILE A 13 29.411 36.544 14.600 1.00 0.00 H new ATOM 0 HG23 ILE A 13 30.079 36.015 13.037 1.00 0.00 H new ATOM 0 HD11 ILE A 13 33.400 38.577 12.326 1.00 0.00 H new ATOM 0 HD12 ILE A 13 32.604 39.230 13.777 1.00 0.00 H new ATOM 0 HD13 ILE A 13 32.774 37.471 13.572 1.00 0.00 H new ATOM 223 N THR A 14 28.950 37.708 10.358 1.00 0.00 N ATOM 224 CA THR A 14 28.743 36.771 9.204 1.00 0.00 C ATOM 225 C THR A 14 30.097 36.363 8.622 1.00 0.00 C ATOM 226 O THR A 14 30.982 37.179 8.456 1.00 0.00 O ATOM 227 CB THR A 14 27.924 37.482 8.122 1.00 0.00 C ATOM 228 OG1 THR A 14 28.623 38.640 7.686 1.00 0.00 O ATOM 229 CG2 THR A 14 26.565 37.887 8.692 1.00 0.00 C ATOM 0 H THR A 14 29.415 38.584 10.120 1.00 0.00 H new ATOM 0 HA THR A 14 28.214 35.882 9.548 1.00 0.00 H new ATOM 0 HB THR A 14 27.774 36.809 7.278 1.00 0.00 H new ATOM 0 HG1 THR A 14 28.101 39.095 6.992 1.00 0.00 H new ATOM 0 HG21 THR A 14 25.983 38.393 7.921 1.00 0.00 H new ATOM 0 HG22 THR A 14 26.030 36.997 9.025 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.711 38.560 9.537 1.00 0.00 H new ATOM 237 N LEU A 15 30.258 35.102 8.305 1.00 0.00 N ATOM 238 CA LEU A 15 31.548 34.611 7.723 1.00 0.00 C ATOM 239 C LEU A 15 31.244 33.834 6.442 1.00 0.00 C ATOM 240 O LEU A 15 30.599 32.804 6.471 1.00 0.00 O ATOM 241 CB LEU A 15 32.241 33.676 8.723 1.00 0.00 C ATOM 242 CG LEU A 15 32.413 34.378 10.080 1.00 0.00 C ATOM 243 CD1 LEU A 15 32.692 33.332 11.163 1.00 0.00 C ATOM 244 CD2 LEU A 15 33.591 35.357 10.019 1.00 0.00 C ATOM 0 H LEU A 15 29.544 34.384 8.426 1.00 0.00 H new ATOM 0 HA LEU A 15 32.200 35.457 7.506 1.00 0.00 H new ATOM 0 HB2 LEU A 15 31.653 32.767 8.848 1.00 0.00 H new ATOM 0 HB3 LEU A 15 33.214 33.375 8.336 1.00 0.00 H new ATOM 0 HG LEU A 15 31.499 34.924 10.314 1.00 0.00 H new ATOM 0 HD11 LEU A 15 32.814 33.829 12.126 1.00 0.00 H new ATOM 0 HD12 LEU A 15 31.857 32.634 11.218 1.00 0.00 H new ATOM 0 HD13 LEU A 15 33.604 32.788 10.917 1.00 0.00 H new ATOM 0 HD21 LEU A 15 33.705 35.850 10.985 1.00 0.00 H new ATOM 0 HD22 LEU A 15 34.504 34.813 9.779 1.00 0.00 H new ATOM 0 HD23 LEU A 15 33.402 36.106 9.250 1.00 0.00 H new ATOM 256 N GLU A 16 31.694 34.315 5.311 1.00 0.00 N ATOM 257 CA GLU A 16 31.419 33.597 4.031 1.00 0.00 C ATOM 258 C GLU A 16 32.574 32.639 3.721 1.00 0.00 C ATOM 259 O GLU A 16 33.675 33.050 3.415 1.00 0.00 O ATOM 260 CB GLU A 16 31.275 34.621 2.897 1.00 0.00 C ATOM 261 CG GLU A 16 32.274 35.761 3.103 1.00 0.00 C ATOM 262 CD GLU A 16 32.290 36.656 1.863 1.00 0.00 C ATOM 263 OE1 GLU A 16 31.662 36.289 0.883 1.00 0.00 O ATOM 264 OE2 GLU A 16 32.931 37.694 1.913 1.00 0.00 O ATOM 0 H GLU A 16 32.239 35.172 5.219 1.00 0.00 H new ATOM 0 HA GLU A 16 30.496 33.025 4.123 1.00 0.00 H new ATOM 0 HB2 GLU A 16 31.451 34.140 1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.259 35.014 2.876 1.00 0.00 H new ATOM 0 HG2 GLU A 16 32.000 36.344 3.982 1.00 0.00 H new ATOM 0 HG3 GLU A 16 33.270 35.357 3.286 1.00 0.00 H new ATOM 271 N VAL A 17 32.325 31.360 3.795 1.00 0.00 N ATOM 272 CA VAL A 17 33.399 30.371 3.499 1.00 0.00 C ATOM 273 C VAL A 17 32.767 29.016 3.194 1.00 0.00 C ATOM 274 O VAL A 17 31.690 28.703 3.663 1.00 0.00 O ATOM 275 CB VAL A 17 34.329 30.244 4.708 1.00 0.00 C ATOM 276 CG1 VAL A 17 33.503 29.933 5.957 1.00 0.00 C ATOM 277 CG2 VAL A 17 35.333 29.115 4.466 1.00 0.00 C ATOM 0 H VAL A 17 31.423 30.957 4.048 1.00 0.00 H new ATOM 0 HA VAL A 17 33.976 30.707 2.637 1.00 0.00 H new ATOM 0 HB VAL A 17 34.866 31.182 4.852 1.00 0.00 H new ATOM 0 HG11 VAL A 17 34.165 29.843 6.818 1.00 0.00 H new ATOM 0 HG12 VAL A 17 32.789 30.738 6.131 1.00 0.00 H new ATOM 0 HG13 VAL A 17 32.965 28.996 5.813 1.00 0.00 H new ATOM 0 HG21 VAL A 17 35.995 29.026 5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 17 34.797 28.177 4.321 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.923 29.337 3.577 1.00 0.00 H new ATOM 287 N GLU A 18 33.423 28.209 2.407 1.00 0.00 N ATOM 288 CA GLU A 18 32.858 26.871 2.064 1.00 0.00 C ATOM 289 C GLU A 18 32.347 26.189 3.345 1.00 0.00 C ATOM 290 O GLU A 18 32.859 26.431 4.421 1.00 0.00 O ATOM 291 CB GLU A 18 33.956 26.008 1.431 1.00 0.00 C ATOM 292 CG GLU A 18 34.199 26.459 -0.012 1.00 0.00 C ATOM 293 CD GLU A 18 34.766 27.879 -0.016 1.00 0.00 C ATOM 294 OE1 GLU A 18 35.501 28.205 0.903 1.00 0.00 O ATOM 295 OE2 GLU A 18 34.459 28.618 -0.937 1.00 0.00 O ATOM 0 H GLU A 18 34.328 28.418 1.985 1.00 0.00 H new ATOM 0 HA GLU A 18 32.033 26.989 1.361 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.877 26.092 2.009 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.663 24.958 1.450 1.00 0.00 H new ATOM 0 HG2 GLU A 18 34.893 25.778 -0.505 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.267 26.427 -0.576 1.00 0.00 H new ATOM 302 N PRO A 19 31.345 25.346 3.240 1.00 0.00 N ATOM 303 CA PRO A 19 30.772 24.637 4.423 1.00 0.00 C ATOM 304 C PRO A 19 31.726 23.566 4.967 1.00 0.00 C ATOM 305 O PRO A 19 31.562 23.075 6.066 1.00 0.00 O ATOM 306 CB PRO A 19 29.484 24.001 3.874 1.00 0.00 C ATOM 307 CG PRO A 19 29.751 23.807 2.418 1.00 0.00 C ATOM 308 CD PRO A 19 30.646 24.973 1.993 1.00 0.00 C ATOM 0 HA PRO A 19 30.595 25.310 5.262 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.268 23.053 4.367 1.00 0.00 H new ATOM 0 HB3 PRO A 19 28.622 24.648 4.036 1.00 0.00 H new ATOM 0 HG2 PRO A 19 30.243 22.851 2.236 1.00 0.00 H new ATOM 0 HG3 PRO A 19 28.822 23.801 1.849 1.00 0.00 H new ATOM 0 HD2 PRO A 19 31.348 24.677 1.213 1.00 0.00 H new ATOM 0 HD3 PRO A 19 30.062 25.804 1.597 1.00 0.00 H new ATOM 316 N SER A 20 32.721 23.201 4.205 1.00 0.00 N ATOM 317 CA SER A 20 33.681 22.164 4.677 1.00 0.00 C ATOM 318 C SER A 20 34.710 22.804 5.611 1.00 0.00 C ATOM 319 O SER A 20 35.678 22.183 6.003 1.00 0.00 O ATOM 320 CB SER A 20 34.393 21.542 3.478 1.00 0.00 C ATOM 321 OG SER A 20 34.837 22.575 2.608 1.00 0.00 O ATOM 0 H SER A 20 32.910 23.577 3.276 1.00 0.00 H new ATOM 0 HA SER A 20 33.138 21.388 5.217 1.00 0.00 H new ATOM 0 HB2 SER A 20 35.240 20.944 3.814 1.00 0.00 H new ATOM 0 HB3 SER A 20 33.718 20.870 2.948 1.00 0.00 H new ATOM 0 HG SER A 20 35.296 22.179 1.838 1.00 0.00 H new ATOM 327 N ASP A 21 34.512 24.043 5.973 1.00 0.00 N ATOM 328 CA ASP A 21 35.484 24.710 6.886 1.00 0.00 C ATOM 329 C ASP A 21 35.732 23.802 8.092 1.00 0.00 C ATOM 330 O ASP A 21 34.978 22.886 8.349 1.00 0.00 O ATOM 331 CB ASP A 21 34.914 26.052 7.361 1.00 0.00 C ATOM 332 CG ASP A 21 36.048 26.941 7.883 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.119 26.907 7.300 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.825 27.639 8.858 1.00 0.00 O ATOM 0 H ASP A 21 33.724 24.619 5.678 1.00 0.00 H new ATOM 0 HA ASP A 21 36.420 24.890 6.358 1.00 0.00 H new ATOM 0 HB2 ASP A 21 34.398 26.550 6.540 1.00 0.00 H new ATOM 0 HB3 ASP A 21 34.177 25.887 8.147 1.00 0.00 H new ATOM 339 N THR A 22 36.777 24.046 8.836 1.00 0.00 N ATOM 340 CA THR A 22 37.075 23.198 10.027 1.00 0.00 C ATOM 341 C THR A 22 36.620 23.932 11.289 1.00 0.00 C ATOM 342 O THR A 22 36.362 25.116 11.266 1.00 0.00 O ATOM 343 CB THR A 22 38.586 22.954 10.092 1.00 0.00 C ATOM 344 OG1 THR A 22 39.064 22.627 8.794 1.00 0.00 O ATOM 345 CG2 THR A 22 38.884 21.802 11.046 1.00 0.00 C ATOM 0 H THR A 22 37.442 24.801 8.669 1.00 0.00 H new ATOM 0 HA THR A 22 36.551 22.245 9.953 1.00 0.00 H new ATOM 0 HB THR A 22 39.082 23.855 10.452 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.031 22.472 8.831 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.960 21.633 11.088 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.517 22.050 12.042 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.389 20.898 10.691 1.00 0.00 H new ATOM 353 N ILE A 23 36.530 23.245 12.393 1.00 0.00 N ATOM 354 CA ILE A 23 36.101 23.918 13.650 1.00 0.00 C ATOM 355 C ILE A 23 37.176 24.923 14.074 1.00 0.00 C ATOM 356 O ILE A 23 36.889 26.057 14.400 1.00 0.00 O ATOM 357 CB ILE A 23 35.923 22.869 14.739 1.00 0.00 C ATOM 358 CG1 ILE A 23 34.806 21.913 14.326 1.00 0.00 C ATOM 359 CG2 ILE A 23 35.549 23.557 16.053 1.00 0.00 C ATOM 360 CD1 ILE A 23 34.843 20.687 15.226 1.00 0.00 C ATOM 0 H ILE A 23 36.734 22.249 12.479 1.00 0.00 H new ATOM 0 HA ILE A 23 35.158 24.441 13.490 1.00 0.00 H new ATOM 0 HB ILE A 23 36.852 22.315 14.876 1.00 0.00 H new ATOM 0 HG12 ILE A 23 33.838 22.409 14.405 1.00 0.00 H new ATOM 0 HG13 ILE A 23 34.929 21.618 13.284 1.00 0.00 H new ATOM 0 HG21 ILE A 23 35.421 22.807 16.833 1.00 0.00 H new ATOM 0 HG22 ILE A 23 36.342 24.248 16.340 1.00 0.00 H new ATOM 0 HG23 ILE A 23 34.617 24.107 15.923 1.00 0.00 H new ATOM 0 HD11 ILE A 23 34.048 19.999 14.937 1.00 0.00 H new ATOM 0 HD12 ILE A 23 35.808 20.190 15.124 1.00 0.00 H new ATOM 0 HD13 ILE A 23 34.700 20.992 16.263 1.00 0.00 H new ATOM 372 N GLU A 24 38.414 24.508 14.067 1.00 0.00 N ATOM 373 CA GLU A 24 39.517 25.427 14.462 1.00 0.00 C ATOM 374 C GLU A 24 39.647 26.542 13.423 1.00 0.00 C ATOM 375 O GLU A 24 40.104 27.629 13.718 1.00 0.00 O ATOM 376 CB GLU A 24 40.830 24.639 14.533 1.00 0.00 C ATOM 377 CG GLU A 24 40.887 23.634 13.379 1.00 0.00 C ATOM 378 CD GLU A 24 42.319 23.116 13.222 1.00 0.00 C ATOM 379 OE1 GLU A 24 42.970 22.915 14.233 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.740 22.930 12.092 1.00 0.00 O ATOM 0 H GLU A 24 38.709 23.568 13.803 1.00 0.00 H new ATOM 0 HA GLU A 24 39.299 25.864 15.437 1.00 0.00 H new ATOM 0 HB2 GLU A 24 41.679 25.321 14.478 1.00 0.00 H new ATOM 0 HB3 GLU A 24 40.902 24.117 15.487 1.00 0.00 H new ATOM 0 HG2 GLU A 24 40.208 22.804 13.572 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.557 24.107 12.454 1.00 0.00 H new ATOM 387 N ASN A 25 39.237 26.289 12.211 1.00 0.00 N ATOM 388 CA ASN A 25 39.323 27.327 11.165 1.00 0.00 C ATOM 389 C ASN A 25 38.351 28.451 11.519 1.00 0.00 C ATOM 390 O ASN A 25 38.659 29.617 11.393 1.00 0.00 O ATOM 391 CB ASN A 25 38.939 26.697 9.825 1.00 0.00 C ATOM 392 CG ASN A 25 40.129 25.921 9.253 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.261 26.158 9.626 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.919 24.996 8.356 1.00 0.00 N ATOM 0 H ASN A 25 38.844 25.399 11.905 1.00 0.00 H new ATOM 0 HA ASN A 25 40.333 27.732 11.096 1.00 0.00 H new ATOM 0 HB2 ASN A 25 38.088 26.029 9.958 1.00 0.00 H new ATOM 0 HB3 ASN A 25 38.629 27.472 9.124 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.705 24.473 7.969 1.00 0.00 H new ATOM 0 HD22 ASN A 25 38.969 24.796 8.042 1.00 0.00 H new ATOM 401 N VAL A 26 37.182 28.101 11.980 1.00 0.00 N ATOM 402 CA VAL A 26 36.192 29.141 12.368 1.00 0.00 C ATOM 403 C VAL A 26 36.737 29.892 13.578 1.00 0.00 C ATOM 404 O VAL A 26 36.878 31.100 13.569 1.00 0.00 O ATOM 405 CB VAL A 26 34.873 28.462 12.743 1.00 0.00 C ATOM 406 CG1 VAL A 26 33.846 29.521 13.140 1.00 0.00 C ATOM 407 CG2 VAL A 26 34.352 27.670 11.544 1.00 0.00 C ATOM 0 H VAL A 26 36.870 27.138 12.104 1.00 0.00 H new ATOM 0 HA VAL A 26 36.021 29.832 11.542 1.00 0.00 H new ATOM 0 HB VAL A 26 35.038 27.787 13.583 1.00 0.00 H new ATOM 0 HG11 VAL A 26 32.907 29.035 13.407 1.00 0.00 H new ATOM 0 HG12 VAL A 26 34.218 30.086 13.995 1.00 0.00 H new ATOM 0 HG13 VAL A 26 33.679 30.198 12.302 1.00 0.00 H new ATOM 0 HG21 VAL A 26 33.412 27.185 11.809 1.00 0.00 H new ATOM 0 HG22 VAL A 26 34.188 28.346 10.705 1.00 0.00 H new ATOM 0 HG23 VAL A 26 35.084 26.913 11.262 1.00 0.00 H new ATOM 417 N LYS A 27 37.045 29.177 14.620 1.00 0.00 N ATOM 418 CA LYS A 27 37.588 29.825 15.843 1.00 0.00 C ATOM 419 C LYS A 27 38.722 30.775 15.455 1.00 0.00 C ATOM 420 O LYS A 27 38.785 31.899 15.911 1.00 0.00 O ATOM 421 CB LYS A 27 38.124 28.744 16.784 1.00 0.00 C ATOM 422 CG LYS A 27 36.960 27.909 17.320 1.00 0.00 C ATOM 423 CD LYS A 27 37.446 27.024 18.470 1.00 0.00 C ATOM 424 CE LYS A 27 36.247 26.361 19.147 1.00 0.00 C ATOM 425 NZ LYS A 27 35.530 25.501 18.164 1.00 0.00 N ATOM 0 H LYS A 27 36.943 28.164 14.678 1.00 0.00 H new ATOM 0 HA LYS A 27 36.801 30.390 16.343 1.00 0.00 H new ATOM 0 HB2 LYS A 27 38.831 28.104 16.255 1.00 0.00 H new ATOM 0 HB3 LYS A 27 38.667 29.203 17.610 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.159 28.563 17.665 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.546 27.291 16.523 1.00 0.00 H new ATOM 0 HD2 LYS A 27 38.130 26.264 18.093 1.00 0.00 H new ATOM 0 HD3 LYS A 27 38.001 27.622 19.193 1.00 0.00 H new ATOM 0 HE2 LYS A 27 36.580 25.762 19.994 1.00 0.00 H new ATOM 0 HE3 LYS A 27 35.572 27.121 19.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 34.659 25.132 18.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 35.288 26.063 17.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 36.142 24.707 17.886 1.00 0.00 H new ATOM 439 N ALA A 28 39.614 30.336 14.610 1.00 0.00 N ATOM 440 CA ALA A 28 40.736 31.220 14.190 1.00 0.00 C ATOM 441 C ALA A 28 40.176 32.371 13.350 1.00 0.00 C ATOM 442 O ALA A 28 40.406 33.530 13.629 1.00 0.00 O ATOM 443 CB ALA A 28 41.732 30.413 13.353 1.00 0.00 C ATOM 0 H ALA A 28 39.614 29.405 14.193 1.00 0.00 H new ATOM 0 HA ALA A 28 41.243 31.619 15.069 1.00 0.00 H new ATOM 0 HB1 ALA A 28 42.555 31.058 13.044 1.00 0.00 H new ATOM 0 HB2 ALA A 28 42.122 29.587 13.948 1.00 0.00 H new ATOM 0 HB3 ALA A 28 41.229 30.018 12.470 1.00 0.00 H new ATOM 449 N LYS A 29 39.448 32.053 12.315 1.00 0.00 N ATOM 450 CA LYS A 29 38.876 33.117 11.446 1.00 0.00 C ATOM 451 C LYS A 29 38.228 34.204 12.310 1.00 0.00 C ATOM 452 O LYS A 29 38.361 35.382 12.040 1.00 0.00 O ATOM 453 CB LYS A 29 37.824 32.502 10.518 1.00 0.00 C ATOM 454 CG LYS A 29 38.521 31.777 9.355 1.00 0.00 C ATOM 455 CD LYS A 29 37.574 30.741 8.757 1.00 0.00 C ATOM 456 CE LYS A 29 38.277 29.998 7.620 1.00 0.00 C ATOM 457 NZ LYS A 29 38.564 30.948 6.508 1.00 0.00 N ATOM 0 H LYS A 29 39.225 31.098 12.034 1.00 0.00 H new ATOM 0 HA LYS A 29 39.672 33.564 10.851 1.00 0.00 H new ATOM 0 HB2 LYS A 29 37.199 31.802 11.073 1.00 0.00 H new ATOM 0 HB3 LYS A 29 37.166 33.280 10.132 1.00 0.00 H new ATOM 0 HG2 LYS A 29 38.819 32.496 8.592 1.00 0.00 H new ATOM 0 HG3 LYS A 29 39.431 31.292 9.709 1.00 0.00 H new ATOM 0 HD2 LYS A 29 37.259 30.035 9.526 1.00 0.00 H new ATOM 0 HD3 LYS A 29 36.674 31.229 8.384 1.00 0.00 H new ATOM 0 HE2 LYS A 29 39.204 29.553 7.981 1.00 0.00 H new ATOM 0 HE3 LYS A 29 37.650 29.182 7.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.736 30.415 5.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 37.750 31.581 6.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.406 31.512 6.742 1.00 0.00 H new ATOM 471 N ILE A 30 37.537 33.829 13.354 1.00 0.00 N ATOM 472 CA ILE A 30 36.898 34.849 14.223 1.00 0.00 C ATOM 473 C ILE A 30 37.971 35.535 15.075 1.00 0.00 C ATOM 474 O ILE A 30 37.974 36.736 15.237 1.00 0.00 O ATOM 475 CB ILE A 30 35.883 34.152 15.132 1.00 0.00 C ATOM 476 CG1 ILE A 30 34.727 33.619 14.280 1.00 0.00 C ATOM 477 CG2 ILE A 30 35.338 35.149 16.156 1.00 0.00 C ATOM 478 CD1 ILE A 30 33.851 32.696 15.129 1.00 0.00 C ATOM 0 H ILE A 30 37.390 32.861 13.639 1.00 0.00 H new ATOM 0 HA ILE A 30 36.393 35.599 13.614 1.00 0.00 H new ATOM 0 HB ILE A 30 36.369 33.328 15.654 1.00 0.00 H new ATOM 0 HG12 ILE A 30 34.133 34.448 13.894 1.00 0.00 H new ATOM 0 HG13 ILE A 30 35.116 33.077 13.418 1.00 0.00 H new ATOM 0 HG21 ILE A 30 34.616 34.649 16.801 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.159 35.535 16.761 1.00 0.00 H new ATOM 0 HG23 ILE A 30 34.851 35.974 15.637 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.028 32.317 14.523 1.00 0.00 H new ATOM 0 HD12 ILE A 30 34.449 31.861 15.493 1.00 0.00 H new ATOM 0 HD13 ILE A 30 33.451 33.252 15.977 1.00 0.00 H new ATOM 490 N GLN A 31 38.876 34.773 15.623 1.00 0.00 N ATOM 491 CA GLN A 31 39.944 35.361 16.470 1.00 0.00 C ATOM 492 C GLN A 31 40.591 36.553 15.761 1.00 0.00 C ATOM 493 O GLN A 31 40.756 37.615 16.329 1.00 0.00 O ATOM 494 CB GLN A 31 41.007 34.285 16.723 1.00 0.00 C ATOM 495 CG GLN A 31 42.245 34.909 17.386 1.00 0.00 C ATOM 496 CD GLN A 31 43.192 35.467 16.316 1.00 0.00 C ATOM 497 OE1 GLN A 31 43.324 34.898 15.250 1.00 0.00 O ATOM 498 NE2 GLN A 31 43.859 36.561 16.558 1.00 0.00 N ATOM 0 H GLN A 31 38.919 33.759 15.518 1.00 0.00 H new ATOM 0 HA GLN A 31 39.515 35.706 17.411 1.00 0.00 H new ATOM 0 HB2 GLN A 31 40.598 33.503 17.362 1.00 0.00 H new ATOM 0 HB3 GLN A 31 41.288 33.813 15.782 1.00 0.00 H new ATOM 0 HG2 GLN A 31 41.941 35.706 18.065 1.00 0.00 H new ATOM 0 HG3 GLN A 31 42.762 34.160 17.986 1.00 0.00 H new ATOM 0 HE21 GLN A 31 43.748 37.039 17.452 1.00 0.00 H new ATOM 0 HE22 GLN A 31 44.491 36.939 15.853 1.00 0.00 H new ATOM 507 N ASP A 32 40.973 36.377 14.533 1.00 0.00 N ATOM 508 CA ASP A 32 41.631 37.485 13.781 1.00 0.00 C ATOM 509 C ASP A 32 40.655 38.644 13.559 1.00 0.00 C ATOM 510 O ASP A 32 41.052 39.791 13.494 1.00 0.00 O ATOM 511 CB ASP A 32 42.108 36.960 12.426 1.00 0.00 C ATOM 512 CG ASP A 32 42.937 38.036 11.722 1.00 0.00 C ATOM 513 OD1 ASP A 32 42.931 39.162 12.192 1.00 0.00 O ATOM 514 OD2 ASP A 32 43.566 37.715 10.728 1.00 0.00 O ATOM 0 H ASP A 32 40.859 35.509 14.010 1.00 0.00 H new ATOM 0 HA ASP A 32 42.478 37.849 14.363 1.00 0.00 H new ATOM 0 HB2 ASP A 32 42.705 36.059 12.564 1.00 0.00 H new ATOM 0 HB3 ASP A 32 41.252 36.685 11.810 1.00 0.00 H new ATOM 519 N LYS A 33 39.385 38.366 13.427 1.00 0.00 N ATOM 520 CA LYS A 33 38.405 39.464 13.194 1.00 0.00 C ATOM 521 C LYS A 33 38.018 40.142 14.514 1.00 0.00 C ATOM 522 O LYS A 33 37.940 41.352 14.595 1.00 0.00 O ATOM 523 CB LYS A 33 37.167 38.879 12.538 1.00 0.00 C ATOM 524 CG LYS A 33 37.558 38.298 11.182 1.00 0.00 C ATOM 525 CD LYS A 33 36.362 37.572 10.570 1.00 0.00 C ATOM 526 CE LYS A 33 36.746 37.032 9.191 1.00 0.00 C ATOM 527 NZ LYS A 33 37.072 38.170 8.286 1.00 0.00 N ATOM 0 H LYS A 33 38.986 37.428 13.470 1.00 0.00 H new ATOM 0 HA LYS A 33 38.858 40.216 12.547 1.00 0.00 H new ATOM 0 HB2 LYS A 33 36.735 38.104 13.171 1.00 0.00 H new ATOM 0 HB3 LYS A 33 36.406 39.649 12.413 1.00 0.00 H new ATOM 0 HG2 LYS A 33 37.892 39.094 10.517 1.00 0.00 H new ATOM 0 HG3 LYS A 33 38.394 37.608 11.298 1.00 0.00 H new ATOM 0 HD2 LYS A 33 36.048 36.754 11.219 1.00 0.00 H new ATOM 0 HD3 LYS A 33 35.515 38.253 10.483 1.00 0.00 H new ATOM 0 HE2 LYS A 33 37.603 36.364 9.276 1.00 0.00 H new ATOM 0 HE3 LYS A 33 35.925 36.447 8.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 36.615 38.022 7.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 36.726 39.057 8.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 38.102 38.227 8.157 1.00 0.00 H new ATOM 541 N GLU A 34 37.762 39.381 15.546 1.00 0.00 N ATOM 542 CA GLU A 34 37.366 39.992 16.851 1.00 0.00 C ATOM 543 C GLU A 34 38.598 40.188 17.735 1.00 0.00 C ATOM 544 O GLU A 34 38.649 41.091 18.547 1.00 0.00 O ATOM 545 CB GLU A 34 36.367 39.074 17.560 1.00 0.00 C ATOM 546 CG GLU A 34 35.174 38.819 16.636 1.00 0.00 C ATOM 547 CD GLU A 34 34.166 37.909 17.340 1.00 0.00 C ATOM 548 OE1 GLU A 34 34.241 37.801 18.551 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.336 37.336 16.654 1.00 0.00 O ATOM 0 H GLU A 34 37.810 38.362 15.542 1.00 0.00 H new ATOM 0 HA GLU A 34 36.905 40.962 16.666 1.00 0.00 H new ATOM 0 HB2 GLU A 34 36.846 38.131 17.824 1.00 0.00 H new ATOM 0 HB3 GLU A 34 36.030 39.532 18.490 1.00 0.00 H new ATOM 0 HG2 GLU A 34 34.701 39.763 16.367 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.512 38.356 15.709 1.00 0.00 H new ATOM 556 N GLY A 35 39.593 39.349 17.600 1.00 0.00 N ATOM 557 CA GLY A 35 40.816 39.489 18.447 1.00 0.00 C ATOM 558 C GLY A 35 40.671 38.609 19.687 1.00 0.00 C ATOM 559 O GLY A 35 41.417 38.722 20.639 1.00 0.00 O ATOM 0 H GLY A 35 39.611 38.572 16.939 1.00 0.00 H new ATOM 0 HA2 GLY A 35 41.701 39.197 17.881 1.00 0.00 H new ATOM 0 HA3 GLY A 35 40.953 40.530 18.739 1.00 0.00 H new ATOM 563 N ILE A 36 39.707 37.731 19.674 1.00 0.00 N ATOM 564 CA ILE A 36 39.476 36.827 20.828 1.00 0.00 C ATOM 565 C ILE A 36 40.186 35.483 20.576 1.00 0.00 C ATOM 566 O ILE A 36 39.791 34.744 19.696 1.00 0.00 O ATOM 567 CB ILE A 36 37.980 36.589 20.935 1.00 0.00 C ATOM 568 CG1 ILE A 36 37.269 37.941 20.966 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.677 35.826 22.219 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.774 37.713 21.114 1.00 0.00 C ATOM 0 H ILE A 36 39.059 37.602 18.897 1.00 0.00 H new ATOM 0 HA ILE A 36 39.864 37.269 21.745 1.00 0.00 H new ATOM 0 HB ILE A 36 37.634 36.006 20.081 1.00 0.00 H new ATOM 0 HG12 ILE A 36 37.641 38.543 21.795 1.00 0.00 H new ATOM 0 HG13 ILE A 36 37.476 38.496 20.051 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.603 35.655 22.296 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.197 34.868 22.204 1.00 0.00 H new ATOM 0 HG23 ILE A 36 38.014 36.408 23.076 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.260 38.674 21.137 1.00 0.00 H new ATOM 0 HD12 ILE A 36 35.410 37.127 20.270 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.578 37.175 22.041 1.00 0.00 H new ATOM 582 N PRO A 37 41.212 35.145 21.328 1.00 0.00 N ATOM 583 CA PRO A 37 41.933 33.852 21.137 1.00 0.00 C ATOM 584 C PRO A 37 40.955 32.672 20.984 1.00 0.00 C ATOM 585 O PRO A 37 39.824 32.745 21.420 1.00 0.00 O ATOM 586 CB PRO A 37 42.768 33.715 22.417 1.00 0.00 C ATOM 587 CG PRO A 37 43.029 35.122 22.853 1.00 0.00 C ATOM 588 CD PRO A 37 41.803 35.939 22.425 1.00 0.00 C ATOM 0 HA PRO A 37 42.537 33.841 20.229 1.00 0.00 H new ATOM 0 HB2 PRO A 37 42.230 33.157 23.183 1.00 0.00 H new ATOM 0 HB3 PRO A 37 43.699 33.180 22.227 1.00 0.00 H new ATOM 0 HG2 PRO A 37 43.174 35.174 23.932 1.00 0.00 H new ATOM 0 HG3 PRO A 37 43.936 35.511 22.390 1.00 0.00 H new ATOM 0 HD2 PRO A 37 41.101 36.067 23.249 1.00 0.00 H new ATOM 0 HD3 PRO A 37 42.085 36.937 22.089 1.00 0.00 H new ATOM 596 N PRO A 38 41.383 31.598 20.365 1.00 0.00 N ATOM 597 CA PRO A 38 40.522 30.394 20.148 1.00 0.00 C ATOM 598 C PRO A 38 40.325 29.567 21.425 1.00 0.00 C ATOM 599 O PRO A 38 39.313 28.920 21.605 1.00 0.00 O ATOM 600 CB PRO A 38 41.304 29.600 19.099 1.00 0.00 C ATOM 601 CG PRO A 38 42.717 29.920 19.409 1.00 0.00 C ATOM 602 CD PRO A 38 42.728 31.398 19.800 1.00 0.00 C ATOM 0 HA PRO A 38 39.511 30.661 19.840 1.00 0.00 H new ATOM 0 HB2 PRO A 38 41.108 28.531 19.176 1.00 0.00 H new ATOM 0 HB3 PRO A 38 41.037 29.901 18.086 1.00 0.00 H new ATOM 0 HG2 PRO A 38 43.091 29.297 20.221 1.00 0.00 H new ATOM 0 HG3 PRO A 38 43.358 29.738 18.547 1.00 0.00 H new ATOM 0 HD2 PRO A 38 43.509 31.618 20.528 1.00 0.00 H new ATOM 0 HD3 PRO A 38 42.905 32.043 18.939 1.00 0.00 H new ATOM 610 N ASP A 39 41.284 29.581 22.311 1.00 0.00 N ATOM 611 CA ASP A 39 41.147 28.791 23.567 1.00 0.00 C ATOM 612 C ASP A 39 40.135 29.467 24.494 1.00 0.00 C ATOM 613 O ASP A 39 39.599 28.853 25.395 1.00 0.00 O ATOM 614 CB ASP A 39 42.504 28.708 24.268 1.00 0.00 C ATOM 615 CG ASP A 39 42.443 27.663 25.383 1.00 0.00 C ATOM 616 OD1 ASP A 39 42.107 28.031 26.496 1.00 0.00 O ATOM 617 OD2 ASP A 39 42.730 26.511 25.105 1.00 0.00 O ATOM 0 H ASP A 39 42.155 30.104 22.219 1.00 0.00 H new ATOM 0 HA ASP A 39 40.799 27.787 23.325 1.00 0.00 H new ATOM 0 HB2 ASP A 39 43.280 28.443 23.550 1.00 0.00 H new ATOM 0 HB3 ASP A 39 42.771 29.681 24.682 1.00 0.00 H new ATOM 622 N GLN A 40 39.874 30.727 24.284 1.00 0.00 N ATOM 623 CA GLN A 40 38.904 31.455 25.147 1.00 0.00 C ATOM 624 C GLN A 40 37.511 31.420 24.514 1.00 0.00 C ATOM 625 O GLN A 40 36.595 32.063 24.989 1.00 0.00 O ATOM 626 CB GLN A 40 39.361 32.906 25.281 1.00 0.00 C ATOM 627 CG GLN A 40 40.724 32.943 25.973 1.00 0.00 C ATOM 628 CD GLN A 40 41.062 34.385 26.361 1.00 0.00 C ATOM 629 OE1 GLN A 40 42.025 34.627 27.063 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.308 35.359 25.932 1.00 0.00 N ATOM 0 H GLN A 40 40.296 31.288 23.544 1.00 0.00 H new ATOM 0 HA GLN A 40 38.860 30.981 26.127 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.427 33.371 24.297 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.632 33.477 25.856 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.710 32.310 26.860 1.00 0.00 H new ATOM 0 HG3 GLN A 40 41.491 32.545 25.309 1.00 0.00 H new ATOM 0 HE21 GLN A 40 39.500 35.157 25.343 1.00 0.00 H new ATOM 0 HE22 GLN A 40 40.526 36.323 26.185 1.00 0.00 H new ATOM 639 N GLN A 41 37.343 30.685 23.439 1.00 0.00 N ATOM 640 CA GLN A 41 36.007 30.615 22.763 1.00 0.00 C ATOM 641 C GLN A 41 35.587 29.156 22.568 1.00 0.00 C ATOM 642 O GLN A 41 36.366 28.321 22.152 1.00 0.00 O ATOM 643 CB GLN A 41 36.100 31.293 21.395 1.00 0.00 C ATOM 644 CG GLN A 41 36.533 32.748 21.576 1.00 0.00 C ATOM 645 CD GLN A 41 36.693 33.407 20.205 1.00 0.00 C ATOM 646 OE1 GLN A 41 35.774 34.024 19.704 1.00 0.00 O ATOM 647 NE2 GLN A 41 37.828 33.299 19.572 1.00 0.00 N ATOM 0 H GLN A 41 38.076 30.129 22.999 1.00 0.00 H new ATOM 0 HA GLN A 41 35.268 31.120 23.385 1.00 0.00 H new ATOM 0 HB2 GLN A 41 36.815 30.765 20.764 1.00 0.00 H new ATOM 0 HB3 GLN A 41 35.135 31.250 20.889 1.00 0.00 H new ATOM 0 HG2 GLN A 41 35.793 33.288 22.167 1.00 0.00 H new ATOM 0 HG3 GLN A 41 37.474 32.793 22.125 1.00 0.00 H new ATOM 0 HE21 GLN A 41 38.599 32.781 19.993 1.00 0.00 H new ATOM 0 HE22 GLN A 41 37.944 33.733 18.656 1.00 0.00 H new ATOM 656 N ARG A 42 34.344 28.855 22.850 1.00 0.00 N ATOM 657 CA ARG A 42 33.821 27.465 22.672 1.00 0.00 C ATOM 658 C ARG A 42 32.497 27.562 21.917 1.00 0.00 C ATOM 659 O ARG A 42 31.620 28.311 22.294 1.00 0.00 O ATOM 660 CB ARG A 42 33.586 26.822 24.043 1.00 0.00 C ATOM 661 CG ARG A 42 34.926 26.385 24.653 1.00 0.00 C ATOM 662 CD ARG A 42 35.496 25.160 23.914 1.00 0.00 C ATOM 663 NE ARG A 42 36.353 24.378 24.851 1.00 0.00 N ATOM 664 CZ ARG A 42 35.816 23.505 25.662 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.571 22.823 26.479 1.00 0.00 N ATOM 666 NH2 ARG A 42 34.525 23.315 25.656 1.00 0.00 N ATOM 0 H ARG A 42 33.659 29.524 23.201 1.00 0.00 H new ATOM 0 HA ARG A 42 34.535 26.855 22.119 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.089 27.530 24.706 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.925 25.961 23.942 1.00 0.00 H new ATOM 0 HG2 ARG A 42 35.638 27.208 24.602 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.789 26.146 25.708 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.685 24.537 23.538 1.00 0.00 H new ATOM 0 HD3 ARG A 42 36.079 25.480 23.050 1.00 0.00 H new ATOM 0 HE ARG A 42 37.362 24.525 24.859 1.00 0.00 H new ATOM 0 HH11 ARG A 42 37.580 22.971 26.485 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.152 22.142 27.112 1.00 0.00 H new ATOM 0 HH21 ARG A 42 33.934 23.848 25.018 1.00 0.00 H new ATOM 0 HH22 ARG A 42 34.107 22.633 26.289 1.00 0.00 H new ATOM 680 N LEU A 43 32.342 26.841 20.837 1.00 0.00 N ATOM 681 CA LEU A 43 31.072 26.944 20.062 1.00 0.00 C ATOM 682 C LEU A 43 30.024 25.964 20.590 1.00 0.00 C ATOM 683 O LEU A 43 30.325 24.845 20.956 1.00 0.00 O ATOM 684 CB LEU A 43 31.344 26.633 18.593 1.00 0.00 C ATOM 685 CG LEU A 43 32.598 27.372 18.115 1.00 0.00 C ATOM 686 CD1 LEU A 43 32.634 27.333 16.595 1.00 0.00 C ATOM 687 CD2 LEU A 43 32.558 28.830 18.571 1.00 0.00 C ATOM 0 H LEU A 43 33.033 26.192 20.462 1.00 0.00 H new ATOM 0 HA LEU A 43 30.690 27.959 20.170 1.00 0.00 H new ATOM 0 HB2 LEU A 43 31.474 25.559 18.460 1.00 0.00 H new ATOM 0 HB3 LEU A 43 30.487 26.928 17.987 1.00 0.00 H new ATOM 0 HG LEU A 43 33.482 26.892 18.534 1.00 0.00 H new ATOM 0 HD11 LEU A 43 33.522 27.855 16.239 1.00 0.00 H new ATOM 0 HD12 LEU A 43 32.663 26.297 16.258 1.00 0.00 H new ATOM 0 HD13 LEU A 43 31.743 27.819 16.197 1.00 0.00 H new ATOM 0 HD21 LEU A 43 33.455 29.344 18.225 1.00 0.00 H new ATOM 0 HD22 LEU A 43 31.677 29.317 18.154 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.514 28.870 19.659 1.00 0.00 H new ATOM 699 N ILE A 44 28.789 26.390 20.604 1.00 0.00 N ATOM 700 CA ILE A 44 27.665 25.520 21.080 1.00 0.00 C ATOM 701 C ILE A 44 26.636 25.405 19.953 1.00 0.00 C ATOM 702 O ILE A 44 26.296 26.386 19.320 1.00 0.00 O ATOM 703 CB ILE A 44 26.997 26.161 22.301 1.00 0.00 C ATOM 704 CG1 ILE A 44 28.027 26.348 23.430 1.00 0.00 C ATOM 705 CG2 ILE A 44 25.849 25.263 22.790 1.00 0.00 C ATOM 706 CD1 ILE A 44 28.702 25.016 23.792 1.00 0.00 C ATOM 0 H ILE A 44 28.503 27.321 20.301 1.00 0.00 H new ATOM 0 HA ILE A 44 28.047 24.536 21.354 1.00 0.00 H new ATOM 0 HB ILE A 44 26.600 27.136 22.019 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.783 27.070 23.120 1.00 0.00 H new ATOM 0 HG13 ILE A 44 27.535 26.760 24.311 1.00 0.00 H new ATOM 0 HG21 ILE A 44 25.374 25.720 23.659 1.00 0.00 H new ATOM 0 HG22 ILE A 44 25.114 25.147 21.994 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.244 24.285 23.065 1.00 0.00 H new ATOM 0 HD11 ILE A 44 29.424 25.180 24.592 1.00 0.00 H new ATOM 0 HD12 ILE A 44 27.947 24.304 24.125 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.215 24.618 22.916 1.00 0.00 H new ATOM 718 N PHE A 45 26.142 24.221 19.687 1.00 0.00 N ATOM 719 CA PHE A 45 25.140 24.049 18.591 1.00 0.00 C ATOM 720 C PHE A 45 24.018 23.111 19.054 1.00 0.00 C ATOM 721 O PHE A 45 24.206 21.921 19.205 1.00 0.00 O ATOM 722 CB PHE A 45 25.846 23.454 17.367 1.00 0.00 C ATOM 723 CG PHE A 45 24.825 23.018 16.341 1.00 0.00 C ATOM 724 CD1 PHE A 45 24.167 23.972 15.558 1.00 0.00 C ATOM 725 CD2 PHE A 45 24.537 21.660 16.180 1.00 0.00 C ATOM 726 CE1 PHE A 45 23.221 23.566 14.608 1.00 0.00 C ATOM 727 CE2 PHE A 45 23.591 21.252 15.232 1.00 0.00 C ATOM 728 CZ PHE A 45 22.933 22.206 14.445 1.00 0.00 C ATOM 0 H PHE A 45 26.390 23.365 20.183 1.00 0.00 H new ATOM 0 HA PHE A 45 24.704 25.014 18.333 1.00 0.00 H new ATOM 0 HB2 PHE A 45 26.519 24.192 16.931 1.00 0.00 H new ATOM 0 HB3 PHE A 45 26.457 22.603 17.668 1.00 0.00 H new ATOM 0 HD1 PHE A 45 24.388 25.021 15.686 1.00 0.00 H new ATOM 0 HD2 PHE A 45 25.044 20.925 16.787 1.00 0.00 H new ATOM 0 HE1 PHE A 45 22.714 24.302 14.002 1.00 0.00 H new ATOM 0 HE2 PHE A 45 23.369 20.202 15.108 1.00 0.00 H new ATOM 0 HZ PHE A 45 22.204 21.892 13.713 1.00 0.00 H new ATOM 738 N ALA A 46 22.846 23.646 19.256 1.00 0.00 N ATOM 739 CA ALA A 46 21.691 22.807 19.683 1.00 0.00 C ATOM 740 C ALA A 46 22.089 21.864 20.823 1.00 0.00 C ATOM 741 O ALA A 46 21.807 20.683 20.784 1.00 0.00 O ATOM 742 CB ALA A 46 21.203 21.978 18.493 1.00 0.00 C ATOM 0 H ALA A 46 22.637 24.638 19.142 1.00 0.00 H new ATOM 0 HA ALA A 46 20.898 23.465 20.038 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.358 21.362 18.801 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.893 22.644 17.688 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.011 21.336 18.141 1.00 0.00 H new ATOM 748 N GLY A 47 22.714 22.369 21.852 1.00 0.00 N ATOM 749 CA GLY A 47 23.091 21.492 22.998 1.00 0.00 C ATOM 750 C GLY A 47 24.206 20.520 22.600 1.00 0.00 C ATOM 751 O GLY A 47 24.662 19.736 23.408 1.00 0.00 O ATOM 0 H GLY A 47 22.980 23.349 21.949 1.00 0.00 H new ATOM 0 HA2 GLY A 47 23.420 22.105 23.837 1.00 0.00 H new ATOM 0 HA3 GLY A 47 22.218 20.932 23.335 1.00 0.00 H new ATOM 755 N LYS A 48 24.649 20.546 21.371 1.00 0.00 N ATOM 756 CA LYS A 48 25.729 19.605 20.947 1.00 0.00 C ATOM 757 C LYS A 48 27.099 20.245 21.183 1.00 0.00 C ATOM 758 O LYS A 48 27.206 21.429 21.431 1.00 0.00 O ATOM 759 CB LYS A 48 25.569 19.274 19.467 1.00 0.00 C ATOM 760 CG LYS A 48 24.152 18.752 19.205 1.00 0.00 C ATOM 761 CD LYS A 48 24.106 18.041 17.851 1.00 0.00 C ATOM 762 CE LYS A 48 22.649 17.793 17.453 1.00 0.00 C ATOM 763 NZ LYS A 48 21.989 16.948 18.487 1.00 0.00 N ATOM 0 H LYS A 48 24.311 21.176 20.643 1.00 0.00 H new ATOM 0 HA LYS A 48 25.655 18.689 21.534 1.00 0.00 H new ATOM 0 HB2 LYS A 48 25.757 20.162 18.863 1.00 0.00 H new ATOM 0 HB3 LYS A 48 26.303 18.525 19.170 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.855 18.065 19.997 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.442 19.579 19.217 1.00 0.00 H new ATOM 0 HD2 LYS A 48 24.603 18.647 17.093 1.00 0.00 H new ATOM 0 HD3 LYS A 48 24.645 17.095 17.907 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.122 18.742 17.352 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.605 17.299 16.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 21.081 16.597 18.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 22.603 16.142 18.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 21.821 17.514 19.343 1.00 0.00 H new ATOM 777 N GLN A 49 28.147 19.461 21.102 1.00 0.00 N ATOM 778 CA GLN A 49 29.526 19.989 21.313 1.00 0.00 C ATOM 779 C GLN A 49 30.424 19.541 20.158 1.00 0.00 C ATOM 780 O GLN A 49 30.535 18.368 19.864 1.00 0.00 O ATOM 781 CB GLN A 49 30.080 19.453 22.626 1.00 0.00 C ATOM 782 CG GLN A 49 29.384 20.143 23.800 1.00 0.00 C ATOM 783 CD GLN A 49 29.852 19.512 25.113 1.00 0.00 C ATOM 784 OE1 GLN A 49 29.960 18.308 25.217 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.137 20.282 26.128 1.00 0.00 N ATOM 0 H GLN A 49 28.101 18.463 20.895 1.00 0.00 H new ATOM 0 HA GLN A 49 29.497 21.078 21.350 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.928 18.375 22.683 1.00 0.00 H new ATOM 0 HB3 GLN A 49 31.155 19.626 22.676 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.611 21.209 23.795 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.303 20.047 23.703 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.047 21.294 26.041 1.00 0.00 H new ATOM 0 HE22 GLN A 49 30.450 19.871 27.008 1.00 0.00 H new ATOM 794 N LEU A 50 31.067 20.470 19.499 1.00 0.00 N ATOM 795 CA LEU A 50 31.958 20.104 18.356 1.00 0.00 C ATOM 796 C LEU A 50 33.388 19.898 18.863 1.00 0.00 C ATOM 797 O LEU A 50 33.966 20.765 19.488 1.00 0.00 O ATOM 798 CB LEU A 50 31.948 21.233 17.323 1.00 0.00 C ATOM 799 CG LEU A 50 30.507 21.669 17.046 1.00 0.00 C ATOM 800 CD1 LEU A 50 30.508 22.792 16.006 1.00 0.00 C ATOM 801 CD2 LEU A 50 29.699 20.478 16.513 1.00 0.00 C ATOM 0 H LEU A 50 31.014 21.468 19.703 1.00 0.00 H new ATOM 0 HA LEU A 50 31.598 19.182 17.899 1.00 0.00 H new ATOM 0 HB2 LEU A 50 32.530 22.079 17.690 1.00 0.00 H new ATOM 0 HB3 LEU A 50 32.420 20.898 16.400 1.00 0.00 H new ATOM 0 HG LEU A 50 30.053 22.026 17.970 1.00 0.00 H new ATOM 0 HD11 LEU A 50 29.483 23.104 15.807 1.00 0.00 H new ATOM 0 HD12 LEU A 50 31.078 23.640 16.386 1.00 0.00 H new ATOM 0 HD13 LEU A 50 30.964 22.433 15.083 1.00 0.00 H new ATOM 0 HD21 LEU A 50 28.674 20.792 16.317 1.00 0.00 H new ATOM 0 HD22 LEU A 50 30.150 20.116 15.589 1.00 0.00 H new ATOM 0 HD23 LEU A 50 29.698 19.678 17.254 1.00 0.00 H new ATOM 813 N GLU A 51 33.964 18.753 18.596 1.00 0.00 N ATOM 814 CA GLU A 51 35.361 18.486 19.055 1.00 0.00 C ATOM 815 C GLU A 51 36.341 18.839 17.933 1.00 0.00 C ATOM 816 O GLU A 51 36.093 18.573 16.774 1.00 0.00 O ATOM 817 CB GLU A 51 35.503 17.002 19.408 1.00 0.00 C ATOM 818 CG GLU A 51 35.276 16.155 18.154 1.00 0.00 C ATOM 819 CD GLU A 51 35.097 14.690 18.554 1.00 0.00 C ATOM 820 OE1 GLU A 51 34.111 14.392 19.209 1.00 0.00 O ATOM 821 OE2 GLU A 51 35.948 13.891 18.200 1.00 0.00 O ATOM 0 H GLU A 51 33.526 17.990 18.079 1.00 0.00 H new ATOM 0 HA GLU A 51 35.580 19.093 19.933 1.00 0.00 H new ATOM 0 HB2 GLU A 51 36.495 16.808 19.816 1.00 0.00 H new ATOM 0 HB3 GLU A 51 34.782 16.730 20.179 1.00 0.00 H new ATOM 0 HG2 GLU A 51 34.394 16.507 17.619 1.00 0.00 H new ATOM 0 HG3 GLU A 51 36.123 16.257 17.475 1.00 0.00 H new ATOM 828 N ASP A 52 37.449 19.439 18.268 1.00 0.00 N ATOM 829 CA ASP A 52 38.444 19.818 17.221 1.00 0.00 C ATOM 830 C ASP A 52 38.846 18.579 16.414 1.00 0.00 C ATOM 831 O ASP A 52 38.739 17.461 16.878 1.00 0.00 O ATOM 832 CB ASP A 52 39.683 20.414 17.890 1.00 0.00 C ATOM 833 CG ASP A 52 39.350 21.805 18.434 1.00 0.00 C ATOM 834 OD1 ASP A 52 38.303 22.323 18.083 1.00 0.00 O ATOM 835 OD2 ASP A 52 40.149 22.329 19.195 1.00 0.00 O ATOM 0 H ASP A 52 37.711 19.685 19.223 1.00 0.00 H new ATOM 0 HA ASP A 52 37.999 20.554 16.551 1.00 0.00 H new ATOM 0 HB2 ASP A 52 40.019 19.766 18.700 1.00 0.00 H new ATOM 0 HB3 ASP A 52 40.501 20.479 17.173 1.00 0.00 H new ATOM 840 N GLY A 53 39.308 18.775 15.206 1.00 0.00 N ATOM 841 CA GLY A 53 39.719 17.614 14.359 1.00 0.00 C ATOM 842 C GLY A 53 38.519 17.119 13.550 1.00 0.00 C ATOM 843 O GLY A 53 38.394 15.945 13.263 1.00 0.00 O ATOM 0 H GLY A 53 39.419 19.690 14.769 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.526 17.908 13.688 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.103 16.810 14.987 1.00 0.00 H new ATOM 847 N ARG A 54 37.633 18.008 13.179 1.00 0.00 N ATOM 848 CA ARG A 54 36.440 17.581 12.390 1.00 0.00 C ATOM 849 C ARG A 54 35.902 18.751 11.561 1.00 0.00 C ATOM 850 O ARG A 54 36.078 19.906 11.897 1.00 0.00 O ATOM 851 CB ARG A 54 35.345 17.085 13.339 1.00 0.00 C ATOM 852 CG ARG A 54 35.762 15.748 13.966 1.00 0.00 C ATOM 853 CD ARG A 54 34.551 15.099 14.635 1.00 0.00 C ATOM 854 NE ARG A 54 34.942 13.774 15.192 1.00 0.00 N ATOM 855 CZ ARG A 54 34.024 12.951 15.620 1.00 0.00 C ATOM 856 NH1 ARG A 54 34.365 11.791 16.112 1.00 0.00 N ATOM 857 NH2 ARG A 54 32.765 13.286 15.553 1.00 0.00 N ATOM 0 H ARG A 54 37.684 19.005 13.387 1.00 0.00 H new ATOM 0 HA ARG A 54 36.736 16.776 11.717 1.00 0.00 H new ATOM 0 HB2 ARG A 54 35.168 17.823 14.121 1.00 0.00 H new ATOM 0 HB3 ARG A 54 34.408 16.965 12.795 1.00 0.00 H new ATOM 0 HG2 ARG A 54 36.166 15.086 13.201 1.00 0.00 H new ATOM 0 HG3 ARG A 54 36.553 15.909 14.699 1.00 0.00 H new ATOM 0 HD2 ARG A 54 34.173 15.742 15.430 1.00 0.00 H new ATOM 0 HD3 ARG A 54 33.744 14.978 13.912 1.00 0.00 H new ATOM 0 HE ARG A 54 35.926 13.510 15.239 1.00 0.00 H new ATOM 0 HH11 ARG A 54 35.349 11.528 16.162 1.00 0.00 H new ATOM 0 HH12 ARG A 54 33.647 11.148 16.446 1.00 0.00 H new ATOM 0 HH21 ARG A 54 32.498 14.191 15.166 1.00 0.00 H new ATOM 0 HH22 ARG A 54 32.048 12.643 15.888 1.00 0.00 H new ATOM 871 N THR A 55 35.236 18.441 10.474 1.00 0.00 N ATOM 872 CA THR A 55 34.657 19.495 9.584 1.00 0.00 C ATOM 873 C THR A 55 33.127 19.379 9.625 1.00 0.00 C ATOM 874 O THR A 55 32.587 18.325 9.901 1.00 0.00 O ATOM 875 CB THR A 55 35.174 19.263 8.152 1.00 0.00 C ATOM 876 OG1 THR A 55 36.489 19.786 8.041 1.00 0.00 O ATOM 877 CG2 THR A 55 34.266 19.952 7.125 1.00 0.00 C ATOM 0 H THR A 55 35.067 17.485 10.162 1.00 0.00 H new ATOM 0 HA THR A 55 34.950 20.492 9.914 1.00 0.00 H new ATOM 0 HB THR A 55 35.175 18.192 7.950 1.00 0.00 H new ATOM 0 HG1 THR A 55 36.487 20.549 7.427 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.652 19.774 6.121 1.00 0.00 H new ATOM 0 HG22 THR A 55 33.257 19.548 7.203 1.00 0.00 H new ATOM 0 HG23 THR A 55 34.244 21.024 7.320 1.00 0.00 H new ATOM 885 N LEU A 56 32.422 20.447 9.362 1.00 0.00 N ATOM 886 CA LEU A 56 30.933 20.384 9.396 1.00 0.00 C ATOM 887 C LEU A 56 30.445 19.290 8.442 1.00 0.00 C ATOM 888 O LEU A 56 29.620 18.468 8.793 1.00 0.00 O ATOM 889 CB LEU A 56 30.366 21.739 8.958 1.00 0.00 C ATOM 890 CG LEU A 56 30.865 22.847 9.906 1.00 0.00 C ATOM 891 CD1 LEU A 56 30.778 24.207 9.202 1.00 0.00 C ATOM 892 CD2 LEU A 56 30.003 22.885 11.176 1.00 0.00 C ATOM 0 H LEU A 56 32.813 21.359 9.125 1.00 0.00 H new ATOM 0 HA LEU A 56 30.596 20.154 10.407 1.00 0.00 H new ATOM 0 HB2 LEU A 56 30.673 21.958 7.935 1.00 0.00 H new ATOM 0 HB3 LEU A 56 29.277 21.706 8.964 1.00 0.00 H new ATOM 0 HG LEU A 56 31.899 22.636 10.177 1.00 0.00 H new ATOM 0 HD11 LEU A 56 31.131 24.988 9.875 1.00 0.00 H new ATOM 0 HD12 LEU A 56 31.397 24.193 8.305 1.00 0.00 H new ATOM 0 HD13 LEU A 56 29.743 24.408 8.925 1.00 0.00 H new ATOM 0 HD21 LEU A 56 30.365 23.672 11.838 1.00 0.00 H new ATOM 0 HD22 LEU A 56 28.966 23.086 10.906 1.00 0.00 H new ATOM 0 HD23 LEU A 56 30.065 21.924 11.687 1.00 0.00 H new ATOM 904 N SER A 57 30.964 19.253 7.245 1.00 0.00 N ATOM 905 CA SER A 57 30.535 18.189 6.297 1.00 0.00 C ATOM 906 C SER A 57 30.929 16.842 6.898 1.00 0.00 C ATOM 907 O SER A 57 30.138 15.926 6.989 1.00 0.00 O ATOM 908 CB SER A 57 31.239 18.381 4.953 1.00 0.00 C ATOM 909 OG SER A 57 30.804 19.600 4.366 1.00 0.00 O ATOM 0 H SER A 57 31.660 19.907 6.886 1.00 0.00 H new ATOM 0 HA SER A 57 29.458 18.234 6.135 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.320 18.397 5.094 1.00 0.00 H new ATOM 0 HB3 SER A 57 31.017 17.545 4.290 1.00 0.00 H new ATOM 0 HG SER A 57 31.254 19.728 3.505 1.00 0.00 H new ATOM 915 N ASP A 58 32.161 16.725 7.310 1.00 0.00 N ATOM 916 CA ASP A 58 32.635 15.451 7.916 1.00 0.00 C ATOM 917 C ASP A 58 31.625 14.977 8.968 1.00 0.00 C ATOM 918 O ASP A 58 31.422 13.792 9.146 1.00 0.00 O ATOM 919 CB ASP A 58 33.998 15.673 8.578 1.00 0.00 C ATOM 920 CG ASP A 58 34.422 14.402 9.314 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.716 13.424 8.646 1.00 0.00 O ATOM 922 OD2 ASP A 58 34.448 14.427 10.533 1.00 0.00 O ATOM 0 H ASP A 58 32.863 17.462 7.252 1.00 0.00 H new ATOM 0 HA ASP A 58 32.730 14.694 7.138 1.00 0.00 H new ATOM 0 HB2 ASP A 58 34.741 15.935 7.825 1.00 0.00 H new ATOM 0 HB3 ASP A 58 33.943 16.509 9.276 1.00 0.00 H new ATOM 927 N TYR A 59 30.989 15.883 9.667 1.00 0.00 N ATOM 928 CA TYR A 59 30.001 15.452 10.696 1.00 0.00 C ATOM 929 C TYR A 59 28.728 14.962 9.988 1.00 0.00 C ATOM 930 O TYR A 59 27.937 14.236 10.555 1.00 0.00 O ATOM 931 CB TYR A 59 29.662 16.657 11.610 1.00 0.00 C ATOM 932 CG TYR A 59 30.368 16.541 12.950 1.00 0.00 C ATOM 933 CD1 TYR A 59 31.229 17.558 13.385 1.00 0.00 C ATOM 934 CD2 TYR A 59 30.145 15.421 13.761 1.00 0.00 C ATOM 935 CE1 TYR A 59 31.864 17.455 14.629 1.00 0.00 C ATOM 936 CE2 TYR A 59 30.782 15.318 15.003 1.00 0.00 C ATOM 937 CZ TYR A 59 31.641 16.333 15.437 1.00 0.00 C ATOM 938 OH TYR A 59 32.263 16.233 16.665 1.00 0.00 O ATOM 0 H TYR A 59 31.110 16.891 9.570 1.00 0.00 H new ATOM 0 HA TYR A 59 30.415 14.646 11.301 1.00 0.00 H new ATOM 0 HB2 TYR A 59 29.957 17.584 11.119 1.00 0.00 H new ATOM 0 HB3 TYR A 59 28.584 16.708 11.766 1.00 0.00 H new ATOM 0 HD1 TYR A 59 31.403 18.422 12.760 1.00 0.00 H new ATOM 0 HD2 TYR A 59 29.481 14.637 13.428 1.00 0.00 H new ATOM 0 HE1 TYR A 59 32.525 18.240 14.965 1.00 0.00 H new ATOM 0 HE2 TYR A 59 30.610 14.454 15.627 1.00 0.00 H new ATOM 0 HH TYR A 59 32.000 15.394 17.098 1.00 0.00 H new ATOM 948 N ASN A 60 28.519 15.368 8.764 1.00 0.00 N ATOM 949 CA ASN A 60 27.293 14.936 8.032 1.00 0.00 C ATOM 950 C ASN A 60 26.056 15.368 8.823 1.00 0.00 C ATOM 951 O ASN A 60 25.212 14.562 9.164 1.00 0.00 O ATOM 952 CB ASN A 60 27.294 13.413 7.869 1.00 0.00 C ATOM 953 CG ASN A 60 28.671 12.949 7.392 1.00 0.00 C ATOM 954 OD1 ASN A 60 29.334 12.184 8.064 1.00 0.00 O ATOM 955 ND2 ASN A 60 29.133 13.383 6.252 1.00 0.00 N ATOM 0 H ASN A 60 29.144 15.980 8.240 1.00 0.00 H new ATOM 0 HA ASN A 60 27.277 15.399 7.045 1.00 0.00 H new ATOM 0 HB2 ASN A 60 27.046 12.936 8.817 1.00 0.00 H new ATOM 0 HB3 ASN A 60 26.530 13.113 7.152 1.00 0.00 H new ATOM 0 HD21 ASN A 60 30.050 13.080 5.925 1.00 0.00 H new ATOM 0 HD22 ASN A 60 28.577 14.025 5.688 1.00 0.00 H new ATOM 962 N ILE A 61 25.943 16.635 9.121 1.00 0.00 N ATOM 963 CA ILE A 61 24.765 17.124 9.894 1.00 0.00 C ATOM 964 C ILE A 61 23.576 17.326 8.950 1.00 0.00 C ATOM 965 O ILE A 61 23.682 17.982 7.934 1.00 0.00 O ATOM 966 CB ILE A 61 25.107 18.457 10.560 1.00 0.00 C ATOM 967 CG1 ILE A 61 26.463 18.345 11.258 1.00 0.00 C ATOM 968 CG2 ILE A 61 24.032 18.806 11.589 1.00 0.00 C ATOM 969 CD1 ILE A 61 26.794 19.671 11.944 1.00 0.00 C ATOM 0 H ILE A 61 26.618 17.354 8.861 1.00 0.00 H new ATOM 0 HA ILE A 61 24.507 16.388 10.655 1.00 0.00 H new ATOM 0 HB ILE A 61 25.151 19.239 9.802 1.00 0.00 H new ATOM 0 HG12 ILE A 61 26.441 17.539 11.992 1.00 0.00 H new ATOM 0 HG13 ILE A 61 27.238 18.095 10.533 1.00 0.00 H new ATOM 0 HG21 ILE A 61 24.277 19.756 12.063 1.00 0.00 H new ATOM 0 HG22 ILE A 61 23.065 18.887 11.092 1.00 0.00 H new ATOM 0 HG23 ILE A 61 23.986 18.024 12.347 1.00 0.00 H new ATOM 0 HD11 ILE A 61 27.760 19.592 12.442 1.00 0.00 H new ATOM 0 HD12 ILE A 61 26.833 20.466 11.199 1.00 0.00 H new ATOM 0 HD13 ILE A 61 26.024 19.902 12.681 1.00 0.00 H new ATOM 1066 N LEU A 67 23.013 27.030 8.269 1.00 0.00 N ATOM 1067 CA LEU A 67 23.746 26.525 9.467 1.00 0.00 C ATOM 1068 C LEU A 67 23.831 27.635 10.518 1.00 0.00 C ATOM 1069 O LEU A 67 24.422 28.674 10.290 1.00 0.00 O ATOM 1070 CB LEU A 67 25.163 26.107 9.061 1.00 0.00 C ATOM 1071 CG LEU A 67 25.108 25.244 7.798 1.00 0.00 C ATOM 1072 CD1 LEU A 67 26.529 24.846 7.395 1.00 0.00 C ATOM 1073 CD2 LEU A 67 24.282 23.980 8.071 1.00 0.00 C ATOM 0 HA LEU A 67 23.215 25.667 9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.775 26.991 8.882 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.634 25.551 9.872 1.00 0.00 H new ATOM 0 HG LEU A 67 24.643 25.811 6.992 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.493 24.231 6.496 1.00 0.00 H new ATOM 0 HD12 LEU A 67 27.116 25.743 7.198 1.00 0.00 H new ATOM 0 HD13 LEU A 67 26.991 24.280 8.204 1.00 0.00 H new ATOM 0 HD21 LEU A 67 24.245 23.368 7.170 1.00 0.00 H new ATOM 0 HD22 LEU A 67 24.744 23.411 8.878 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.270 24.262 8.360 1.00 0.00 H new ATOM 1085 N HIS A 68 23.246 27.420 11.668 1.00 0.00 N ATOM 1086 CA HIS A 68 23.281 28.452 12.752 1.00 0.00 C ATOM 1087 C HIS A 68 24.266 28.016 13.838 1.00 0.00 C ATOM 1088 O HIS A 68 24.294 26.870 14.237 1.00 0.00 O ATOM 1089 CB HIS A 68 21.883 28.591 13.362 1.00 0.00 C ATOM 1090 CG HIS A 68 20.916 29.040 12.301 1.00 0.00 C ATOM 1091 ND1 HIS A 68 20.936 30.325 11.777 1.00 0.00 N ATOM 1092 CD2 HIS A 68 19.895 28.387 11.654 1.00 0.00 C ATOM 1093 CE1 HIS A 68 19.956 30.405 10.858 1.00 0.00 C ATOM 1094 NE2 HIS A 68 19.295 29.251 10.747 1.00 0.00 N ATOM 0 H HIS A 68 22.741 26.567 11.906 1.00 0.00 H new ATOM 0 HA HIS A 68 23.597 29.409 12.336 1.00 0.00 H new ATOM 0 HB2 HIS A 68 21.562 27.638 13.782 1.00 0.00 H new ATOM 0 HB3 HIS A 68 21.901 29.311 14.180 1.00 0.00 H new ATOM 0 HD2 HIS A 68 19.604 27.361 11.824 1.00 0.00 H new ATOM 0 HE1 HIS A 68 19.733 31.291 10.283 1.00 0.00 H new ATOM 0 HE2 HIS A 68 18.512 29.046 10.126 1.00 0.00 H new ATOM 1103 N LEU A 69 25.069 28.928 14.324 1.00 0.00 N ATOM 1104 CA LEU A 69 26.059 28.584 15.395 1.00 0.00 C ATOM 1105 C LEU A 69 26.059 29.694 16.446 1.00 0.00 C ATOM 1106 O LEU A 69 25.801 30.842 16.144 1.00 0.00 O ATOM 1107 CB LEU A 69 27.461 28.470 14.786 1.00 0.00 C ATOM 1108 CG LEU A 69 27.500 27.352 13.734 1.00 0.00 C ATOM 1109 CD1 LEU A 69 28.827 27.429 12.974 1.00 0.00 C ATOM 1110 CD2 LEU A 69 27.377 25.978 14.411 1.00 0.00 C ATOM 0 H LEU A 69 25.083 29.903 14.024 1.00 0.00 H new ATOM 0 HA LEU A 69 25.785 27.633 15.853 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.744 29.418 14.329 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.189 28.265 15.571 1.00 0.00 H new ATOM 0 HG LEU A 69 26.666 27.479 13.044 1.00 0.00 H new ATOM 0 HD11 LEU A 69 28.863 26.638 12.225 1.00 0.00 H new ATOM 0 HD12 LEU A 69 28.909 28.399 12.483 1.00 0.00 H new ATOM 0 HD13 LEU A 69 29.654 27.305 13.673 1.00 0.00 H new ATOM 0 HD21 LEU A 69 27.406 25.195 13.653 1.00 0.00 H new ATOM 0 HD22 LEU A 69 28.204 25.840 15.107 1.00 0.00 H new ATOM 0 HD23 LEU A 69 26.433 25.923 14.954 1.00 0.00 H new ATOM 1122 N VAL A 70 26.356 29.361 17.680 1.00 0.00 N ATOM 1123 CA VAL A 70 26.386 30.390 18.770 1.00 0.00 C ATOM 1124 C VAL A 70 27.732 30.300 19.488 1.00 0.00 C ATOM 1125 O VAL A 70 28.054 29.298 20.096 1.00 0.00 O ATOM 1126 CB VAL A 70 25.261 30.104 19.768 1.00 0.00 C ATOM 1127 CG1 VAL A 70 25.259 31.175 20.860 1.00 0.00 C ATOM 1128 CG2 VAL A 70 23.915 30.115 19.039 1.00 0.00 C ATOM 0 H VAL A 70 26.581 28.413 17.982 1.00 0.00 H new ATOM 0 HA VAL A 70 26.251 31.386 18.348 1.00 0.00 H new ATOM 0 HB VAL A 70 25.420 29.126 20.221 1.00 0.00 H new ATOM 0 HG11 VAL A 70 24.457 30.970 21.570 1.00 0.00 H new ATOM 0 HG12 VAL A 70 26.216 31.165 21.381 1.00 0.00 H new ATOM 0 HG13 VAL A 70 25.102 32.155 20.409 1.00 0.00 H new ATOM 0 HG21 VAL A 70 23.114 29.911 19.750 1.00 0.00 H new ATOM 0 HG22 VAL A 70 23.756 31.092 18.584 1.00 0.00 H new ATOM 0 HG23 VAL A 70 23.915 29.349 18.263 1.00 0.00 H new ATOM 1138 N LEU A 71 28.533 31.330 19.418 1.00 0.00 N ATOM 1139 CA LEU A 71 29.863 31.294 20.092 1.00 0.00 C ATOM 1140 C LEU A 71 29.698 31.652 21.569 1.00 0.00 C ATOM 1141 O LEU A 71 28.960 32.549 21.921 1.00 0.00 O ATOM 1142 CB LEU A 71 30.789 32.312 19.404 1.00 0.00 C ATOM 1143 CG LEU A 71 32.260 32.141 19.872 1.00 0.00 C ATOM 1144 CD1 LEU A 71 33.216 32.443 18.711 1.00 0.00 C ATOM 1145 CD2 LEU A 71 32.570 33.111 21.025 1.00 0.00 C ATOM 0 H LEU A 71 28.323 32.196 18.922 1.00 0.00 H new ATOM 0 HA LEU A 71 30.295 30.296 20.019 1.00 0.00 H new ATOM 0 HB2 LEU A 71 30.732 32.186 18.323 1.00 0.00 H new ATOM 0 HB3 LEU A 71 30.450 33.324 19.626 1.00 0.00 H new ATOM 0 HG LEU A 71 32.394 31.114 20.210 1.00 0.00 H new ATOM 0 HD11 LEU A 71 34.246 32.321 19.047 1.00 0.00 H new ATOM 0 HD12 LEU A 71 33.018 31.755 17.889 1.00 0.00 H new ATOM 0 HD13 LEU A 71 33.064 33.468 18.372 1.00 0.00 H new ATOM 0 HD21 LEU A 71 33.604 32.980 21.343 1.00 0.00 H new ATOM 0 HD22 LEU A 71 32.421 34.137 20.687 1.00 0.00 H new ATOM 0 HD23 LEU A 71 31.904 32.905 21.863 1.00 0.00 H new ATOM 1157 N ARG A 72 30.391 30.958 22.439 1.00 0.00 N ATOM 1158 CA ARG A 72 30.293 31.248 23.904 1.00 0.00 C ATOM 1159 C ARG A 72 31.562 31.981 24.348 1.00 0.00 C ATOM 1160 O ARG A 72 32.637 31.743 23.833 1.00 0.00 O ATOM 1161 CB ARG A 72 30.173 29.929 24.672 1.00 0.00 C ATOM 1162 CG ARG A 72 29.735 30.209 26.110 1.00 0.00 C ATOM 1163 CD ARG A 72 29.484 28.884 26.833 1.00 0.00 C ATOM 1164 NE ARG A 72 28.966 29.156 28.203 1.00 0.00 N ATOM 1165 CZ ARG A 72 28.539 28.171 28.947 1.00 0.00 C ATOM 1166 NH1 ARG A 72 28.088 28.408 30.148 1.00 0.00 N ATOM 1167 NH2 ARG A 72 28.565 26.951 28.489 1.00 0.00 N ATOM 0 H ARG A 72 31.025 30.197 22.195 1.00 0.00 H new ATOM 0 HA ARG A 72 29.418 31.866 24.105 1.00 0.00 H new ATOM 0 HB2 ARG A 72 29.451 29.276 24.182 1.00 0.00 H new ATOM 0 HB3 ARG A 72 31.129 29.406 24.668 1.00 0.00 H new ATOM 0 HG2 ARG A 72 30.503 30.780 26.631 1.00 0.00 H new ATOM 0 HG3 ARG A 72 28.829 30.815 26.114 1.00 0.00 H new ATOM 0 HD2 ARG A 72 28.767 28.283 26.274 1.00 0.00 H new ATOM 0 HD3 ARG A 72 30.407 28.308 26.890 1.00 0.00 H new ATOM 0 HE ARG A 72 28.945 30.111 28.560 1.00 0.00 H new ATOM 0 HH11 ARG A 72 28.069 29.363 30.506 1.00 0.00 H new ATOM 0 HH12 ARG A 72 27.755 27.639 30.729 1.00 0.00 H new ATOM 0 HH21 ARG A 72 28.919 26.766 27.550 1.00 0.00 H new ATOM 0 HH22 ARG A 72 28.232 26.181 29.069 1.00 0.00 H new ATOM 1181 N LEU A 73 31.452 32.871 25.298 1.00 0.00 N ATOM 1182 CA LEU A 73 32.657 33.615 25.766 1.00 0.00 C ATOM 1183 C LEU A 73 33.377 32.799 26.843 1.00 0.00 C ATOM 1184 O LEU A 73 32.791 32.398 27.829 1.00 0.00 O ATOM 1185 CB LEU A 73 32.228 34.964 26.352 1.00 0.00 C ATOM 1186 CG LEU A 73 31.247 35.656 25.400 1.00 0.00 C ATOM 1187 CD1 LEU A 73 30.812 36.993 26.005 1.00 0.00 C ATOM 1188 CD2 LEU A 73 31.926 35.904 24.046 1.00 0.00 C ATOM 0 H LEU A 73 30.581 33.115 25.770 1.00 0.00 H new ATOM 0 HA LEU A 73 33.330 33.780 24.925 1.00 0.00 H new ATOM 0 HB2 LEU A 73 31.761 34.816 27.325 1.00 0.00 H new ATOM 0 HB3 LEU A 73 33.102 35.596 26.511 1.00 0.00 H new ATOM 0 HG LEU A 73 30.375 35.019 25.253 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.114 37.488 25.330 1.00 0.00 H new ATOM 0 HD12 LEU A 73 30.326 36.817 26.965 1.00 0.00 H new ATOM 0 HD13 LEU A 73 31.686 37.627 26.152 1.00 0.00 H new ATOM 0 HD21 LEU A 73 31.225 36.396 23.372 1.00 0.00 H new ATOM 0 HD22 LEU A 73 32.800 36.540 24.188 1.00 0.00 H new ATOM 0 HD23 LEU A 73 32.236 34.952 23.615 1.00 0.00 H new